NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
607731 | 2ndg | 26060 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 HT1 GLY 1 29.538 0.678 1.853 2 H2 GLY 1 HT2 GLY 1 28.695 -0.493 0.966 3 H3 GLY 1 HT3 GLY 1 28.905 1.067 0.330 4 HA2 GLY 1 HA1 GLY 1 30.400 -0.538 -0.712 5 HA3 GLY 1 HA2 GLY 1 31.260 0.741 0.137 6 H SER 2 HN SER 2 32.864 -1.207 -0.205 7 HA SER 2 HA SER 2 32.624 -3.056 2.066 8 HB2 SER 2 HB2 SER 2 34.445 -3.196 -0.348 9 HB3 SER 2 HB1 SER 2 34.302 -4.423 0.911 10 HG SER 2 HG SER 2 32.400 -3.642 -1.037 11 H HIS 3 HN HIS 3 33.428 -0.235 2.223 12 HA HIS 3 HA HIS 3 35.943 -0.682 3.680 13 HB2 HIS 3 HB2 HIS 3 35.297 1.801 2.061 14 HB3 HIS 3 HB1 HIS 3 36.735 1.555 3.043 15 HD1 HIS 3 HD1 HIS 3 35.268 0.837 -0.271 16 HD2 HIS 3 HD2 HIS 3 38.628 -0.268 1.923 17 HE1 HIS 3 HE1 HIS 3 36.843 -0.224 -1.926 18 HE2 HIS 3 HE2 HIS 3 38.810 -1.005 -0.556 19 H MET 4 HN MET 4 34.034 -1.026 5.227 20 HA MET 4 HA MET 4 32.744 1.492 5.984 21 HB2 MET 4 HB2 MET 4 31.117 0.105 7.184 22 HB3 MET 4 HB1 MET 4 31.231 -0.343 5.491 23 HG2 MET 4 HG2 MET 4 32.622 -2.258 6.092 24 HG3 MET 4 HG1 MET 4 32.503 -1.808 7.792 25 HE1 MET 4 HE1 MET 4 31.618 -4.193 8.470 26 HE2 MET 4 HE2 MET 4 31.780 -4.713 6.793 27 HE3 MET 4 HE3 MET 4 30.277 -5.009 7.666 28 H ALA 5 HN ALA 5 33.381 2.570 7.664 29 HA ALA 5 HA ALA 5 34.675 1.141 9.899 30 HB1 ALA 5 HB1 ALA 5 35.629 3.357 10.505 31 HB2 ALA 5 HB2 ALA 5 34.958 4.010 9.011 32 HB3 ALA 5 HB3 ALA 5 36.190 2.750 8.948 33 H SER 6 HN SER 6 32.360 3.584 8.924 34 HA SER 6 HA SER 6 31.124 3.472 11.589 35 HB2 SER 6 HB2 SER 6 31.745 5.727 10.788 36 HB3 SER 6 HB1 SER 6 30.756 5.486 9.351 37 HG SER 6 HG SER 6 28.959 5.728 10.509 38 H SER 7 HN SER 7 29.207 2.489 11.808 39 HA SER 7 HA SER 7 28.139 0.960 9.657 40 HB2 SER 7 HB2 SER 7 26.882 1.558 12.352 41 HB3 SER 7 HB1 SER 7 26.503 0.205 11.283 42 HG SER 7 HG SER 7 28.598 -0.595 11.626 43 H CYS 8 HN CYS 8 26.858 1.721 8.072 44 HA CYS 8 HA CYS 8 25.300 4.144 8.653 45 HB2 CYS 8 HB2 CYS 8 25.264 4.579 6.270 46 HB3 CYS 8 HB1 CYS 8 26.921 4.314 6.794 47 HG CYS 8 HG CYS 8 26.891 1.595 5.868 48 H ALA 9 HN ALA 9 23.168 4.096 8.698 49 HA ALA 9 HA ALA 9 21.813 1.680 7.687 50 HB1 ALA 9 HB1 ALA 9 20.021 2.162 9.298 51 HB2 ALA 9 HB2 ALA 9 20.916 3.582 9.855 52 HB3 ALA 9 HB3 ALA 9 21.583 1.969 10.105 53 H VAL 10 HN VAL 10 20.705 1.987 5.874 54 HA VAL 10 HA VAL 10 19.982 4.731 5.132 55 HB VAL 10 HB VAL 10 19.933 2.296 3.347 56 HG11 VAL 10 HG11 VAL 10 18.587 3.896 2.355 57 HG12 VAL 10 HG12 VAL 10 20.161 4.182 1.608 58 HG13 VAL 10 HG13 VAL 10 19.599 5.232 2.910 59 HG21 VAL 10 HG21 VAL 10 22.199 2.475 3.876 60 HG22 VAL 10 HG22 VAL 10 22.146 4.236 3.915 61 HG23 VAL 10 HG23 VAL 10 22.040 3.384 2.374 62 H GLN 11 HN GLN 11 17.934 5.361 5.088 63 HA GLN 11 HA GLN 11 15.923 3.336 5.813 64 HB2 GLN 11 HB2 GLN 11 15.664 6.295 6.318 65 HB3 GLN 11 HB1 GLN 11 14.811 4.975 7.103 66 HG2 GLN 11 HG2 GLN 11 16.342 4.837 8.700 67 HG3 GLN 11 HG1 GLN 11 17.644 4.743 7.516 68 HE21 GLN 11 HE21 GLN 11 15.445 7.452 7.667 69 HE22 GLN 11 HE22 GLN 11 16.610 8.592 8.258 70 H VAL 12 HN VAL 12 14.321 2.987 4.450 71 HA VAL 12 HA VAL 12 13.823 4.985 2.361 72 HB VAL 12 HB VAL 12 12.710 3.092 1.157 73 HG11 VAL 12 HG11 VAL 12 15.222 3.723 1.000 74 HG12 VAL 12 HG12 VAL 12 14.697 2.178 0.334 75 HG13 VAL 12 HG13 VAL 12 15.484 2.237 1.911 76 HG21 VAL 12 HG21 VAL 12 12.166 1.815 3.152 77 HG22 VAL 12 HG22 VAL 12 13.867 1.403 3.344 78 HG23 VAL 12 HG23 VAL 12 12.974 0.848 1.925 79 H LYS 13 HN LYS 13 11.592 5.584 1.942 80 HA LYS 13 HA LYS 13 9.914 5.057 4.333 81 HB2 LYS 13 HB2 LYS 13 10.911 7.507 4.065 82 HB3 LYS 13 HB1 LYS 13 9.687 7.651 2.814 83 HG2 LYS 13 HG2 LYS 13 7.939 7.360 4.382 84 HG3 LYS 13 HG1 LYS 13 9.071 6.862 5.644 85 HD2 LYS 13 HD2 LYS 13 10.150 9.133 5.401 86 HD3 LYS 13 HD1 LYS 13 8.774 9.587 4.396 87 HE2 LYS 13 HE2 LYS 13 8.407 10.347 6.650 88 HE3 LYS 13 HE1 LYS 13 7.269 9.055 6.276 89 HZ1 LYS 13 HZ1 LYS 13 8.574 7.518 7.535 90 HZ2 LYS 13 HZ2 LYS 13 8.296 8.879 8.503 91 HZ3 LYS 13 HZ3 LYS 13 9.807 8.657 7.765 92 H LEU 14 HN LEU 14 8.218 3.850 3.752 93 HA LEU 14 HA LEU 14 7.072 4.310 1.087 94 HB2 LEU 14 HB2 LEU 14 6.788 1.941 2.924 95 HB3 LEU 14 HB1 LEU 14 5.935 2.125 1.408 96 HG LEU 14 HG LEU 14 8.941 1.949 1.684 97 HD11 LEU 14 HD11 LEU 14 6.957 -0.082 0.690 98 HD12 LEU 14 HD12 LEU 14 7.797 -0.150 2.239 99 HD13 LEU 14 HD13 LEU 14 8.710 -0.263 0.734 100 HD21 LEU 14 HD21 LEU 14 7.182 1.897 -0.761 101 HD22 LEU 14 HD22 LEU 14 8.940 1.756 -0.725 102 HD23 LEU 14 HD23 LEU 14 8.166 3.265 -0.243 103 H GLU 15 HN GLU 15 4.849 4.553 0.888 104 HA GLU 15 HA GLU 15 3.604 5.618 3.330 105 HB2 GLU 15 HB2 GLU 15 4.464 7.364 1.821 106 HB3 GLU 15 HB1 GLU 15 3.491 6.714 0.513 107 HG2 GLU 15 HG2 GLU 15 1.484 7.390 1.543 108 HG3 GLU 15 HG1 GLU 15 2.298 7.742 3.067 109 H LEU 16 HN LEU 16 1.761 4.714 3.845 110 HA LEU 16 HA LEU 16 0.241 3.187 1.853 111 HB2 LEU 16 HB2 LEU 16 -0.060 3.376 4.842 112 HB3 LEU 16 HB1 LEU 16 -1.179 2.522 3.815 113 HG LEU 16 HG LEU 16 0.191 0.896 4.814 114 HD11 LEU 16 HD11 LEU 16 1.710 1.018 2.327 115 HD12 LEU 16 HD12 LEU 16 -0.043 1.059 2.157 116 HD13 LEU 16 HD13 LEU 16 0.734 -0.285 2.998 117 HD21 LEU 16 HD21 LEU 16 2.652 2.267 3.837 118 HD22 LEU 16 HD22 LEU 16 2.529 0.941 4.988 119 HD23 LEU 16 HD23 LEU 16 1.989 2.559 5.440 120 H GLY 17 HN GLY 17 -1.708 3.848 1.191 121 HA2 GLY 17 HA2 GLY 17 -2.965 6.123 2.526 122 HA3 GLY 17 HA1 GLY 17 -2.456 6.349 0.860 123 H HIS 18 HN HIS 18 -5.053 6.668 1.686 124 HA HIS 18 HA HIS 18 -6.293 5.236 -0.374 125 HB2 HIS 18 HB2 HIS 18 -7.256 3.434 0.583 126 HB3 HIS 18 HB1 HIS 18 -6.146 3.674 1.924 127 HD1 HIS 18 HD1 HIS 18 -7.141 5.128 3.970 128 HD2 HIS 18 HD2 HIS 18 -9.896 3.613 1.242 129 HE1 HIS 18 HE1 HIS 18 -9.394 5.357 5.071 130 HE2 HIS 18 HE2 HIS 18 -11.010 4.268 3.484 131 H ARG 19 HN ARG 19 -8.197 6.133 -0.929 132 HA ARG 19 HA ARG 19 -9.318 8.180 0.876 133 HB2 ARG 19 HB2 ARG 19 -9.481 8.076 -2.146 134 HB3 ARG 19 HB1 ARG 19 -10.195 9.298 -1.123 135 HG2 ARG 19 HG2 ARG 19 -7.995 10.057 -0.446 136 HG3 ARG 19 HG1 ARG 19 -7.247 8.809 -1.446 137 HD2 ARG 19 HD2 ARG 19 -7.246 10.913 -2.644 138 HD3 ARG 19 HD1 ARG 19 -8.350 9.776 -3.426 139 HE ARG 19 HE ARG 19 -9.561 11.581 -1.500 140 HH11 ARG 19 HH11 ARG 19 -8.763 11.046 -4.879 141 HH12 ARG 19 HH12 ARG 19 -10.004 12.116 -5.461 142 HH21 ARG 19 HH21 ARG 19 -11.172 12.965 -2.259 143 HH22 ARG 19 HH22 ARG 19 -11.384 13.206 -3.970 144 H ALA 20 HN ALA 20 -11.672 8.326 0.813 145 HA ALA 20 HA ALA 20 -13.046 6.152 -0.558 146 HB1 ALA 20 HB1 ALA 20 -12.928 4.991 1.395 147 HB2 ALA 20 HB2 ALA 20 -14.422 5.896 1.656 148 HB3 ALA 20 HB3 ALA 20 -12.916 6.448 2.392 149 H GLN 21 HN GLN 21 -14.989 6.671 -1.265 150 HA GLN 21 HA GLN 21 -16.464 8.902 -0.168 151 HB2 GLN 21 HB2 GLN 21 -16.623 10.149 -2.201 152 HB3 GLN 21 HB1 GLN 21 -14.922 9.854 -1.902 153 HG2 GLN 21 HG2 GLN 21 -14.845 9.309 -4.031 154 HG3 GLN 21 HG1 GLN 21 -15.513 7.773 -3.520 155 HE21 GLN 21 HE21 GLN 21 -17.653 7.294 -3.953 156 HE22 GLN 21 HE22 GLN 21 -18.608 8.225 -5.059 157 H VAL 22 HN VAL 22 -18.674 8.719 -0.577 158 HA VAL 22 HA VAL 22 -19.397 6.064 -1.582 159 HB VAL 22 HB VAL 22 -21.211 7.848 -0.003 160 HG11 VAL 22 HG11 VAL 22 -22.131 5.586 0.652 161 HG12 VAL 22 HG12 VAL 22 -21.146 4.925 -0.646 162 HG13 VAL 22 HG13 VAL 22 -22.407 6.106 -1.005 163 HG21 VAL 22 HG21 VAL 22 -20.556 6.660 2.011 164 HG22 VAL 22 HG22 VAL 22 -19.203 7.566 1.330 165 HG23 VAL 22 HG23 VAL 22 -19.295 5.817 1.110 166 H ARG 23 HN ARG 23 -20.808 5.780 -3.183 167 HA ARG 23 HA ARG 23 -21.984 8.157 -4.446 168 HB2 ARG 23 HB2 ARG 23 -22.704 6.179 -6.116 169 HB3 ARG 23 HB1 ARG 23 -21.139 6.980 -6.220 170 HG2 ARG 23 HG2 ARG 23 -20.002 5.168 -5.551 171 HG3 ARG 23 HG1 ARG 23 -21.241 4.680 -4.398 172 HD2 ARG 23 HD2 ARG 23 -21.024 3.049 -6.199 173 HD3 ARG 23 HD1 ARG 23 -22.607 3.824 -6.238 174 HE ARG 23 HE ARG 23 -21.956 5.026 -8.163 175 HH11 ARG 23 HH11 ARG 23 -19.473 2.824 -7.056 176 HH12 ARG 23 HH12 ARG 23 -18.744 2.648 -8.624 177 HH21 ARG 23 HH21 ARG 23 -20.997 4.833 -10.213 178 HH22 ARG 23 HH22 ARG 23 -19.610 3.811 -10.431 179 H LYS 24 HN LYS 24 -24.101 8.562 -4.230 180 HA LYS 24 HA LYS 24 -25.555 7.169 -2.228 181 HB2 LYS 24 HB2 LYS 24 -25.706 9.643 -2.906 182 HB3 LYS 24 HB1 LYS 24 -26.769 9.095 -4.194 183 HG2 LYS 24 HG2 LYS 24 -28.172 9.781 -2.437 184 HG3 LYS 24 HG1 LYS 24 -28.177 8.017 -2.397 185 HD2 LYS 24 HD2 LYS 24 -26.455 8.093 -0.620 186 HD3 LYS 24 HD1 LYS 24 -26.575 9.854 -0.620 187 HE2 LYS 24 HE2 LYS 24 -27.919 9.029 1.172 188 HE3 LYS 24 HE1 LYS 24 -29.001 9.613 -0.091 189 HZ1 LYS 24 HZ1 LYS 24 -29.750 7.499 0.791 190 HZ2 LYS 24 HZ2 LYS 24 -28.269 6.773 0.397 191 HZ3 LYS 24 HZ3 LYS 24 -29.301 7.326 -0.836 192 H LYS 25 HN LYS 25 -25.048 6.550 -5.463 193 HA LYS 25 HA LYS 25 -27.360 4.732 -5.537 194 HB2 LYS 25 HB2 LYS 25 -27.518 6.686 -7.137 195 HB3 LYS 25 HB1 LYS 25 -26.094 6.057 -7.951 196 HG2 LYS 25 HG2 LYS 25 -28.381 4.212 -7.587 197 HG3 LYS 25 HG1 LYS 25 -28.565 5.524 -8.751 198 HD2 LYS 25 HD2 LYS 25 -26.579 4.778 -9.930 199 HD3 LYS 25 HD1 LYS 25 -26.318 3.509 -8.730 200 HE2 LYS 25 HE2 LYS 25 -27.372 2.481 -10.592 201 HE3 LYS 25 HE1 LYS 25 -28.585 2.629 -9.318 202 HZ1 LYS 25 HZ1 LYS 25 -29.449 4.605 -10.424 203 HZ2 LYS 25 HZ2 LYS 25 -29.500 3.262 -11.454 204 HZ3 LYS 25 HZ3 LYS 25 -28.298 4.436 -11.660 205 HA PRO 26 HA PRO 26 -23.723 2.004 -5.343 206 HB2 PRO 26 HB2 PRO 26 -25.911 0.013 -5.270 207 HB3 PRO 26 HB1 PRO 26 -24.532 0.209 -4.190 208 HG2 PRO 26 HG2 PRO 26 -27.007 0.903 -3.444 209 HG3 PRO 26 HG1 PRO 26 -25.581 1.820 -2.922 210 HD2 PRO 26 HD2 PRO 26 -27.617 2.488 -5.002 211 HD3 PRO 26 HD1 PRO 26 -26.745 3.560 -3.886 212 H THR 27 HN THR 27 -22.998 0.178 -6.629 213 HA THR 27 HA THR 27 -23.755 0.457 -9.390 214 HB THR 27 HB THR 27 -21.401 0.082 -8.831 215 HG1 THR 27 HG1 THR 27 -21.425 -2.202 -10.094 216 HG21 THR 27 HG21 THR 27 -21.443 -1.243 -6.882 217 HG22 THR 27 HG22 THR 27 -20.731 -2.265 -8.131 218 HG23 THR 27 HG23 THR 27 -22.416 -2.491 -7.664 219 H VAL 28 HN VAL 28 -23.841 -1.836 -10.584 220 HA VAL 28 HA VAL 28 -26.360 -2.837 -10.302 221 HB VAL 28 HB VAL 28 -25.169 -3.240 -12.283 222 HG11 VAL 28 HG11 VAL 28 -22.912 -3.334 -11.256 223 HG12 VAL 28 HG12 VAL 28 -23.183 -4.590 -12.470 224 HG13 VAL 28 HG13 VAL 28 -23.252 -4.994 -10.754 225 HG21 VAL 28 HG21 VAL 28 -25.670 -5.843 -10.857 226 HG22 VAL 28 HG22 VAL 28 -25.429 -5.687 -12.597 227 HG23 VAL 28 HG23 VAL 28 -26.820 -4.923 -11.827 228 H GLU 29 HN GLU 29 -23.428 -4.142 -8.765 229 HA GLU 29 HA GLU 29 -24.984 -6.275 -7.560 230 HB2 GLU 29 HB2 GLU 29 -22.039 -5.645 -7.372 231 HB3 GLU 29 HB1 GLU 29 -22.814 -7.059 -6.666 232 HG2 GLU 29 HG2 GLU 29 -23.588 -7.629 -9.018 233 HG3 GLU 29 HG1 GLU 29 -22.477 -6.379 -9.573 234 H GLY 30 HN GLY 30 -24.621 -3.146 -6.819 235 HA2 GLY 30 HA2 GLY 30 -25.579 -2.127 -4.966 236 HA3 GLY 30 HA1 GLY 30 -25.568 -3.674 -4.134 237 H PHE 31 HN PHE 31 -22.714 -2.270 -5.591 238 HA PHE 31 HA PHE 31 -21.479 -2.102 -2.972 239 HB2 PHE 31 HB2 PHE 31 -20.239 -1.474 -5.662 240 HB3 PHE 31 HB1 PHE 31 -19.396 -1.762 -4.142 241 HD1 PHE 31 HD1 PHE 31 -21.324 -4.190 -3.453 242 HD2 PHE 31 HD2 PHE 31 -18.925 -3.155 -6.800 243 HE1 PHE 31 HE1 PHE 31 -21.110 -6.567 -4.032 244 HE2 PHE 31 HE2 PHE 31 -18.706 -5.523 -7.383 245 HZ PHE 31 HZ PHE 31 -19.802 -7.237 -6.000 246 H THR 32 HN THR 32 -21.344 -0.275 -1.868 247 HA THR 32 HA THR 32 -22.505 2.118 -3.086 248 HB THR 32 HB THR 32 -22.966 2.821 -0.778 249 HG1 THR 32 HG1 THR 32 -22.667 0.711 0.663 250 HG21 THR 32 HG21 THR 32 -23.871 0.085 -1.472 251 HG22 THR 32 HG22 THR 32 -24.662 1.586 -1.915 252 HG23 THR 32 HG23 THR 32 -24.606 1.074 -0.225 253 H HIS 33 HN HIS 33 -19.627 0.999 -1.462 254 HA HIS 33 HA HIS 33 -18.671 3.764 -1.142 255 HB2 HIS 33 HB2 HIS 33 -18.133 1.211 0.344 256 HB3 HIS 33 HB1 HIS 33 -16.982 2.540 0.430 257 HD1 HIS 33 HD1 HIS 33 -20.670 1.871 1.177 258 HD2 HIS 33 HD2 HIS 33 -17.547 4.374 2.318 259 HE1 HIS 33 HE1 HIS 33 -21.521 3.173 3.159 260 HE2 HIS 33 HE2 HIS 33 -19.663 4.768 3.746 261 H ASP 34 HN ASP 34 -17.169 4.429 -2.517 262 HA ASP 34 HA ASP 34 -15.483 2.423 -3.868 263 HB2 ASP 34 HB2 ASP 34 -16.390 5.185 -4.672 264 HB3 ASP 34 HB1 ASP 34 -14.986 4.434 -5.419 265 H TRP 35 HN TRP 35 -13.333 2.471 -3.617 266 HA TRP 35 HA TRP 35 -12.153 4.765 -2.266 267 HB2 TRP 35 HB2 TRP 35 -10.916 3.263 -0.702 268 HB3 TRP 35 HB1 TRP 35 -12.641 3.374 -0.404 269 HD1 TRP 35 HD1 TRP 35 -14.002 1.123 -0.403 270 HE1 TRP 35 HE1 TRP 35 -13.333 -1.357 -0.680 271 HE3 TRP 35 HE3 TRP 35 -9.202 1.735 -2.088 272 HZ2 TRP 35 HZ2 TRP 35 -11.070 -2.848 -1.484 273 HZ3 TRP 35 HZ3 TRP 35 -7.852 -0.270 -2.580 274 HH2 TRP 35 HH2 TRP 35 -8.755 -2.507 -2.255 275 H MET 36 HN MET 36 -9.774 4.582 -2.134 276 HA MET 36 HA MET 36 -8.522 3.029 -4.264 277 HB2 MET 36 HB2 MET 36 -9.041 5.024 -5.456 278 HB3 MET 36 HB1 MET 36 -8.572 6.042 -4.100 279 HG2 MET 36 HG2 MET 36 -6.229 5.149 -4.412 280 HG3 MET 36 HG1 MET 36 -6.790 4.490 -5.951 281 HE1 MET 36 HE1 MET 36 -6.280 7.329 -3.695 282 HE2 MET 36 HE2 MET 36 -7.799 8.045 -4.253 283 HE3 MET 36 HE3 MET 36 -6.260 8.800 -4.676 284 H VAL 37 HN VAL 37 -6.555 2.310 -3.616 285 HA VAL 37 HA VAL 37 -5.486 3.411 -1.110 286 HB VAL 37 HB VAL 37 -4.056 1.184 -1.346 287 HG11 VAL 37 HG11 VAL 37 -6.886 1.277 -0.431 288 HG12 VAL 37 HG12 VAL 37 -5.497 1.773 0.518 289 HG13 VAL 37 HG13 VAL 37 -5.703 0.080 0.060 290 HG21 VAL 37 HG21 VAL 37 -4.929 0.495 -3.468 291 HG22 VAL 37 HG22 VAL 37 -6.584 0.634 -2.875 292 HG23 VAL 37 HG23 VAL 37 -5.517 -0.612 -2.228 293 H PHE 38 HN PHE 38 -3.207 3.426 -0.801 294 HA PHE 38 HA PHE 38 -1.623 4.133 -3.196 295 HB2 PHE 38 HB2 PHE 38 -2.227 5.647 -0.703 296 HB3 PHE 38 HB1 PHE 38 -0.582 5.740 -1.301 297 HD1 PHE 38 HD2 PHE 38 -4.077 6.683 -1.924 298 HD2 PHE 38 HD1 PHE 38 -0.053 6.882 -3.286 299 HE1 PHE 38 HE2 PHE 38 -4.684 8.523 -3.433 300 HE2 PHE 38 HE1 PHE 38 -0.639 8.742 -4.783 301 HZ PHE 38 HZ PHE 38 -2.979 9.564 -4.868 302 H VAL 39 HN VAL 39 0.272 2.966 -3.277 303 HA VAL 39 HA VAL 39 1.819 3.014 -0.792 304 HB VAL 39 HB VAL 39 2.955 0.868 -1.536 305 HG11 VAL 39 HG11 VAL 39 1.090 1.266 0.244 306 HG12 VAL 39 HG12 VAL 39 1.583 -0.371 -0.186 307 HG13 VAL 39 HG13 VAL 39 0.110 0.316 -0.873 308 HG21 VAL 39 HG21 VAL 39 2.333 0.341 -3.667 309 HG22 VAL 39 HG22 VAL 39 0.697 0.962 -3.455 310 HG23 VAL 39 HG23 VAL 39 1.143 -0.600 -2.768 311 H ARG 40 HN ARG 40 3.536 4.225 -1.070 312 HA ARG 40 HA ARG 40 5.227 4.115 -3.394 313 HB2 ARG 40 HB2 ARG 40 4.944 6.448 -4.087 314 HB3 ARG 40 HB1 ARG 40 3.418 5.582 -4.262 315 HG2 ARG 40 HG2 ARG 40 2.442 6.660 -2.452 316 HG3 ARG 40 HG1 ARG 40 3.995 7.108 -1.753 317 HD2 ARG 40 HD2 ARG 40 4.337 8.706 -3.612 318 HD3 ARG 40 HD1 ARG 40 2.723 8.300 -4.224 319 HE ARG 40 HE ARG 40 2.915 9.243 -1.463 320 HH11 ARG 40 HH11 ARG 40 2.068 9.885 -4.798 321 HH12 ARG 40 HH12 ARG 40 1.145 11.311 -4.422 322 HH21 ARG 40 HH21 ARG 40 1.710 11.091 -0.955 323 HH22 ARG 40 HH22 ARG 40 0.953 12.013 -2.227 324 H GLY 41 HN GLY 41 6.742 6.262 -3.194 325 HA2 GLY 41 HA2 GLY 41 7.529 6.402 -0.365 326 HA3 GLY 41 HA1 GLY 41 8.542 6.829 -1.736 327 HA PRO 42 HA PRO 42 6.428 10.621 0.330 328 HB2 PRO 42 HB2 PRO 42 9.268 11.364 0.750 329 HB3 PRO 42 HB1 PRO 42 7.900 11.503 1.859 330 HG2 PRO 42 HG2 PRO 42 9.778 9.624 2.232 331 HG3 PRO 42 HG1 PRO 42 8.065 9.298 2.541 332 HD2 PRO 42 HD2 PRO 42 9.738 8.506 0.200 333 HD3 PRO 42 HD1 PRO 42 8.500 7.581 1.074 334 H GLU 43 HN GLU 43 6.393 12.685 -0.556 335 HA GLU 43 HA GLU 43 6.842 12.917 -3.264 336 HB2 GLU 43 HB2 GLU 43 6.876 15.239 -1.334 337 HB3 GLU 43 HB1 GLU 43 6.449 15.281 -3.037 338 HG2 GLU 43 HG2 GLU 43 4.390 15.347 -2.046 339 HG3 GLU 43 HG1 GLU 43 4.579 13.619 -2.338 340 H HIS 44 HN HIS 44 8.552 13.026 -4.414 341 HA HIS 44 HA HIS 44 10.515 13.881 -5.279 342 HB2 HIS 44 HB2 HIS 44 11.041 14.853 -2.471 343 HB3 HIS 44 HB1 HIS 44 12.269 14.898 -3.729 344 HD1 HIS 44 HD1 HIS 44 11.783 16.489 -5.786 345 HD2 HIS 44 HD2 HIS 44 9.216 16.926 -2.533 346 HE1 HIS 44 HE1 HIS 44 10.576 18.666 -6.154 347 HE2 HIS 44 HE2 HIS 44 8.870 18.788 -4.305 348 H SER 45 HN SER 45 10.208 11.755 -2.603 349 HA SER 45 HA SER 45 12.651 10.344 -3.391 350 HB2 SER 45 HB2 SER 45 11.490 8.807 -1.433 351 HB3 SER 45 HB1 SER 45 12.691 10.062 -1.139 352 HG SER 45 HG SER 45 9.881 10.449 -1.144 353 H ASN 46 HN ASN 46 12.483 8.943 -5.002 354 HA ASN 46 HA ASN 46 9.850 7.796 -5.586 355 HB2 ASN 46 HB2 ASN 46 12.384 8.059 -7.187 356 HB3 ASN 46 HB1 ASN 46 11.103 6.958 -7.683 357 HD21 ASN 46 HD21 ASN 46 8.990 8.718 -6.673 358 HD22 ASN 46 HD22 ASN 46 8.881 10.030 -7.793 359 H ILE 47 HN ILE 47 9.365 5.787 -5.131 360 HA ILE 47 HA ILE 47 11.355 4.148 -3.855 361 HB ILE 47 HB ILE 47 9.675 2.553 -3.302 362 HG12 ILE 47 HG12 ILE 47 7.386 4.138 -4.150 363 HG13 ILE 47 HG11 ILE 47 8.202 3.330 -5.477 364 HG21 ILE 47 HG21 ILE 47 10.000 4.361 -1.830 365 HG22 ILE 47 HG22 ILE 47 8.281 4.008 -1.884 366 HG23 ILE 47 HG23 ILE 47 8.928 5.397 -2.758 367 HD11 ILE 47 HD11 ILE 47 7.149 2.139 -2.950 368 HD12 ILE 47 HD12 ILE 47 7.895 1.236 -4.269 369 HD13 ILE 47 HD13 ILE 47 6.353 2.062 -4.521 370 H GLN 48 HN GLN 48 9.859 4.369 -6.924 371 HA GLN 48 HA GLN 48 10.196 1.800 -7.915 372 HB2 GLN 48 HB2 GLN 48 9.028 3.611 -9.098 373 HB3 GLN 48 HB1 GLN 48 10.553 4.444 -9.346 374 HG2 GLN 48 HG2 GLN 48 9.933 3.389 -11.391 375 HG3 GLN 48 HG1 GLN 48 11.311 2.553 -10.729 376 HE21 GLN 48 HE21 GLN 48 7.772 2.272 -11.146 377 HE22 GLN 48 HE22 GLN 48 7.760 0.553 -11.037 378 H HIS 49 HN HIS 49 12.644 3.895 -6.857 379 HA HIS 49 HA HIS 49 14.732 2.812 -8.511 380 HB2 HIS 49 HB2 HIS 49 14.660 4.679 -6.179 381 HB3 HIS 49 HB1 HIS 49 16.183 3.891 -6.582 382 HD1 HIS 49 HD1 HIS 49 16.266 4.034 -9.577 383 HD2 HIS 49 HD2 HIS 49 14.898 7.169 -7.214 384 HE1 HIS 49 HE1 HIS 49 16.430 6.096 -11.015 385 HE2 HIS 49 HE2 HIS 49 15.430 7.941 -9.627 386 H PHE 50 HN PHE 50 13.502 2.194 -5.230 387 HA PHE 50 HA PHE 50 15.380 -0.061 -5.089 388 HB2 PHE 50 HB2 PHE 50 15.201 0.089 -2.621 389 HB3 PHE 50 HB1 PHE 50 15.894 1.526 -3.366 390 HD1 PHE 50 HD1 PHE 50 12.882 0.181 -1.686 391 HD2 PHE 50 HD2 PHE 50 14.880 3.620 -3.197 392 HE1 PHE 50 HE1 PHE 50 11.298 1.622 -0.503 393 HE2 PHE 50 HE2 PHE 50 13.277 5.064 -2.018 394 HZ PHE 50 HZ PHE 50 11.481 4.066 -0.668 395 H VAL 51 HN VAL 51 12.293 0.626 -5.722 396 HA VAL 51 HA VAL 51 11.230 -1.847 -4.528 397 HB VAL 51 HB VAL 51 9.910 0.800 -5.123 398 HG11 VAL 51 HG11 VAL 51 7.874 -0.375 -4.078 399 HG12 VAL 51 HG12 VAL 51 8.657 -1.873 -4.637 400 HG13 VAL 51 HG13 VAL 51 8.214 -0.621 -5.805 401 HG21 VAL 51 HG21 VAL 51 9.253 0.576 -2.711 402 HG22 VAL 51 HG22 VAL 51 10.982 0.777 -3.008 403 HG23 VAL 51 HG23 VAL 51 10.333 -0.817 -2.623 404 H GLU 52 HN GLU 52 10.103 -3.229 -5.876 405 HA GLU 52 HA GLU 52 10.793 -2.828 -8.713 406 HB2 GLU 52 HB2 GLU 52 11.846 -4.719 -7.457 407 HB3 GLU 52 HB1 GLU 52 10.247 -5.413 -7.243 408 HG2 GLU 52 HG2 GLU 52 10.009 -5.694 -9.629 409 HG3 GLU 52 HG1 GLU 52 11.562 -4.899 -9.900 410 H LYS 53 HN LYS 53 8.349 -4.602 -6.833 411 HA LYS 53 HA LYS 53 6.273 -3.527 -8.569 412 HB2 LYS 53 HB2 LYS 53 5.245 -5.767 -8.789 413 HB3 LYS 53 HB1 LYS 53 6.828 -5.674 -9.546 414 HG2 LYS 53 HG2 LYS 53 7.831 -6.837 -7.693 415 HG3 LYS 53 HG1 LYS 53 6.297 -6.864 -6.833 416 HD2 LYS 53 HD2 LYS 53 6.849 -8.183 -9.495 417 HD3 LYS 53 HD1 LYS 53 6.826 -9.014 -7.939 418 HE2 LYS 53 HE2 LYS 53 4.508 -8.609 -7.657 419 HE3 LYS 53 HE1 LYS 53 4.489 -7.460 -8.998 420 HZ1 LYS 53 HZ1 LYS 53 5.038 -9.323 -10.491 421 HZ2 LYS 53 HZ2 LYS 53 3.550 -9.539 -9.712 422 HZ3 LYS 53 HZ3 LYS 53 4.912 -10.396 -9.185 423 H VAL 54 HN VAL 54 4.070 -4.451 -7.589 424 HA VAL 54 HA VAL 54 4.155 -4.364 -4.674 425 HB VAL 54 HB VAL 54 3.137 -2.186 -6.438 426 HG11 VAL 54 HG11 VAL 54 2.123 -2.082 -3.693 427 HG12 VAL 54 HG12 VAL 54 1.346 -3.292 -4.714 428 HG13 VAL 54 HG13 VAL 54 1.353 -1.597 -5.203 429 HG21 VAL 54 HG21 VAL 54 3.915 -1.112 -4.082 430 HG22 VAL 54 HG22 VAL 54 4.976 -1.366 -5.461 431 HG23 VAL 54 HG23 VAL 54 4.928 -2.548 -4.152 432 H VAL 55 HN VAL 55 2.106 -4.962 -3.699 433 HA VAL 55 HA VAL 55 0.088 -6.023 -5.523 434 HB VAL 55 HB VAL 55 2.029 -7.696 -4.318 435 HG11 VAL 55 HG11 VAL 55 -0.727 -8.096 -3.182 436 HG12 VAL 55 HG12 VAL 55 0.769 -7.801 -2.288 437 HG13 VAL 55 HG13 VAL 55 0.547 -9.320 -3.158 438 HG21 VAL 55 HG21 VAL 55 -0.526 -8.455 -5.716 439 HG22 VAL 55 HG22 VAL 55 0.942 -9.426 -5.576 440 HG23 VAL 55 HG23 VAL 55 0.957 -7.939 -6.525 441 H PHE 56 HN PHE 56 -1.931 -6.169 -4.654 442 HA PHE 56 HA PHE 56 -2.266 -5.292 -1.864 443 HB2 PHE 56 HB2 PHE 56 -3.746 -4.439 -4.354 444 HB3 PHE 56 HB1 PHE 56 -4.529 -4.375 -2.773 445 HD1 PHE 56 HD1 PHE 56 -1.522 -3.211 -4.621 446 HD2 PHE 56 HD2 PHE 56 -4.246 -2.529 -1.418 447 HE1 PHE 56 HE1 PHE 56 -0.498 -1.018 -4.234 448 HE2 PHE 56 HE2 PHE 56 -3.223 -0.321 -1.029 449 HZ PHE 56 HZ PHE 56 -1.345 0.433 -2.439 450 H HIS 57 HN HIS 57 -3.442 -6.670 -0.642 451 HA HIS 57 HA HIS 57 -4.938 -8.796 -2.060 452 HB2 HIS 57 HB2 HIS 57 -3.964 -8.719 0.821 453 HB3 HIS 57 HB1 HIS 57 -4.825 -10.053 0.063 454 HD1 HIS 57 HD1 HIS 57 -3.425 -11.826 -0.922 455 HD2 HIS 57 HD2 HIS 57 -1.285 -8.296 -0.398 456 HE1 HIS 57 HE1 HIS 57 -1.026 -12.404 -1.410 457 HE2 HIS 57 HE2 HIS 57 0.272 -10.329 -0.799 458 H LEU 58 HN LEU 58 -6.742 -7.368 -2.400 459 HA LEU 58 HA LEU 58 -8.121 -6.181 -0.200 460 HB2 LEU 58 HB2 LEU 58 -9.665 -6.955 -2.626 461 HB3 LEU 58 HB1 LEU 58 -9.719 -5.463 -1.704 462 HG LEU 58 HG LEU 58 -7.699 -6.242 -3.795 463 HD11 LEU 58 HD11 LEU 58 -8.701 -4.777 -5.143 464 HD12 LEU 58 HD12 LEU 58 -9.321 -3.778 -3.838 465 HD13 LEU 58 HD13 LEU 58 -10.102 -5.312 -4.229 466 HD21 LEU 58 HD21 LEU 58 -7.669 -3.992 -1.809 467 HD22 LEU 58 HD22 LEU 58 -6.901 -3.838 -3.389 468 HD23 LEU 58 HD23 LEU 58 -6.366 -5.088 -2.267 469 H HIS 59 HN HIS 59 -10.712 -6.981 -0.187 470 HA HIS 59 HA HIS 59 -10.480 -9.577 1.055 471 HB2 HIS 59 HB2 HIS 59 -12.359 -7.405 1.163 472 HB3 HIS 59 HB1 HIS 59 -13.213 -8.912 0.836 473 HD1 HIS 59 HD1 HIS 59 -11.475 -10.828 2.553 474 HD2 HIS 59 HD2 HIS 59 -12.865 -7.116 3.821 475 HE1 HIS 59 HE1 HIS 59 -11.479 -10.923 5.061 476 HE2 HIS 59 HE2 HIS 59 -12.030 -8.578 5.787 477 H GLU 60 HN GLU 60 -11.612 -11.407 0.514 478 HA GLU 60 HA GLU 60 -11.420 -12.143 -2.184 479 HB2 GLU 60 HB2 GLU 60 -13.023 -13.572 -0.075 480 HB3 GLU 60 HB1 GLU 60 -12.220 -14.282 -1.467 481 HG2 GLU 60 HG2 GLU 60 -10.812 -14.879 0.246 482 HG3 GLU 60 HG1 GLU 60 -10.051 -13.391 -0.310 483 H SER 61 HN SER 61 -14.018 -10.791 -0.367 484 HA SER 61 HA SER 61 -16.172 -11.455 -2.055 485 HB2 SER 61 HB2 SER 61 -16.294 -10.422 0.258 486 HB3 SER 61 HB1 SER 61 -15.848 -8.887 -0.483 487 HG SER 61 HG SER 61 -18.067 -10.418 -1.368 488 H PHE 62 HN PHE 62 -13.481 -9.393 -2.481 489 HA PHE 62 HA PHE 62 -14.671 -7.866 -4.655 490 HB2 PHE 62 HB2 PHE 62 -11.873 -7.891 -3.486 491 HB3 PHE 62 HB1 PHE 62 -12.405 -6.827 -4.775 492 HD1 PHE 62 HD1 PHE 62 -13.352 -7.777 -1.296 493 HD2 PHE 62 HD2 PHE 62 -13.055 -4.707 -4.215 494 HE1 PHE 62 HE1 PHE 62 -14.060 -6.118 0.381 495 HE2 PHE 62 HE2 PHE 62 -13.769 -3.040 -2.554 496 HZ PHE 62 HZ PHE 62 -14.270 -3.746 -0.248 497 HA PRO 63 HA PRO 63 -13.343 -10.878 -7.693 498 HB2 PRO 63 HB2 PRO 63 -13.367 -8.590 -9.559 499 HB3 PRO 63 HB1 PRO 63 -14.286 -10.097 -9.620 500 HG2 PRO 63 HG2 PRO 63 -15.460 -7.768 -9.013 501 HG3 PRO 63 HG1 PRO 63 -15.959 -9.289 -8.248 502 HD2 PRO 63 HD2 PRO 63 -14.242 -7.091 -7.159 503 HD3 PRO 63 HD1 PRO 63 -15.499 -8.048 -6.346 504 H ARG 64 HN ARG 64 -11.322 -11.541 -7.975 505 HA ARG 64 HA ARG 64 -9.044 -11.557 -7.953 506 HB2 ARG 64 HB2 ARG 64 -9.527 -9.164 -9.731 507 HB3 ARG 64 HB1 ARG 64 -7.947 -9.894 -9.490 508 HG2 ARG 64 HG2 ARG 64 -8.797 -12.001 -10.415 509 HG3 ARG 64 HG1 ARG 64 -10.359 -11.230 -10.696 510 HD2 ARG 64 HD2 ARG 64 -9.015 -11.262 -12.719 511 HD3 ARG 64 HD1 ARG 64 -9.319 -9.614 -12.177 512 HE ARG 64 HE ARG 64 -6.848 -10.604 -11.159 513 HH11 ARG 64 HH11 ARG 64 -8.364 -9.248 -14.016 514 HH12 ARG 64 HH12 ARG 64 -6.868 -8.659 -14.684 515 HH21 ARG 64 HH21 ARG 64 -4.887 -9.783 -12.013 516 HH22 ARG 64 HH22 ARG 64 -4.895 -8.937 -13.532 517 HA PRO 65 HA PRO 65 -9.136 -8.246 -4.718 518 HB2 PRO 65 HB2 PRO 65 -8.127 -9.760 -2.679 519 HB3 PRO 65 HB1 PRO 65 -9.845 -9.649 -3.070 520 HG2 PRO 65 HG2 PRO 65 -7.885 -11.791 -3.731 521 HG3 PRO 65 HG1 PRO 65 -9.597 -11.923 -3.286 522 HD2 PRO 65 HD2 PRO 65 -8.677 -12.133 -5.850 523 HD3 PRO 65 HD1 PRO 65 -10.302 -11.569 -5.433 524 H LYS 66 HN LYS 66 -6.617 -10.362 -5.754 525 HA LYS 66 HA LYS 66 -4.543 -8.743 -4.610 526 HB2 LYS 66 HB2 LYS 66 -4.236 -11.153 -4.631 527 HB3 LYS 66 HB1 LYS 66 -4.401 -11.182 -6.378 528 HG2 LYS 66 HG2 LYS 66 -2.343 -10.017 -6.680 529 HG3 LYS 66 HG1 LYS 66 -2.220 -9.680 -4.953 530 HD2 LYS 66 HD2 LYS 66 -1.621 -11.826 -4.431 531 HD3 LYS 66 HD1 LYS 66 -2.396 -12.515 -5.859 532 HE2 LYS 66 HE2 LYS 66 -0.625 -11.602 -7.261 533 HE3 LYS 66 HE1 LYS 66 0.124 -10.858 -5.848 534 HZ1 LYS 66 HZ1 LYS 66 0.690 -12.946 -4.973 535 HZ2 LYS 66 HZ2 LYS 66 1.092 -13.041 -6.616 536 HZ3 LYS 66 HZ3 LYS 66 -0.325 -13.781 -6.046 537 H ARG 67 HN ARG 67 -4.303 -6.853 -5.560 538 HA ARG 67 HA ARG 67 -4.181 -6.744 -8.495 539 HB2 ARG 67 HB2 ARG 67 -4.277 -4.384 -6.596 540 HB3 ARG 67 HB1 ARG 67 -4.566 -4.391 -8.334 541 HG2 ARG 67 HG2 ARG 67 -6.310 -5.610 -6.215 542 HG3 ARG 67 HG1 ARG 67 -6.659 -4.179 -7.190 543 HD2 ARG 67 HD2 ARG 67 -6.535 -5.645 -9.222 544 HD3 ARG 67 HD1 ARG 67 -6.409 -7.037 -8.130 545 HE ARG 67 HE ARG 67 -8.632 -6.886 -7.699 546 HH11 ARG 67 HH11 ARG 67 -7.652 -3.918 -9.316 547 HH12 ARG 67 HH12 ARG 67 -9.288 -3.366 -9.539 548 HH21 ARG 67 HH21 ARG 67 -10.751 -6.179 -8.031 549 HH22 ARG 67 HH22 ARG 67 -11.053 -4.637 -8.777 550 H VAL 68 HN VAL 68 -2.250 -6.506 -9.447 551 HA VAL 68 HA VAL 68 0.020 -5.945 -7.673 552 HB VAL 68 HB VAL 68 1.394 -7.289 -8.942 553 HG11 VAL 68 HG11 VAL 68 -0.302 -8.699 -7.902 554 HG12 VAL 68 HG12 VAL 68 0.230 -9.385 -9.440 555 HG13 VAL 68 HG13 VAL 68 -1.317 -8.547 -9.341 556 HG21 VAL 68 HG21 VAL 68 1.042 -6.183 -11.060 557 HG22 VAL 68 HG22 VAL 68 -0.500 -7.019 -11.269 558 HG23 VAL 68 HG23 VAL 68 1.009 -7.936 -11.266 559 H CYS 69 HN CYS 69 1.466 -4.344 -8.157 560 HA CYS 69 HA CYS 69 0.890 -2.722 -10.540 561 HB2 CYS 69 HB2 CYS 69 1.583 -1.703 -7.772 562 HB3 CYS 69 HB1 CYS 69 1.455 -0.702 -9.214 563 HG CYS 69 HG CYS 69 -1.297 -2.466 -8.833 564 H LYS 70 HN LYS 70 2.542 -2.960 -11.861 565 HA LYS 70 HA LYS 70 5.268 -3.248 -10.764 566 HB2 LYS 70 HB2 LYS 70 4.425 -3.782 -13.615 567 HB3 LYS 70 HB1 LYS 70 5.865 -4.354 -12.787 568 HG2 LYS 70 HG2 LYS 70 4.660 -5.973 -11.579 569 HG3 LYS 70 HG1 LYS 70 3.112 -5.220 -11.964 570 HD2 LYS 70 HD2 LYS 70 3.535 -5.755 -14.363 571 HD3 LYS 70 HD1 LYS 70 4.965 -6.654 -13.857 572 HE2 LYS 70 HE2 LYS 70 3.619 -8.187 -12.590 573 HE3 LYS 70 HE1 LYS 70 2.169 -7.227 -12.885 574 HZ1 LYS 70 HZ1 LYS 70 3.748 -8.713 -14.914 575 HZ2 LYS 70 HZ2 LYS 70 2.440 -7.696 -15.269 576 HZ3 LYS 70 HZ3 LYS 70 2.195 -9.102 -14.352 577 H ASP 71 HN ASP 71 3.391 -0.891 -11.532 578 HA ASP 71 HA ASP 71 5.122 0.504 -13.444 579 HB2 ASP 71 HB2 ASP 71 2.160 0.698 -12.847 580 HB3 ASP 71 HB1 ASP 71 2.995 1.872 -13.852 581 HA PRO 72 HA PRO 72 5.590 4.177 -10.636 582 HB2 PRO 72 HB2 PRO 72 3.620 5.405 -12.542 583 HB3 PRO 72 HB1 PRO 72 5.040 6.140 -11.789 584 HG2 PRO 72 HG2 PRO 72 5.238 5.310 -14.260 585 HG3 PRO 72 HG1 PRO 72 6.529 4.896 -13.113 586 HD2 PRO 72 HD2 PRO 72 4.347 3.193 -14.205 587 HD3 PRO 72 HD1 PRO 72 6.024 2.764 -13.834 588 HA PRO 73 HA PRO 73 2.802 5.366 -7.483 589 HB2 PRO 73 HB2 PRO 73 0.577 6.176 -9.315 590 HB3 PRO 73 HB1 PRO 73 1.013 6.839 -7.734 591 HG2 PRO 73 HG2 PRO 73 1.843 7.905 -10.137 592 HG3 PRO 73 HG1 PRO 73 2.700 8.121 -8.605 593 HD2 PRO 73 HD2 PRO 73 3.610 6.743 -10.918 594 HD3 PRO 73 HD1 PRO 73 4.417 6.846 -9.343 595 H TYR 74 HN TYR 74 2.380 3.539 -6.576 596 HA TYR 74 HA TYR 74 0.878 1.449 -7.891 597 HB2 TYR 74 HB2 TYR 74 2.116 1.409 -5.145 598 HB3 TYR 74 HB1 TYR 74 1.741 0.031 -6.163 599 HD1 TYR 74 HD2 TYR 74 3.975 3.006 -5.928 600 HD2 TYR 74 HD1 TYR 74 3.387 -0.856 -7.604 601 HE1 TYR 74 HE2 TYR 74 6.281 3.032 -6.784 602 HE2 TYR 74 HE1 TYR 74 5.697 -0.840 -8.460 603 HH TYR 74 HH TYR 74 7.434 0.817 -9.050 604 H LYS 75 HN LYS 75 -1.219 1.031 -7.489 605 HA LYS 75 HA LYS 75 -2.539 1.922 -5.068 606 HB2 LYS 75 HB2 LYS 75 -4.054 3.443 -6.380 607 HB3 LYS 75 HB1 LYS 75 -2.394 4.021 -6.214 608 HG2 LYS 75 HG2 LYS 75 -1.849 3.339 -8.418 609 HG3 LYS 75 HG1 LYS 75 -3.386 2.512 -8.608 610 HD2 LYS 75 HD2 LYS 75 -2.750 5.405 -8.649 611 HD3 LYS 75 HD1 LYS 75 -3.785 4.489 -9.727 612 HE2 LYS 75 HE2 LYS 75 -5.324 4.253 -7.700 613 HE3 LYS 75 HE1 LYS 75 -4.351 5.556 -7.016 614 HZ1 LYS 75 HZ1 LYS 75 -5.983 5.648 -9.487 615 HZ2 LYS 75 HZ2 LYS 75 -4.870 6.855 -9.062 616 HZ3 LYS 75 HZ3 LYS 75 -6.206 6.548 -8.065 617 H VAL 76 HN VAL 76 -4.859 1.621 -5.233 618 HA VAL 76 HA VAL 76 -5.830 -0.231 -7.277 619 HB VAL 76 HB VAL 76 -5.887 -0.791 -4.327 620 HG11 VAL 76 HG11 VAL 76 -8.173 -0.958 -5.353 621 HG12 VAL 76 HG12 VAL 76 -7.561 -2.458 -4.652 622 HG13 VAL 76 HG13 VAL 76 -7.537 -2.227 -6.402 623 HG21 VAL 76 HG21 VAL 76 -4.015 -1.754 -5.492 624 HG22 VAL 76 HG22 VAL 76 -5.074 -2.407 -6.735 625 HG23 VAL 76 HG23 VAL 76 -5.152 -3.035 -5.090 626 H GLU 77 HN GLU 77 -7.830 0.319 -7.940 627 HA GLU 77 HA GLU 77 -9.449 2.018 -6.155 628 HB2 GLU 77 HB2 GLU 77 -9.337 2.025 -9.171 629 HB3 GLU 77 HB1 GLU 77 -10.466 2.948 -8.210 630 HG2 GLU 77 HG2 GLU 77 -8.856 4.350 -7.379 631 HG3 GLU 77 HG1 GLU 77 -7.582 3.209 -7.759 632 H GLU 78 HN GLU 78 -11.191 1.099 -5.446 633 HA GLU 78 HA GLU 78 -12.610 -0.814 -7.124 634 HB2 GLU 78 HB2 GLU 78 -11.005 -1.579 -4.808 635 HB3 GLU 78 HB1 GLU 78 -12.676 -2.113 -4.676 636 HG2 GLU 78 HG2 GLU 78 -10.646 -2.817 -6.772 637 HG3 GLU 78 HG1 GLU 78 -11.541 -3.879 -5.687 638 H SER 79 HN SER 79 -14.532 -1.727 -5.730 639 HA SER 79 HA SER 79 -15.701 0.399 -4.102 640 HB2 SER 79 HB2 SER 79 -16.368 0.819 -6.470 641 HB3 SER 79 HB1 SER 79 -17.118 -0.780 -6.508 642 HG SER 79 HG SER 79 -17.999 1.576 -5.362 643 H GLY 80 HN GLY 80 -17.258 -0.306 -2.676 644 HA2 GLY 80 HA2 GLY 80 -18.166 -3.024 -2.563 645 HA3 GLY 80 HA1 GLY 80 -16.869 -2.700 -1.418 646 H TYR 81 HN TYR 81 -18.307 -2.991 0.397 647 HA TYR 81 HA TYR 81 -19.770 -0.535 0.948 648 HB2 TYR 81 HB2 TYR 81 -21.802 -1.784 1.725 649 HB3 TYR 81 HB1 TYR 81 -21.534 -1.823 -0.014 650 HD1 TYR 81 HD2 TYR 81 -21.365 -3.836 3.079 651 HD2 TYR 81 HD1 TYR 81 -21.115 -3.864 -1.168 652 HE1 TYR 81 HE2 TYR 81 -21.475 -6.293 3.091 653 HE2 TYR 81 HE1 TYR 81 -21.228 -6.318 -1.162 654 HH TYR 81 HH TYR 81 -22.146 -8.118 1.535 655 H ALA 82 HN ALA 82 -17.382 -2.090 1.995 656 HA ALA 82 HA ALA 82 -17.919 -1.518 4.757 657 HB1 ALA 82 HB1 ALA 82 -18.675 -3.637 5.138 658 HB2 ALA 82 HB2 ALA 82 -16.947 -3.936 5.295 659 HB3 ALA 82 HB3 ALA 82 -17.774 -4.317 3.785 660 H GLY 83 HN GLY 83 -15.993 -1.680 6.098 661 HA2 GLY 83 HA2 GLY 83 -13.540 -1.349 4.518 662 HA3 GLY 83 HA1 GLY 83 -13.793 -0.763 6.158 663 H PHE 84 HN PHE 84 -11.527 -2.014 5.890 664 HA PHE 84 HA PHE 84 -11.539 -4.274 7.516 665 HB2 PHE 84 HB2 PHE 84 -10.964 -6.052 5.859 666 HB3 PHE 84 HB1 PHE 84 -12.621 -5.486 5.718 667 HD1 PHE 84 HD1 PHE 84 -13.138 -3.788 3.880 668 HD2 PHE 84 HD2 PHE 84 -9.551 -6.073 3.992 669 HE1 PHE 84 HE1 PHE 84 -12.818 -3.379 1.483 670 HE2 PHE 84 HE2 PHE 84 -9.207 -5.664 1.596 671 HZ PHE 84 HZ PHE 84 -10.841 -4.315 0.327 672 H ILE 85 HN ILE 85 -9.398 -5.131 7.864 673 HA ILE 85 HA ILE 85 -7.224 -3.434 7.177 674 HB ILE 85 HB ILE 85 -7.351 -6.214 8.338 675 HG12 ILE 85 HG12 ILE 85 -7.926 -4.280 9.781 676 HG13 ILE 85 HG11 ILE 85 -6.492 -5.140 10.330 677 HG21 ILE 85 HG21 ILE 85 -4.842 -4.647 7.758 678 HG22 ILE 85 HG22 ILE 85 -5.348 -6.125 6.939 679 HG23 ILE 85 HG23 ILE 85 -4.931 -6.164 8.653 680 HD11 ILE 85 HD11 ILE 85 -6.425 -2.609 8.718 681 HD12 ILE 85 HD12 ILE 85 -5.061 -3.433 9.468 682 HD13 ILE 85 HD13 ILE 85 -6.301 -2.685 10.474 683 H LEU 86 HN LEU 86 -6.094 -3.338 5.356 684 HA LEU 86 HA LEU 86 -6.363 -5.573 3.459 685 HB2 LEU 86 HB2 LEU 86 -7.162 -3.093 2.965 686 HB3 LEU 86 HB1 LEU 86 -5.457 -2.865 2.611 687 HG LEU 86 HG LEU 86 -6.775 -5.180 1.313 688 HD11 LEU 86 HD11 LEU 86 -7.148 -2.415 0.196 689 HD12 LEU 86 HD12 LEU 86 -8.382 -3.221 1.165 690 HD13 LEU 86 HD13 LEU 86 -7.855 -3.935 -0.358 691 HD21 LEU 86 HD21 LEU 86 -5.284 -3.352 -0.299 692 HD22 LEU 86 HD22 LEU 86 -5.004 -5.065 -0.005 693 HD23 LEU 86 HD23 LEU 86 -4.360 -3.856 1.111 694 HA PRO 87 HA PRO 87 -2.018 -6.007 4.504 695 HB2 PRO 87 HB2 PRO 87 -2.178 -8.481 2.975 696 HB3 PRO 87 HB1 PRO 87 -1.868 -8.259 4.696 697 HG2 PRO 87 HG2 PRO 87 -4.166 -9.344 3.724 698 HG3 PRO 87 HG1 PRO 87 -4.077 -8.455 5.255 699 HD2 PRO 87 HD2 PRO 87 -5.067 -7.545 2.585 700 HD3 PRO 87 HD1 PRO 87 -5.701 -7.191 4.207 701 H ILE 88 HN ILE 88 -1.009 -4.536 3.238 702 HA ILE 88 HA ILE 88 -0.980 -4.927 0.347 703 HB ILE 88 HB ILE 88 0.057 -2.539 1.893 704 HG12 ILE 88 HG12 ILE 88 -2.583 -2.650 0.443 705 HG13 ILE 88 HG11 ILE 88 -2.474 -3.174 2.121 706 HG21 ILE 88 HG21 ILE 88 0.914 -2.846 -0.386 707 HG22 ILE 88 HG22 ILE 88 -0.112 -1.418 -0.253 708 HG23 ILE 88 HG23 ILE 88 -0.740 -2.889 -0.996 709 HD11 ILE 88 HD11 ILE 88 -1.666 -0.455 1.132 710 HD12 ILE 88 HD12 ILE 88 -1.756 -0.993 2.804 711 HD13 ILE 88 HD13 ILE 88 -3.228 -0.843 1.845 712 H GLU 89 HN GLU 89 0.922 -5.182 -0.788 713 HA GLU 89 HA GLU 89 3.344 -5.564 0.842 714 HB2 GLU 89 HB2 GLU 89 2.347 -7.199 -1.480 715 HB3 GLU 89 HB1 GLU 89 4.009 -7.266 -0.907 716 HG2 GLU 89 HG2 GLU 89 3.165 -7.960 1.307 717 HG3 GLU 89 HG1 GLU 89 1.536 -8.001 0.635 718 H VAL 90 HN VAL 90 5.096 -4.509 0.211 719 HA VAL 90 HA VAL 90 5.174 -3.509 -2.552 720 HB VAL 90 HB VAL 90 6.819 -2.364 -0.313 721 HG11 VAL 90 HG11 VAL 90 7.336 -0.682 -1.907 722 HG12 VAL 90 HG12 VAL 90 6.135 -1.287 -3.027 723 HG13 VAL 90 HG13 VAL 90 7.583 -2.231 -2.689 724 HG21 VAL 90 HG21 VAL 90 4.262 -2.090 -0.127 725 HG22 VAL 90 HG22 VAL 90 4.419 -1.042 -1.536 726 HG23 VAL 90 HG23 VAL 90 5.262 -0.641 -0.039 727 H TYR 91 HN TYR 91 6.594 -4.480 -3.824 728 HA TYR 91 HA TYR 91 8.498 -6.348 -2.646 729 HB2 TYR 91 HB2 TYR 91 7.563 -5.797 -5.435 730 HB3 TYR 91 HB1 TYR 91 9.058 -6.680 -5.176 731 HD1 TYR 91 HD1 TYR 91 5.770 -6.836 -3.394 732 HD2 TYR 91 HD2 TYR 91 8.677 -8.875 -5.729 733 HE1 TYR 91 HE1 TYR 91 4.511 -8.928 -3.133 734 HE2 TYR 91 HE2 TYR 91 7.414 -10.968 -5.486 735 HH TYR 91 HH TYR 91 4.241 -11.077 -4.336 736 H PHE 92 HN PHE 92 10.605 -6.107 -2.568 737 HA PHE 92 HA PHE 92 11.685 -3.459 -3.283 738 HB2 PHE 92 HB2 PHE 92 12.554 -5.588 -1.300 739 HB3 PHE 92 HB1 PHE 92 13.501 -4.138 -1.644 740 HD1 PHE 92 HD1 PHE 92 11.086 -2.261 -1.894 741 HD2 PHE 92 HD2 PHE 92 12.159 -5.191 1.002 742 HE1 PHE 92 HE1 PHE 92 9.887 -0.990 -0.174 743 HE2 PHE 92 HE2 PHE 92 10.928 -3.922 2.726 744 HZ PHE 92 HZ PHE 92 9.810 -1.821 2.133 745 H LYS 93 HN LYS 93 13.925 -3.424 -4.197 746 HA LYS 93 HA LYS 93 14.492 -5.795 -5.827 747 HB2 LYS 93 HB2 LYS 93 15.632 -2.995 -6.004 748 HB3 LYS 93 HB1 LYS 93 15.968 -4.312 -7.121 749 HG2 LYS 93 HG2 LYS 93 13.655 -4.322 -7.842 750 HG3 LYS 93 HG1 LYS 93 13.270 -3.057 -6.673 751 HD2 LYS 93 HD2 LYS 93 14.496 -1.438 -7.814 752 HD3 LYS 93 HD1 LYS 93 15.430 -2.646 -8.709 753 HE2 LYS 93 HE2 LYS 93 13.921 -2.545 -10.409 754 HE3 LYS 93 HE1 LYS 93 12.638 -3.010 -9.302 755 HZ1 LYS 93 HZ1 LYS 93 12.212 -0.902 -10.423 756 HZ2 LYS 93 HZ2 LYS 93 13.602 -0.230 -9.732 757 HZ3 LYS 93 HZ3 LYS 93 12.303 -0.700 -8.746 758 H ASN 94 HN ASN 94 15.541 -7.110 -4.331 759 HA ASN 94 HA ASN 94 18.296 -6.411 -3.863 760 HB2 ASN 94 HB2 ASN 94 18.118 -6.980 -1.398 761 HB3 ASN 94 HB1 ASN 94 17.451 -5.426 -1.879 762 HD21 ASN 94 HD21 ASN 94 16.164 -5.370 -0.030 763 HD22 ASN 94 HD22 ASN 94 14.757 -6.358 0.142 764 H LYS 95 HN LYS 95 19.619 -8.186 -3.360 765 HA LYS 95 HA LYS 95 18.374 -10.834 -3.678 766 HB2 LYS 95 HB2 LYS 95 21.249 -9.961 -3.943 767 HB3 LYS 95 HB1 LYS 95 20.701 -11.620 -4.098 768 HG2 LYS 95 HG2 LYS 95 19.355 -10.999 -6.036 769 HG3 LYS 95 HG1 LYS 95 19.900 -9.325 -5.876 770 HD2 LYS 95 HD2 LYS 95 22.189 -9.988 -6.294 771 HD3 LYS 95 HD1 LYS 95 21.726 -11.690 -6.320 772 HE2 LYS 95 HE2 LYS 95 22.047 -10.821 -8.579 773 HE3 LYS 95 HE1 LYS 95 20.372 -11.303 -8.315 774 HZ1 LYS 95 HZ1 LYS 95 19.779 -8.988 -7.994 775 HZ2 LYS 95 HZ2 LYS 95 20.554 -9.180 -9.490 776 HZ3 LYS 95 HZ3 LYS 95 21.395 -8.513 -8.178 777 H GLU 96 HN GLU 96 19.257 -8.721 -1.457 778 HA GLU 96 HA GLU 96 20.306 -10.591 0.516 779 HB2 GLU 96 HB2 GLU 96 20.727 -8.451 1.849 780 HB3 GLU 96 HB1 GLU 96 21.699 -8.643 0.398 781 HG2 GLU 96 HG2 GLU 96 19.168 -7.047 0.378 782 HG3 GLU 96 HG1 GLU 96 20.696 -6.349 0.911 783 H GLU 97 HN GLU 97 19.350 -8.736 2.639 784 HA GLU 97 HA GLU 97 17.341 -9.900 3.871 785 HB2 GLU 97 HB2 GLU 97 17.556 -6.913 3.505 786 HB3 GLU 97 HB1 GLU 97 16.577 -7.705 4.736 787 HG2 GLU 97 HG2 GLU 97 19.580 -7.854 4.467 788 HG3 GLU 97 HG1 GLU 97 18.683 -6.911 5.653 789 HA PRO 98 HA PRO 98 13.399 -10.481 2.425 790 HB2 PRO 98 HB2 PRO 98 11.916 -8.312 3.578 791 HB3 PRO 98 HB1 PRO 98 11.993 -9.987 4.130 792 HG2 PRO 98 HG2 PRO 98 13.553 -7.628 5.006 793 HG3 PRO 98 HG1 PRO 98 13.069 -9.063 5.931 794 HD2 PRO 98 HD2 PRO 98 15.597 -8.768 5.182 795 HD3 PRO 98 HD1 PRO 98 14.816 -10.362 5.036 796 H ARG 99 HN ARG 99 12.589 -10.212 0.478 797 HA ARG 99 HA ARG 99 13.143 -7.755 -0.973 798 HB2 ARG 99 HB2 ARG 99 11.813 -10.219 -2.068 799 HB3 ARG 99 HB1 ARG 99 12.753 -9.007 -2.931 800 HG2 ARG 99 HG2 ARG 99 14.720 -9.757 -1.549 801 HG3 ARG 99 HG1 ARG 99 13.731 -11.132 -1.058 802 HD2 ARG 99 HD2 ARG 99 14.620 -10.425 -3.851 803 HD3 ARG 99 HD1 ARG 99 15.067 -11.840 -2.902 804 HE ARG 99 HE ARG 99 12.819 -12.664 -3.166 805 HH11 ARG 99 HH11 ARG 99 13.690 -9.946 -5.195 806 HH12 ARG 99 HH12 ARG 99 12.463 -10.268 -6.381 807 HH21 ARG 99 HH21 ARG 99 11.212 -13.097 -4.723 808 HH22 ARG 99 HH22 ARG 99 11.046 -12.059 -6.105 809 H LYS 100 HN LYS 100 10.877 -8.404 1.049 810 HA LYS 100 HA LYS 100 8.873 -6.855 -0.374 811 HB2 LYS 100 HB2 LYS 100 7.030 -8.393 0.189 812 HB3 LYS 100 HB1 LYS 100 8.183 -9.129 -0.916 813 HG2 LYS 100 HG2 LYS 100 9.024 -10.556 0.712 814 HG3 LYS 100 HG1 LYS 100 8.419 -9.560 2.035 815 HD2 LYS 100 HD2 LYS 100 7.014 -11.436 2.016 816 HD3 LYS 100 HD1 LYS 100 6.083 -10.179 1.205 817 HE2 LYS 100 HE2 LYS 100 7.725 -12.195 -0.308 818 HE3 LYS 100 HE1 LYS 100 6.059 -12.505 0.174 819 HZ1 LYS 100 HZ1 LYS 100 5.434 -10.457 -1.041 820 HZ2 LYS 100 HZ2 LYS 100 6.057 -11.685 -2.032 821 HZ3 LYS 100 HZ3 LYS 100 7.029 -10.360 -1.625 822 H VAL 101 HN VAL 101 7.508 -5.733 0.958 823 HA VAL 101 HA VAL 101 7.711 -6.224 3.846 824 HB VAL 101 HB VAL 101 8.961 -4.179 3.183 825 HG11 VAL 101 HG11 VAL 101 7.860 -3.348 1.294 826 HG12 VAL 101 HG12 VAL 101 7.520 -2.168 2.570 827 HG13 VAL 101 HG13 VAL 101 6.290 -3.346 2.111 828 HG21 VAL 101 HG21 VAL 101 8.027 -2.724 4.869 829 HG22 VAL 101 HG22 VAL 101 7.950 -4.405 5.407 830 HG23 VAL 101 HG23 VAL 101 6.497 -3.602 4.811 831 H ARG 102 HN ARG 102 5.738 -6.162 4.944 832 HA ARG 102 HA ARG 102 3.394 -5.889 3.181 833 HB2 ARG 102 HB2 ARG 102 4.034 -8.219 4.127 834 HB3 ARG 102 HB1 ARG 102 3.399 -7.603 5.652 835 HG2 ARG 102 HG2 ARG 102 1.280 -7.020 4.255 836 HG3 ARG 102 HG1 ARG 102 1.963 -8.104 3.054 837 HD2 ARG 102 HD2 ARG 102 0.459 -9.378 4.338 838 HD3 ARG 102 HD1 ARG 102 2.074 -9.837 4.853 839 HE ARG 102 HE ARG 102 0.746 -7.777 6.414 840 HH11 ARG 102 HH11 ARG 102 1.644 -11.157 6.129 841 HH12 ARG 102 HH12 ARG 102 1.324 -11.498 7.806 842 HH21 ARG 102 HH21 ARG 102 0.324 -8.223 8.583 843 HH22 ARG 102 HH22 ARG 102 0.553 -9.840 9.195 844 H PHE 103 HN PHE 103 2.253 -4.181 3.641 845 HA PHE 103 HA PHE 103 2.257 -3.139 6.387 846 HB2 PHE 103 HB2 PHE 103 1.590 -1.789 3.762 847 HB3 PHE 103 HB1 PHE 103 1.510 -1.009 5.334 848 HD1 PHE 103 HD1 PHE 103 3.997 -1.990 6.601 849 HD2 PHE 103 HD2 PHE 103 3.246 -0.671 2.621 850 HE1 PHE 103 HE1 PHE 103 6.352 -1.289 6.387 851 HE2 PHE 103 HE2 PHE 103 5.591 0.021 2.407 852 HZ PHE 103 HZ PHE 103 7.144 -0.284 4.289 853 H ASP 104 HN ASP 104 0.540 -3.770 7.519 854 HA ASP 104 HA ASP 104 -1.948 -4.485 6.208 855 HB2 ASP 104 HB2 ASP 104 -1.187 -4.411 9.137 856 HB3 ASP 104 HB1 ASP 104 -2.744 -4.955 8.534 857 H TYR 105 HN TYR 105 -2.636 -2.546 5.313 858 HA TYR 105 HA TYR 105 -2.886 -0.220 7.048 859 HB2 TYR 105 HB2 TYR 105 -1.981 0.113 4.805 860 HB3 TYR 105 HB1 TYR 105 -3.425 -0.606 4.091 861 HD1 TYR 105 HD1 TYR 105 -2.485 2.219 6.376 862 HD2 TYR 105 HD2 TYR 105 -5.036 0.786 3.301 863 HE1 TYR 105 HE1 TYR 105 -3.539 4.441 6.219 864 HE2 TYR 105 HE2 TYR 105 -6.091 2.984 3.128 865 HH TYR 105 HH TYR 105 -4.764 5.764 4.459 866 H ASP 106 HN ASP 106 -4.740 0.511 7.894 867 HA ASP 106 HA ASP 106 -7.048 -1.208 7.769 868 HB2 ASP 106 HB2 ASP 106 -6.267 -0.095 9.868 869 HB3 ASP 106 HB1 ASP 106 -6.750 1.453 9.182 870 H LEU 107 HN LEU 107 -8.353 -1.092 6.056 871 HA LEU 107 HA LEU 107 -8.731 1.376 4.612 872 HB2 LEU 107 HB2 LEU 107 -9.155 -1.427 4.150 873 HB3 LEU 107 HB1 LEU 107 -10.621 -0.539 3.781 874 HG LEU 107 HG LEU 107 -9.220 0.935 2.282 875 HD11 LEU 107 HD11 LEU 107 -7.093 -0.053 1.508 876 HD12 LEU 107 HD12 LEU 107 -7.175 -1.192 2.856 877 HD13 LEU 107 HD13 LEU 107 -7.038 0.540 3.170 878 HD21 LEU 107 HD21 LEU 107 -9.031 -0.837 0.520 879 HD22 LEU 107 HD22 LEU 107 -10.609 -0.697 1.300 880 HD23 LEU 107 HD23 LEU 107 -9.513 -2.002 1.756 881 H PHE 108 HN PHE 108 -9.833 2.777 6.026 882 HA PHE 108 HA PHE 108 -12.440 1.831 6.980 883 HB2 PHE 108 HB2 PHE 108 -12.515 3.816 8.414 884 HB3 PHE 108 HB1 PHE 108 -11.065 2.871 8.715 885 HD1 PHE 108 HD2 PHE 108 -12.383 5.973 7.234 886 HD2 PHE 108 HD1 PHE 108 -8.891 3.805 8.345 887 HE1 PHE 108 HE2 PHE 108 -11.035 8.010 6.953 888 HE2 PHE 108 HE1 PHE 108 -7.542 5.844 8.076 889 HZ PHE 108 HZ PHE 108 -8.611 7.946 7.374 890 H LEU 109 HN LEU 109 -14.336 2.715 6.337 891 HA LEU 109 HA LEU 109 -14.196 4.801 4.249 892 HB2 LEU 109 HB2 LEU 109 -16.342 2.686 4.506 893 HB3 LEU 109 HB1 LEU 109 -16.077 3.783 3.164 894 HG LEU 109 HG LEU 109 -14.298 1.475 3.952 895 HD11 LEU 109 HD11 LEU 109 -16.434 0.861 2.855 896 HD12 LEU 109 HD12 LEU 109 -15.008 0.449 1.906 897 HD13 LEU 109 HD13 LEU 109 -15.970 1.863 1.482 898 HD21 LEU 109 HD21 LEU 109 -14.018 3.503 1.741 899 HD22 LEU 109 HD22 LEU 109 -13.100 1.999 1.842 900 HD23 LEU 109 HD23 LEU 109 -12.915 3.229 3.092 901 H HIS 110 HN HIS 110 -16.075 6.308 4.286 902 HA HIS 110 HA HIS 110 -16.952 6.671 7.062 903 HB2 HIS 110 HB2 HIS 110 -15.703 8.464 5.554 904 HB3 HIS 110 HB1 HIS 110 -17.343 8.804 5.013 905 HD1 HIS 110 HD1 HIS 110 -18.822 10.161 6.571 906 HD2 HIS 110 HD2 HIS 110 -15.248 8.970 8.338 907 HE1 HIS 110 HE1 HIS 110 -18.719 11.366 8.772 908 HE2 HIS 110 HE2 HIS 110 -16.554 10.637 9.829 909 H LEU 111 HN LEU 111 -19.124 7.555 7.435 910 HA LEU 111 HA LEU 111 -21.054 5.808 6.413 911 HB2 LEU 111 HB2 LEU 111 -20.917 7.902 8.388 912 HB3 LEU 111 HB1 LEU 111 -22.443 7.962 7.523 913 HG LEU 111 HG LEU 111 -22.545 6.590 9.587 914 HD11 LEU 111 HD11 LEU 111 -23.533 4.559 8.501 915 HD12 LEU 111 HD12 LEU 111 -22.968 5.192 6.954 916 HD13 LEU 111 HD13 LEU 111 -24.150 6.098 7.899 917 HD21 LEU 111 HD21 LEU 111 -20.665 4.775 8.090 918 HD22 LEU 111 HD22 LEU 111 -21.438 4.427 9.640 919 HD23 LEU 111 HD23 LEU 111 -20.253 5.728 9.518 920 H GLU 112 HN GLU 112 -22.804 6.043 5.150 921 HA GLU 112 HA GLU 112 -22.537 7.419 2.745 922 HB2 GLU 112 HB2 GLU 112 -23.980 5.370 3.294 923 HB3 GLU 112 HB1 GLU 112 -25.170 6.511 3.894 924 HG2 GLU 112 HG2 GLU 112 -25.291 7.567 1.702 925 HG3 GLU 112 HG1 GLU 112 -24.094 6.429 1.084 926 H GLY 113 HN GLY 113 -23.134 9.382 2.037 927 HA2 GLY 113 HA2 GLY 113 -24.762 11.195 2.076 928 HA3 GLY 113 HA1 GLY 113 -24.824 11.018 3.824 929 H HIS 114 HN HIS 114 -22.114 10.845 4.415 930 HA HIS 114 HA HIS 114 -20.923 13.279 3.299 931 HB2 HIS 114 HB2 HIS 114 -21.416 12.909 6.271 932 HB3 HIS 114 HB1 HIS 114 -20.349 14.122 5.585 933 HD1 HIS 114 HD1 HIS 114 -21.396 16.244 4.683 934 HD2 HIS 114 HD2 HIS 114 -24.191 13.395 5.858 935 HE1 HIS 114 HE1 HIS 114 -23.607 17.435 4.714 936 HE2 HIS 114 HE2 HIS 114 -25.248 15.747 5.604 937 HA PRO 115 HA PRO 115 -17.632 10.333 4.376 938 HB2 PRO 115 HB2 PRO 115 -17.104 9.247 1.992 939 HB3 PRO 115 HB1 PRO 115 -18.484 8.712 2.956 940 HG2 PRO 115 HG2 PRO 115 -18.445 10.286 0.465 941 HG3 PRO 115 HG1 PRO 115 -19.765 9.345 1.176 942 HD2 PRO 115 HD2 PRO 115 -19.264 12.206 1.353 943 HD3 PRO 115 HD1 PRO 115 -20.684 11.289 1.902 944 HA PRO 116 HA PRO 116 -14.425 12.905 2.504 945 HB2 PRO 116 HB2 PRO 116 -13.519 14.119 4.720 946 HB3 PRO 116 HB1 PRO 116 -14.916 14.741 3.836 947 HG2 PRO 116 HG2 PRO 116 -14.809 13.406 6.452 948 HG3 PRO 116 HG1 PRO 116 -16.078 14.432 5.766 949 HD2 PRO 116 HD2 PRO 116 -15.932 11.533 5.856 950 HD3 PRO 116 HD1 PRO 116 -17.276 12.567 5.328 951 H VAL 117 HN VAL 117 -13.280 10.866 2.149 952 HA VAL 117 HA VAL 117 -11.544 10.248 4.452 953 HB VAL 117 HB VAL 117 -12.675 8.306 2.445 954 HG11 VAL 117 HG11 VAL 117 -10.481 7.951 4.465 955 HG12 VAL 117 HG12 VAL 117 -10.402 7.680 2.729 956 HG13 VAL 117 HG13 VAL 117 -11.361 6.607 3.748 957 HG21 VAL 117 HG21 VAL 117 -13.497 7.179 4.501 958 HG22 VAL 117 HG22 VAL 117 -14.192 8.780 4.251 959 HG23 VAL 117 HG23 VAL 117 -12.911 8.551 5.442 960 H ASN 118 HN ASN 118 -9.629 11.003 4.089 961 HA ASN 118 HA ASN 118 -8.198 10.130 1.704 962 HB2 ASN 118 HB2 ASN 118 -9.062 12.490 1.305 963 HB3 ASN 118 HB1 ASN 118 -8.031 13.009 2.630 964 HD21 ASN 118 HD21 ASN 118 -5.665 12.567 2.362 965 HD22 ASN 118 HD22 ASN 118 -5.019 12.616 0.758 966 H HIS 119 HN HIS 119 -6.833 8.798 2.868 967 HA HIS 119 HA HIS 119 -5.374 10.076 5.092 968 HB2 HIS 119 HB2 HIS 119 -7.137 8.357 5.779 969 HB3 HIS 119 HB1 HIS 119 -6.089 7.159 5.025 970 HD1 HIS 119 HD1 HIS 119 -5.258 5.899 7.028 971 HD2 HIS 119 HD2 HIS 119 -4.865 10.021 7.449 972 HE1 HIS 119 HE1 HIS 119 -3.913 6.244 9.119 973 HE2 HIS 119 HE2 HIS 119 -3.909 8.738 9.481 974 H LEU 120 HN LEU 120 -3.272 9.903 5.084 975 HA LEU 120 HA LEU 120 -1.925 7.789 3.578 976 HB2 LEU 120 HB2 LEU 120 -1.674 10.727 3.125 977 HB3 LEU 120 HB1 LEU 120 -0.222 9.756 3.015 978 HG LEU 120 HG LEU 120 -2.686 9.155 1.400 979 HD11 LEU 120 HD11 LEU 120 -0.777 10.148 -0.302 980 HD12 LEU 120 HD12 LEU 120 -0.671 11.236 1.082 981 HD13 LEU 120 HD13 LEU 120 -2.211 11.015 0.248 982 HD21 LEU 120 HD21 LEU 120 -0.700 7.499 1.916 983 HD22 LEU 120 HD22 LEU 120 0.109 8.448 0.666 984 HD23 LEU 120 HD23 LEU 120 -1.400 7.612 0.299 985 H ARG 121 HN ARG 121 -0.331 6.896 4.717 986 HA ARG 121 HA ARG 121 0.890 8.430 6.904 987 HB2 ARG 121 HB2 ARG 121 0.880 6.270 8.260 988 HB3 ARG 121 HB1 ARG 121 -0.655 7.115 8.110 989 HG2 ARG 121 HG2 ARG 121 -1.260 4.923 7.776 990 HG3 ARG 121 HG1 ARG 121 -1.070 5.503 6.131 991 HD2 ARG 121 HD2 ARG 121 -0.065 3.348 6.282 992 HD3 ARG 121 HD1 ARG 121 1.230 4.527 6.118 993 HE ARG 121 HE ARG 121 1.969 3.971 8.229 994 HH11 ARG 121 HH11 ARG 121 -1.235 2.626 7.752 995 HH12 ARG 121 HH12 ARG 121 -1.097 1.499 9.065 996 HH21 ARG 121 HH21 ARG 121 2.152 2.498 9.943 997 HH22 ARG 121 HH22 ARG 121 0.828 1.436 10.326 998 H CYS 122 HN CYS 122 3.011 7.644 7.535 999 HA CYS 122 HA CYS 122 4.308 6.442 5.189 1000 HB2 CYS 122 HB2 CYS 122 5.485 8.491 7.028 1001 HB3 CYS 122 HB1 CYS 122 6.161 7.920 5.513 1002 HG CYS 122 HG CYS 122 3.990 9.025 3.993 1003 H GLU 123 HN GLU 123 5.523 4.728 5.469 1004 HA GLU 123 HA GLU 123 6.190 3.842 8.189 1005 HB2 GLU 123 HB2 GLU 123 5.978 2.389 5.551 1006 HB3 GLU 123 HB1 GLU 123 6.671 1.654 6.993 1007 HG2 GLU 123 HG2 GLU 123 3.808 2.445 6.463 1008 HG3 GLU 123 HG1 GLU 123 4.491 0.914 6.981 1009 H LYS 124 HN LYS 124 8.309 2.816 8.478 1010 HA LYS 124 HA LYS 124 10.387 4.098 6.830 1011 HB2 LYS 124 HB2 LYS 124 10.120 5.350 8.896 1012 HB3 LYS 124 HB1 LYS 124 10.243 3.871 9.837 1013 HG2 LYS 124 HG2 LYS 124 12.569 3.633 8.780 1014 HG3 LYS 124 HG1 LYS 124 12.394 5.335 8.357 1015 HD2 LYS 124 HD2 LYS 124 13.540 5.236 10.408 1016 HD3 LYS 124 HD1 LYS 124 11.896 5.773 10.768 1017 HE2 LYS 124 HE2 LYS 124 11.263 3.656 11.567 1018 HE3 LYS 124 HE1 LYS 124 12.687 2.890 10.866 1019 HZ1 LYS 124 HZ1 LYS 124 14.056 4.084 12.479 1020 HZ2 LYS 124 HZ2 LYS 124 12.907 3.114 13.256 1021 HZ3 LYS 124 HZ3 LYS 124 12.672 4.789 13.158 1022 H LEU 125 HN LEU 125 11.846 2.684 6.062 1023 HA LEU 125 HA LEU 125 12.268 0.193 7.598 1024 HB2 LEU 125 HB2 LEU 125 12.659 0.518 4.630 1025 HB3 LEU 125 HB1 LEU 125 12.649 -0.974 5.543 1026 HG LEU 125 HG LEU 125 10.149 0.618 5.634 1027 HD11 LEU 125 HD11 LEU 125 10.766 0.843 3.272 1028 HD12 LEU 125 HD12 LEU 125 9.382 -0.234 3.485 1029 HD13 LEU 125 HD13 LEU 125 10.981 -0.908 3.171 1030 HD21 LEU 125 HD21 LEU 125 9.224 -1.723 5.320 1031 HD22 LEU 125 HD22 LEU 125 10.149 -1.438 6.799 1032 HD23 LEU 125 HD23 LEU 125 10.893 -2.291 5.447 1033 H THR 126 HN THR 126 14.124 0.576 8.689 1034 HA THR 126 HA THR 126 16.326 1.990 7.374 1035 HB THR 126 HB THR 126 16.484 0.937 10.174 1036 HG1 THR 126 HG1 THR 126 14.460 2.037 10.031 1037 HG21 THR 126 HG21 THR 126 18.323 2.149 8.815 1038 HG22 THR 126 HG22 THR 126 18.033 2.622 10.489 1039 HG23 THR 126 HG23 THR 126 17.388 3.601 9.170 1040 H PHE 127 HN PHE 127 17.844 0.870 6.352 1041 HA PHE 127 HA PHE 127 18.257 -1.937 7.121 1042 HB2 PHE 127 HB2 PHE 127 18.990 -0.535 4.540 1043 HB3 PHE 127 HB1 PHE 127 19.219 -2.249 4.884 1044 HD1 PHE 127 HD1 PHE 127 17.313 -3.762 5.007 1045 HD2 PHE 127 HD2 PHE 127 16.816 0.357 4.070 1046 HE1 PHE 127 HE1 PHE 127 15.023 -4.214 4.244 1047 HE2 PHE 127 HE2 PHE 127 14.533 -0.084 3.302 1048 HZ PHE 127 HZ PHE 127 13.623 -2.372 3.397 1049 H ASN 128 HN ASN 128 19.805 -2.110 8.537 1050 HA ASN 128 HA ASN 128 21.973 -0.253 8.743 1051 HB2 ASN 128 HB2 ASN 128 21.362 -2.837 10.169 1052 HB3 ASN 128 HB1 ASN 128 22.776 -1.847 10.511 1053 HD21 ASN 128 HD21 ASN 128 19.299 -2.040 10.704 1054 HD22 ASN 128 HD22 ASN 128 19.098 -0.727 11.822 1055 H ASN 129 HN ASN 129 23.687 -0.260 7.524 1056 HA ASN 129 HA ASN 129 25.437 -0.885 6.237 1057 HB2 ASN 129 HB2 ASN 129 25.411 -3.434 7.861 1058 HB3 ASN 129 HB1 ASN 129 26.786 -2.718 7.025 1059 HD21 ASN 129 HD21 ASN 129 24.859 -2.731 9.851 1060 HD22 ASN 129 HD22 ASN 129 25.724 -1.512 10.727 1061 HA PRO 130 HA PRO 130 23.081 -3.785 3.522 1062 HB2 PRO 130 HB2 PRO 130 22.122 -2.052 1.717 1063 HB3 PRO 130 HB1 PRO 130 21.310 -2.315 3.263 1064 HG2 PRO 130 HG2 PRO 130 22.964 -0.025 2.362 1065 HG3 PRO 130 HG1 PRO 130 21.612 -0.058 3.505 1066 HD2 PRO 130 HD2 PRO 130 24.377 -0.034 4.121 1067 HD3 PRO 130 HD1 PRO 130 23.032 -0.267 5.253 1068 H THR 131 HN THR 131 23.726 -4.537 1.476 1069 HA THR 131 HA THR 131 26.385 -4.027 0.716 1070 HB THR 131 HB THR 131 25.438 -6.178 0.210 1071 HG1 THR 131 HG1 THR 131 26.836 -6.010 -1.375 1072 HG21 THR 131 HG21 THR 131 23.106 -5.591 -0.051 1073 HG22 THR 131 HG22 THR 131 23.659 -6.442 -1.495 1074 HG23 THR 131 HG23 THR 131 23.468 -4.690 -1.526 1075 H GLU 132 HN GLU 132 27.082 -3.285 -1.503 1076 HA GLU 132 HA GLU 132 26.445 -0.582 -1.689 1077 HB2 GLU 132 HB2 GLU 132 28.538 -1.719 -2.579 1078 HB3 GLU 132 HB1 GLU 132 27.585 -2.142 -3.997 1079 HG2 GLU 132 HG2 GLU 132 28.749 -0.175 -4.548 1080 HG3 GLU 132 HG1 GLU 132 27.078 0.318 -4.242 1081 H ASP 133 HN ASP 133 25.361 -3.267 -3.775 1082 HA ASP 133 HA ASP 133 23.941 -1.826 -5.681 1083 HB2 ASP 133 HB2 ASP 133 23.386 -4.549 -4.485 1084 HB3 ASP 133 HB1 ASP 133 22.413 -3.877 -5.786 1085 H PHE 134 HN PHE 134 22.913 -2.862 -2.458 1086 HA PHE 134 HA PHE 134 20.225 -1.961 -2.820 1087 HB2 PHE 134 HB2 PHE 134 21.127 -3.757 -1.139 1088 HB3 PHE 134 HB1 PHE 134 21.458 -2.358 -0.116 1089 HD1 PHE 134 HD1 PHE 134 18.652 -2.719 -2.483 1090 HD2 PHE 134 HD2 PHE 134 19.863 -2.657 1.598 1091 HE1 PHE 134 HE1 PHE 134 16.312 -2.612 -1.800 1092 HE2 PHE 134 HE2 PHE 134 17.504 -2.554 2.287 1093 HZ PHE 134 HZ PHE 134 15.732 -2.526 0.578 1094 H ARG 135 HN ARG 135 22.896 -0.854 -0.774 1095 HA ARG 135 HA ARG 135 22.068 1.580 0.122 1096 HB2 ARG 135 HB2 ARG 135 24.124 0.851 0.810 1097 HB3 ARG 135 HB1 ARG 135 24.685 0.558 -0.835 1098 HG2 ARG 135 HG2 ARG 135 25.748 2.553 -0.699 1099 HG3 ARG 135 HG1 ARG 135 24.165 3.290 -0.775 1100 HD2 ARG 135 HD2 ARG 135 24.082 3.196 1.699 1101 HD3 ARG 135 HD1 ARG 135 25.743 2.593 1.711 1102 HE ARG 135 HE ARG 135 25.959 4.856 0.280 1103 HH11 ARG 135 HH11 ARG 135 24.534 4.153 3.398 1104 HH12 ARG 135 HH12 ARG 135 24.828 5.742 4.041 1105 HH21 ARG 135 HH21 ARG 135 26.346 6.950 1.114 1106 HH22 ARG 135 HH22 ARG 135 25.844 7.332 2.732 1107 H ARG 136 HN ARG 136 23.539 0.932 -2.978 1108 HA ARG 136 HA ARG 136 23.681 3.469 -4.041 1109 HB2 ARG 136 HB2 ARG 136 24.770 1.479 -4.891 1110 HB3 ARG 136 HB1 ARG 136 23.229 0.796 -5.377 1111 HG2 ARG 136 HG2 ARG 136 23.078 2.881 -6.897 1112 HG3 ARG 136 HG1 ARG 136 24.823 2.984 -6.597 1113 HD2 ARG 136 HD2 ARG 136 24.725 1.653 -8.497 1114 HD3 ARG 136 HD1 ARG 136 24.852 0.485 -7.173 1115 HE ARG 136 HE ARG 136 22.217 1.163 -8.296 1116 HH11 ARG 136 HH11 ARG 136 24.759 -1.159 -7.636 1117 HH12 ARG 136 HH12 ARG 136 23.776 -2.544 -8.033 1118 HH21 ARG 136 HH21 ARG 136 20.932 -0.651 -8.867 1119 HH22 ARG 136 HH22 ARG 136 21.597 -2.256 -8.723 1120 H LYS 137 HN LYS 137 21.019 1.097 -4.346 1121 HA LYS 137 HA LYS 137 19.412 2.827 -5.953 1122 HB2 LYS 137 HB2 LYS 137 18.763 0.306 -4.429 1123 HB3 LYS 137 HB1 LYS 137 17.560 1.197 -5.360 1124 HG2 LYS 137 HG2 LYS 137 19.046 0.928 -7.362 1125 HG3 LYS 137 HG1 LYS 137 20.051 -0.148 -6.392 1126 HD2 LYS 137 HD2 LYS 137 17.180 -0.783 -6.369 1127 HD3 LYS 137 HD1 LYS 137 17.957 -0.942 -7.941 1128 HE2 LYS 137 HE2 LYS 137 17.975 -3.046 -6.671 1129 HE3 LYS 137 HE1 LYS 137 19.594 -2.464 -7.032 1130 HZ1 LYS 137 HZ1 LYS 137 19.758 -1.623 -4.776 1131 HZ2 LYS 137 HZ2 LYS 137 19.418 -3.284 -4.764 1132 HZ3 LYS 137 HZ3 LYS 137 18.192 -2.166 -4.434 1133 H LEU 138 HN LEU 138 19.397 1.955 -2.523 1134 HA LEU 138 HA LEU 138 17.175 3.388 -1.675 1135 HB2 LEU 138 HB2 LEU 138 19.743 3.058 -0.141 1136 HB3 LEU 138 HB1 LEU 138 18.160 3.387 0.530 1137 HG LEU 138 HG LEU 138 19.161 0.828 -0.685 1138 HD11 LEU 138 HD11 LEU 138 19.594 1.307 1.710 1139 HD12 LEU 138 HD12 LEU 138 18.596 -0.120 1.436 1140 HD13 LEU 138 HD13 LEU 138 17.852 1.390 1.962 1141 HD21 LEU 138 HD21 LEU 138 16.326 1.509 0.015 1142 HD22 LEU 138 HD22 LEU 138 16.920 -0.084 -0.445 1143 HD23 LEU 138 HD23 LEU 138 16.951 1.243 -1.609 1144 H LEU 139 HN LEU 139 20.429 4.510 -2.354 1145 HA LEU 139 HA LEU 139 20.092 7.124 -1.260 1146 HB2 LEU 139 HB2 LEU 139 22.084 6.135 -3.297 1147 HB3 LEU 139 HB1 LEU 139 22.205 7.625 -2.382 1148 HG LEU 139 HG LEU 139 22.164 4.895 -1.115 1149 HD11 LEU 139 HD11 LEU 139 24.444 4.779 -1.139 1150 HD12 LEU 139 HD12 LEU 139 24.641 6.528 -1.331 1151 HD13 LEU 139 HD13 LEU 139 24.143 5.541 -2.707 1152 HD21 LEU 139 HD21 LEU 139 21.440 6.799 0.256 1153 HD22 LEU 139 HD22 LEU 139 22.997 7.578 -0.034 1154 HD23 LEU 139 HD23 LEU 139 22.923 6.051 0.850 1155 H LYS 140 HN LYS 140 19.758 5.733 -4.479 1156 HA LYS 140 HA LYS 140 19.473 8.172 -5.871 1157 HB2 LYS 140 HB2 LYS 140 19.433 5.399 -6.515 1158 HB3 LYS 140 HB1 LYS 140 18.020 6.166 -7.208 1159 HG2 LYS 140 HG2 LYS 140 19.278 7.626 -8.508 1160 HG3 LYS 140 HG1 LYS 140 20.745 7.329 -7.571 1161 HD2 LYS 140 HD2 LYS 140 19.410 5.110 -9.069 1162 HD3 LYS 140 HD1 LYS 140 20.504 6.218 -9.887 1163 HE2 LYS 140 HE2 LYS 140 21.180 4.633 -7.424 1164 HE3 LYS 140 HE1 LYS 140 21.549 4.136 -9.069 1165 HZ1 LYS 140 HZ1 LYS 140 23.488 5.167 -8.230 1166 HZ2 LYS 140 HZ2 LYS 140 22.618 6.468 -7.590 1167 HZ3 LYS 140 HZ3 LYS 140 22.786 6.308 -9.268 1168 H ALA 141 HN ALA 141 17.318 6.269 -4.021 1169 HA ALA 141 HA ALA 141 14.825 6.728 -5.019 1170 HB1 ALA 141 HB1 ALA 141 13.988 6.191 -2.920 1171 HB2 ALA 141 HB2 ALA 141 15.363 6.910 -2.084 1172 HB3 ALA 141 HB3 ALA 141 15.563 5.401 -2.974 1173 H1 GLY 212 HT1 GLY 212 -16.169 9.623 15.999 1174 H2 GLY 212 HT2 GLY 212 -17.528 8.609 15.901 1175 H3 GLY 212 HT3 GLY 212 -17.475 10.048 15.007 1176 HA2 GLY 212 HA1 GLY 212 -15.723 9.228 13.631 1177 HA3 GLY 212 HA2 GLY 212 -15.601 7.784 14.626 1178 H GLY 213 HN GLY 213 -17.274 9.360 12.055 1179 HA2 GLY 213 HA2 GLY 213 -19.427 7.431 11.927 1180 HA3 GLY 213 HA1 GLY 213 -19.098 8.714 10.772 1181 H LYS 214 HN LYS 214 -17.582 5.722 11.935 1182 HA LYS 214 HA LYS 214 -16.454 5.237 9.310 1183 HB2 LYS 214 HB2 LYS 214 -15.458 3.222 10.427 1184 HB3 LYS 214 HB1 LYS 214 -15.004 4.759 11.146 1185 HG2 LYS 214 HG2 LYS 214 -16.723 4.398 12.892 1186 HG3 LYS 214 HG1 LYS 214 -17.034 2.803 12.204 1187 HD2 LYS 214 HD2 LYS 214 -14.350 3.734 13.219 1188 HD3 LYS 214 HD1 LYS 214 -15.494 2.775 14.160 1189 HE2 LYS 214 HE2 LYS 214 -15.349 0.969 12.557 1190 HE3 LYS 214 HE1 LYS 214 -14.298 1.936 11.521 1191 HZ1 LYS 214 HZ1 LYS 214 -13.593 1.205 14.307 1192 HZ2 LYS 214 HZ2 LYS 214 -12.574 1.853 13.116 1193 HZ3 LYS 214 HZ3 LYS 214 -13.153 0.264 12.967 1194 H ALA 215 HN ALA 215 -17.211 3.897 7.851 1195 HA ALA 215 HA ALA 215 -19.854 2.894 8.026 1196 HB1 ALA 215 HB1 ALA 215 -19.409 1.979 5.794 1197 HB2 ALA 215 HB2 ALA 215 -17.693 2.334 5.991 1198 HB3 ALA 215 HB3 ALA 215 -18.864 3.651 5.926 1199 HA PRO 216 HA PRO 216 -19.629 -1.244 9.526 1200 HB2 PRO 216 HB2 PRO 216 -20.452 -2.761 7.335 1201 HB3 PRO 216 HB1 PRO 216 -21.506 -2.007 8.524 1202 HG2 PRO 216 HG2 PRO 216 -20.718 -1.031 5.819 1203 HG3 PRO 216 HG1 PRO 216 -22.289 -0.931 6.637 1204 HD2 PRO 216 HD2 PRO 216 -20.691 1.196 6.476 1205 HD3 PRO 216 HD1 PRO 216 -21.625 0.877 7.956 1206 H ARG 217 HN ARG 217 -18.588 -3.346 9.309 1207 HA ARG 217 HA ARG 217 -16.371 -3.412 7.395 1208 HB2 ARG 217 HB2 ARG 217 -15.445 -2.372 9.380 1209 HB3 ARG 217 HB1 ARG 217 -16.109 -3.636 10.402 1210 HG2 ARG 217 HG2 ARG 217 -14.538 -5.201 9.698 1211 HG3 ARG 217 HG1 ARG 217 -14.127 -4.277 8.252 1212 HD2 ARG 217 HD2 ARG 217 -13.520 -3.467 11.095 1213 HD3 ARG 217 HD1 ARG 217 -12.361 -4.140 9.948 1214 HE ARG 217 HE ARG 217 -13.730 -1.720 9.103 1215 HH11 ARG 217 HH11 ARG 217 -10.879 -3.079 10.638 1216 HH12 ARG 217 HH12 ARG 217 -9.875 -1.700 10.270 1217 HH21 ARG 217 HH21 ARG 217 -12.421 0.067 8.620 1218 HH22 ARG 217 HH22 ARG 217 -10.751 0.091 9.115 1219 H1 KCR 218 HN KCR 218 -15.838 -5.397 6.688 1220 H4 KCR 218 HA KCR 218 -17.672 -7.532 7.329 1221 H5 KCR 218 HB1 KCR 218 -16.523 -8.750 5.505 1222 H6 KCR 218 HB2 KCR 218 -15.379 -7.421 5.362 1223 H7 KCR 218 HG1 KCR 218 -17.207 -5.915 4.763 1224 H8 KCR 218 HG2 KCR 218 -18.347 -7.254 4.897 1225 H9 KCR 218 HD1 KCR 218 -17.286 -8.413 3.076 1226 H10 KCR 218 HD2 KCR 218 -16.007 -7.197 2.999 1227 H11 KCR 218 HE1 KCR 218 -17.655 -5.497 2.403 1228 H12 KCR 218 HE2 KCR 218 -18.937 -6.705 2.486 1229 H13 KCR 218 HZ1 KCR 218 -17.763 -7.840 0.614 1230 H14 KCR 218 HH1 KCR 218 -17.212 -7.543 -1.702 1231 H15 KCR 218 HJ1 KCR 218 -17.164 -4.524 -2.339 1232 H16 KCR 218 HF3 KCR 218 -16.787 -5.240 -4.599 1233 H17 KCR 218 HF1 KCR 218 -15.986 -6.668 -3.946 1234 H18 KCR 218 HF2 KCR 218 -17.723 -6.693 -4.248 1235 H GLN 219 HN GLN 219 -17.340 -8.853 8.934 1236 HA GLN 219 HA GLN 219 -14.570 -9.544 9.654 1237 HB2 GLN 219 HB2 GLN 219 -17.042 -9.377 11.377 1238 HB3 GLN 219 HB1 GLN 219 -15.544 -10.127 11.912 1239 HG2 GLN 219 HG2 GLN 219 -14.394 -7.956 11.460 1240 HG3 GLN 219 HG1 GLN 219 -15.981 -7.249 11.166 1241 HE21 GLN 219 HE21 GLN 219 -17.360 -6.884 12.877 1242 HE22 GLN 219 HE22 GLN 219 -16.851 -6.999 14.528 1243 H LEU 220 HN LEU 220 -15.962 -10.798 7.569 1244 HA LEU 220 HA LEU 220 -16.865 -13.368 8.502 1245 HB2 LEU 220 HB2 LEU 220 -17.729 -12.368 6.427 1246 HB3 LEU 220 HB1 LEU 220 -16.121 -12.414 5.732 1247 HG LEU 220 HG LEU 220 -16.170 -14.894 5.877 1248 HD11 LEU 220 HD11 LEU 220 -18.301 -16.014 6.270 1249 HD12 LEU 220 HD12 LEU 220 -19.049 -14.466 6.664 1250 HD13 LEU 220 HD13 LEU 220 -17.777 -15.120 7.697 1251 HD21 LEU 220 HD21 LEU 220 -17.725 -15.206 4.015 1252 HD22 LEU 220 HD22 LEU 220 -16.741 -13.756 3.810 1253 HD23 LEU 220 HD23 LEU 220 -18.420 -13.617 4.333 1254 H ALA 221 HN ALA 221 -13.909 -11.859 7.664 1255 HA ALA 221 HA ALA 221 -12.459 -14.382 7.461 1256 HB1 ALA 221 HB1 ALA 221 -10.529 -12.993 6.899 1257 HB2 ALA 221 HB2 ALA 221 -11.475 -11.538 7.214 1258 HB3 ALA 221 HB3 ALA 221 -11.908 -12.597 5.872 1259 H THR 222 HN THR 222 -10.257 -14.287 8.686 1260 HA THR 222 HA THR 222 -10.768 -13.328 11.425 1261 HB THR 222 HB THR 222 -11.001 -15.756 11.361 1262 HG1 THR 222 HG1 THR 222 -9.145 -16.245 12.818 1263 HG21 THR 222 HG21 THR 222 -9.125 -17.202 10.744 1264 HG22 THR 222 HG22 THR 222 -8.189 -15.786 10.265 1265 HG23 THR 222 HG23 THR 222 -9.651 -16.218 9.378 1266 H LYS 223 HN LYS 223 -9.134 -12.270 12.426 1267 HA LYS 223 HA LYS 223 -6.759 -11.701 10.822 1268 HB2 LYS 223 HB2 LYS 223 -6.310 -9.945 12.516 1269 HB3 LYS 223 HB1 LYS 223 -7.876 -9.769 11.741 1270 HG2 LYS 223 HG2 LYS 223 -8.938 -10.804 13.707 1271 HG3 LYS 223 HG1 LYS 223 -7.357 -10.891 14.486 1272 HD2 LYS 223 HD2 LYS 223 -8.701 -8.352 13.558 1273 HD3 LYS 223 HD1 LYS 223 -8.673 -8.935 15.222 1274 HE2 LYS 223 HE2 LYS 223 -6.242 -8.772 15.253 1275 HE3 LYS 223 HE1 LYS 223 -6.244 -8.244 13.570 1276 HZ1 LYS 223 HZ1 LYS 223 -7.515 -6.776 15.822 1277 HZ2 LYS 223 HZ2 LYS 223 -7.442 -6.262 14.210 1278 HZ3 LYS 223 HZ3 LYS 223 -6.017 -6.390 15.122 1279 H ALA 224 HN ALA 224 -7.629 -14.010 12.910 1280 HA ALA 224 HA ALA 224 -4.969 -14.212 14.149 1281 HB1 ALA 224 HB1 ALA 224 -5.980 -15.777 15.728 1282 HB2 ALA 224 HB2 ALA 224 -7.528 -15.629 14.897 1283 HB3 ALA 224 HB3 ALA 224 -6.839 -14.236 15.731 Start of MODEL 2 1 H1 GLY 1 HT1 GLY 1 38.826 -8.626 2.765 2 H2 GLY 1 HT2 GLY 1 37.848 -7.302 3.159 3 H3 GLY 1 HT3 GLY 1 39.004 -7.864 4.267 4 HA2 GLY 1 HA1 GLY 1 40.789 -7.218 2.811 5 HA3 GLY 1 HA2 GLY 1 39.615 -6.694 1.612 6 H SER 2 HN SER 2 40.169 -4.576 1.539 7 HA SER 2 HA SER 2 40.491 -3.043 3.977 8 HB2 SER 2 HB2 SER 2 41.946 -2.651 2.007 9 HB3 SER 2 HB1 SER 2 40.533 -2.140 1.085 10 HG SER 2 HG SER 2 41.499 -0.910 3.463 11 H HIS 3 HN HIS 3 37.940 -3.953 1.977 12 HA HIS 3 HA HIS 3 36.359 -1.571 2.223 13 HB2 HIS 3 HB2 HIS 3 36.064 -3.091 0.313 14 HB3 HIS 3 HB1 HIS 3 35.551 -4.373 1.405 15 HD1 HIS 3 HD1 HIS 3 33.111 -4.678 1.258 16 HD2 HIS 3 HD2 HIS 3 34.183 -0.675 0.894 17 HE1 HIS 3 HE1 HIS 3 30.951 -3.415 1.029 18 HE2 HIS 3 HE2 HIS 3 31.614 -0.986 0.967 19 H MET 4 HN MET 4 36.715 -1.436 4.557 20 HA MET 4 HA MET 4 34.566 -2.838 5.995 21 HB2 MET 4 HB2 MET 4 37.312 -2.178 7.091 22 HB3 MET 4 HB1 MET 4 35.983 -2.854 8.020 23 HG2 MET 4 HG2 MET 4 37.361 -4.188 5.701 24 HG3 MET 4 HG1 MET 4 37.628 -4.547 7.405 25 HE1 MET 4 HE1 MET 4 35.741 -7.739 6.184 26 HE2 MET 4 HE2 MET 4 37.173 -7.110 6.998 27 HE3 MET 4 HE3 MET 4 36.925 -6.797 5.279 28 H ALA 5 HN ALA 5 33.433 -0.875 5.309 29 HA ALA 5 HA ALA 5 34.374 1.661 6.346 30 HB1 ALA 5 HB1 ALA 5 32.404 2.592 5.220 31 HB2 ALA 5 HB2 ALA 5 31.872 0.958 4.820 32 HB3 ALA 5 HB3 ALA 5 33.373 1.587 4.140 33 H SER 6 HN SER 6 32.304 3.048 7.106 34 HA SER 6 HA SER 6 31.639 1.988 9.698 35 HB2 SER 6 HB2 SER 6 30.690 4.559 8.415 36 HB3 SER 6 HB1 SER 6 30.762 4.183 10.135 37 HG SER 6 HG SER 6 32.977 4.457 8.361 38 H SER 7 HN SER 7 29.621 1.402 10.435 39 HA SER 7 HA SER 7 27.843 0.322 8.491 40 HB2 SER 7 HB2 SER 7 28.207 -0.745 10.685 41 HB3 SER 7 HB1 SER 7 27.474 0.646 11.486 42 HG SER 7 HG SER 7 25.740 -0.556 11.272 43 H CYS 8 HN CYS 8 26.578 1.582 7.303 44 HA CYS 8 HA CYS 8 25.255 3.878 8.589 45 HB2 CYS 8 HB2 CYS 8 25.522 3.388 5.621 46 HB3 CYS 8 HB1 CYS 8 25.076 4.886 6.432 47 HG CYS 8 HG CYS 8 27.737 4.996 7.664 48 H ALA 9 HN ALA 9 23.191 3.522 9.129 49 HA ALA 9 HA ALA 9 21.665 1.427 7.821 50 HB1 ALA 9 HB1 ALA 9 19.902 1.954 9.444 51 HB2 ALA 9 HB2 ALA 9 20.834 3.356 9.994 52 HB3 ALA 9 HB3 ALA 9 21.462 1.728 10.250 53 H VAL 10 HN VAL 10 20.604 1.791 6.004 54 HA VAL 10 HA VAL 10 19.911 4.549 5.285 55 HB VAL 10 HB VAL 10 19.818 2.111 3.500 56 HG11 VAL 10 HG11 VAL 10 18.490 3.720 2.495 57 HG12 VAL 10 HG12 VAL 10 20.067 4.024 1.765 58 HG13 VAL 10 HG13 VAL 10 19.488 5.055 3.074 59 HG21 VAL 10 HG21 VAL 10 22.085 2.235 3.933 60 HG22 VAL 10 HG22 VAL 10 22.063 3.989 4.121 61 HG23 VAL 10 HG23 VAL 10 21.926 3.271 2.515 62 H GLN 11 HN GLN 11 17.873 5.219 5.350 63 HA GLN 11 HA GLN 11 15.786 3.173 5.760 64 HB2 GLN 11 HB2 GLN 11 15.505 6.082 6.522 65 HB3 GLN 11 HB1 GLN 11 14.595 4.708 7.116 66 HG2 GLN 11 HG2 GLN 11 16.172 4.138 8.664 67 HG3 GLN 11 HG1 GLN 11 17.493 4.805 7.707 68 HE21 GLN 11 HE21 GLN 11 17.791 7.084 7.717 69 HE22 GLN 11 HE22 GLN 11 17.209 8.029 9.048 70 H VAL 12 HN VAL 12 14.390 2.931 4.194 71 HA VAL 12 HA VAL 12 13.932 5.173 2.360 72 HB VAL 12 HB VAL 12 12.682 3.292 1.044 73 HG11 VAL 12 HG11 VAL 12 15.651 3.710 1.205 74 HG12 VAL 12 HG12 VAL 12 14.510 4.364 0.042 75 HG13 VAL 12 HG13 VAL 12 14.925 2.652 0.004 76 HG21 VAL 12 HG21 VAL 12 12.777 1.539 2.618 77 HG22 VAL 12 HG22 VAL 12 14.518 1.720 2.831 78 HG23 VAL 12 HG23 VAL 12 13.872 1.102 1.308 79 H LYS 13 HN LYS 13 11.889 5.965 2.036 80 HA LYS 13 HA LYS 13 9.942 5.068 4.031 81 HB2 LYS 13 HB2 LYS 13 10.556 7.764 2.888 82 HB3 LYS 13 HB1 LYS 13 8.970 7.440 3.580 83 HG2 LYS 13 HG2 LYS 13 10.030 6.755 5.667 84 HG3 LYS 13 HG1 LYS 13 11.614 7.118 4.981 85 HD2 LYS 13 HD2 LYS 13 10.909 9.469 4.685 86 HD3 LYS 13 HD1 LYS 13 9.379 9.084 5.479 87 HE2 LYS 13 HE2 LYS 13 10.534 8.487 7.510 88 HE3 LYS 13 HE1 LYS 13 12.097 8.701 6.726 89 HZ1 LYS 13 HZ1 LYS 13 11.533 11.065 6.429 90 HZ2 LYS 13 HZ2 LYS 13 11.609 10.608 8.059 91 HZ3 LYS 13 HZ3 LYS 13 10.101 10.824 7.309 92 H LEU 14 HN LEU 14 8.207 4.144 3.424 93 HA LEU 14 HA LEU 14 7.193 4.590 0.692 94 HB2 LEU 14 HB2 LEU 14 6.756 2.226 2.505 95 HB3 LEU 14 HB1 LEU 14 6.018 2.433 0.935 96 HG LEU 14 HG LEU 14 8.992 2.155 1.406 97 HD11 LEU 14 HD11 LEU 14 6.967 0.176 0.390 98 HD12 LEU 14 HD12 LEU 14 7.802 0.100 1.941 99 HD13 LEU 14 HD13 LEU 14 8.712 -0.071 0.438 100 HD21 LEU 14 HD21 LEU 14 7.408 2.052 -1.155 101 HD22 LEU 14 HD22 LEU 14 9.161 1.947 -0.977 102 HD23 LEU 14 HD23 LEU 14 8.323 3.453 -0.600 103 H GLU 15 HN GLU 15 5.022 5.010 0.461 104 HA GLU 15 HA GLU 15 3.767 6.006 2.927 105 HB2 GLU 15 HB2 GLU 15 4.531 7.749 1.356 106 HB3 GLU 15 HB1 GLU 15 3.529 7.048 0.096 107 HG2 GLU 15 HG2 GLU 15 1.537 7.652 1.244 108 HG3 GLU 15 HG1 GLU 15 2.439 8.136 2.678 109 H LEU 16 HN LEU 16 1.950 5.071 3.513 110 HA LEU 16 HA LEU 16 0.407 3.485 1.586 111 HB2 LEU 16 HB2 LEU 16 0.189 3.773 4.582 112 HB3 LEU 16 HB1 LEU 16 -1.036 2.979 3.631 113 HG LEU 16 HG LEU 16 0.265 1.284 4.605 114 HD11 LEU 16 HD11 LEU 16 1.697 1.098 2.102 115 HD12 LEU 16 HD12 LEU 16 -0.007 1.498 1.892 116 HD13 LEU 16 HD13 LEU 16 0.456 0.046 2.781 117 HD21 LEU 16 HD21 LEU 16 2.768 2.408 3.450 118 HD22 LEU 16 HD22 LEU 16 2.590 1.169 4.684 119 HD23 LEU 16 HD23 LEU 16 2.212 2.853 5.056 120 H GLY 17 HN GLY 17 -1.683 4.026 1.059 121 HA2 GLY 17 HA2 GLY 17 -2.889 6.332 2.359 122 HA3 GLY 17 HA1 GLY 17 -2.475 6.536 0.661 123 H HIS 18 HN HIS 18 -5.022 6.821 1.541 124 HA HIS 18 HA HIS 18 -6.346 5.225 -0.330 125 HB2 HIS 18 HB2 HIS 18 -7.013 3.406 0.796 126 HB3 HIS 18 HB1 HIS 18 -6.027 3.913 2.156 127 HD1 HIS 18 HD1 HIS 18 -7.309 5.421 3.976 128 HD2 HIS 18 HD2 HIS 18 -9.702 3.368 1.274 129 HE1 HIS 18 HE1 HIS 18 -9.605 5.392 4.999 130 HE2 HIS 18 HE2 HIS 18 -11.053 4.234 3.302 131 H ARG 19 HN ARG 19 -8.249 6.093 -0.859 132 HA ARG 19 HA ARG 19 -9.371 8.165 0.909 133 HB2 ARG 19 HB2 ARG 19 -9.446 8.048 -2.112 134 HB3 ARG 19 HB1 ARG 19 -10.235 9.254 -1.127 135 HG2 ARG 19 HG2 ARG 19 -8.102 10.090 -0.365 136 HG3 ARG 19 HG1 ARG 19 -7.263 8.841 -1.292 137 HD2 ARG 19 HD2 ARG 19 -7.227 10.871 -2.567 138 HD3 ARG 19 HD1 ARG 19 -8.332 9.730 -3.345 139 HE ARG 19 HE ARG 19 -9.749 11.419 -1.561 140 HH11 ARG 19 HH11 ARG 19 -8.143 11.481 -4.668 141 HH12 ARG 19 HH12 ARG 19 -9.174 12.718 -5.322 142 HH21 ARG 19 HH21 ARG 19 -11.082 13.062 -2.390 143 HH22 ARG 19 HH22 ARG 19 -10.839 13.639 -4.017 144 H ALA 20 HN ALA 20 -11.731 8.326 0.785 145 HA ALA 20 HA ALA 20 -13.071 6.079 -0.500 146 HB1 ALA 20 HB1 ALA 20 -13.005 4.975 1.473 147 HB2 ALA 20 HB2 ALA 20 -14.441 5.959 1.770 148 HB3 ALA 20 HB3 ALA 20 -12.881 6.455 2.427 149 H GLN 21 HN GLN 21 -14.981 6.550 -1.287 150 HA GLN 21 HA GLN 21 -16.510 8.832 -0.268 151 HB2 GLN 21 HB2 GLN 21 -16.960 9.663 -2.492 152 HB3 GLN 21 HB1 GLN 21 -15.216 9.538 -2.308 153 HG2 GLN 21 HG2 GLN 21 -15.006 7.952 -3.852 154 HG3 GLN 21 HG1 GLN 21 -16.535 7.184 -3.454 155 HE21 GLN 21 HE21 GLN 21 -18.431 7.948 -4.406 156 HE22 GLN 21 HE22 GLN 21 -18.413 8.951 -5.816 157 H VAL 22 HN VAL 22 -18.795 8.611 -0.727 158 HA VAL 22 HA VAL 22 -19.538 5.833 -1.350 159 HB VAL 22 HB VAL 22 -20.244 6.799 0.882 160 HG11 VAL 22 HG11 VAL 22 -22.179 8.253 0.933 161 HG12 VAL 22 HG12 VAL 22 -22.133 8.403 -0.823 162 HG13 VAL 22 HG13 VAL 22 -20.809 9.042 0.155 163 HG21 VAL 22 HG21 VAL 22 -21.384 4.868 0.284 164 HG22 VAL 22 HG22 VAL 22 -22.198 5.651 -1.069 165 HG23 VAL 22 HG23 VAL 22 -22.681 6.025 0.586 166 H ARG 23 HN ARG 23 -21.005 5.396 -2.959 167 HA ARG 23 HA ARG 23 -21.941 7.685 -4.545 168 HB2 ARG 23 HB2 ARG 23 -22.739 5.634 -6.054 169 HB3 ARG 23 HB1 ARG 23 -21.095 6.252 -6.134 170 HG2 ARG 23 HG2 ARG 23 -20.206 4.387 -5.292 171 HG3 ARG 23 HG1 ARG 23 -21.502 4.175 -4.118 172 HD2 ARG 23 HD2 ARG 23 -21.493 2.337 -5.680 173 HD3 ARG 23 HD1 ARG 23 -22.947 3.304 -5.909 174 HE ARG 23 HE ARG 23 -21.936 4.200 -7.917 175 HH11 ARG 23 HH11 ARG 23 -20.341 1.443 -6.476 176 HH12 ARG 23 HH12 ARG 23 -19.688 0.851 -7.972 177 HH21 ARG 23 HH21 ARG 23 -21.077 3.433 -9.919 178 HH22 ARG 23 HH22 ARG 23 -20.114 1.984 -9.935 179 H LYS 24 HN LYS 24 -23.976 8.329 -4.304 180 HA LYS 24 HA LYS 24 -25.536 7.333 -2.198 181 HB2 LYS 24 HB2 LYS 24 -25.531 9.662 -3.256 182 HB3 LYS 24 HB1 LYS 24 -26.642 8.994 -4.443 183 HG2 LYS 24 HG2 LYS 24 -27.921 10.087 -2.750 184 HG3 LYS 24 HG1 LYS 24 -28.146 8.347 -2.574 185 HD2 LYS 24 HD2 LYS 24 -26.504 8.305 -0.770 186 HD3 LYS 24 HD1 LYS 24 -26.264 10.045 -0.944 187 HE2 LYS 24 HE2 LYS 24 -27.756 9.593 0.914 188 HE3 LYS 24 HE1 LYS 24 -28.627 10.407 -0.384 189 HZ1 LYS 24 HZ1 LYS 24 -29.827 8.503 0.652 190 HZ2 LYS 24 HZ2 LYS 24 -28.657 7.465 -0.004 191 HZ3 LYS 24 HZ3 LYS 24 -29.644 8.384 -1.029 192 H LYS 25 HN LYS 25 -25.208 6.201 -5.357 193 HA LYS 25 HA LYS 25 -27.556 4.473 -4.968 194 HB2 LYS 25 HB2 LYS 25 -27.923 6.077 -6.823 195 HB3 LYS 25 HB1 LYS 25 -26.498 5.461 -7.632 196 HG2 LYS 25 HG2 LYS 25 -28.312 4.413 -8.663 197 HG3 LYS 25 HG1 LYS 25 -27.649 3.227 -7.549 198 HD2 LYS 25 HD2 LYS 25 -29.358 3.810 -5.899 199 HD3 LYS 25 HD1 LYS 25 -30.061 4.941 -7.059 200 HE2 LYS 25 HE2 LYS 25 -30.612 3.188 -8.561 201 HE3 LYS 25 HE1 LYS 25 -29.664 2.019 -7.639 202 HZ1 LYS 25 HZ1 LYS 25 -31.230 2.307 -5.795 203 HZ2 LYS 25 HZ2 LYS 25 -31.998 1.730 -7.193 204 HZ3 LYS 25 HZ3 LYS 25 -32.163 3.359 -6.745 205 HA PRO 26 HA PRO 26 -24.134 1.502 -4.941 206 HB2 PRO 26 HB2 PRO 26 -26.372 -0.405 -4.686 207 HB3 PRO 26 HB1 PRO 26 -24.965 -0.181 -3.648 208 HG2 PRO 26 HG2 PRO 26 -27.419 0.593 -2.888 209 HG3 PRO 26 HG1 PRO 26 -25.962 1.499 -2.431 210 HD2 PRO 26 HD2 PRO 26 -27.998 2.109 -4.545 211 HD3 PRO 26 HD1 PRO 26 -27.141 3.212 -3.450 212 H THR 27 HN THR 27 -23.519 -0.261 -6.282 213 HA THR 27 HA THR 27 -24.546 -0.003 -8.965 214 HB THR 27 HB THR 27 -22.127 -0.166 -8.637 215 HG1 THR 27 HG1 THR 27 -22.060 -2.423 -9.923 216 HG21 THR 27 HG21 THR 27 -21.890 -1.506 -6.689 217 HG22 THR 27 HG22 THR 27 -21.162 -2.418 -8.014 218 HG23 THR 27 HG23 THR 27 -22.769 -2.845 -7.429 219 H VAL 28 HN VAL 28 -24.504 -2.340 -10.143 220 HA VAL 28 HA VAL 28 -26.900 -3.560 -9.636 221 HB VAL 28 HB VAL 28 -25.859 -3.906 -11.711 222 HG11 VAL 28 HG11 VAL 28 -23.522 -3.738 -10.893 223 HG12 VAL 28 HG12 VAL 28 -23.768 -5.051 -12.051 224 HG13 VAL 28 HG13 VAL 28 -23.641 -5.407 -10.328 225 HG21 VAL 28 HG21 VAL 28 -25.948 -6.504 -10.194 226 HG22 VAL 28 HG22 VAL 28 -25.891 -6.374 -11.952 227 HG23 VAL 28 HG23 VAL 28 -27.276 -5.738 -11.065 228 H GLU 29 HN GLU 29 -23.731 -4.522 -8.364 229 HA GLU 29 HA GLU 29 -24.892 -6.820 -7.041 230 HB2 GLU 29 HB2 GLU 29 -22.068 -5.764 -6.953 231 HB3 GLU 29 HB1 GLU 29 -22.604 -7.328 -6.350 232 HG2 GLU 29 HG2 GLU 29 -23.327 -7.883 -8.690 233 HG3 GLU 29 HG1 GLU 29 -22.564 -6.380 -9.209 234 H GLY 30 HN GLY 30 -24.809 -3.619 -6.321 235 HA2 GLY 30 HA2 GLY 30 -25.793 -2.700 -4.421 236 HA3 GLY 30 HA1 GLY 30 -25.589 -4.236 -3.596 237 H PHE 31 HN PHE 31 -23.001 -2.489 -5.186 238 HA PHE 31 HA PHE 31 -21.619 -2.311 -2.638 239 HB2 PHE 31 HB2 PHE 31 -20.595 -1.614 -5.402 240 HB3 PHE 31 HB1 PHE 31 -19.633 -1.804 -3.938 241 HD1 PHE 31 HD1 PHE 31 -21.342 -4.350 -3.090 242 HD2 PHE 31 HD2 PHE 31 -19.213 -3.227 -6.585 243 HE1 PHE 31 HE1 PHE 31 -20.986 -6.717 -3.633 244 HE2 PHE 31 HE2 PHE 31 -18.857 -5.583 -7.134 245 HZ PHE 31 HZ PHE 31 -19.744 -7.337 -5.657 246 H THR 32 HN THR 32 -21.501 -0.482 -1.518 247 HA THR 32 HA THR 32 -22.849 1.869 -2.614 248 HB THR 32 HB THR 32 -23.128 2.558 -0.275 249 HG1 THR 32 HG1 THR 32 -22.683 0.525 1.179 250 HG21 THR 32 HG21 THR 32 -24.053 -0.133 -1.066 251 HG22 THR 32 HG22 THR 32 -24.930 1.381 -1.172 252 HG23 THR 32 HG23 THR 32 -24.616 0.642 0.402 253 H HIS 33 HN HIS 33 -19.800 0.866 -1.225 254 HA HIS 33 HA HIS 33 -18.916 3.680 -1.099 255 HB2 HIS 33 HB2 HIS 33 -18.320 1.286 0.601 256 HB3 HIS 33 HB1 HIS 33 -17.147 2.594 0.515 257 HD1 HIS 33 HD1 HIS 33 -20.665 1.857 1.696 258 HD2 HIS 33 HD2 HIS 33 -17.775 4.838 1.961 259 HE1 HIS 33 HE1 HIS 33 -21.444 3.411 3.529 260 HE2 HIS 33 HE2 HIS 33 -19.601 5.106 3.766 261 H ASP 34 HN ASP 34 -17.206 4.305 -2.257 262 HA ASP 34 HA ASP 34 -15.586 2.239 -3.619 263 HB2 ASP 34 HB2 ASP 34 -16.565 4.931 -4.504 264 HB3 ASP 34 HB1 ASP 34 -15.029 4.340 -5.122 265 H TRP 35 HN TRP 35 -13.399 2.358 -3.466 266 HA TRP 35 HA TRP 35 -12.246 4.667 -2.125 267 HB2 TRP 35 HB2 TRP 35 -10.943 3.181 -0.584 268 HB3 TRP 35 HB1 TRP 35 -12.658 3.296 -0.238 269 HD1 TRP 35 HD1 TRP 35 -14.044 1.051 -0.242 270 HE1 TRP 35 HE1 TRP 35 -13.386 -1.432 -0.528 271 HE3 TRP 35 HE3 TRP 35 -9.245 1.653 -1.925 272 HZ2 TRP 35 HZ2 TRP 35 -11.123 -2.927 -1.336 273 HZ3 TRP 35 HZ3 TRP 35 -7.898 -0.350 -2.417 274 HH2 TRP 35 HH2 TRP 35 -8.806 -2.587 -2.104 275 H MET 36 HN MET 36 -9.862 4.518 -2.025 276 HA MET 36 HA MET 36 -8.625 2.988 -4.176 277 HB2 MET 36 HB2 MET 36 -9.242 4.961 -5.363 278 HB3 MET 36 HB1 MET 36 -8.755 6.002 -4.030 279 HG2 MET 36 HG2 MET 36 -6.402 5.160 -4.422 280 HG3 MET 36 HG1 MET 36 -7.004 4.495 -5.943 281 HE1 MET 36 HE1 MET 36 -6.524 7.342 -3.684 282 HE2 MET 36 HE2 MET 36 -8.080 8.006 -4.213 283 HE3 MET 36 HE3 MET 36 -6.579 8.818 -4.661 284 H VAL 37 HN VAL 37 -6.679 2.269 -3.506 285 HA VAL 37 HA VAL 37 -5.539 3.463 -1.079 286 HB VAL 37 HB VAL 37 -4.072 1.250 -1.334 287 HG11 VAL 37 HG11 VAL 37 -6.839 1.375 -0.241 288 HG12 VAL 37 HG12 VAL 37 -5.379 1.859 0.604 289 HG13 VAL 37 HG13 VAL 37 -5.645 0.163 0.187 290 HG21 VAL 37 HG21 VAL 37 -5.067 0.494 -3.385 291 HG22 VAL 37 HG22 VAL 37 -6.681 0.614 -2.687 292 HG23 VAL 37 HG23 VAL 37 -5.545 -0.591 -2.080 293 H PHE 38 HN PHE 38 -3.247 3.531 -0.853 294 HA PHE 38 HA PHE 38 -1.766 4.136 -3.338 295 HB2 PHE 38 HB2 PHE 38 -2.216 5.760 -0.874 296 HB3 PHE 38 HB1 PHE 38 -0.627 5.836 -1.613 297 HD1 PHE 38 HD2 PHE 38 -4.165 6.730 -1.959 298 HD2 PHE 38 HD1 PHE 38 -0.293 6.878 -3.714 299 HE1 PHE 38 HE2 PHE 38 -4.934 8.486 -3.495 300 HE2 PHE 38 HE1 PHE 38 -1.041 8.652 -5.243 301 HZ PHE 38 HZ PHE 38 -3.387 9.457 -5.140 302 H VAL 39 HN VAL 39 0.115 2.975 -3.457 303 HA VAL 39 HA VAL 39 1.763 3.072 -1.039 304 HB VAL 39 HB VAL 39 2.862 0.912 -1.797 305 HG11 VAL 39 HG11 VAL 39 1.065 1.322 0.036 306 HG12 VAL 39 HG12 VAL 39 1.518 -0.321 -0.410 307 HG13 VAL 39 HG13 VAL 39 0.032 0.388 -1.044 308 HG21 VAL 39 HG21 VAL 39 2.144 0.467 -3.943 309 HG22 VAL 39 HG22 VAL 39 0.482 0.943 -3.591 310 HG23 VAL 39 HG23 VAL 39 1.108 -0.589 -2.983 311 H ARG 40 HN ARG 40 3.363 4.410 -1.453 312 HA ARG 40 HA ARG 40 4.929 4.275 -3.872 313 HB2 ARG 40 HB2 ARG 40 4.519 6.553 -4.626 314 HB3 ARG 40 HB1 ARG 40 2.995 5.669 -4.631 315 HG2 ARG 40 HG2 ARG 40 2.129 6.868 -2.881 316 HG3 ARG 40 HG1 ARG 40 3.714 7.226 -2.199 317 HD2 ARG 40 HD2 ARG 40 4.094 8.740 -4.192 318 HD3 ARG 40 HD1 ARG 40 2.376 8.527 -4.569 319 HE ARG 40 HE ARG 40 2.478 9.287 -1.914 320 HH11 ARG 40 HH11 ARG 40 3.470 10.670 -4.991 321 HH12 ARG 40 HH12 ARG 40 3.307 12.310 -4.430 322 HH21 ARG 40 HH21 ARG 40 2.238 11.399 -1.206 323 HH22 ARG 40 HH22 ARG 40 2.551 12.727 -2.290 324 H GLY 41 HN GLY 41 6.368 6.483 -3.799 325 HA2 GLY 41 HA2 GLY 41 7.292 6.693 -1.017 326 HA3 GLY 41 HA1 GLY 41 8.259 7.056 -2.439 327 HA PRO 42 HA PRO 42 5.952 10.841 -0.428 328 HB2 PRO 42 HB2 PRO 42 8.712 11.492 0.426 329 HB3 PRO 42 HB1 PRO 42 7.195 11.671 1.310 330 HG2 PRO 42 HG2 PRO 42 8.953 9.732 1.906 331 HG3 PRO 42 HG1 PRO 42 7.211 9.486 2.035 332 HD2 PRO 42 HD2 PRO 42 9.111 8.511 -0.025 333 HD3 PRO 42 HD1 PRO 42 7.648 7.745 0.619 334 H GLU 43 HN GLU 43 6.356 13.064 -1.013 335 HA GLU 43 HA GLU 43 7.020 13.474 -3.665 336 HB2 GLU 43 HB2 GLU 43 6.955 15.346 -1.313 337 HB3 GLU 43 HB1 GLU 43 7.311 15.911 -2.937 338 HG2 GLU 43 HG2 GLU 43 4.787 14.551 -2.014 339 HG3 GLU 43 HG1 GLU 43 4.979 16.256 -2.410 340 H HIS 44 HN HIS 44 8.848 13.305 -4.661 341 HA HIS 44 HA HIS 44 10.906 14.001 -5.380 342 HB2 HIS 44 HB2 HIS 44 12.122 15.604 -4.310 343 HB3 HIS 44 HB1 HIS 44 10.744 15.705 -3.219 344 HD1 HIS 44 HD1 HIS 44 14.277 14.423 -3.415 345 HD2 HIS 44 HD2 HIS 44 11.204 14.809 -0.640 346 HE1 HIS 44 HE1 HIS 44 15.318 13.936 -1.179 347 HE2 HIS 44 HE2 HIS 44 13.397 13.969 0.455 348 H SER 45 HN SER 45 10.263 11.873 -2.797 349 HA SER 45 HA SER 45 12.742 10.395 -3.311 350 HB2 SER 45 HB2 SER 45 11.768 8.882 -1.468 351 HB3 SER 45 HB1 SER 45 12.292 10.489 -0.980 352 HG SER 45 HG SER 45 9.639 10.113 -1.787 353 H ASN 46 HN ASN 46 12.680 9.022 -4.997 354 HA ASN 46 HA ASN 46 10.070 7.956 -5.824 355 HB2 ASN 46 HB2 ASN 46 12.375 8.797 -7.259 356 HB3 ASN 46 HB1 ASN 46 12.214 7.065 -7.506 357 HD21 ASN 46 HD21 ASN 46 10.890 10.162 -8.171 358 HD22 ASN 46 HD22 ASN 46 9.654 9.631 -9.267 359 H ILE 47 HN ILE 47 9.495 5.909 -5.398 360 HA ILE 47 HA ILE 47 11.385 4.256 -3.972 361 HB ILE 47 HB ILE 47 9.641 2.720 -3.566 362 HG12 ILE 47 HG12 ILE 47 7.871 4.318 -5.414 363 HG13 ILE 47 HG11 ILE 47 8.654 2.794 -5.843 364 HG21 ILE 47 HG21 ILE 47 9.674 4.686 -2.226 365 HG22 ILE 47 HG22 ILE 47 8.013 4.163 -2.468 366 HG23 ILE 47 HG23 ILE 47 8.652 5.540 -3.371 367 HD11 ILE 47 HD11 ILE 47 7.128 2.727 -3.356 368 HD12 ILE 47 HD12 ILE 47 7.179 1.571 -4.689 369 HD13 ILE 47 HD13 ILE 47 6.163 3.011 -4.805 370 H GLN 48 HN GLN 48 10.345 4.624 -7.171 371 HA GLN 48 HA GLN 48 10.405 1.954 -8.066 372 HB2 GLN 48 HB2 GLN 48 9.491 4.178 -9.124 373 HB3 GLN 48 HB1 GLN 48 11.099 4.274 -9.825 374 HG2 GLN 48 HG2 GLN 48 10.715 2.576 -11.268 375 HG3 GLN 48 HG1 GLN 48 9.678 1.709 -10.142 376 HE21 GLN 48 HE21 GLN 48 7.449 2.354 -9.947 377 HE22 GLN 48 HE22 GLN 48 6.714 3.219 -11.247 378 H HIS 49 HN HIS 49 12.810 3.905 -6.975 379 HA HIS 49 HA HIS 49 15.004 2.885 -8.537 380 HB2 HIS 49 HB2 HIS 49 14.714 4.703 -6.179 381 HB3 HIS 49 HB1 HIS 49 16.283 3.943 -6.457 382 HD1 HIS 49 HD1 HIS 49 16.437 4.160 -9.523 383 HD2 HIS 49 HD2 HIS 49 15.188 7.240 -7.025 384 HE1 HIS 49 HE1 HIS 49 16.805 6.279 -10.821 385 HE2 HIS 49 HE2 HIS 49 15.813 8.095 -9.386 386 H PHE 50 HN PHE 50 13.525 2.215 -5.380 387 HA PHE 50 HA PHE 50 15.376 -0.049 -5.114 388 HB2 PHE 50 HB2 PHE 50 15.078 0.121 -2.658 389 HB3 PHE 50 HB1 PHE 50 15.824 1.548 -3.374 390 HD1 PHE 50 HD1 PHE 50 12.705 0.241 -1.874 391 HD2 PHE 50 HD2 PHE 50 14.848 3.661 -3.199 392 HE1 PHE 50 HE1 PHE 50 11.082 1.686 -0.760 393 HE2 PHE 50 HE2 PHE 50 13.192 5.115 -2.110 394 HZ PHE 50 HZ PHE 50 11.301 4.129 -0.888 395 H VAL 51 HN VAL 51 12.342 0.646 -5.948 396 HA VAL 51 HA VAL 51 11.217 -1.820 -4.798 397 HB VAL 51 HB VAL 51 9.898 0.856 -5.296 398 HG11 VAL 51 HG11 VAL 51 7.874 -0.563 -4.274 399 HG12 VAL 51 HG12 VAL 51 8.681 -1.853 -5.186 400 HG13 VAL 51 HG13 VAL 51 8.136 -0.396 -6.019 401 HG21 VAL 51 HG21 VAL 51 9.203 0.494 -2.906 402 HG22 VAL 51 HG22 VAL 51 10.933 0.706 -3.163 403 HG23 VAL 51 HG23 VAL 51 10.274 -0.906 -2.880 404 H GLU 52 HN GLU 52 10.239 -3.209 -6.165 405 HA GLU 52 HA GLU 52 10.781 -2.683 -9.009 406 HB2 GLU 52 HB2 GLU 52 11.909 -4.608 -7.893 407 HB3 GLU 52 HB1 GLU 52 10.332 -5.323 -7.598 408 HG2 GLU 52 HG2 GLU 52 11.414 -6.349 -9.504 409 HG3 GLU 52 HG1 GLU 52 9.951 -5.499 -10.002 410 H LYS 53 HN LYS 53 8.386 -4.427 -7.031 411 HA LYS 53 HA LYS 53 6.273 -3.424 -8.768 412 HB2 LYS 53 HB2 LYS 53 5.277 -5.688 -8.929 413 HB3 LYS 53 HB1 LYS 53 6.839 -5.566 -9.722 414 HG2 LYS 53 HG2 LYS 53 7.908 -6.671 -7.856 415 HG3 LYS 53 HG1 LYS 53 6.373 -6.765 -6.999 416 HD2 LYS 53 HD2 LYS 53 6.986 -8.045 -9.667 417 HD3 LYS 53 HD1 LYS 53 6.993 -8.886 -8.117 418 HE2 LYS 53 HE2 LYS 53 4.653 -8.547 -7.832 419 HE3 LYS 53 HE1 LYS 53 4.602 -7.432 -9.201 420 HZ1 LYS 53 HZ1 LYS 53 3.749 -9.590 -9.827 421 HZ2 LYS 53 HZ2 LYS 53 5.182 -10.343 -9.326 422 HZ3 LYS 53 HZ3 LYS 53 5.198 -9.290 -10.658 423 H VAL 54 HN VAL 54 4.089 -4.354 -7.768 424 HA VAL 54 HA VAL 54 4.169 -4.214 -4.853 425 HB VAL 54 HB VAL 54 3.092 -2.093 -6.659 426 HG11 VAL 54 HG11 VAL 54 2.134 -1.960 -3.894 427 HG12 VAL 54 HG12 VAL 54 1.361 -3.198 -4.884 428 HG13 VAL 54 HG13 VAL 54 1.328 -1.511 -5.396 429 HG21 VAL 54 HG21 VAL 54 3.901 -0.954 -4.342 430 HG22 VAL 54 HG22 VAL 54 4.930 -1.205 -5.743 431 HG23 VAL 54 HG23 VAL 54 4.948 -2.365 -4.414 432 H VAL 55 HN VAL 55 2.146 -4.841 -3.859 433 HA VAL 55 HA VAL 55 0.138 -5.980 -5.650 434 HB VAL 55 HB VAL 55 2.144 -7.589 -4.492 435 HG11 VAL 55 HG11 VAL 55 -0.542 -8.032 -3.208 436 HG12 VAL 55 HG12 VAL 55 0.978 -7.646 -2.392 437 HG13 VAL 55 HG13 VAL 55 0.780 -9.204 -3.198 438 HG21 VAL 55 HG21 VAL 55 -0.467 -8.401 -5.750 439 HG22 VAL 55 HG22 VAL 55 0.991 -9.387 -5.620 440 HG23 VAL 55 HG23 VAL 55 0.992 -7.938 -6.626 441 H PHE 56 HN PHE 56 -1.865 -6.206 -4.726 442 HA PHE 56 HA PHE 56 -2.181 -5.380 -1.918 443 HB2 PHE 56 HB2 PHE 56 -3.744 -4.512 -4.358 444 HB3 PHE 56 HB1 PHE 56 -4.486 -4.504 -2.757 445 HD1 PHE 56 HD1 PHE 56 -1.540 -3.226 -4.634 446 HD2 PHE 56 HD2 PHE 56 -4.262 -2.644 -1.409 447 HE1 PHE 56 HE1 PHE 56 -0.593 -0.999 -4.251 448 HE2 PHE 56 HE2 PHE 56 -3.312 -0.403 -1.021 449 HZ PHE 56 HZ PHE 56 -1.471 0.419 -2.442 450 H HIS 57 HN HIS 57 -3.219 -6.913 -0.728 451 HA HIS 57 HA HIS 57 -4.844 -8.893 -2.201 452 HB2 HIS 57 HB2 HIS 57 -3.865 -9.105 0.660 453 HB3 HIS 57 HB1 HIS 57 -4.664 -10.360 -0.285 454 HD1 HIS 57 HD1 HIS 57 -3.172 -11.989 -1.382 455 HD2 HIS 57 HD2 HIS 57 -1.193 -8.446 -0.465 456 HE1 HIS 57 HE1 HIS 57 -0.743 -12.418 -1.867 457 HE2 HIS 57 HE2 HIS 57 0.452 -10.342 -1.074 458 H LEU 58 HN LEU 58 -6.645 -7.572 -2.415 459 HA LEU 58 HA LEU 58 -7.864 -6.243 -0.220 460 HB2 LEU 58 HB2 LEU 58 -9.455 -7.183 -2.577 461 HB3 LEU 58 HB1 LEU 58 -9.632 -5.705 -1.650 462 HG LEU 58 HG LEU 58 -7.561 -6.316 -3.741 463 HD11 LEU 58 HD11 LEU 58 -8.660 -4.905 -5.069 464 HD12 LEU 58 HD12 LEU 58 -9.322 -3.951 -3.749 465 HD13 LEU 58 HD13 LEU 58 -10.021 -5.523 -4.146 466 HD21 LEU 58 HD21 LEU 58 -7.695 -4.029 -1.787 467 HD22 LEU 58 HD22 LEU 58 -6.825 -3.939 -3.317 468 HD23 LEU 58 HD23 LEU 58 -6.348 -5.121 -2.100 469 H HIS 59 HN HIS 59 -10.430 -6.907 0.023 470 HA HIS 59 HA HIS 59 -10.288 -9.354 1.527 471 HB2 HIS 59 HB2 HIS 59 -11.654 -7.206 2.054 472 HB3 HIS 59 HB1 HIS 59 -12.832 -7.861 0.924 473 HD1 HIS 59 HD1 HIS 59 -11.172 -8.693 4.233 474 HD2 HIS 59 HD2 HIS 59 -14.497 -9.771 1.964 475 HE1 HIS 59 HE1 HIS 59 -12.582 -10.138 5.732 476 HE2 HIS 59 HE2 HIS 59 -14.668 -10.637 4.398 477 H GLU 60 HN GLU 60 -11.431 -11.213 1.180 478 HA GLU 60 HA GLU 60 -11.155 -12.332 -1.306 479 HB2 GLU 60 HB2 GLU 60 -13.075 -13.290 0.808 480 HB3 GLU 60 HB1 GLU 60 -12.261 -14.272 -0.400 481 HG2 GLU 60 HG2 GLU 60 -11.128 -14.708 1.593 482 HG3 GLU 60 HG1 GLU 60 -10.092 -13.556 0.758 483 H SER 61 HN SER 61 -13.928 -10.666 -0.027 484 HA SER 61 HA SER 61 -15.848 -11.663 -1.852 485 HB2 SER 61 HB2 SER 61 -17.076 -9.522 -1.124 486 HB3 SER 61 HB1 SER 61 -16.694 -10.709 0.125 487 HG SER 61 HG SER 61 -15.672 -8.161 -0.289 488 H PHE 62 HN PHE 62 -13.258 -9.520 -2.216 489 HA PHE 62 HA PHE 62 -14.425 -8.039 -4.428 490 HB2 PHE 62 HB2 PHE 62 -11.664 -8.021 -3.185 491 HB3 PHE 62 HB1 PHE 62 -12.139 -7.003 -4.534 492 HD1 PHE 62 HD1 PHE 62 -13.259 -7.841 -1.072 493 HD2 PHE 62 HD2 PHE 62 -12.842 -4.870 -4.074 494 HE1 PHE 62 HE1 PHE 62 -14.080 -6.139 0.503 495 HE2 PHE 62 HE2 PHE 62 -13.665 -3.160 -2.514 496 HZ PHE 62 HZ PHE 62 -14.285 -3.793 -0.218 497 HA PRO 63 HA PRO 63 -13.286 -11.210 -7.323 498 HB2 PRO 63 HB2 PRO 63 -13.480 -9.083 -9.357 499 HB3 PRO 63 HB1 PRO 63 -14.409 -10.577 -9.204 500 HG2 PRO 63 HG2 PRO 63 -15.493 -8.177 -8.688 501 HG3 PRO 63 HG1 PRO 63 -15.951 -9.629 -7.779 502 HD2 PRO 63 HD2 PRO 63 -14.131 -7.390 -6.990 503 HD3 PRO 63 HD1 PRO 63 -15.321 -8.274 -6.012 504 H ARG 64 HN ARG 64 -11.262 -11.874 -7.593 505 HA ARG 64 HA ARG 64 -8.994 -11.883 -7.821 506 HB2 ARG 64 HB2 ARG 64 -9.598 -9.618 -9.736 507 HB3 ARG 64 HB1 ARG 64 -8.045 -10.431 -9.606 508 HG2 ARG 64 HG2 ARG 64 -9.100 -12.535 -10.289 509 HG3 ARG 64 HG1 ARG 64 -10.644 -11.700 -10.447 510 HD2 ARG 64 HD2 ARG 64 -9.615 -11.912 -12.606 511 HD3 ARG 64 HD1 ARG 64 -9.649 -10.217 -12.130 512 HE ARG 64 HE ARG 64 -7.198 -11.593 -11.476 513 HH11 ARG 64 HH11 ARG 64 -8.908 -9.723 -13.898 514 HH12 ARG 64 HH12 ARG 64 -7.452 -9.214 -14.707 515 HH21 ARG 64 HH21 ARG 64 -5.305 -10.922 -12.513 516 HH22 ARG 64 HH22 ARG 64 -5.396 -9.919 -13.930 517 HA PRO 65 HA PRO 65 -9.027 -8.293 -4.883 518 HB2 PRO 65 HB2 PRO 65 -8.055 -9.606 -2.709 519 HB3 PRO 65 HB1 PRO 65 -9.768 -9.568 -3.140 520 HG2 PRO 65 HG2 PRO 65 -7.746 -11.714 -3.588 521 HG3 PRO 65 HG1 PRO 65 -9.452 -11.852 -3.129 522 HD2 PRO 65 HD2 PRO 65 -8.538 -12.266 -5.668 523 HD3 PRO 65 HD1 PRO 65 -10.173 -11.698 -5.293 524 H LYS 66 HN LYS 66 -6.512 -10.499 -5.746 525 HA LYS 66 HA LYS 66 -4.433 -8.845 -4.673 526 HB2 LYS 66 HB2 LYS 66 -4.139 -11.279 -4.730 527 HB3 LYS 66 HB1 LYS 66 -4.236 -11.248 -6.485 528 HG2 LYS 66 HG2 LYS 66 -2.176 -10.099 -6.679 529 HG3 LYS 66 HG1 LYS 66 -2.145 -9.728 -4.956 530 HD2 LYS 66 HD2 LYS 66 -1.354 -11.755 -4.393 531 HD3 LYS 66 HD1 LYS 66 -2.301 -12.591 -5.625 532 HE2 LYS 66 HE2 LYS 66 0.123 -10.920 -6.248 533 HE3 LYS 66 HE1 LYS 66 0.205 -12.650 -5.916 534 HZ1 LYS 66 HZ1 LYS 66 -1.479 -11.464 -8.058 535 HZ2 LYS 66 HZ2 LYS 66 -1.144 -13.108 -7.801 536 HZ3 LYS 66 HZ3 LYS 66 0.087 -12.063 -8.312 537 H ARG 67 HN ARG 67 -4.275 -6.947 -5.580 538 HA ARG 67 HA ARG 67 -4.351 -6.731 -8.515 539 HB2 ARG 67 HB2 ARG 67 -4.318 -4.318 -6.728 540 HB3 ARG 67 HB1 ARG 67 -5.146 -4.559 -8.264 541 HG2 ARG 67 HG2 ARG 67 -5.976 -5.808 -5.652 542 HG3 ARG 67 HG1 ARG 67 -6.671 -4.341 -6.337 543 HD2 ARG 67 HD2 ARG 67 -6.675 -7.033 -7.700 544 HD3 ARG 67 HD1 ARG 67 -8.010 -6.394 -6.740 545 HE ARG 67 HE ARG 67 -7.067 -4.796 -9.005 546 HH11 ARG 67 HH11 ARG 67 -9.463 -6.992 -7.704 547 HH12 ARG 67 HH12 ARG 67 -10.715 -6.471 -8.786 548 HH21 ARG 67 HH21 ARG 67 -8.713 -4.112 -10.430 549 HH22 ARG 67 HH22 ARG 67 -10.286 -4.836 -10.334 550 H VAL 68 HN VAL 68 -2.356 -6.804 -9.395 551 HA VAL 68 HA VAL 68 -0.096 -5.914 -7.764 552 HB VAL 68 HB VAL 68 1.303 -7.261 -8.974 553 HG11 VAL 68 HG11 VAL 68 -0.348 -8.704 -7.929 554 HG12 VAL 68 HG12 VAL 68 0.210 -9.401 -9.452 555 HG13 VAL 68 HG13 VAL 68 -1.361 -8.608 -9.374 556 HG21 VAL 68 HG21 VAL 68 0.997 -6.243 -11.123 557 HG22 VAL 68 HG22 VAL 68 -0.560 -7.051 -11.331 558 HG23 VAL 68 HG23 VAL 68 0.929 -7.998 -11.295 559 H CYS 69 HN CYS 69 1.252 -4.269 -8.307 560 HA CYS 69 HA CYS 69 0.620 -2.737 -10.744 561 HB2 CYS 69 HB2 CYS 69 1.266 -1.593 -8.011 562 HB3 CYS 69 HB1 CYS 69 1.008 -0.659 -9.481 563 HG CYS 69 HG CYS 69 -1.296 -2.399 -7.665 564 H LYS 70 HN LYS 70 2.365 -2.700 -12.035 565 HA LYS 70 HA LYS 70 5.023 -3.090 -10.803 566 HB2 LYS 70 HB2 LYS 70 4.270 -3.471 -13.706 567 HB3 LYS 70 HB1 LYS 70 5.736 -4.013 -12.905 568 HG2 LYS 70 HG2 LYS 70 4.595 -5.747 -11.772 569 HG3 LYS 70 HG1 LYS 70 3.020 -5.050 -12.156 570 HD2 LYS 70 HD2 LYS 70 3.314 -5.549 -14.490 571 HD3 LYS 70 HD1 LYS 70 4.963 -6.105 -14.199 572 HE2 LYS 70 HE2 LYS 70 4.169 -7.966 -12.916 573 HE3 LYS 70 HE1 LYS 70 2.513 -7.361 -12.978 574 HZ1 LYS 70 HZ1 LYS 70 4.030 -8.049 -15.425 575 HZ2 LYS 70 HZ2 LYS 70 2.355 -7.842 -15.247 576 HZ3 LYS 70 HZ3 LYS 70 3.118 -9.200 -14.578 577 H ASP 71 HN ASP 71 3.172 -0.642 -11.949 578 HA ASP 71 HA ASP 71 5.370 0.691 -13.379 579 HB2 ASP 71 HB2 ASP 71 3.707 1.622 -14.887 580 HB3 ASP 71 HB1 ASP 71 3.225 -0.061 -14.679 581 HA PRO 72 HA PRO 72 5.108 4.512 -10.910 582 HB2 PRO 72 HB2 PRO 72 3.046 5.659 -12.760 583 HB3 PRO 72 HB1 PRO 72 4.457 6.442 -12.041 584 HG2 PRO 72 HG2 PRO 72 4.618 5.658 -14.524 585 HG3 PRO 72 HG1 PRO 72 5.956 5.259 -13.423 586 HD2 PRO 72 HD2 PRO 72 3.734 3.527 -14.416 587 HD3 PRO 72 HD1 PRO 72 5.456 3.135 -14.222 588 HA PRO 73 HA PRO 73 2.486 5.434 -7.642 589 HB2 PRO 73 HB2 PRO 73 0.139 6.297 -9.289 590 HB3 PRO 73 HB1 PRO 73 0.669 6.888 -7.708 591 HG2 PRO 73 HG2 PRO 73 1.325 8.083 -10.102 592 HG3 PRO 73 HG1 PRO 73 2.277 8.238 -8.620 593 HD2 PRO 73 HD2 PRO 73 3.049 6.986 -11.054 594 HD3 PRO 73 HD1 PRO 73 3.961 7.037 -9.535 595 H TYR 74 HN TYR 74 2.159 3.566 -6.806 596 HA TYR 74 HA TYR 74 0.593 1.498 -8.069 597 HB2 TYR 74 HB2 TYR 74 1.946 1.436 -5.377 598 HB3 TYR 74 HB1 TYR 74 1.528 0.063 -6.387 599 HD1 TYR 74 HD2 TYR 74 3.748 3.060 -6.268 600 HD2 TYR 74 HD1 TYR 74 3.121 -0.826 -7.861 601 HE1 TYR 74 HE2 TYR 74 6.008 3.100 -7.222 602 HE2 TYR 74 HE1 TYR 74 5.383 -0.802 -8.832 603 HH TYR 74 HH TYR 74 7.113 0.627 -9.428 604 H LYS 75 HN LYS 75 -1.483 1.107 -7.598 605 HA LYS 75 HA LYS 75 -2.683 1.922 -5.083 606 HB2 LYS 75 HB2 LYS 75 -4.295 3.417 -6.330 607 HB3 LYS 75 HB1 LYS 75 -2.646 4.033 -6.211 608 HG2 LYS 75 HG2 LYS 75 -2.163 3.274 -8.442 609 HG3 LYS 75 HG1 LYS 75 -3.767 2.581 -8.583 610 HD2 LYS 75 HD2 LYS 75 -2.929 5.435 -8.497 611 HD3 LYS 75 HD1 LYS 75 -3.920 4.625 -9.695 612 HE2 LYS 75 HE2 LYS 75 -5.683 4.409 -7.955 613 HE3 LYS 75 HE1 LYS 75 -4.670 5.424 -6.928 614 HZ1 LYS 75 HZ1 LYS 75 -5.846 6.190 -9.539 615 HZ2 LYS 75 HZ2 LYS 75 -4.744 7.139 -8.672 616 HZ3 LYS 75 HZ3 LYS 75 -6.270 6.801 -8.017 617 H VAL 76 HN VAL 76 -5.003 1.572 -5.156 618 HA VAL 76 HA VAL 76 -5.980 -0.318 -7.163 619 HB VAL 76 HB VAL 76 -5.937 -0.841 -4.207 620 HG11 VAL 76 HG11 VAL 76 -8.253 -1.047 -5.165 621 HG12 VAL 76 HG12 VAL 76 -7.604 -2.520 -4.443 622 HG13 VAL 76 HG13 VAL 76 -7.633 -2.334 -6.199 623 HG21 VAL 76 HG21 VAL 76 -4.097 -1.795 -5.439 624 HG22 VAL 76 HG22 VAL 76 -5.197 -2.472 -6.629 625 HG23 VAL 76 HG23 VAL 76 -5.200 -3.083 -4.977 626 H GLU 77 HN GLU 77 -7.955 0.230 -7.830 627 HA GLU 77 HA GLU 77 -9.590 1.938 -6.070 628 HB2 GLU 77 HB2 GLU 77 -9.647 1.766 -9.084 629 HB3 GLU 77 HB1 GLU 77 -10.640 2.806 -8.094 630 HG2 GLU 77 HG2 GLU 77 -8.865 4.138 -7.458 631 HG3 GLU 77 HG1 GLU 77 -7.709 2.930 -7.981 632 H GLU 78 HN GLU 78 -11.276 0.983 -5.263 633 HA GLU 78 HA GLU 78 -12.677 -1.033 -6.841 634 HB2 GLU 78 HB2 GLU 78 -11.121 -1.616 -4.405 635 HB3 GLU 78 HB1 GLU 78 -12.737 -2.311 -4.439 636 HG2 GLU 78 HG2 GLU 78 -10.432 -2.809 -6.285 637 HG3 GLU 78 HG1 GLU 78 -11.371 -3.953 -5.330 638 H SER 79 HN SER 79 -14.543 -1.941 -5.401 639 HA SER 79 HA SER 79 -15.795 0.205 -3.872 640 HB2 SER 79 HB2 SER 79 -16.418 0.547 -6.259 641 HB3 SER 79 HB1 SER 79 -17.137 -1.066 -6.274 642 HG SER 79 HG SER 79 -18.077 1.303 -5.194 643 H GLY 80 HN GLY 80 -17.567 -0.505 -2.604 644 HA2 GLY 80 HA2 GLY 80 -18.386 -3.200 -2.357 645 HA3 GLY 80 HA1 GLY 80 -17.060 -2.886 -1.243 646 H TYR 81 HN TYR 81 -18.462 -3.131 0.613 647 HA TYR 81 HA TYR 81 -19.950 -0.669 1.106 648 HB2 TYR 81 HB2 TYR 81 -21.890 -1.959 2.070 649 HB3 TYR 81 HB1 TYR 81 -21.732 -2.016 0.319 650 HD1 TYR 81 HD1 TYR 81 -21.118 -4.078 -0.820 651 HD2 TYR 81 HD2 TYR 81 -21.546 -3.972 3.408 652 HE1 TYR 81 HE1 TYR 81 -21.198 -6.535 -0.765 653 HE2 TYR 81 HE2 TYR 81 -21.620 -6.422 3.473 654 HH TYR 81 HH TYR 81 -22.185 -8.280 1.965 655 H ALA 82 HN ALA 82 -17.500 -2.250 2.160 656 HA ALA 82 HA ALA 82 -17.889 -1.401 4.876 657 HB1 ALA 82 HB1 ALA 82 -18.821 -3.506 5.283 658 HB2 ALA 82 HB2 ALA 82 -17.135 -3.699 5.753 659 HB3 ALA 82 HB3 ALA 82 -17.693 -4.316 4.199 660 H GLY 83 HN GLY 83 -15.913 -1.563 6.159 661 HA2 GLY 83 HA2 GLY 83 -13.527 -1.412 4.455 662 HA3 GLY 83 HA1 GLY 83 -13.681 -0.746 6.077 663 H PHE 84 HN PHE 84 -11.476 -2.055 5.834 664 HA PHE 84 HA PHE 84 -11.530 -4.262 7.551 665 HB2 PHE 84 HB2 PHE 84 -10.916 -6.076 5.937 666 HB3 PHE 84 HB1 PHE 84 -12.572 -5.514 5.748 667 HD1 PHE 84 HD1 PHE 84 -13.073 -3.885 3.857 668 HD2 PHE 84 HD2 PHE 84 -9.434 -6.072 4.120 669 HE1 PHE 84 HE1 PHE 84 -12.676 -3.494 1.467 670 HE2 PHE 84 HE2 PHE 84 -9.016 -5.682 1.737 671 HZ PHE 84 HZ PHE 84 -10.634 -4.393 0.393 672 H ILE 85 HN ILE 85 -9.365 -5.078 7.976 673 HA ILE 85 HA ILE 85 -7.183 -3.409 7.298 674 HB ILE 85 HB ILE 85 -7.311 -6.221 8.384 675 HG12 ILE 85 HG12 ILE 85 -7.889 -4.357 9.900 676 HG13 ILE 85 HG11 ILE 85 -6.436 -5.212 10.407 677 HG21 ILE 85 HG21 ILE 85 -4.787 -4.648 7.847 678 HG22 ILE 85 HG22 ILE 85 -5.310 -6.099 6.992 679 HG23 ILE 85 HG23 ILE 85 -4.893 -6.189 8.702 680 HD11 ILE 85 HD11 ILE 85 -6.395 -2.644 8.857 681 HD12 ILE 85 HD12 ILE 85 -5.037 -3.456 9.633 682 HD13 ILE 85 HD13 ILE 85 -6.316 -2.739 10.614 683 H LEU 86 HN LEU 86 -6.008 -3.310 5.478 684 HA LEU 86 HA LEU 86 -6.302 -5.545 3.577 685 HB2 LEU 86 HB2 LEU 86 -7.168 -3.098 3.065 686 HB3 LEU 86 HB1 LEU 86 -5.473 -2.818 2.699 687 HG LEU 86 HG LEU 86 -6.758 -5.176 1.427 688 HD11 LEU 86 HD11 LEU 86 -7.119 -2.423 0.273 689 HD12 LEU 86 HD12 LEU 86 -8.363 -3.222 1.238 690 HD13 LEU 86 HD13 LEU 86 -7.817 -3.951 -0.272 691 HD21 LEU 86 HD21 LEU 86 -5.290 -3.441 -0.259 692 HD22 LEU 86 HD22 LEU 86 -4.925 -5.103 0.201 693 HD23 LEU 86 HD23 LEU 86 -4.356 -3.760 1.198 694 HA PRO 87 HA PRO 87 -1.912 -5.995 4.537 695 HB2 PRO 87 HB2 PRO 87 -1.784 -8.385 3.181 696 HB3 PRO 87 HB1 PRO 87 -2.245 -8.231 4.880 697 HG2 PRO 87 HG2 PRO 87 -3.993 -8.479 2.460 698 HG3 PRO 87 HG1 PRO 87 -4.147 -9.276 4.038 699 HD2 PRO 87 HD2 PRO 87 -5.655 -7.151 3.415 700 HD3 PRO 87 HD1 PRO 87 -5.011 -7.377 5.052 701 H ILE 88 HN ILE 88 -1.050 -4.410 3.216 702 HA ILE 88 HA ILE 88 -1.020 -4.859 0.337 703 HB ILE 88 HB ILE 88 0.041 -2.438 1.808 704 HG12 ILE 88 HG12 ILE 88 -2.639 -2.529 0.448 705 HG13 ILE 88 HG11 ILE 88 -2.491 -3.107 2.107 706 HG21 ILE 88 HG21 ILE 88 0.821 -2.789 -0.495 707 HG22 ILE 88 HG22 ILE 88 -0.201 -1.358 -0.350 708 HG23 ILE 88 HG23 ILE 88 -0.857 -2.841 -1.041 709 HD11 ILE 88 HD11 ILE 88 -1.858 -0.342 1.112 710 HD12 ILE 88 HD12 ILE 88 -1.608 -0.907 2.758 711 HD13 ILE 88 HD13 ILE 88 -3.237 -0.828 2.090 712 H GLU 89 HN GLU 89 0.939 -4.954 -0.820 713 HA GLU 89 HA GLU 89 3.343 -5.348 0.827 714 HB2 GLU 89 HB2 GLU 89 2.427 -7.164 -1.407 715 HB3 GLU 89 HB1 GLU 89 4.010 -7.231 -0.648 716 HG2 GLU 89 HG2 GLU 89 2.864 -7.687 1.520 717 HG3 GLU 89 HG1 GLU 89 1.351 -7.813 0.625 718 H VAL 90 HN VAL 90 5.087 -4.360 0.089 719 HA VAL 90 HA VAL 90 5.108 -3.472 -2.715 720 HB VAL 90 HB VAL 90 6.770 -2.268 -0.517 721 HG11 VAL 90 HG11 VAL 90 7.301 -0.635 -2.139 722 HG12 VAL 90 HG12 VAL 90 6.103 -1.249 -3.257 723 HG13 VAL 90 HG13 VAL 90 7.545 -2.196 -2.895 724 HG21 VAL 90 HG21 VAL 90 4.206 -1.992 -0.363 725 HG22 VAL 90 HG22 VAL 90 4.386 -0.966 -1.786 726 HG23 VAL 90 HG23 VAL 90 5.212 -0.545 -0.284 727 H TYR 91 HN TYR 91 6.619 -4.322 -4.010 728 HA TYR 91 HA TYR 91 8.476 -6.231 -2.822 729 HB2 TYR 91 HB2 TYR 91 7.557 -5.676 -5.598 730 HB3 TYR 91 HB1 TYR 91 9.078 -6.523 -5.361 731 HD1 TYR 91 HD1 TYR 91 5.819 -6.732 -3.561 732 HD2 TYR 91 HD2 TYR 91 8.748 -8.752 -5.882 733 HE1 TYR 91 HE1 TYR 91 4.617 -8.837 -3.236 734 HE2 TYR 91 HE2 TYR 91 7.534 -10.873 -5.585 735 HH TYR 91 HH TYR 91 5.958 -11.850 -3.917 736 H PHE 92 HN PHE 92 10.546 -6.028 -2.652 737 HA PHE 92 HA PHE 92 11.733 -3.425 -3.329 738 HB2 PHE 92 HB2 PHE 92 12.443 -5.570 -1.306 739 HB3 PHE 92 HB1 PHE 92 13.469 -4.169 -1.628 740 HD1 PHE 92 HD1 PHE 92 11.070 -2.244 -1.999 741 HD2 PHE 92 HD2 PHE 92 12.098 -5.080 0.995 742 HE1 PHE 92 HE1 PHE 92 9.872 -0.901 -0.328 743 HE2 PHE 92 HE2 PHE 92 10.862 -3.756 2.668 744 HZ PHE 92 HZ PHE 92 9.769 -1.658 2.003 745 H LYS 93 HN LYS 93 13.967 -3.444 -4.124 746 HA LYS 93 HA LYS 93 14.548 -5.796 -5.783 747 HB2 LYS 93 HB2 LYS 93 15.829 -3.055 -5.805 748 HB3 LYS 93 HB1 LYS 93 16.138 -4.345 -6.957 749 HG2 LYS 93 HG2 LYS 93 13.916 -4.170 -7.834 750 HG3 LYS 93 HG1 LYS 93 13.473 -3.003 -6.580 751 HD2 LYS 93 HD2 LYS 93 15.094 -1.412 -7.464 752 HD3 LYS 93 HD1 LYS 93 15.643 -2.591 -8.653 753 HE2 LYS 93 HE2 LYS 93 13.152 -2.559 -9.431 754 HE3 LYS 93 HE1 LYS 93 13.089 -1.019 -8.570 755 HZ1 LYS 93 HZ1 LYS 93 13.637 -0.565 -10.810 756 HZ2 LYS 93 HZ2 LYS 93 14.855 -1.736 -10.836 757 HZ3 LYS 93 HZ3 LYS 93 15.056 -0.333 -9.911 758 H ASN 94 HN ASN 94 15.518 -7.220 -4.301 759 HA ASN 94 HA ASN 94 18.101 -6.327 -3.213 760 HB2 ASN 94 HB2 ASN 94 15.991 -7.889 -1.715 761 HB3 ASN 94 HB1 ASN 94 17.649 -7.678 -1.175 762 HD21 ASN 94 HD21 ASN 94 18.226 -5.923 -0.131 763 HD22 ASN 94 HD22 ASN 94 17.159 -4.609 0.229 764 H LYS 95 HN LYS 95 19.632 -7.943 -2.874 765 HA LYS 95 HA LYS 95 18.981 -10.625 -3.926 766 HB2 LYS 95 HB2 LYS 95 21.649 -9.227 -3.720 767 HB3 LYS 95 HB1 LYS 95 21.446 -10.896 -4.229 768 HG2 LYS 95 HG2 LYS 95 20.674 -10.321 -6.282 769 HG3 LYS 95 HG1 LYS 95 19.914 -8.839 -5.694 770 HD2 LYS 95 HD2 LYS 95 21.793 -8.302 -7.136 771 HD3 LYS 95 HD1 LYS 95 22.157 -7.824 -5.478 772 HE2 LYS 95 HE2 LYS 95 24.088 -8.885 -6.483 773 HE3 LYS 95 HE1 LYS 95 23.451 -9.888 -5.180 774 HZ1 LYS 95 HZ1 LYS 95 24.063 -11.136 -7.210 775 HZ2 LYS 95 HZ2 LYS 95 22.840 -10.315 -8.055 776 HZ3 LYS 95 HZ3 LYS 95 22.438 -11.339 -6.765 777 H GLU 96 HN GLU 96 19.254 -8.849 -1.285 778 HA GLU 96 HA GLU 96 20.203 -11.030 0.436 779 HB2 GLU 96 HB2 GLU 96 20.619 -8.589 1.828 780 HB3 GLU 96 HB1 GLU 96 21.870 -9.656 1.206 781 HG2 GLU 96 HG2 GLU 96 22.308 -7.460 0.443 782 HG3 GLU 96 HG1 GLU 96 21.778 -8.418 -0.936 783 H GLU 97 HN GLU 97 19.537 -9.268 2.771 784 HA GLU 97 HA GLU 97 17.225 -10.182 3.705 785 HB2 GLU 97 HB2 GLU 97 18.384 -7.425 4.024 786 HB3 GLU 97 HB1 GLU 97 17.025 -8.010 4.980 787 HG2 GLU 97 HG2 GLU 97 19.784 -9.213 4.875 788 HG3 GLU 97 HG1 GLU 97 19.107 -8.260 6.197 789 HA PRO 98 HA PRO 98 13.332 -9.632 2.522 790 HB2 PRO 98 HB2 PRO 98 13.009 -6.828 3.565 791 HB3 PRO 98 HB1 PRO 98 11.836 -8.163 3.556 792 HG2 PRO 98 HG2 PRO 98 13.164 -7.676 5.707 793 HG3 PRO 98 HG1 PRO 98 13.039 -9.362 5.176 794 HD2 PRO 98 HD2 PRO 98 15.350 -7.455 5.024 795 HD3 PRO 98 HD1 PRO 98 15.405 -9.208 5.321 796 H ARG 99 HN ARG 99 12.752 -9.603 0.602 797 HA ARG 99 HA ARG 99 13.269 -7.293 -1.113 798 HB2 ARG 99 HB2 ARG 99 12.510 -10.139 -1.735 799 HB3 ARG 99 HB1 ARG 99 12.669 -8.874 -2.952 800 HG2 ARG 99 HG2 ARG 99 14.960 -8.577 -2.499 801 HG3 ARG 99 HG1 ARG 99 14.864 -9.567 -1.050 802 HD2 ARG 99 HD2 ARG 99 15.947 -10.609 -3.067 803 HD3 ARG 99 HD1 ARG 99 14.680 -11.568 -2.338 804 HE ARG 99 HE ARG 99 13.700 -9.906 -4.454 805 HH11 ARG 99 HH11 ARG 99 15.365 -12.910 -3.765 806 HH12 ARG 99 HH12 ARG 99 14.939 -13.643 -5.283 807 HH21 ARG 99 HH21 ARG 99 13.119 -10.873 -6.445 808 HH22 ARG 99 HH22 ARG 99 13.685 -12.475 -6.819 809 H LYS 100 HN LYS 100 11.081 -8.052 0.992 810 HA LYS 100 HA LYS 100 8.966 -6.696 -0.433 811 HB2 LYS 100 HB2 LYS 100 7.280 -8.501 0.092 812 HB3 LYS 100 HB1 LYS 100 8.402 -8.849 -1.213 813 HG2 LYS 100 HG2 LYS 100 9.785 -10.136 0.422 814 HG3 LYS 100 HG1 LYS 100 8.484 -9.917 1.593 815 HD2 LYS 100 HD2 LYS 100 8.153 -11.240 -1.100 816 HD3 LYS 100 HD1 LYS 100 8.431 -12.111 0.408 817 HE2 LYS 100 HE2 LYS 100 6.173 -12.224 0.397 818 HE3 LYS 100 HE1 LYS 100 6.319 -10.635 1.143 819 HZ1 LYS 100 HZ1 LYS 100 5.639 -11.298 -1.657 820 HZ2 LYS 100 HZ2 LYS 100 6.191 -9.757 -1.226 821 HZ3 LYS 100 HZ3 LYS 100 4.765 -10.362 -0.542 822 H VAL 101 HN VAL 101 7.625 -5.628 0.857 823 HA VAL 101 HA VAL 101 7.808 -6.102 3.760 824 HB VAL 101 HB VAL 101 8.977 -4.019 3.064 825 HG11 VAL 101 HG11 VAL 101 7.860 -3.268 1.158 826 HG12 VAL 101 HG12 VAL 101 7.444 -2.086 2.405 827 HG13 VAL 101 HG13 VAL 101 6.281 -3.332 1.951 828 HG21 VAL 101 HG21 VAL 101 7.937 -2.537 4.686 829 HG22 VAL 101 HG22 VAL 101 7.997 -4.196 5.290 830 HG23 VAL 101 HG23 VAL 101 6.480 -3.537 4.678 831 H ARG 102 HN ARG 102 5.870 -5.936 4.922 832 HA ARG 102 HA ARG 102 3.453 -5.770 3.257 833 HB2 ARG 102 HB2 ARG 102 3.910 -7.985 4.358 834 HB3 ARG 102 HB1 ARG 102 3.746 -7.177 5.910 835 HG2 ARG 102 HG2 ARG 102 1.453 -6.511 5.336 836 HG3 ARG 102 HG1 ARG 102 1.581 -7.383 3.807 837 HD2 ARG 102 HD2 ARG 102 0.450 -8.831 5.283 838 HD3 ARG 102 HD1 ARG 102 2.103 -9.440 5.205 839 HE ARG 102 HE ARG 102 1.433 -7.624 7.399 840 HH11 ARG 102 HH11 ARG 102 1.998 -10.901 6.300 841 HH12 ARG 102 HH12 ARG 102 2.253 -11.528 7.900 842 HH21 ARG 102 HH21 ARG 102 1.781 -8.446 9.509 843 HH22 ARG 102 HH22 ARG 102 2.136 -10.134 9.724 844 H PHE 103 HN PHE 103 2.169 -4.117 3.629 845 HA PHE 103 HA PHE 103 2.291 -2.838 6.274 846 HB2 PHE 103 HB2 PHE 103 1.541 -1.633 3.604 847 HB3 PHE 103 HB1 PHE 103 1.502 -0.785 5.142 848 HD1 PHE 103 HD1 PHE 103 4.010 -1.657 6.384 849 HD2 PHE 103 HD2 PHE 103 3.172 -0.594 2.351 850 HE1 PHE 103 HE1 PHE 103 6.342 -0.941 6.094 851 HE2 PHE 103 HE2 PHE 103 5.511 0.104 2.050 852 HZ PHE 103 HZ PHE 103 7.097 -0.063 3.922 853 H ASP 104 HN ASP 104 0.691 -3.786 7.380 854 HA ASP 104 HA ASP 104 -1.831 -4.492 6.189 855 HB2 ASP 104 HB2 ASP 104 -1.068 -4.375 9.114 856 HB3 ASP 104 HB1 ASP 104 -2.500 -5.148 8.449 857 H TYR 105 HN TYR 105 -2.617 -2.594 5.338 858 HA TYR 105 HA TYR 105 -2.797 -0.279 7.092 859 HB2 TYR 105 HB2 TYR 105 -1.961 0.030 4.800 860 HB3 TYR 105 HB1 TYR 105 -3.487 -0.586 4.156 861 HD1 TYR 105 HD1 TYR 105 -2.238 2.037 6.492 862 HD2 TYR 105 HD2 TYR 105 -5.084 0.944 3.538 863 HE1 TYR 105 HE1 TYR 105 -3.172 4.308 6.591 864 HE2 TYR 105 HE2 TYR 105 -6.036 3.194 3.605 865 HH TYR 105 HH TYR 105 -6.108 5.083 5.593 866 H ASP 106 HN ASP 106 -4.616 0.463 7.987 867 HA ASP 106 HA ASP 106 -6.956 -1.203 7.900 868 HB2 ASP 106 HB2 ASP 106 -6.198 -0.138 9.999 869 HB3 ASP 106 HB1 ASP 106 -6.535 1.446 9.306 870 H LEU 107 HN LEU 107 -8.172 -1.085 6.110 871 HA LEU 107 HA LEU 107 -8.604 1.394 4.725 872 HB2 LEU 107 HB2 LEU 107 -9.070 -1.405 4.252 873 HB3 LEU 107 HB1 LEU 107 -10.519 -0.484 3.890 874 HG LEU 107 HG LEU 107 -9.089 0.964 2.390 875 HD11 LEU 107 HD11 LEU 107 -6.976 -0.086 1.611 876 HD12 LEU 107 HD12 LEU 107 -7.083 -1.199 2.980 877 HD13 LEU 107 HD13 LEU 107 -6.911 0.535 3.264 878 HD21 LEU 107 HD21 LEU 107 -8.939 -0.809 0.622 879 HD22 LEU 107 HD22 LEU 107 -10.512 -0.647 1.409 880 HD23 LEU 107 HD23 LEU 107 -9.435 -1.969 1.858 881 H PHE 108 HN PHE 108 -9.784 2.875 5.767 882 HA PHE 108 HA PHE 108 -12.243 1.994 7.101 883 HB2 PHE 108 HB2 PHE 108 -12.110 4.104 8.405 884 HB3 PHE 108 HB1 PHE 108 -10.741 3.038 8.673 885 HD1 PHE 108 HD2 PHE 108 -11.845 6.221 7.247 886 HD2 PHE 108 HD1 PHE 108 -8.513 3.668 7.965 887 HE1 PHE 108 HE2 PHE 108 -10.316 8.079 6.748 888 HE2 PHE 108 HE1 PHE 108 -6.982 5.525 7.467 889 HZ PHE 108 HZ PHE 108 -7.882 7.732 6.857 890 H LEU 109 HN LEU 109 -14.135 2.609 6.304 891 HA LEU 109 HA LEU 109 -14.167 4.809 4.338 892 HB2 LEU 109 HB2 LEU 109 -16.291 2.685 4.707 893 HB3 LEU 109 HB1 LEU 109 -16.119 3.805 3.370 894 HG LEU 109 HG LEU 109 -14.317 1.457 3.980 895 HD11 LEU 109 HD11 LEU 109 -16.549 0.949 2.986 896 HD12 LEU 109 HD12 LEU 109 -15.180 0.493 1.977 897 HD13 LEU 109 HD13 LEU 109 -16.100 1.950 1.607 898 HD21 LEU 109 HD21 LEU 109 -14.153 3.517 1.786 899 HD22 LEU 109 HD22 LEU 109 -13.211 2.024 1.854 900 HD23 LEU 109 HD23 LEU 109 -12.989 3.264 3.089 901 H HIS 110 HN HIS 110 -15.925 6.375 4.596 902 HA HIS 110 HA HIS 110 -16.882 6.452 7.364 903 HB2 HIS 110 HB2 HIS 110 -16.326 8.582 5.355 904 HB3 HIS 110 HB1 HIS 110 -17.554 8.886 6.579 905 HD1 HIS 110 HD1 HIS 110 -16.448 10.410 8.197 906 HD2 HIS 110 HD2 HIS 110 -14.010 7.205 7.143 907 HE1 HIS 110 HE1 HIS 110 -14.400 10.604 9.646 908 HE2 HIS 110 HE2 HIS 110 -13.042 8.542 9.137 909 H LEU 111 HN LEU 111 -19.083 7.526 7.634 910 HA LEU 111 HA LEU 111 -20.920 5.645 6.787 911 HB2 LEU 111 HB2 LEU 111 -20.965 8.088 8.341 912 HB3 LEU 111 HB1 LEU 111 -22.462 7.843 7.457 913 HG LEU 111 HG LEU 111 -22.466 6.893 9.773 914 HD11 LEU 111 HD11 LEU 111 -23.346 4.649 9.058 915 HD12 LEU 111 HD12 LEU 111 -22.834 5.049 7.417 916 HD13 LEU 111 HD13 LEU 111 -24.056 6.032 8.225 917 HD21 LEU 111 HD21 LEU 111 -20.472 4.981 8.563 918 HD22 LEU 111 HD22 LEU 111 -21.246 4.800 10.143 919 HD23 LEU 111 HD23 LEU 111 -20.146 6.149 9.849 920 H GLU 112 HN GLU 112 -22.423 5.451 5.319 921 HA GLU 112 HA GLU 112 -22.226 6.561 2.798 922 HB2 GLU 112 HB2 GLU 112 -23.424 4.467 3.380 923 HB3 GLU 112 HB1 GLU 112 -24.702 5.425 4.108 924 HG2 GLU 112 HG2 GLU 112 -25.187 6.431 1.935 925 HG3 GLU 112 HG1 GLU 112 -23.909 5.458 1.207 926 H GLY 113 HN GLY 113 -22.715 8.462 2.002 927 HA2 GLY 113 HA2 GLY 113 -24.539 10.105 1.680 928 HA3 GLY 113 HA1 GLY 113 -24.673 10.135 3.434 929 H HIS 114 HN HIS 114 -22.104 10.296 4.283 930 HA HIS 114 HA HIS 114 -20.843 12.488 2.813 931 HB2 HIS 114 HB2 HIS 114 -21.747 12.763 5.693 932 HB3 HIS 114 HB1 HIS 114 -20.584 13.833 4.924 933 HD1 HIS 114 HD1 HIS 114 -21.471 15.548 3.242 934 HD2 HIS 114 HD2 HIS 114 -24.417 13.125 4.898 935 HE1 HIS 114 HE1 HIS 114 -23.664 16.612 2.607 936 HE2 HIS 114 HE2 HIS 114 -25.429 15.190 3.712 937 HA PRO 115 HA PRO 115 -17.515 10.147 4.794 938 HB2 PRO 115 HB2 PRO 115 -16.760 8.547 2.747 939 HB3 PRO 115 HB1 PRO 115 -18.064 8.109 3.856 940 HG2 PRO 115 HG2 PRO 115 -18.220 8.842 1.040 941 HG3 PRO 115 HG1 PRO 115 -19.468 8.139 2.079 942 HD2 PRO 115 HD2 PRO 115 -19.041 10.945 1.322 943 HD3 PRO 115 HD1 PRO 115 -20.479 10.179 2.035 944 HA PRO 116 HA PRO 116 -14.586 12.618 2.384 945 HB2 PRO 116 HB2 PRO 116 -13.663 14.076 4.491 946 HB3 PRO 116 HB1 PRO 116 -15.083 14.539 3.552 947 HG2 PRO 116 HG2 PRO 116 -14.941 13.607 6.300 948 HG3 PRO 116 HG1 PRO 116 -16.326 14.279 5.426 949 HD2 PRO 116 HD2 PRO 116 -15.646 11.474 5.959 950 HD3 PRO 116 HD1 PRO 116 -17.191 12.177 5.434 951 H VAL 117 HN VAL 117 -13.238 10.751 2.070 952 HA VAL 117 HA VAL 117 -11.362 10.337 4.313 953 HB VAL 117 HB VAL 117 -12.432 8.302 2.368 954 HG11 VAL 117 HG11 VAL 117 -10.197 8.027 4.362 955 HG12 VAL 117 HG12 VAL 117 -10.065 7.915 2.612 956 HG13 VAL 117 HG13 VAL 117 -10.958 6.689 3.510 957 HG21 VAL 117 HG21 VAL 117 -13.158 7.156 4.416 958 HG22 VAL 117 HG22 VAL 117 -13.882 8.756 4.263 959 HG23 VAL 117 HG23 VAL 117 -12.539 8.499 5.376 960 H ASN 118 HN ASN 118 -9.478 11.181 3.868 961 HA ASN 118 HA ASN 118 -8.092 10.321 1.456 962 HB2 ASN 118 HB2 ASN 118 -9.044 12.612 0.987 963 HB3 ASN 118 HB1 ASN 118 -8.060 13.230 2.308 964 HD21 ASN 118 HD21 ASN 118 -5.664 12.789 2.087 965 HD22 ASN 118 HD22 ASN 118 -4.991 12.867 0.497 966 H HIS 119 HN HIS 119 -6.612 9.070 2.619 967 HA HIS 119 HA HIS 119 -5.058 10.537 4.651 968 HB2 HIS 119 HB2 HIS 119 -6.777 8.876 5.588 969 HB3 HIS 119 HB1 HIS 119 -5.717 7.624 4.944 970 HD1 HIS 119 HD1 HIS 119 -5.097 6.725 7.291 971 HD2 HIS 119 HD2 HIS 119 -4.170 10.739 6.722 972 HE1 HIS 119 HE1 HIS 119 -3.604 7.358 9.212 973 HE2 HIS 119 HE2 HIS 119 -3.005 9.773 8.818 974 H LEU 120 HN LEU 120 -2.952 10.346 4.581 975 HA LEU 120 HA LEU 120 -1.646 8.091 3.248 976 HB2 LEU 120 HB2 LEU 120 -1.344 10.993 2.558 977 HB3 LEU 120 HB1 LEU 120 0.031 9.920 2.403 978 HG LEU 120 HG LEU 120 -2.584 9.349 1.036 979 HD11 LEU 120 HD11 LEU 120 -0.723 10.196 -0.844 980 HD12 LEU 120 HD12 LEU 120 -0.634 11.396 0.447 981 HD13 LEU 120 HD13 LEU 120 -2.178 11.056 -0.337 982 HD21 LEU 120 HD21 LEU 120 -0.662 7.635 1.457 983 HD22 LEU 120 HD22 LEU 120 0.144 8.515 0.155 984 HD23 LEU 120 HD23 LEU 120 -1.416 7.744 -0.135 985 H ARG 121 HN ARG 121 0.533 7.768 3.964 986 HA ARG 121 HA ARG 121 1.574 9.309 6.155 987 HB2 ARG 121 HB2 ARG 121 0.843 8.084 7.936 988 HB3 ARG 121 HB1 ARG 121 -0.296 7.374 6.841 989 HG2 ARG 121 HG2 ARG 121 2.418 6.178 7.248 990 HG3 ARG 121 HG1 ARG 121 1.062 5.807 8.302 991 HD2 ARG 121 HD2 ARG 121 1.646 4.901 5.598 992 HD3 ARG 121 HD1 ARG 121 0.607 4.194 6.830 993 HE ARG 121 HE ARG 121 -0.185 5.842 4.643 994 HH11 ARG 121 HH11 ARG 121 -1.022 5.008 7.947 995 HH12 ARG 121 HH12 ARG 121 -2.695 5.455 7.760 996 HH21 ARG 121 HH21 ARG 121 -2.320 6.499 4.409 997 HH22 ARG 121 HH22 ARG 121 -3.434 6.309 5.725 998 H CYS 122 HN CYS 122 3.756 8.942 6.448 999 HA CYS 122 HA CYS 122 4.958 7.159 4.470 1000 HB2 CYS 122 HB2 CYS 122 7.053 8.432 5.053 1001 HB3 CYS 122 HB1 CYS 122 5.771 9.372 4.299 1002 HG CYS 122 HG CYS 122 7.372 10.438 6.685 1003 H GLU 123 HN GLU 123 5.756 5.283 5.010 1004 HA GLU 123 HA GLU 123 6.314 4.655 7.820 1005 HB2 GLU 123 HB2 GLU 123 6.109 2.860 5.384 1006 HB3 GLU 123 HB1 GLU 123 6.312 2.310 7.048 1007 HG2 GLU 123 HG2 GLU 123 4.013 4.019 6.264 1008 HG3 GLU 123 HG1 GLU 123 3.962 2.277 6.002 1009 H LYS 124 HN LYS 124 8.295 3.221 8.151 1010 HA LYS 124 HA LYS 124 10.496 4.281 6.514 1011 HB2 LYS 124 HB2 LYS 124 10.212 5.611 8.577 1012 HB3 LYS 124 HB1 LYS 124 10.417 4.143 9.523 1013 HG2 LYS 124 HG2 LYS 124 12.707 3.916 8.558 1014 HG3 LYS 124 HG1 LYS 124 12.452 5.464 7.752 1015 HD2 LYS 124 HD2 LYS 124 12.165 5.175 10.711 1016 HD3 LYS 124 HD1 LYS 124 13.727 5.486 9.934 1017 HE2 LYS 124 HE2 LYS 124 13.130 7.562 9.235 1018 HE3 LYS 124 HE1 LYS 124 11.426 7.132 9.107 1019 HZ1 LYS 124 HZ1 LYS 124 11.441 7.082 11.619 1020 HZ2 LYS 124 HZ2 LYS 124 11.606 8.613 10.913 1021 HZ3 LYS 124 HZ3 LYS 124 12.966 7.824 11.547 1022 H LEU 125 HN LEU 125 11.937 2.808 5.905 1023 HA LEU 125 HA LEU 125 12.114 0.291 7.436 1024 HB2 LEU 125 HB2 LEU 125 12.639 0.675 4.493 1025 HB3 LEU 125 HB1 LEU 125 12.572 -0.845 5.358 1026 HG LEU 125 HG LEU 125 10.123 0.835 5.407 1027 HD11 LEU 125 HD11 LEU 125 10.721 1.056 3.082 1028 HD12 LEU 125 HD12 LEU 125 9.410 -0.115 3.233 1029 HD13 LEU 125 HD13 LEU 125 11.060 -0.673 2.976 1030 HD21 LEU 125 HD21 LEU 125 9.124 -1.469 5.103 1031 HD22 LEU 125 HD22 LEU 125 10.034 -1.208 6.595 1032 HD23 LEU 125 HD23 LEU 125 10.768 -2.099 5.263 1033 H THR 126 HN THR 126 13.963 0.465 8.615 1034 HA THR 126 HA THR 126 16.304 1.801 7.462 1035 HB THR 126 HB THR 126 16.297 0.661 10.225 1036 HG1 THR 126 HG1 THR 126 15.457 2.994 10.677 1037 HG21 THR 126 HG21 THR 126 18.236 1.811 9.024 1038 HG22 THR 126 HG22 THR 126 17.849 2.338 10.662 1039 HG23 THR 126 HG23 THR 126 17.332 3.304 9.278 1040 H PHE 127 HN PHE 127 17.921 0.688 6.623 1041 HA PHE 127 HA PHE 127 18.255 -2.144 7.380 1042 HB2 PHE 127 HB2 PHE 127 18.960 -0.832 4.741 1043 HB3 PHE 127 HB1 PHE 127 19.139 -2.538 5.127 1044 HD1 PHE 127 HD2 PHE 127 16.777 0.150 4.416 1045 HD2 PHE 127 HD1 PHE 127 17.212 -4.025 5.144 1046 HE1 PHE 127 HE2 PHE 127 14.482 -0.215 3.664 1047 HE2 PHE 127 HE1 PHE 127 14.909 -4.395 4.373 1048 HZ PHE 127 HZ PHE 127 13.544 -2.486 3.635 1049 H ASN 128 HN ASN 128 20.026 -2.497 8.544 1050 HA ASN 128 HA ASN 128 21.937 -0.380 8.912 1051 HB2 ASN 128 HB2 ASN 128 21.783 -3.159 10.076 1052 HB3 ASN 128 HB1 ASN 128 22.992 -1.961 10.521 1053 HD21 ASN 128 HD21 ASN 128 19.632 -2.847 10.697 1054 HD22 ASN 128 HD22 ASN 128 19.193 -1.703 11.930 1055 H ASN 129 HN ASN 129 23.553 -0.027 7.662 1056 HA ASN 129 HA ASN 129 25.107 -0.228 6.028 1057 HB2 ASN 129 HB2 ASN 129 26.198 -1.077 8.191 1058 HB3 ASN 129 HB1 ASN 129 26.051 -2.683 7.481 1059 HD21 ASN 129 HD21 ASN 129 27.452 -3.298 5.887 1060 HD22 ASN 129 HD22 ASN 129 28.730 -2.286 5.289 1061 HA PRO 130 HA PRO 130 23.098 -3.575 3.613 1062 HB2 PRO 130 HB2 PRO 130 22.089 -2.042 1.650 1063 HB3 PRO 130 HB1 PRO 130 21.260 -2.230 3.200 1064 HG2 PRO 130 HG2 PRO 130 22.902 0.043 2.189 1065 HG3 PRO 130 HG1 PRO 130 21.438 0.070 3.186 1066 HD2 PRO 130 HD2 PRO 130 24.036 0.345 4.129 1067 HD3 PRO 130 HD1 PRO 130 22.632 -0.100 5.113 1068 H THR 131 HN THR 131 23.755 -4.436 1.606 1069 HA THR 131 HA THR 131 26.432 -3.973 0.904 1070 HB THR 131 HB THR 131 25.436 -6.143 0.465 1071 HG1 THR 131 HG1 THR 131 25.929 -6.164 -1.964 1072 HG21 THR 131 HG21 THR 131 23.702 -6.541 -1.106 1073 HG22 THR 131 HG22 THR 131 23.787 -4.890 -1.725 1074 HG23 THR 131 HG23 THR 131 23.155 -5.194 -0.106 1075 H GLU 132 HN GLU 132 27.253 -3.253 -1.225 1076 HA GLU 132 HA GLU 132 26.667 -0.553 -1.524 1077 HB2 GLU 132 HB2 GLU 132 28.710 -1.992 -2.408 1078 HB3 GLU 132 HB1 GLU 132 27.758 -2.019 -3.888 1079 HG2 GLU 132 HG2 GLU 132 29.316 -0.218 -3.990 1080 HG3 GLU 132 HG1 GLU 132 27.690 0.448 -3.831 1081 H ASP 133 HN ASP 133 25.460 -3.292 -3.437 1082 HA ASP 133 HA ASP 133 24.194 -1.840 -5.473 1083 HB2 ASP 133 HB2 ASP 133 23.500 -4.551 -4.331 1084 HB3 ASP 133 HB1 ASP 133 22.784 -3.881 -5.789 1085 H PHE 134 HN PHE 134 22.754 -3.237 -2.518 1086 HA PHE 134 HA PHE 134 20.186 -2.117 -2.949 1087 HB2 PHE 134 HB2 PHE 134 20.784 -4.054 -1.335 1088 HB3 PHE 134 HB1 PHE 134 21.369 -2.802 -0.237 1089 HD1 PHE 134 HD1 PHE 134 18.408 -2.868 -2.444 1090 HD2 PHE 134 HD2 PHE 134 19.858 -2.719 1.540 1091 HE1 PHE 134 HE1 PHE 134 16.134 -2.508 -1.644 1092 HE2 PHE 134 HE2 PHE 134 17.562 -2.384 2.361 1093 HZ PHE 134 HZ PHE 134 15.693 -2.283 0.754 1094 H ARG 135 HN ARG 135 22.898 -1.164 -0.927 1095 HA ARG 135 HA ARG 135 22.049 1.182 0.199 1096 HB2 ARG 135 HB2 ARG 135 24.081 0.433 0.882 1097 HB3 ARG 135 HB1 ARG 135 24.650 0.163 -0.769 1098 HG2 ARG 135 HG2 ARG 135 25.689 2.157 -0.690 1099 HG3 ARG 135 HG1 ARG 135 24.129 2.926 -0.453 1100 HD2 ARG 135 HD2 ARG 135 25.947 3.326 1.315 1101 HD3 ARG 135 HD1 ARG 135 24.341 2.872 1.875 1102 HE ARG 135 HE ARG 135 25.617 0.495 1.697 1103 HH11 ARG 135 HH11 ARG 135 26.403 3.529 3.257 1104 HH12 ARG 135 HH12 ARG 135 27.400 2.788 4.473 1105 HH21 ARG 135 HH21 ARG 135 26.895 -0.490 3.307 1106 HH22 ARG 135 HH22 ARG 135 27.677 0.491 4.507 1107 H ARG 136 HN ARG 136 23.431 0.756 -2.999 1108 HA ARG 136 HA ARG 136 23.571 3.346 -3.912 1109 HB2 ARG 136 HB2 ARG 136 23.675 0.704 -4.934 1110 HB3 ARG 136 HB1 ARG 136 22.712 1.707 -5.972 1111 HG2 ARG 136 HG2 ARG 136 24.506 3.209 -6.360 1112 HG3 ARG 136 HG1 ARG 136 25.482 2.421 -5.114 1113 HD2 ARG 136 HD2 ARG 136 26.198 1.682 -7.308 1114 HD3 ARG 136 HD1 ARG 136 25.447 0.351 -6.424 1115 HE ARG 136 HE ARG 136 23.781 1.859 -8.292 1116 HH11 ARG 136 HH11 ARG 136 25.585 -1.065 -7.572 1117 HH12 ARG 136 HH12 ARG 136 24.770 -2.007 -8.785 1118 HH21 ARG 136 HH21 ARG 136 22.718 0.630 -9.874 1119 HH22 ARG 136 HH22 ARG 136 23.148 -1.040 -10.121 1120 H LYS 137 HN LYS 137 20.943 1.030 -4.281 1121 HA LYS 137 HA LYS 137 19.275 2.688 -5.815 1122 HB2 LYS 137 HB2 LYS 137 18.458 0.401 -4.009 1123 HB3 LYS 137 HB1 LYS 137 17.522 1.066 -5.345 1124 HG2 LYS 137 HG2 LYS 137 19.188 0.299 -6.929 1125 HG3 LYS 137 HG1 LYS 137 20.206 -0.279 -5.609 1126 HD2 LYS 137 HD2 LYS 137 18.015 -1.632 -4.997 1127 HD3 LYS 137 HD1 LYS 137 17.698 -1.419 -6.725 1128 HE2 LYS 137 HE2 LYS 137 19.877 -2.400 -7.242 1129 HE3 LYS 137 HE1 LYS 137 20.199 -2.605 -5.524 1130 HZ1 LYS 137 HZ1 LYS 137 19.455 -4.667 -6.442 1131 HZ2 LYS 137 HZ2 LYS 137 18.075 -3.944 -7.107 1132 HZ3 LYS 137 HZ3 LYS 137 18.236 -4.072 -5.421 1133 H LEU 138 HN LEU 138 19.273 1.883 -2.395 1134 HA LEU 138 HA LEU 138 17.093 3.395 -1.555 1135 HB2 LEU 138 HB2 LEU 138 19.609 2.938 0.022 1136 HB3 LEU 138 HB1 LEU 138 18.020 3.300 0.661 1137 HG LEU 138 HG LEU 138 18.974 0.743 -0.593 1138 HD11 LEU 138 HD11 LEU 138 19.434 1.121 1.787 1139 HD12 LEU 138 HD12 LEU 138 18.320 -0.220 1.519 1140 HD13 LEU 138 HD13 LEU 138 17.707 1.340 2.070 1141 HD21 LEU 138 HD21 LEU 138 16.142 1.504 0.061 1142 HD22 LEU 138 HD22 LEU 138 16.695 -0.111 -0.363 1143 HD23 LEU 138 HD23 LEU 138 16.797 1.196 -1.542 1144 H LEU 139 HN LEU 139 20.479 4.336 -1.925 1145 HA LEU 139 HA LEU 139 20.170 6.949 -0.855 1146 HB2 LEU 139 HB2 LEU 139 22.302 5.792 -2.650 1147 HB3 LEU 139 HB1 LEU 139 22.413 7.345 -1.846 1148 HG LEU 139 HG LEU 139 22.167 4.693 -0.425 1149 HD11 LEU 139 HD11 LEU 139 24.318 4.432 -0.974 1150 HD12 LEU 139 HD12 LEU 139 24.619 5.715 0.209 1151 HD13 LEU 139 HD13 LEU 139 24.478 6.114 -1.504 1152 HD21 LEU 139 HD21 LEU 139 21.249 6.625 0.769 1153 HD22 LEU 139 HD22 LEU 139 22.810 7.435 0.638 1154 HD23 LEU 139 HD23 LEU 139 22.663 5.945 1.573 1155 H LYS 140 HN LYS 140 19.640 5.583 -3.983 1156 HA LYS 140 HA LYS 140 19.711 8.055 -5.422 1157 HB2 LYS 140 HB2 LYS 140 19.533 5.280 -6.049 1158 HB3 LYS 140 HB1 LYS 140 18.233 6.144 -6.844 1159 HG2 LYS 140 HG2 LYS 140 19.653 7.410 -8.126 1160 HG3 LYS 140 HG1 LYS 140 21.011 7.189 -7.019 1161 HD2 LYS 140 HD2 LYS 140 19.818 4.921 -8.596 1162 HD3 LYS 140 HD1 LYS 140 21.133 5.918 -9.208 1163 HE2 LYS 140 HE2 LYS 140 21.173 4.379 -6.624 1164 HE3 LYS 140 HE1 LYS 140 21.873 3.829 -8.143 1165 HZ1 LYS 140 HZ1 LYS 140 23.512 5.453 -8.069 1166 HZ2 LYS 140 HZ2 LYS 140 23.393 4.979 -6.445 1167 HZ3 LYS 140 HZ3 LYS 140 22.665 6.416 -6.963 1168 H ALA 141 HN ALA 141 17.376 6.276 -3.667 1169 HA ALA 141 HA ALA 141 14.970 6.859 -4.816 1170 HB1 ALA 141 HB1 ALA 141 14.004 6.237 -2.842 1171 HB2 ALA 141 HB2 ALA 141 15.207 7.070 -1.860 1172 HB3 ALA 141 HB3 ALA 141 15.616 5.552 -2.657 1173 H1 GLY 212 HT1 GLY 212 -21.125 7.773 15.446 1174 H2 GLY 212 HT2 GLY 212 -20.573 6.541 16.473 1175 H3 GLY 212 HT3 GLY 212 -21.238 6.155 14.961 1176 HA2 GLY 212 HA1 GLY 212 -18.730 7.679 15.383 1177 HA3 GLY 212 HA2 GLY 212 -18.821 5.978 14.941 1178 H GLY 213 HN GLY 213 -17.484 7.895 13.390 1179 HA2 GLY 213 HA2 GLY 213 -19.306 8.428 11.149 1180 HA3 GLY 213 HA1 GLY 213 -17.702 9.117 11.361 1181 H LYS 214 HN LYS 214 -17.210 6.041 12.133 1182 HA LYS 214 HA LYS 214 -16.151 5.422 9.504 1183 HB2 LYS 214 HB2 LYS 214 -14.849 5.097 11.624 1184 HB3 LYS 214 HB1 LYS 214 -15.971 3.819 12.062 1185 HG2 LYS 214 HG2 LYS 214 -15.249 2.452 10.262 1186 HG3 LYS 214 HG1 LYS 214 -14.329 3.777 9.543 1187 HD2 LYS 214 HD2 LYS 214 -12.879 3.809 11.546 1188 HD3 LYS 214 HD1 LYS 214 -13.767 2.424 12.182 1189 HE2 LYS 214 HE2 LYS 214 -13.011 1.025 10.417 1190 HE3 LYS 214 HE1 LYS 214 -12.358 2.399 9.524 1191 HZ1 LYS 214 HZ1 LYS 214 -11.331 1.217 12.045 1192 HZ2 LYS 214 HZ2 LYS 214 -10.828 2.733 11.470 1193 HZ3 LYS 214 HZ3 LYS 214 -10.531 1.341 10.548 1194 H ALA 215 HN ALA 215 -16.971 4.010 8.124 1195 HA ALA 215 HA ALA 215 -19.642 3.083 8.459 1196 HB1 ALA 215 HB1 ALA 215 -19.295 2.105 6.203 1197 HB2 ALA 215 HB2 ALA 215 -17.599 2.572 6.294 1198 HB3 ALA 215 HB3 ALA 215 -18.855 3.810 6.296 1199 HA PRO 216 HA PRO 216 -19.381 -1.124 9.866 1200 HB2 PRO 216 HB2 PRO 216 -20.345 -2.497 7.614 1201 HB3 PRO 216 HB1 PRO 216 -21.296 -1.894 8.961 1202 HG2 PRO 216 HG2 PRO 216 -20.836 -0.683 6.294 1203 HG3 PRO 216 HG1 PRO 216 -22.279 -0.632 7.317 1204 HD2 PRO 216 HD2 PRO 216 -20.661 1.474 7.063 1205 HD3 PRO 216 HD1 PRO 216 -21.436 1.095 8.615 1206 H ARG 217 HN ARG 217 -18.510 -3.316 9.330 1207 HA ARG 217 HA ARG 217 -16.366 -3.297 7.369 1208 HB2 ARG 217 HB2 ARG 217 -15.158 -2.300 9.111 1209 HB3 ARG 217 HB1 ARG 217 -15.967 -3.252 10.346 1210 HG2 ARG 217 HG2 ARG 217 -14.676 -5.151 9.883 1211 HG3 ARG 217 HG1 ARG 217 -14.119 -4.499 8.340 1212 HD2 ARG 217 HD2 ARG 217 -13.462 -3.292 11.018 1213 HD3 ARG 217 HD1 ARG 217 -12.421 -4.436 10.171 1214 HE ARG 217 HE ARG 217 -13.053 -2.307 8.451 1215 HH11 ARG 217 HH11 ARG 217 -11.183 -2.941 11.341 1216 HH12 ARG 217 HH12 ARG 217 -9.971 -1.743 10.970 1217 HH21 ARG 217 HH21 ARG 217 -11.457 -0.715 7.974 1218 HH22 ARG 217 HH22 ARG 217 -10.137 -0.483 9.083 1219 H1 KCR 218 HN KCR 218 -15.624 -5.302 6.795 1220 H4 KCR 218 HA KCR 218 -17.233 -7.571 7.694 1221 H5 KCR 218 HB1 KCR 218 -16.357 -8.731 5.752 1222 H6 KCR 218 HB2 KCR 218 -15.190 -7.446 5.463 1223 H7 KCR 218 HG1 KCR 218 -17.047 -5.892 5.022 1224 H8 KCR 218 HG2 KCR 218 -18.183 -7.224 5.239 1225 H9 KCR 218 HD1 KCR 218 -17.300 -8.382 3.345 1226 H10 KCR 218 HD2 KCR 218 -15.973 -7.229 3.196 1227 H11 KCR 218 HE1 KCR 218 -17.550 -5.451 2.665 1228 H12 KCR 218 HE2 KCR 218 -18.898 -6.575 2.856 1229 H13 KCR 218 HZ1 KCR 218 -18.058 -7.776 0.923 1230 H14 KCR 218 HH1 KCR 218 -17.463 -7.596 -1.408 1231 H15 KCR 218 HJ1 KCR 218 -16.875 -4.647 -2.069 1232 H16 KCR 218 HF3 KCR 218 -17.576 -5.638 -4.333 1233 H17 KCR 218 HF1 KCR 218 -15.949 -6.199 -3.952 1234 H18 KCR 218 HF2 KCR 218 -17.332 -7.253 -3.669 1235 H GLN 219 HN GLN 219 -16.288 -9.442 8.567 1236 HA GLN 219 HA GLN 219 -14.960 -10.488 10.074 1237 HB2 GLN 219 HB2 GLN 219 -12.862 -9.268 8.289 1238 HB3 GLN 219 HB1 GLN 219 -12.433 -10.263 9.673 1239 HG2 GLN 219 HG2 GLN 219 -14.122 -11.123 7.335 1240 HG3 GLN 219 HG1 GLN 219 -12.434 -11.553 7.615 1241 HE21 GLN 219 HE21 GLN 219 -11.922 -13.002 9.264 1242 HE22 GLN 219 HE22 GLN 219 -13.121 -14.029 9.988 1243 H LEU 220 HN LEU 220 -15.958 -8.927 11.566 1244 HA LEU 220 HA LEU 220 -14.653 -6.619 12.477 1245 HB2 LEU 220 HB2 LEU 220 -16.532 -8.500 13.908 1246 HB3 LEU 220 HB1 LEU 220 -15.970 -6.989 14.593 1247 HG LEU 220 HG LEU 220 -18.133 -6.572 13.753 1248 HD11 LEU 220 HD11 LEU 220 -16.140 -5.566 11.732 1249 HD12 LEU 220 HD12 LEU 220 -16.551 -4.805 13.269 1250 HD13 LEU 220 HD13 LEU 220 -17.759 -4.918 11.990 1251 HD21 LEU 220 HD21 LEU 220 -18.835 -7.067 11.467 1252 HD22 LEU 220 HD22 LEU 220 -18.372 -8.533 12.331 1253 HD23 LEU 220 HD23 LEU 220 -17.274 -7.823 11.148 1254 H ALA 221 HN ALA 221 -13.370 -6.266 14.331 1255 HA ALA 221 HA ALA 221 -11.560 -6.628 15.640 1256 HB1 ALA 221 HB1 ALA 221 -12.497 -9.496 15.759 1257 HB2 ALA 221 HB2 ALA 221 -12.991 -8.207 16.856 1258 HB3 ALA 221 HB3 ALA 221 -11.311 -8.740 16.823 1259 H THR 222 HN THR 222 -11.143 -6.507 12.978 1260 HA THR 222 HA THR 222 -9.378 -8.633 12.139 1261 HB THR 222 HB THR 222 -9.030 -6.279 10.559 1262 HG1 THR 222 HG1 THR 222 -11.776 -6.981 10.716 1263 HG21 THR 222 HG21 THR 222 -8.852 -8.582 9.750 1264 HG22 THR 222 HG22 THR 222 -10.031 -7.670 8.806 1265 HG23 THR 222 HG23 THR 222 -10.577 -8.818 10.028 1266 H LYS 223 HN LYS 223 -7.344 -8.775 12.819 1267 HA LYS 223 HA LYS 223 -5.793 -6.324 13.217 1268 HB2 LYS 223 HB2 LYS 223 -4.910 -7.129 15.361 1269 HB3 LYS 223 HB1 LYS 223 -6.652 -6.900 15.439 1270 HG2 LYS 223 HG2 LYS 223 -6.987 -9.299 15.170 1271 HG3 LYS 223 HG1 LYS 223 -5.242 -9.535 15.073 1272 HD2 LYS 223 HD2 LYS 223 -5.037 -8.574 17.348 1273 HD3 LYS 223 HD1 LYS 223 -6.798 -8.483 17.433 1274 HE2 LYS 223 HE2 LYS 223 -6.056 -10.479 18.559 1275 HE3 LYS 223 HE1 LYS 223 -6.901 -10.928 17.079 1276 HZ1 LYS 223 HZ1 LYS 223 -4.905 -12.236 17.338 1277 HZ2 LYS 223 HZ2 LYS 223 -3.954 -10.836 17.458 1278 HZ3 LYS 223 HZ3 LYS 223 -4.730 -11.210 15.997 1279 H ALA 224 HN ALA 224 -3.536 -6.624 13.035 1280 HA ALA 224 HA ALA 224 -2.832 -8.990 11.476 1281 HB1 ALA 224 HB1 ALA 224 -1.287 -6.441 11.939 1282 HB2 ALA 224 HB2 ALA 224 -2.298 -6.796 10.537 1283 HB3 ALA 224 HB3 ALA 224 -0.838 -7.739 10.834 Start of MODEL 3 1 H1 GLY 1 HT1 GLY 1 21.915 -7.692 9.715 2 H2 GLY 1 HT2 GLY 1 21.960 -7.909 11.396 3 H3 GLY 1 HT3 GLY 1 22.832 -8.949 10.379 4 HA2 GLY 1 HA1 GLY 1 24.321 -7.225 9.734 5 HA3 GLY 1 HA2 GLY 1 23.358 -6.042 10.612 6 H SER 2 HN SER 2 26.106 -6.415 11.056 7 HA SER 2 HA SER 2 26.238 -7.881 13.589 8 HB2 SER 2 HB2 SER 2 28.420 -6.608 11.918 9 HB3 SER 2 HB1 SER 2 28.680 -7.530 13.400 10 HG SER 2 HG SER 2 27.541 -9.287 12.271 11 H HIS 3 HN HIS 3 26.587 -4.655 12.220 12 HA HIS 3 HA HIS 3 26.666 -2.579 13.149 13 HB2 HIS 3 HB2 HIS 3 24.380 -3.379 13.823 14 HB3 HIS 3 HB1 HIS 3 25.060 -3.841 15.380 15 HD1 HIS 3 HD1 HIS 3 25.121 -2.066 17.142 16 HD2 HIS 3 HD2 HIS 3 24.550 -0.509 13.328 17 HE1 HIS 3 HE1 HIS 3 24.692 0.392 17.465 18 HE2 HIS 3 HE2 HIS 3 24.591 1.340 15.130 19 H MET 4 HN MET 4 28.993 -2.944 13.495 20 HA MET 4 HA MET 4 29.664 -3.160 16.361 21 HB2 MET 4 HB2 MET 4 31.306 -3.960 13.951 22 HB3 MET 4 HB1 MET 4 31.906 -3.956 15.602 23 HG2 MET 4 HG2 MET 4 30.364 -5.671 16.234 24 HG3 MET 4 HG1 MET 4 29.559 -5.586 14.669 25 HE1 MET 4 HE1 MET 4 29.796 -8.245 14.468 26 HE2 MET 4 HE2 MET 4 30.632 -8.299 16.020 27 HE3 MET 4 HE3 MET 4 31.333 -9.098 14.612 28 H ALA 5 HN ALA 5 31.652 -2.147 13.625 29 HA ALA 5 HA ALA 5 32.177 0.368 15.040 30 HB1 ALA 5 HB1 ALA 5 34.145 0.523 13.513 31 HB2 ALA 5 HB2 ALA 5 33.730 -1.079 12.903 32 HB3 ALA 5 HB3 ALA 5 34.172 -0.867 14.597 33 H SER 6 HN SER 6 32.267 -0.527 11.608 34 HA SER 6 HA SER 6 31.139 2.077 10.946 35 HB2 SER 6 HB2 SER 6 32.233 -0.067 9.109 36 HB3 SER 6 HB1 SER 6 31.888 1.609 8.689 37 HG SER 6 HG SER 6 34.040 1.556 9.081 38 H SER 7 HN SER 7 28.967 1.785 11.495 39 HA SER 7 HA SER 7 27.523 -0.225 9.901 40 HB2 SER 7 HB2 SER 7 26.747 1.079 12.523 41 HB3 SER 7 HB1 SER 7 25.756 -0.073 11.625 42 HG SER 7 HG SER 7 28.248 -1.050 11.977 43 H CYS 8 HN CYS 8 26.646 0.673 8.157 44 HA CYS 8 HA CYS 8 25.483 3.364 8.402 45 HB2 CYS 8 HB2 CYS 8 27.065 3.316 6.638 46 HB3 CYS 8 HB1 CYS 8 26.440 1.800 6.008 47 HG CYS 8 HG CYS 8 24.833 4.830 5.885 48 H ALA 9 HN ALA 9 23.376 3.478 8.612 49 HA ALA 9 HA ALA 9 21.752 1.233 7.619 50 HB1 ALA 9 HB1 ALA 9 20.101 1.829 9.294 51 HB2 ALA 9 HB2 ALA 9 21.086 3.199 9.807 52 HB3 ALA 9 HB3 ALA 9 21.669 1.553 10.054 53 H VAL 10 HN VAL 10 20.711 1.674 5.809 54 HA VAL 10 HA VAL 10 20.116 4.472 5.150 55 HB VAL 10 HB VAL 10 19.944 2.061 3.335 56 HG11 VAL 10 HG11 VAL 10 18.590 3.689 2.391 57 HG12 VAL 10 HG12 VAL 10 20.148 3.969 1.607 58 HG13 VAL 10 HG13 VAL 10 19.629 5.008 2.934 59 HG21 VAL 10 HG21 VAL 10 22.231 2.188 3.723 60 HG22 VAL 10 HG22 VAL 10 22.200 3.938 3.925 61 HG23 VAL 10 HG23 VAL 10 22.034 3.233 2.318 62 H GLN 11 HN GLN 11 18.077 5.222 5.000 63 HA GLN 11 HA GLN 11 15.950 3.309 5.733 64 HB2 GLN 11 HB2 GLN 11 15.831 6.265 6.301 65 HB3 GLN 11 HB1 GLN 11 14.940 4.965 7.072 66 HG2 GLN 11 HG2 GLN 11 16.533 4.605 8.601 67 HG3 GLN 11 HG1 GLN 11 17.829 4.787 7.420 68 HE21 GLN 11 HE21 GLN 11 16.762 7.423 6.601 69 HE22 GLN 11 HE22 GLN 11 17.265 8.520 7.841 70 H VAL 12 HN VAL 12 14.464 3.018 4.236 71 HA VAL 12 HA VAL 12 13.859 5.255 2.432 72 HB VAL 12 HB VAL 12 12.679 3.403 1.072 73 HG11 VAL 12 HG11 VAL 12 15.635 3.840 1.281 74 HG12 VAL 12 HG12 VAL 12 14.511 4.428 0.067 75 HG13 VAL 12 HG13 VAL 12 14.973 2.727 0.093 76 HG21 VAL 12 HG21 VAL 12 12.768 1.648 2.686 77 HG22 VAL 12 HG22 VAL 12 14.525 1.744 2.776 78 HG23 VAL 12 HG23 VAL 12 13.744 1.186 1.294 79 H LYS 13 HN LYS 13 11.764 5.967 2.262 80 HA LYS 13 HA LYS 13 9.935 4.882 4.281 81 HB2 LYS 13 HB2 LYS 13 10.367 7.658 3.247 82 HB3 LYS 13 HB1 LYS 13 8.802 7.209 3.911 83 HG2 LYS 13 HG2 LYS 13 9.882 6.542 5.992 84 HG3 LYS 13 HG1 LYS 13 11.440 7.064 5.341 85 HD2 LYS 13 HD2 LYS 13 10.639 9.338 5.137 86 HD3 LYS 13 HD1 LYS 13 9.027 8.847 5.658 87 HE2 LYS 13 HE2 LYS 13 9.893 8.242 7.843 88 HE3 LYS 13 HE1 LYS 13 11.531 8.648 7.327 89 HZ1 LYS 13 HZ1 LYS 13 10.898 10.933 7.089 90 HZ2 LYS 13 HZ2 LYS 13 10.457 10.413 8.642 91 HZ3 LYS 13 HZ3 LYS 13 9.277 10.582 7.436 92 H LEU 14 HN LEU 14 8.166 3.940 3.669 93 HA LEU 14 HA LEU 14 7.107 4.504 0.977 94 HB2 LEU 14 HB2 LEU 14 6.825 2.017 2.641 95 HB3 LEU 14 HB1 LEU 14 5.991 2.293 1.131 96 HG LEU 14 HG LEU 14 8.999 2.155 1.403 97 HD11 LEU 14 HD11 LEU 14 7.023 0.096 0.455 98 HD12 LEU 14 HD12 LEU 14 7.987 0.009 1.928 99 HD13 LEU 14 HD13 LEU 14 8.775 -0.043 0.351 100 HD21 LEU 14 HD21 LEU 14 7.241 2.042 -1.040 101 HD22 LEU 14 HD22 LEU 14 9.005 2.056 -0.992 102 HD23 LEU 14 HD23 LEU 14 8.097 3.484 -0.494 103 H GLU 15 HN GLU 15 4.974 4.972 0.801 104 HA GLU 15 HA GLU 15 3.719 5.764 3.340 105 HB2 GLU 15 HB2 GLU 15 4.448 7.663 2.003 106 HB3 GLU 15 HB1 GLU 15 3.573 7.055 0.607 107 HG2 GLU 15 HG2 GLU 15 1.497 7.574 1.544 108 HG3 GLU 15 HG1 GLU 15 2.168 7.776 3.157 109 H LEU 16 HN LEU 16 1.850 4.920 3.851 110 HA LEU 16 HA LEU 16 0.338 3.341 1.899 111 HB2 LEU 16 HB2 LEU 16 0.139 3.627 4.889 112 HB3 LEU 16 HB1 LEU 16 -1.101 2.833 3.953 113 HG LEU 16 HG LEU 16 0.188 1.114 4.862 114 HD11 LEU 16 HD11 LEU 16 1.667 1.107 2.352 115 HD12 LEU 16 HD12 LEU 16 -0.071 1.344 2.189 116 HD13 LEU 16 HD13 LEU 16 0.552 -0.083 3.019 117 HD21 LEU 16 HD21 LEU 16 2.725 2.270 3.823 118 HD22 LEU 16 HD22 LEU 16 2.502 1.022 5.040 119 HD23 LEU 16 HD23 LEU 16 2.107 2.701 5.412 120 H GLY 17 HN GLY 17 -1.743 3.862 1.349 121 HA2 GLY 17 HA2 GLY 17 -2.982 6.205 2.557 122 HA3 GLY 17 HA1 GLY 17 -2.509 6.365 0.872 123 H HIS 18 HN HIS 18 -5.095 6.673 1.722 124 HA HIS 18 HA HIS 18 -6.339 5.141 -0.261 125 HB2 HIS 18 HB2 HIS 18 -7.201 3.337 0.781 126 HB3 HIS 18 HB1 HIS 18 -6.158 3.706 2.147 127 HD1 HIS 18 HD1 HIS 18 -7.305 5.242 4.058 128 HD2 HIS 18 HD2 HIS 18 -9.873 3.430 1.329 129 HE1 HIS 18 HE1 HIS 18 -9.611 5.434 5.052 130 HE2 HIS 18 HE2 HIS 18 -11.117 4.208 3.460 131 H ARG 19 HN ARG 19 -8.276 5.970 -0.810 132 HA ARG 19 HA ARG 19 -9.394 8.072 0.925 133 HB2 ARG 19 HB2 ARG 19 -9.502 7.883 -2.089 134 HB3 ARG 19 HB1 ARG 19 -10.294 9.102 -1.125 135 HG2 ARG 19 HG2 ARG 19 -8.141 9.936 -0.369 136 HG3 ARG 19 HG1 ARG 19 -7.330 8.708 -1.347 137 HD2 ARG 19 HD2 ARG 19 -7.414 10.871 -2.502 138 HD3 ARG 19 HD1 ARG 19 -8.325 9.623 -3.358 139 HE ARG 19 HE ARG 19 -10.048 11.027 -1.625 140 HH11 ARG 19 HH11 ARG 19 -8.228 11.565 -4.571 141 HH12 ARG 19 HH12 ARG 19 -9.422 12.630 -5.259 142 HH21 ARG 19 HH21 ARG 19 -11.591 12.428 -2.496 143 HH22 ARG 19 HH22 ARG 19 -11.341 13.126 -4.074 144 H ALA 20 HN ALA 20 -11.803 8.337 0.531 145 HA ALA 20 HA ALA 20 -13.139 6.027 -0.587 146 HB1 ALA 20 HB1 ALA 20 -13.077 4.976 1.420 147 HB2 ALA 20 HB2 ALA 20 -14.525 5.959 1.669 148 HB3 ALA 20 HB3 ALA 20 -12.978 6.486 2.333 149 H GLN 21 HN GLN 21 -15.054 6.526 -1.408 150 HA GLN 21 HA GLN 21 -16.638 8.710 -0.378 151 HB2 GLN 21 HB2 GLN 21 -16.736 9.986 -2.380 152 HB3 GLN 21 HB1 GLN 21 -15.039 9.700 -2.055 153 HG2 GLN 21 HG2 GLN 21 -14.931 9.202 -4.197 154 HG3 GLN 21 HG1 GLN 21 -15.573 7.645 -3.715 155 HE21 GLN 21 HE21 GLN 21 -17.656 7.095 -4.264 156 HE22 GLN 21 HE22 GLN 21 -18.627 8.046 -5.333 157 H VAL 22 HN VAL 22 -18.836 8.565 -1.030 158 HA VAL 22 HA VAL 22 -19.477 5.856 -1.974 159 HB VAL 22 HB VAL 22 -20.242 6.486 0.325 160 HG11 VAL 22 HG11 VAL 22 -22.150 7.937 0.604 161 HG12 VAL 22 HG12 VAL 22 -22.171 8.285 -1.126 162 HG13 VAL 22 HG13 VAL 22 -20.816 8.828 -0.135 163 HG21 VAL 22 HG21 VAL 22 -22.458 5.516 0.075 164 HG22 VAL 22 HG22 VAL 22 -21.282 4.677 -0.933 165 HG23 VAL 22 HG23 VAL 22 -22.409 5.824 -1.658 166 H ARG 23 HN ARG 23 -20.817 5.511 -3.643 167 HA ARG 23 HA ARG 23 -21.604 7.820 -5.249 168 HB2 ARG 23 HB2 ARG 23 -22.596 5.666 -6.613 169 HB3 ARG 23 HB1 ARG 23 -20.981 6.330 -6.832 170 HG2 ARG 23 HG2 ARG 23 -19.958 4.633 -5.697 171 HG3 ARG 23 HG1 ARG 23 -21.391 4.255 -4.746 172 HD2 ARG 23 HD2 ARG 23 -20.782 2.547 -6.478 173 HD3 ARG 23 HD1 ARG 23 -22.426 3.169 -6.594 174 HE ARG 23 HE ARG 23 -21.824 4.361 -8.538 175 HH11 ARG 23 HH11 ARG 23 -19.156 2.474 -7.269 176 HH12 ARG 23 HH12 ARG 23 -18.334 2.367 -8.795 177 HH21 ARG 23 HH21 ARG 23 -20.705 4.283 -10.535 178 HH22 ARG 23 HH22 ARG 23 -19.193 3.428 -10.639 179 H LYS 24 HN LYS 24 -23.741 8.179 -5.891 180 HA LYS 24 HA LYS 24 -25.556 8.086 -3.737 181 HB2 LYS 24 HB2 LYS 24 -26.013 8.790 -6.640 182 HB3 LYS 24 HB1 LYS 24 -27.140 9.122 -5.331 183 HG2 LYS 24 HG2 LYS 24 -24.337 10.157 -5.296 184 HG3 LYS 24 HG1 LYS 24 -25.638 11.023 -6.117 185 HD2 LYS 24 HD2 LYS 24 -26.889 11.096 -4.006 186 HD3 LYS 24 HD1 LYS 24 -25.567 10.246 -3.201 187 HE2 LYS 24 HE2 LYS 24 -25.297 12.909 -4.588 188 HE3 LYS 24 HE1 LYS 24 -25.542 12.709 -2.853 189 HZ1 LYS 24 HZ1 LYS 24 -23.234 11.616 -4.382 190 HZ2 LYS 24 HZ2 LYS 24 -23.468 11.517 -2.707 191 HZ3 LYS 24 HZ3 LYS 24 -23.202 13.025 -3.436 192 H LYS 25 HN LYS 25 -24.893 5.942 -6.296 193 HA LYS 25 HA LYS 25 -27.138 4.245 -5.495 194 HB2 LYS 25 HB2 LYS 25 -27.776 5.548 -7.539 195 HB3 LYS 25 HB1 LYS 25 -26.443 4.775 -8.386 196 HG2 LYS 25 HG2 LYS 25 -27.449 2.660 -8.266 197 HG3 LYS 25 HG1 LYS 25 -28.618 3.196 -7.057 198 HD2 LYS 25 HD2 LYS 25 -29.534 4.762 -8.759 199 HD3 LYS 25 HD1 LYS 25 -28.491 3.985 -9.955 200 HE2 LYS 25 HE2 LYS 25 -30.533 2.560 -8.267 201 HE3 LYS 25 HE1 LYS 25 -30.812 3.095 -9.925 202 HZ1 LYS 25 HZ1 LYS 25 -30.211 0.805 -9.948 203 HZ2 LYS 25 HZ2 LYS 25 -28.842 1.075 -8.994 204 HZ3 LYS 25 HZ3 LYS 25 -28.902 1.672 -10.578 205 HA PRO 26 HA PRO 26 -23.718 1.320 -5.332 206 HB2 PRO 26 HB2 PRO 26 -25.948 -0.621 -5.323 207 HB3 PRO 26 HB1 PRO 26 -24.612 -0.438 -4.188 208 HG2 PRO 26 HG2 PRO 26 -27.111 0.311 -3.566 209 HG3 PRO 26 HG1 PRO 26 -25.688 1.187 -2.972 210 HD2 PRO 26 HD2 PRO 26 -27.611 1.921 -5.126 211 HD3 PRO 26 HD1 PRO 26 -26.735 2.960 -3.983 212 H THR 27 HN THR 27 -22.987 -0.507 -6.597 213 HA THR 27 HA THR 27 -23.780 -0.279 -9.364 214 HB THR 27 HB THR 27 -21.412 -0.519 -8.921 215 HG1 THR 27 HG1 THR 27 -21.414 -2.936 -9.973 216 HG21 THR 27 HG21 THR 27 -21.206 -1.666 -6.896 217 HG22 THR 27 HG22 THR 27 -20.612 -2.818 -8.095 218 HG23 THR 27 HG23 THR 27 -22.242 -2.987 -7.447 219 H VAL 28 HN VAL 28 -23.825 -2.603 -10.505 220 HA VAL 28 HA VAL 28 -26.329 -3.612 -10.168 221 HB VAL 28 HB VAL 28 -25.174 -4.082 -12.148 222 HG11 VAL 28 HG11 VAL 28 -22.900 -4.081 -11.150 223 HG12 VAL 28 HG12 VAL 28 -23.156 -5.381 -12.321 224 HG13 VAL 28 HG13 VAL 28 -23.189 -5.734 -10.593 225 HG21 VAL 28 HG21 VAL 28 -25.604 -6.630 -10.607 226 HG22 VAL 28 HG22 VAL 28 -25.356 -6.559 -12.351 227 HG23 VAL 28 HG23 VAL 28 -26.768 -5.788 -11.628 228 H GLU 29 HN GLU 29 -23.411 -4.771 -8.549 229 HA GLU 29 HA GLU 29 -24.926 -6.942 -7.328 230 HB2 GLU 29 HB2 GLU 29 -21.968 -6.343 -7.283 231 HB3 GLU 29 HB1 GLU 29 -22.723 -7.768 -6.573 232 HG2 GLU 29 HG2 GLU 29 -23.560 -8.386 -8.837 233 HG3 GLU 29 HG1 GLU 29 -22.682 -7.006 -9.493 234 H GLY 30 HN GLY 30 -24.585 -3.832 -6.632 235 HA2 GLY 30 HA2 GLY 30 -25.476 -2.817 -4.752 236 HA3 GLY 30 HA1 GLY 30 -25.385 -4.351 -3.899 237 H PHE 31 HN PHE 31 -22.654 -2.865 -5.505 238 HA PHE 31 HA PHE 31 -21.336 -2.558 -2.929 239 HB2 PHE 31 HB2 PHE 31 -20.144 -2.012 -5.657 240 HB3 PHE 31 HB1 PHE 31 -19.292 -2.302 -4.144 241 HD1 PHE 31 HD1 PHE 31 -21.160 -4.756 -3.421 242 HD2 PHE 31 HD2 PHE 31 -18.880 -3.689 -6.850 243 HE1 PHE 31 HE1 PHE 31 -20.917 -7.131 -4.011 244 HE2 PHE 31 HE2 PHE 31 -18.631 -6.050 -7.430 245 HZ PHE 31 HZ PHE 31 -19.654 -7.780 -6.012 246 H THR 32 HN THR 32 -21.235 -0.626 -1.942 247 HA THR 32 HA THR 32 -22.540 1.616 -3.307 248 HB THR 32 HB THR 32 -23.060 2.439 -1.062 249 HG1 THR 32 HG1 THR 32 -22.549 1.126 0.749 250 HG21 THR 32 HG21 THR 32 -23.776 -0.385 -1.609 251 HG22 THR 32 HG22 THR 32 -24.699 1.046 -2.027 252 HG23 THR 32 HG23 THR 32 -24.524 0.561 -0.337 253 H HIS 33 HN HIS 33 -19.614 0.809 -1.535 254 HA HIS 33 HA HIS 33 -18.856 3.654 -1.472 255 HB2 HIS 33 HB2 HIS 33 -18.344 1.344 0.343 256 HB3 HIS 33 HB1 HIS 33 -17.112 2.598 0.253 257 HD1 HIS 33 HD1 HIS 33 -20.704 2.056 1.315 258 HD2 HIS 33 HD2 HIS 33 -17.714 4.936 1.568 259 HE1 HIS 33 HE1 HIS 33 -21.504 3.725 3.029 260 HE2 HIS 33 HE2 HIS 33 -19.574 5.314 3.323 261 H ASP 34 HN ASP 34 -17.207 4.329 -2.658 262 HA ASP 34 HA ASP 34 -15.458 2.345 -3.934 263 HB2 ASP 34 HB2 ASP 34 -16.211 5.178 -4.668 264 HB3 ASP 34 HB1 ASP 34 -14.800 4.392 -5.359 265 H TRP 35 HN TRP 35 -13.306 2.376 -3.580 266 HA TRP 35 HA TRP 35 -12.171 4.651 -2.177 267 HB2 TRP 35 HB2 TRP 35 -10.949 3.139 -0.603 268 HB3 TRP 35 HB1 TRP 35 -12.673 3.265 -0.318 269 HD1 TRP 35 HD1 TRP 35 -14.061 1.032 -0.341 270 HE1 TRP 35 HE1 TRP 35 -13.406 -1.456 -0.588 271 HE3 TRP 35 HE3 TRP 35 -9.225 1.592 -1.935 272 HZ2 TRP 35 HZ2 TRP 35 -11.141 -2.971 -1.338 273 HZ3 TRP 35 HZ3 TRP 35 -7.885 -0.428 -2.389 274 HH2 TRP 35 HH2 TRP 35 -8.807 -2.651 -2.066 275 H MET 36 HN MET 36 -9.788 4.449 -2.010 276 HA MET 36 HA MET 36 -8.542 2.904 -4.146 277 HB2 MET 36 HB2 MET 36 -9.103 4.880 -5.354 278 HB3 MET 36 HB1 MET 36 -8.615 5.918 -4.021 279 HG2 MET 36 HG2 MET 36 -6.274 5.039 -4.368 280 HG3 MET 36 HG1 MET 36 -6.864 4.355 -5.886 281 HE1 MET 36 HE1 MET 36 -6.496 7.234 -3.653 282 HE2 MET 36 HE2 MET 36 -7.986 7.936 -4.306 283 HE3 MET 36 HE3 MET 36 -6.428 8.687 -4.659 284 H VAL 37 HN VAL 37 -6.651 2.138 -3.433 285 HA VAL 37 HA VAL 37 -5.552 3.271 -0.965 286 HB VAL 37 HB VAL 37 -4.099 1.057 -1.240 287 HG11 VAL 37 HG11 VAL 37 -6.908 1.137 -0.262 288 HG12 VAL 37 HG12 VAL 37 -5.499 1.638 0.655 289 HG13 VAL 37 HG13 VAL 37 -5.708 -0.056 0.201 290 HG21 VAL 37 HG21 VAL 37 -5.055 0.405 -3.364 291 HG22 VAL 37 HG22 VAL 37 -6.677 0.459 -2.673 292 HG23 VAL 37 HG23 VAL 37 -5.520 -0.750 -2.115 293 H PHE 38 HN PHE 38 -3.340 3.495 -0.671 294 HA PHE 38 HA PHE 38 -1.800 4.152 -3.105 295 HB2 PHE 38 HB2 PHE 38 -2.414 5.698 -0.643 296 HB3 PHE 38 HB1 PHE 38 -0.769 5.814 -1.239 297 HD1 PHE 38 HD1 PHE 38 -0.274 6.894 -3.282 298 HD2 PHE 38 HD2 PHE 38 -4.273 6.705 -1.859 299 HE1 PHE 38 HE1 PHE 38 -0.894 8.689 -4.837 300 HE2 PHE 38 HE2 PHE 38 -4.916 8.486 -3.425 301 HZ PHE 38 HZ PHE 38 -3.240 9.489 -4.917 302 H VAL 39 HN VAL 39 0.060 2.983 -3.233 303 HA VAL 39 HA VAL 39 1.694 3.044 -0.805 304 HB VAL 39 HB VAL 39 2.838 0.930 -1.657 305 HG11 VAL 39 HG11 VAL 39 1.068 1.265 0.227 306 HG12 VAL 39 HG12 VAL 39 1.536 -0.359 -0.272 307 HG13 VAL 39 HG13 VAL 39 0.030 0.346 -0.861 308 HG21 VAL 39 HG21 VAL 39 2.097 0.500 -3.787 309 HG22 VAL 39 HG22 VAL 39 0.450 1.010 -3.427 310 HG23 VAL 39 HG23 VAL 39 1.037 -0.547 -2.845 311 H ARG 40 HN ARG 40 3.363 4.292 -1.108 312 HA ARG 40 HA ARG 40 4.799 4.480 -3.622 313 HB2 ARG 40 HB2 ARG 40 4.411 6.953 -3.788 314 HB3 ARG 40 HB1 ARG 40 2.955 6.019 -4.101 315 HG2 ARG 40 HG2 ARG 40 1.875 6.767 -2.311 316 HG3 ARG 40 HG1 ARG 40 3.328 6.769 -1.301 317 HD2 ARG 40 HD2 ARG 40 2.887 9.036 -1.452 318 HD3 ARG 40 HD1 ARG 40 4.047 8.817 -2.750 319 HE ARG 40 HE ARG 40 2.019 8.730 -4.250 320 HH11 ARG 40 HH11 ARG 40 1.920 10.315 -1.130 321 HH12 ARG 40 HH12 ARG 40 0.785 11.535 -1.638 322 HH21 ARG 40 HH21 ARG 40 0.514 10.314 -4.927 323 HH22 ARG 40 HH22 ARG 40 -0.016 11.538 -3.811 324 H GLY 41 HN GLY 41 6.345 6.515 -3.374 325 HA2 GLY 41 HA2 GLY 41 7.320 6.615 -0.603 326 HA3 GLY 41 HA1 GLY 41 8.261 7.037 -2.032 327 HA PRO 42 HA PRO 42 5.835 10.684 -0.190 328 HB2 PRO 42 HB2 PRO 42 7.984 11.720 1.350 329 HB3 PRO 42 HB1 PRO 42 6.494 10.999 1.958 330 HG2 PRO 42 HG2 PRO 42 9.108 9.931 2.106 331 HG3 PRO 42 HG1 PRO 42 7.617 9.119 2.579 332 HD2 PRO 42 HD2 PRO 42 9.290 8.769 0.199 333 HD3 PRO 42 HD1 PRO 42 8.057 7.700 0.878 334 H GLU 43 HN GLU 43 6.474 13.024 -0.228 335 HA GLU 43 HA GLU 43 7.017 13.729 -2.793 336 HB2 GLU 43 HB2 GLU 43 7.623 15.468 -0.401 337 HB3 GLU 43 HB1 GLU 43 7.254 16.008 -2.031 338 HG2 GLU 43 HG2 GLU 43 5.258 16.344 -0.955 339 HG3 GLU 43 HG1 GLU 43 5.016 14.756 -1.679 340 H HIS 44 HN HIS 44 8.673 13.623 -4.035 341 HA HIS 44 HA HIS 44 10.688 14.193 -4.919 342 HB2 HIS 44 HB2 HIS 44 11.403 15.022 -2.116 343 HB3 HIS 44 HB1 HIS 44 12.558 15.054 -3.443 344 HD1 HIS 44 HD1 HIS 44 11.506 16.461 -5.645 345 HD2 HIS 44 HD2 HIS 44 10.176 17.422 -1.820 346 HE1 HIS 44 HE1 HIS 44 10.491 18.756 -5.829 347 HE2 HIS 44 HE2 HIS 44 9.563 19.254 -3.545 348 H SER 45 HN SER 45 10.285 11.907 -2.417 349 HA SER 45 HA SER 45 12.724 10.523 -3.257 350 HB2 SER 45 HB2 SER 45 11.881 8.871 -1.399 351 HB3 SER 45 HB1 SER 45 12.652 10.390 -0.945 352 HG SER 45 HG SER 45 9.868 10.331 -1.302 353 H ASN 46 HN ASN 46 12.551 9.255 -4.977 354 HA ASN 46 HA ASN 46 9.957 8.080 -5.636 355 HB2 ASN 46 HB2 ASN 46 12.501 8.485 -7.162 356 HB3 ASN 46 HB1 ASN 46 11.365 7.250 -7.688 357 HD21 ASN 46 HD21 ASN 46 12.028 10.604 -7.467 358 HD22 ASN 46 HD22 ASN 46 10.651 11.150 -8.358 359 H ILE 47 HN ILE 47 9.463 6.017 -5.348 360 HA ILE 47 HA ILE 47 11.390 4.387 -3.948 361 HB ILE 47 HB ILE 47 9.652 2.806 -3.577 362 HG12 ILE 47 HG12 ILE 47 7.849 4.523 -5.277 363 HG13 ILE 47 HG11 ILE 47 8.616 3.028 -5.826 364 HG21 ILE 47 HG21 ILE 47 9.746 4.671 -2.124 365 HG22 ILE 47 HG22 ILE 47 8.060 4.237 -2.381 366 HG23 ILE 47 HG23 ILE 47 8.750 5.638 -3.204 367 HD11 ILE 47 HD11 ILE 47 7.098 2.899 -3.310 368 HD12 ILE 47 HD12 ILE 47 7.237 1.716 -4.612 369 HD13 ILE 47 HD13 ILE 47 6.162 3.107 -4.789 370 H GLN 48 HN GLN 48 10.206 4.712 -7.140 371 HA GLN 48 HA GLN 48 10.416 2.105 -8.106 372 HB2 GLN 48 HB2 GLN 48 9.357 3.869 -9.395 373 HB3 GLN 48 HB1 GLN 48 10.860 4.775 -9.475 374 HG2 GLN 48 HG2 GLN 48 10.386 3.721 -11.591 375 HG3 GLN 48 HG1 GLN 48 11.831 3.037 -10.883 376 HE21 GLN 48 HE21 GLN 48 8.550 2.248 -9.913 377 HE22 GLN 48 HE22 GLN 48 8.599 0.608 -10.458 378 H HIS 49 HN HIS 49 12.815 4.088 -6.913 379 HA HIS 49 HA HIS 49 14.993 3.044 -8.483 380 HB2 HIS 49 HB2 HIS 49 14.753 4.918 -6.171 381 HB3 HIS 49 HB1 HIS 49 16.310 4.144 -6.470 382 HD1 HIS 49 HD1 HIS 49 16.328 4.259 -9.570 383 HD2 HIS 49 HD2 HIS 49 15.247 7.434 -7.101 384 HE1 HIS 49 HE1 HIS 49 16.691 6.343 -10.936 385 HE2 HIS 49 HE2 HIS 49 16.138 8.255 -9.391 386 H PHE 50 HN PHE 50 13.504 2.358 -5.345 387 HA PHE 50 HA PHE 50 15.377 0.112 -5.082 388 HB2 PHE 50 HB2 PHE 50 15.040 0.227 -2.627 389 HB3 PHE 50 HB1 PHE 50 15.808 1.659 -3.305 390 HD1 PHE 50 HD1 PHE 50 12.665 0.347 -1.861 391 HD2 PHE 50 HD2 PHE 50 14.836 3.779 -3.119 392 HE1 PHE 50 HE1 PHE 50 11.044 1.781 -0.738 393 HE2 PHE 50 HE2 PHE 50 13.177 5.225 -2.022 394 HZ PHE 50 HZ PHE 50 11.272 4.227 -0.828 395 H VAL 51 HN VAL 51 12.318 0.805 -5.905 396 HA VAL 51 HA VAL 51 11.215 -1.671 -4.751 397 HB VAL 51 HB VAL 51 9.872 0.979 -5.334 398 HG11 VAL 51 HG11 VAL 51 7.886 -0.518 -4.256 399 HG12 VAL 51 HG12 VAL 51 8.704 -1.735 -5.256 400 HG13 VAL 51 HG13 VAL 51 8.092 -0.255 -5.997 401 HG21 VAL 51 HG21 VAL 51 9.128 0.561 -2.926 402 HG22 VAL 51 HG22 VAL 51 10.819 0.967 -3.191 403 HG23 VAL 51 HG23 VAL 51 10.350 -0.706 -2.891 404 H GLU 52 HN GLU 52 10.169 -3.067 -6.089 405 HA GLU 52 HA GLU 52 10.733 -2.651 -8.946 406 HB2 GLU 52 HB2 GLU 52 11.797 -4.589 -7.834 407 HB3 GLU 52 HB1 GLU 52 10.211 -5.210 -7.412 408 HG2 GLU 52 HG2 GLU 52 11.046 -6.415 -9.296 409 HG3 GLU 52 HG1 GLU 52 9.692 -5.418 -9.822 410 H LYS 53 HN LYS 53 8.340 -4.545 -7.099 411 HA LYS 53 HA LYS 53 6.221 -3.390 -8.762 412 HB2 LYS 53 HB2 LYS 53 5.147 -5.618 -8.912 413 HB3 LYS 53 HB1 LYS 53 6.707 -5.563 -9.718 414 HG2 LYS 53 HG2 LYS 53 7.744 -6.718 -7.882 415 HG3 LYS 53 HG1 LYS 53 6.243 -6.704 -6.964 416 HD2 LYS 53 HD2 LYS 53 6.664 -8.070 -9.631 417 HD3 LYS 53 HD1 LYS 53 6.718 -8.881 -8.067 418 HE2 LYS 53 HE2 LYS 53 4.403 -8.392 -7.665 419 HE3 LYS 53 HE1 LYS 53 4.339 -7.367 -9.100 420 HZ1 LYS 53 HZ1 LYS 53 4.778 -10.309 -9.052 421 HZ2 LYS 53 HZ2 LYS 53 4.787 -9.352 -10.451 422 HZ3 LYS 53 HZ3 LYS 53 3.361 -9.521 -9.553 423 H VAL 54 HN VAL 54 4.016 -4.184 -7.778 424 HA VAL 54 HA VAL 54 4.132 -4.163 -4.856 425 HB VAL 54 HB VAL 54 3.032 -1.997 -6.592 426 HG11 VAL 54 HG11 VAL 54 2.072 -1.927 -3.834 427 HG12 VAL 54 HG12 VAL 54 1.315 -3.169 -4.830 428 HG13 VAL 54 HG13 VAL 54 1.255 -1.478 -5.328 429 HG21 VAL 54 HG21 VAL 54 3.838 -0.946 -4.218 430 HG22 VAL 54 HG22 VAL 54 4.850 -1.112 -5.645 431 HG23 VAL 54 HG23 VAL 54 4.903 -2.337 -4.377 432 H VAL 55 HN VAL 55 2.137 -4.829 -3.853 433 HA VAL 55 HA VAL 55 0.123 -5.983 -5.626 434 HB VAL 55 HB VAL 55 2.187 -7.573 -4.526 435 HG11 VAL 55 HG11 VAL 55 -0.487 -8.131 -3.262 436 HG12 VAL 55 HG12 VAL 55 1.015 -7.717 -2.430 437 HG13 VAL 55 HG13 VAL 55 0.872 -9.257 -3.278 438 HG21 VAL 55 HG21 VAL 55 -0.406 -8.380 -5.824 439 HG22 VAL 55 HG22 VAL 55 1.051 -9.369 -5.697 440 HG23 VAL 55 HG23 VAL 55 1.066 -7.897 -6.669 441 H PHE 56 HN PHE 56 -1.853 -6.282 -4.664 442 HA PHE 56 HA PHE 56 -2.121 -5.377 -1.876 443 HB2 PHE 56 HB2 PHE 56 -3.733 -4.631 -4.311 444 HB3 PHE 56 HB1 PHE 56 -4.456 -4.578 -2.704 445 HD1 PHE 56 HD1 PHE 56 -1.600 -3.284 -4.698 446 HD2 PHE 56 HD2 PHE 56 -4.189 -2.715 -1.365 447 HE1 PHE 56 HE1 PHE 56 -0.669 -1.037 -4.372 448 HE2 PHE 56 HE2 PHE 56 -3.256 -0.458 -1.033 449 HZ PHE 56 HZ PHE 56 -1.487 0.377 -2.537 450 H HIS 57 HN HIS 57 -3.123 -6.826 -0.599 451 HA HIS 57 HA HIS 57 -4.685 -8.963 -1.911 452 HB2 HIS 57 HB2 HIS 57 -3.592 -8.870 0.922 453 HB3 HIS 57 HB1 HIS 57 -4.435 -10.225 0.176 454 HD1 HIS 57 HD1 HIS 57 -2.993 -11.961 -0.794 455 HD2 HIS 57 HD2 HIS 57 -1.001 -8.322 -0.476 456 HE1 HIS 57 HE1 HIS 57 -0.598 -12.439 -1.395 457 HE2 HIS 57 HE2 HIS 57 0.626 -10.289 -0.913 458 H LEU 58 HN LEU 58 -6.541 -7.633 -2.175 459 HA LEU 58 HA LEU 58 -7.757 -6.265 -0.018 460 HB2 LEU 58 HB2 LEU 58 -9.380 -7.368 -2.281 461 HB3 LEU 58 HB1 LEU 58 -9.579 -5.853 -1.420 462 HG LEU 58 HG LEU 58 -7.562 -6.506 -3.546 463 HD11 LEU 58 HD11 LEU 58 -8.723 -5.166 -4.889 464 HD12 LEU 58 HD12 LEU 58 -9.352 -4.165 -3.587 465 HD13 LEU 58 HD13 LEU 58 -10.045 -5.760 -3.896 466 HD21 LEU 58 HD21 LEU 58 -7.653 -4.135 -1.693 467 HD22 LEU 58 HD22 LEU 58 -6.831 -4.114 -3.251 468 HD23 LEU 58 HD23 LEU 58 -6.308 -5.233 -1.994 469 H HIS 59 HN HIS 59 -10.271 -7.021 0.409 470 HA HIS 59 HA HIS 59 -9.882 -9.358 2.031 471 HB2 HIS 59 HB2 HIS 59 -11.366 -7.279 2.535 472 HB3 HIS 59 HB1 HIS 59 -12.570 -8.094 1.542 473 HD1 HIS 59 HD1 HIS 59 -10.484 -8.762 4.658 474 HD2 HIS 59 HD2 HIS 59 -14.088 -9.903 2.906 475 HE1 HIS 59 HE1 HIS 59 -11.650 -10.201 6.365 476 HE2 HIS 59 HE2 HIS 59 -13.826 -10.884 5.292 477 H GLU 60 HN GLU 60 -10.891 -11.298 1.888 478 HA GLU 60 HA GLU 60 -10.926 -12.540 -0.585 479 HB2 GLU 60 HB2 GLU 60 -12.406 -13.475 1.864 480 HB3 GLU 60 HB1 GLU 60 -11.724 -14.480 0.592 481 HG2 GLU 60 HG2 GLU 60 -10.223 -14.746 2.328 482 HG3 GLU 60 HG1 GLU 60 -9.455 -13.489 1.365 483 H SER 61 HN SER 61 -13.432 -10.809 0.976 484 HA SER 61 HA SER 61 -15.669 -11.860 -0.393 485 HB2 SER 61 HB2 SER 61 -15.928 -10.504 1.612 486 HB3 SER 61 HB1 SER 61 -15.173 -9.127 0.816 487 HG SER 61 HG SER 61 -17.616 -10.356 0.018 488 H PHE 62 HN PHE 62 -13.068 -9.847 -1.365 489 HA PHE 62 HA PHE 62 -14.469 -8.713 -3.649 490 HB2 PHE 62 HB2 PHE 62 -11.607 -8.471 -2.685 491 HB3 PHE 62 HB1 PHE 62 -12.236 -7.675 -4.117 492 HD1 PHE 62 HD1 PHE 62 -13.241 -8.031 -0.535 493 HD2 PHE 62 HD2 PHE 62 -12.673 -5.460 -3.871 494 HE1 PHE 62 HE1 PHE 62 -13.933 -6.105 0.835 495 HE2 PHE 62 HE2 PHE 62 -13.370 -3.532 -2.515 496 HZ PHE 62 HZ PHE 62 -14.001 -3.852 -0.157 497 HA PRO 63 HA PRO 63 -13.281 -12.165 -6.249 498 HB2 PRO 63 HB2 PRO 63 -13.851 -10.247 -8.428 499 HB3 PRO 63 HB1 PRO 63 -14.558 -11.835 -8.116 500 HG2 PRO 63 HG2 PRO 63 -15.952 -9.592 -7.692 501 HG3 PRO 63 HG1 PRO 63 -16.114 -10.997 -6.622 502 HD2 PRO 63 HD2 PRO 63 -14.578 -8.460 -6.202 503 HD3 PRO 63 HD1 PRO 63 -15.565 -9.384 -5.049 504 H ARG 64 HN ARG 64 -11.259 -12.681 -6.761 505 HA ARG 64 HA ARG 64 -9.003 -12.475 -7.076 506 HB2 ARG 64 HB2 ARG 64 -9.980 -10.512 -9.158 507 HB3 ARG 64 HB1 ARG 64 -8.337 -11.133 -9.067 508 HG2 ARG 64 HG2 ARG 64 -9.149 -13.389 -9.456 509 HG3 ARG 64 HG1 ARG 64 -10.809 -12.797 -9.498 510 HD2 ARG 64 HD2 ARG 64 -8.605 -12.046 -11.402 511 HD3 ARG 64 HD1 ARG 64 -9.958 -13.124 -11.735 512 HE ARG 64 HE ARG 64 -10.747 -10.484 -10.892 513 HH11 ARG 64 HH11 ARG 64 -9.939 -12.544 -13.603 514 HH12 ARG 64 HH12 ARG 64 -10.724 -11.524 -14.775 515 HH21 ARG 64 HH21 ARG 64 -11.797 -9.154 -12.416 516 HH22 ARG 64 HH22 ARG 64 -11.779 -9.587 -14.098 517 HA PRO 65 HA PRO 65 -9.064 -8.570 -4.572 518 HB2 PRO 65 HB2 PRO 65 -7.902 -9.550 -2.330 519 HB3 PRO 65 HB1 PRO 65 -9.633 -9.674 -2.654 520 HG2 PRO 65 HG2 PRO 65 -7.488 -11.722 -2.962 521 HG3 PRO 65 HG1 PRO 65 -9.156 -11.912 -2.385 522 HD2 PRO 65 HD2 PRO 65 -8.330 -12.567 -4.913 523 HD3 PRO 65 HD1 PRO 65 -9.990 -12.104 -4.501 524 H LYS 66 HN LYS 66 -6.476 -10.730 -5.348 525 HA LYS 66 HA LYS 66 -4.430 -8.941 -4.466 526 HB2 LYS 66 HB2 LYS 66 -4.028 -11.352 -4.429 527 HB3 LYS 66 HB1 LYS 66 -4.218 -11.418 -6.175 528 HG2 LYS 66 HG2 LYS 66 -2.236 -10.121 -6.515 529 HG3 LYS 66 HG1 LYS 66 -2.108 -9.783 -4.790 530 HD2 LYS 66 HD2 LYS 66 -1.105 -11.724 -4.363 531 HD3 LYS 66 HD1 LYS 66 -2.214 -12.633 -5.392 532 HE2 LYS 66 HE2 LYS 66 0.047 -10.949 -6.451 533 HE3 LYS 66 HE1 LYS 66 0.204 -12.668 -6.096 534 HZ1 LYS 66 HZ1 LYS 66 -1.657 -11.441 -8.069 535 HZ2 LYS 66 HZ2 LYS 66 -1.607 -13.090 -7.679 536 HZ3 LYS 66 HZ3 LYS 66 -0.269 -12.353 -8.417 537 H ARG 67 HN ARG 67 -4.273 -7.089 -5.475 538 HA ARG 67 HA ARG 67 -4.304 -7.070 -8.419 539 HB2 ARG 67 HB2 ARG 67 -4.453 -4.622 -6.648 540 HB3 ARG 67 HB1 ARG 67 -4.934 -4.786 -8.333 541 HG2 ARG 67 HG2 ARG 67 -6.330 -5.964 -5.942 542 HG3 ARG 67 HG1 ARG 67 -6.892 -4.628 -6.948 543 HD2 ARG 67 HD2 ARG 67 -6.979 -6.187 -8.881 544 HD3 ARG 67 HD1 ARG 67 -6.523 -7.506 -7.792 545 HE ARG 67 HE ARG 67 -8.658 -7.588 -7.030 546 HH11 ARG 67 HH11 ARG 67 -8.263 -4.545 -8.753 547 HH12 ARG 67 HH12 ARG 67 -9.959 -4.167 -8.694 548 HH21 ARG 67 HH21 ARG 67 -10.880 -7.072 -6.988 549 HH22 ARG 67 HH22 ARG 67 -11.433 -5.574 -7.685 550 H VAL 68 HN VAL 68 -2.469 -6.389 -9.512 551 HA VAL 68 HA VAL 68 -0.175 -5.782 -7.765 552 HB VAL 68 HB VAL 68 1.264 -7.032 -9.039 553 HG11 VAL 68 HG11 VAL 68 -0.323 -8.568 -8.022 554 HG12 VAL 68 HG12 VAL 68 0.233 -9.192 -9.578 555 HG13 VAL 68 HG13 VAL 68 -1.363 -8.454 -9.445 556 HG21 VAL 68 HG21 VAL 68 0.890 -5.956 -11.151 557 HG22 VAL 68 HG22 VAL 68 -0.635 -6.817 -11.366 558 HG23 VAL 68 HG23 VAL 68 0.890 -7.706 -11.375 559 H CYS 69 HN CYS 69 1.186 -4.127 -8.274 560 HA CYS 69 HA CYS 69 0.567 -2.533 -10.669 561 HB2 CYS 69 HB2 CYS 69 1.153 -1.484 -7.887 562 HB3 CYS 69 HB1 CYS 69 0.983 -0.489 -9.331 563 HG CYS 69 HG CYS 69 -1.708 -2.164 -9.349 564 H LYS 70 HN LYS 70 2.331 -2.518 -11.935 565 HA LYS 70 HA LYS 70 4.962 -2.978 -10.671 566 HB2 LYS 70 HB2 LYS 70 4.268 -3.222 -13.601 567 HB3 LYS 70 HB1 LYS 70 5.692 -3.844 -12.783 568 HG2 LYS 70 HG2 LYS 70 4.496 -5.605 -11.793 569 HG3 LYS 70 HG1 LYS 70 2.943 -4.834 -12.109 570 HD2 LYS 70 HD2 LYS 70 3.248 -5.157 -14.498 571 HD3 LYS 70 HD1 LYS 70 4.829 -5.885 -14.210 572 HE2 LYS 70 HE2 LYS 70 3.819 -7.737 -13.057 573 HE3 LYS 70 HE1 LYS 70 2.229 -6.975 -13.142 574 HZ1 LYS 70 HZ1 LYS 70 2.214 -7.219 -15.498 575 HZ2 LYS 70 HZ2 LYS 70 2.606 -8.732 -14.834 576 HZ3 LYS 70 HZ3 LYS 70 3.819 -7.765 -15.522 577 H ASP 71 HN ASP 71 3.157 -0.467 -11.674 578 HA ASP 71 HA ASP 71 5.373 0.967 -12.964 579 HB2 ASP 71 HB2 ASP 71 2.386 1.110 -13.366 580 HB3 ASP 71 HB1 ASP 71 3.453 2.385 -13.936 581 HA PRO 72 HA PRO 72 5.262 4.619 -10.180 582 HB2 PRO 72 HB2 PRO 72 3.686 5.697 -12.511 583 HB3 PRO 72 HB1 PRO 72 4.826 6.552 -11.462 584 HG2 PRO 72 HG2 PRO 72 5.669 5.629 -13.780 585 HG3 PRO 72 HG1 PRO 72 6.676 5.412 -12.332 586 HD2 PRO 72 HD2 PRO 72 5.118 3.417 -13.855 587 HD3 PRO 72 HD1 PRO 72 6.554 3.194 -12.843 588 HA PRO 73 HA PRO 73 2.435 5.648 -7.335 589 HB2 PRO 73 HB2 PRO 73 0.248 6.548 -9.172 590 HB3 PRO 73 HB1 PRO 73 0.650 7.130 -7.551 591 HG2 PRO 73 HG2 PRO 73 1.533 8.311 -9.883 592 HG3 PRO 73 HG1 PRO 73 2.356 8.452 -8.323 593 HD2 PRO 73 HD2 PRO 73 3.321 7.186 -10.677 594 HD3 PRO 73 HD1 PRO 73 4.089 7.208 -9.079 595 H TYR 74 HN TYR 74 2.016 3.775 -6.530 596 HA TYR 74 HA TYR 74 0.524 1.745 -7.954 597 HB2 TYR 74 HB2 TYR 74 1.774 1.597 -5.208 598 HB3 TYR 74 HB1 TYR 74 1.356 0.244 -6.246 599 HD1 TYR 74 HD2 TYR 74 3.600 3.208 -6.046 600 HD2 TYR 74 HD1 TYR 74 2.980 -0.665 -7.674 601 HE1 TYR 74 HE2 TYR 74 5.877 3.233 -6.940 602 HE2 TYR 74 HE1 TYR 74 5.269 -0.652 -8.584 603 HH TYR 74 HH TYR 74 6.989 0.851 -9.174 604 H LYS 75 HN LYS 75 -1.540 1.228 -7.541 605 HA LYS 75 HA LYS 75 -2.854 1.996 -5.082 606 HB2 LYS 75 HB2 LYS 75 -4.556 3.385 -6.385 607 HB3 LYS 75 HB1 LYS 75 -2.994 4.131 -6.078 608 HG2 LYS 75 HG2 LYS 75 -2.318 3.933 -8.282 609 HG3 LYS 75 HG1 LYS 75 -3.505 2.685 -8.647 610 HD2 LYS 75 HD2 LYS 75 -4.182 4.758 -9.666 611 HD3 LYS 75 HD1 LYS 75 -5.302 4.395 -8.361 612 HE2 LYS 75 HE2 LYS 75 -4.130 5.939 -6.925 613 HE3 LYS 75 HE1 LYS 75 -2.958 6.280 -8.189 614 HZ1 LYS 75 HZ1 LYS 75 -5.873 6.797 -8.434 615 HZ2 LYS 75 HZ2 LYS 75 -4.656 7.266 -9.519 616 HZ3 LYS 75 HZ3 LYS 75 -4.734 7.970 -7.976 617 H VAL 76 HN VAL 76 -4.895 1.188 -4.864 618 HA VAL 76 HA VAL 76 -5.923 -0.469 -7.075 619 HB VAL 76 HB VAL 76 -5.879 -1.148 -4.151 620 HG11 VAL 76 HG11 VAL 76 -8.209 -1.243 -5.128 621 HG12 VAL 76 HG12 VAL 76 -7.596 -2.742 -4.424 622 HG13 VAL 76 HG13 VAL 76 -7.617 -2.531 -6.178 623 HG21 VAL 76 HG21 VAL 76 -4.072 -2.052 -5.473 624 HG22 VAL 76 HG22 VAL 76 -5.206 -2.642 -6.681 625 HG23 VAL 76 HG23 VAL 76 -5.188 -3.350 -5.067 626 H GLU 77 HN GLU 77 -7.808 0.138 -7.787 627 HA GLU 77 HA GLU 77 -9.477 1.889 -6.112 628 HB2 GLU 77 HB2 GLU 77 -9.503 1.583 -9.117 629 HB3 GLU 77 HB1 GLU 77 -10.408 2.746 -8.179 630 HG2 GLU 77 HG2 GLU 77 -8.736 4.172 -8.123 631 HG3 GLU 77 HG1 GLU 77 -7.615 2.920 -7.614 632 H GLU 78 HN GLU 78 -11.156 0.920 -5.250 633 HA GLU 78 HA GLU 78 -12.550 -1.121 -6.817 634 HB2 GLU 78 HB2 GLU 78 -11.044 -1.613 -4.370 635 HB3 GLU 78 HB1 GLU 78 -12.722 -2.123 -4.236 636 HG2 GLU 78 HG2 GLU 78 -10.596 -3.096 -6.101 637 HG3 GLU 78 HG1 GLU 78 -11.638 -4.002 -5.008 638 H SER 79 HN SER 79 -14.583 -1.796 -5.775 639 HA SER 79 HA SER 79 -15.878 0.368 -4.299 640 HB2 SER 79 HB2 SER 79 -17.333 -0.971 -6.559 641 HB3 SER 79 HB1 SER 79 -17.512 0.661 -5.923 642 HG SER 79 HG SER 79 -15.894 1.367 -7.113 643 H GLY 80 HN GLY 80 -17.045 -0.442 -2.626 644 HA2 GLY 80 HA2 GLY 80 -18.126 -3.135 -2.696 645 HA3 GLY 80 HA1 GLY 80 -16.839 -2.852 -1.528 646 H TYR 81 HN TYR 81 -18.297 -3.170 0.269 647 HA TYR 81 HA TYR 81 -19.856 -0.745 0.770 648 HB2 TYR 81 HB2 TYR 81 -21.774 -2.128 1.651 649 HB3 TYR 81 HB1 TYR 81 -21.558 -2.158 -0.097 650 HD1 TYR 81 HD2 TYR 81 -21.141 -4.123 3.001 651 HD2 TYR 81 HD1 TYR 81 -21.011 -4.171 -1.249 652 HE1 TYR 81 HE2 TYR 81 -21.051 -6.579 3.036 653 HE2 TYR 81 HE1 TYR 81 -20.923 -6.624 -1.218 654 HH TYR 81 HH TYR 81 -21.459 -8.457 1.654 655 H ALA 82 HN ALA 82 -17.361 -2.150 1.853 656 HA ALA 82 HA ALA 82 -17.867 -1.454 4.574 657 HB1 ALA 82 HB1 ALA 82 -18.802 -3.618 4.775 658 HB2 ALA 82 HB2 ALA 82 -17.191 -3.709 5.479 659 HB3 ALA 82 HB3 ALA 82 -17.484 -4.348 3.862 660 H GLY 83 HN GLY 83 -15.966 -1.744 5.956 661 HA2 GLY 83 HA2 GLY 83 -13.490 -1.435 4.399 662 HA3 GLY 83 HA1 GLY 83 -13.771 -0.771 6.003 663 H PHE 84 HN PHE 84 -11.507 -1.998 5.894 664 HA PHE 84 HA PHE 84 -11.497 -4.229 7.550 665 HB2 PHE 84 HB2 PHE 84 -10.913 -6.044 5.952 666 HB3 PHE 84 HB1 PHE 84 -12.559 -5.464 5.723 667 HD1 PHE 84 HD1 PHE 84 -13.015 -3.864 3.819 668 HD2 PHE 84 HD2 PHE 84 -9.370 -6.022 4.186 669 HE1 PHE 84 HE1 PHE 84 -12.551 -3.459 1.444 670 HE2 PHE 84 HE2 PHE 84 -8.883 -5.620 1.817 671 HZ PHE 84 HZ PHE 84 -10.470 -4.337 0.429 672 H ILE 85 HN ILE 85 -9.346 -4.916 8.031 673 HA ILE 85 HA ILE 85 -7.167 -3.291 7.298 674 HB ILE 85 HB ILE 85 -7.311 -6.081 8.429 675 HG12 ILE 85 HG12 ILE 85 -7.882 -4.180 9.903 676 HG13 ILE 85 HG11 ILE 85 -6.440 -5.039 10.437 677 HG21 ILE 85 HG21 ILE 85 -4.777 -4.538 7.878 678 HG22 ILE 85 HG22 ILE 85 -5.303 -5.996 7.040 679 HG23 ILE 85 HG23 ILE 85 -4.896 -6.065 8.754 680 HD11 ILE 85 HD11 ILE 85 -6.368 -2.502 8.836 681 HD12 ILE 85 HD12 ILE 85 -5.020 -3.311 9.633 682 HD13 ILE 85 HD13 ILE 85 -6.295 -2.564 10.596 683 H LEU 86 HN LEU 86 -5.958 -3.222 5.497 684 HA LEU 86 HA LEU 86 -6.253 -5.459 3.599 685 HB2 LEU 86 HB2 LEU 86 -7.050 -2.982 3.071 686 HB3 LEU 86 HB1 LEU 86 -5.343 -2.769 2.706 687 HG LEU 86 HG LEU 86 -6.659 -5.112 1.480 688 HD11 LEU 86 HD11 LEU 86 -7.050 -2.393 0.267 689 HD12 LEU 86 HD12 LEU 86 -8.275 -3.161 1.278 690 HD13 LEU 86 HD13 LEU 86 -7.759 -3.933 -0.219 691 HD21 LEU 86 HD21 LEU 86 -5.234 -3.426 -0.270 692 HD22 LEU 86 HD22 LEU 86 -4.828 -5.056 0.260 693 HD23 LEU 86 HD23 LEU 86 -4.279 -3.657 1.191 694 HA PRO 87 HA PRO 87 -1.903 -5.878 4.592 695 HB2 PRO 87 HB2 PRO 87 -2.083 -8.394 3.154 696 HB3 PRO 87 HB1 PRO 87 -1.778 -8.119 4.868 697 HG2 PRO 87 HG2 PRO 87 -4.081 -9.223 3.915 698 HG3 PRO 87 HG1 PRO 87 -3.987 -8.304 5.427 699 HD2 PRO 87 HD2 PRO 87 -4.968 -7.440 2.738 700 HD3 PRO 87 HD1 PRO 87 -5.605 -7.052 4.351 701 H ILE 88 HN ILE 88 -0.982 -4.404 3.240 702 HA ILE 88 HA ILE 88 -0.996 -4.888 0.368 703 HB ILE 88 HB ILE 88 0.102 -2.470 1.818 704 HG12 ILE 88 HG12 ILE 88 -2.584 -2.527 0.477 705 HG13 ILE 88 HG11 ILE 88 -2.439 -3.137 2.126 706 HG21 ILE 88 HG21 ILE 88 0.855 -2.818 -0.489 707 HG22 ILE 88 HG22 ILE 88 -0.176 -1.394 -0.344 708 HG23 ILE 88 HG23 ILE 88 -0.826 -2.886 -1.022 709 HD11 ILE 88 HD11 ILE 88 -1.688 -0.369 1.218 710 HD12 ILE 88 HD12 ILE 88 -1.606 -0.985 2.863 711 HD13 ILE 88 HD13 ILE 88 -3.166 -0.814 2.062 712 H GLU 89 HN GLU 89 0.930 -5.010 -0.837 713 HA GLU 89 HA GLU 89 3.379 -5.395 0.745 714 HB2 GLU 89 HB2 GLU 89 2.342 -7.109 -1.499 715 HB3 GLU 89 HB1 GLU 89 4.026 -7.119 -0.997 716 HG2 GLU 89 HG2 GLU 89 3.215 -7.716 1.303 717 HG3 GLU 89 HG1 GLU 89 1.621 -7.954 0.589 718 H VAL 90 HN VAL 90 5.096 -4.342 0.051 719 HA VAL 90 HA VAL 90 5.118 -3.395 -2.733 720 HB VAL 90 HB VAL 90 6.781 -2.216 -0.525 721 HG11 VAL 90 HG11 VAL 90 7.316 -0.579 -2.125 722 HG12 VAL 90 HG12 VAL 90 6.079 -1.134 -3.229 723 HG13 VAL 90 HG13 VAL 90 7.508 -2.121 -2.931 724 HG21 VAL 90 HG21 VAL 90 4.230 -1.944 -0.320 725 HG22 VAL 90 HG22 VAL 90 4.365 -0.926 -1.752 726 HG23 VAL 90 HG23 VAL 90 5.221 -0.487 -0.273 727 H TYR 91 HN TYR 91 6.584 -4.298 -4.024 728 HA TYR 91 HA TYR 91 8.471 -6.193 -2.843 729 HB2 TYR 91 HB2 TYR 91 7.514 -5.656 -5.621 730 HB3 TYR 91 HB1 TYR 91 9.021 -6.530 -5.379 731 HD1 TYR 91 HD1 TYR 91 5.833 -6.673 -3.460 732 HD2 TYR 91 HD2 TYR 91 8.584 -8.728 -5.956 733 HE1 TYR 91 HE1 TYR 91 4.595 -8.756 -3.102 734 HE2 TYR 91 HE2 TYR 91 7.336 -10.824 -5.622 735 HH TYR 91 HH TYR 91 4.248 -10.882 -3.990 736 H PHE 92 HN PHE 92 10.591 -6.012 -2.817 737 HA PHE 92 HA PHE 92 11.694 -3.359 -3.456 738 HB2 PHE 92 HB2 PHE 92 12.491 -5.525 -1.496 739 HB3 PHE 92 HB1 PHE 92 13.499 -4.113 -1.823 740 HD1 PHE 92 HD1 PHE 92 11.208 -2.126 -2.091 741 HD2 PHE 92 HD2 PHE 92 12.044 -5.139 0.793 742 HE1 PHE 92 HE1 PHE 92 10.033 -0.811 -0.392 743 HE2 PHE 92 HE2 PHE 92 10.840 -3.826 2.502 744 HZ PHE 92 HZ PHE 92 9.851 -1.659 1.905 745 H LYS 93 HN LYS 93 13.938 -3.304 -4.277 746 HA LYS 93 HA LYS 93 14.540 -5.610 -5.997 747 HB2 LYS 93 HB2 LYS 93 15.638 -2.789 -6.032 748 HB3 LYS 93 HB1 LYS 93 16.126 -4.071 -7.132 749 HG2 LYS 93 HG2 LYS 93 13.925 -4.139 -8.090 750 HG3 LYS 93 HG1 LYS 93 13.346 -2.931 -6.936 751 HD2 LYS 93 HD2 LYS 93 14.882 -1.268 -7.792 752 HD3 LYS 93 HD1 LYS 93 15.638 -2.438 -8.869 753 HE2 LYS 93 HE2 LYS 93 13.695 -2.425 -10.368 754 HE3 LYS 93 HE1 LYS 93 12.647 -1.757 -9.111 755 HZ1 LYS 93 HZ1 LYS 93 13.699 0.348 -9.337 756 HZ2 LYS 93 HZ2 LYS 93 13.336 -0.192 -10.896 757 HZ3 LYS 93 HZ3 LYS 93 14.927 -0.279 -10.323 758 H ASN 94 HN ASN 94 15.551 -6.979 -4.494 759 HA ASN 94 HA ASN 94 18.299 -6.304 -3.980 760 HB2 ASN 94 HB2 ASN 94 16.889 -5.456 -2.007 761 HB3 ASN 94 HB1 ASN 94 16.695 -7.154 -1.628 762 HD21 ASN 94 HD21 ASN 94 19.591 -5.785 -3.038 763 HD22 ASN 94 HD22 ASN 94 20.599 -6.038 -1.651 764 H LYS 95 HN LYS 95 19.535 -8.174 -3.214 765 HA LYS 95 HA LYS 95 18.261 -10.730 -3.950 766 HB2 LYS 95 HB2 LYS 95 20.168 -10.022 -5.352 767 HB3 LYS 95 HB1 LYS 95 21.178 -9.979 -3.918 768 HG2 LYS 95 HG2 LYS 95 20.778 -12.398 -3.618 769 HG3 LYS 95 HG1 LYS 95 19.886 -12.394 -5.144 770 HD2 LYS 95 HD2 LYS 95 21.893 -11.563 -6.296 771 HD3 LYS 95 HD1 LYS 95 22.776 -11.605 -4.770 772 HE2 LYS 95 HE2 LYS 95 22.302 -14.055 -4.658 773 HE3 LYS 95 HE1 LYS 95 21.626 -13.939 -6.284 774 HZ1 LYS 95 HZ1 LYS 95 23.770 -13.134 -7.074 775 HZ2 LYS 95 HZ2 LYS 95 23.931 -14.658 -6.348 776 HZ3 LYS 95 HZ3 LYS 95 24.416 -13.263 -5.512 777 H GLU 96 HN GLU 96 19.240 -8.889 -1.408 778 HA GLU 96 HA GLU 96 20.110 -11.122 0.278 779 HB2 GLU 96 HB2 GLU 96 20.292 -8.385 1.409 780 HB3 GLU 96 HB1 GLU 96 21.530 -9.644 1.366 781 HG2 GLU 96 HG2 GLU 96 20.815 -7.868 -0.954 782 HG3 GLU 96 HG1 GLU 96 22.160 -7.608 0.153 783 H GLU 97 HN GLU 97 19.324 -9.466 2.708 784 HA GLU 97 HA GLU 97 17.193 -10.531 3.753 785 HB2 GLU 97 HB2 GLU 97 17.871 -7.601 3.791 786 HB3 GLU 97 HB1 GLU 97 16.647 -8.322 4.832 787 HG2 GLU 97 HG2 GLU 97 19.545 -9.145 4.755 788 HG3 GLU 97 HG1 GLU 97 18.845 -8.032 5.929 789 HA PRO 98 HA PRO 98 13.284 -10.554 2.267 790 HB2 PRO 98 HB2 PRO 98 11.900 -8.496 3.665 791 HB3 PRO 98 HB1 PRO 98 11.938 -10.218 4.052 792 HG2 PRO 98 HG2 PRO 98 13.600 -7.994 5.104 793 HG3 PRO 98 HG1 PRO 98 13.019 -9.453 5.936 794 HD2 PRO 98 HD2 PRO 98 15.560 -9.293 5.222 795 HD3 PRO 98 HD1 PRO 98 14.673 -10.809 4.932 796 H ARG 99 HN ARG 99 12.646 -10.002 0.375 797 HA ARG 99 HA ARG 99 13.294 -7.311 -0.597 798 HB2 ARG 99 HB2 ARG 99 12.569 -9.724 -2.292 799 HB3 ARG 99 HB1 ARG 99 13.280 -8.214 -2.833 800 HG2 ARG 99 HG2 ARG 99 15.348 -8.802 -2.270 801 HG3 ARG 99 HG1 ARG 99 14.836 -9.500 -0.735 802 HD2 ARG 99 HD2 ARG 99 15.829 -11.212 -2.174 803 HD3 ARG 99 HD1 ARG 99 14.125 -11.546 -1.945 804 HE ARG 99 HE ARG 99 15.084 -10.155 -4.353 805 HH11 ARG 99 HH11 ARG 99 13.436 -12.854 -2.845 806 HH12 ARG 99 HH12 ARG 99 12.787 -13.455 -4.348 807 HH21 ARG 99 HH21 ARG 99 14.254 -10.951 -6.323 808 HH22 ARG 99 HH22 ARG 99 13.241 -12.366 -6.322 809 H LYS 100 HN LYS 100 10.941 -8.163 1.007 810 HA LYS 100 HA LYS 100 8.964 -6.743 -0.588 811 HB2 LYS 100 HB2 LYS 100 7.179 -8.385 -0.002 812 HB3 LYS 100 HB1 LYS 100 8.379 -9.025 -1.120 813 HG2 LYS 100 HG2 LYS 100 9.274 -10.455 0.446 814 HG3 LYS 100 HG1 LYS 100 8.740 -9.467 1.807 815 HD2 LYS 100 HD2 LYS 100 7.381 -11.376 1.888 816 HD3 LYS 100 HD1 LYS 100 6.368 -10.139 1.146 817 HE2 LYS 100 HE2 LYS 100 7.944 -11.994 -0.592 818 HE3 LYS 100 HE1 LYS 100 6.453 -12.555 0.158 819 HZ1 LYS 100 HZ1 LYS 100 5.332 -10.608 -0.847 820 HZ2 LYS 100 HZ2 LYS 100 5.940 -11.715 -1.983 821 HZ3 LYS 100 HZ3 LYS 100 6.763 -10.264 -1.692 822 H VAL 101 HN VAL 101 7.584 -5.538 0.671 823 HA VAL 101 HA VAL 101 7.812 -5.935 3.575 824 HB VAL 101 HB VAL 101 8.993 -3.890 2.822 825 HG11 VAL 101 HG11 VAL 101 7.853 -3.097 0.961 826 HG12 VAL 101 HG12 VAL 101 7.450 -1.930 2.228 827 HG13 VAL 101 HG13 VAL 101 6.285 -3.173 1.775 828 HG21 VAL 101 HG21 VAL 101 8.062 -2.420 4.500 829 HG22 VAL 101 HG22 VAL 101 8.066 -4.091 5.075 830 HG23 VAL 101 HG23 VAL 101 6.564 -3.354 4.514 831 H ARG 102 HN ARG 102 5.955 -5.986 4.714 832 HA ARG 102 HA ARG 102 3.472 -5.872 3.154 833 HB2 ARG 102 HB2 ARG 102 4.099 -8.095 3.930 834 HB3 ARG 102 HB1 ARG 102 4.220 -7.505 5.577 835 HG2 ARG 102 HG2 ARG 102 1.896 -7.201 5.764 836 HG3 ARG 102 HG1 ARG 102 1.648 -7.397 4.026 837 HD2 ARG 102 HD2 ARG 102 1.035 -9.392 5.432 838 HD3 ARG 102 HD1 ARG 102 2.185 -9.707 4.133 839 HE ARG 102 HE ARG 102 3.945 -9.602 5.882 840 HH11 ARG 102 HH11 ARG 102 0.643 -10.292 6.829 841 HH12 ARG 102 HH12 ARG 102 1.110 -11.251 8.202 842 HH21 ARG 102 HH21 ARG 102 4.562 -10.839 7.674 843 HH22 ARG 102 HH22 ARG 102 3.342 -11.542 8.701 844 H PHE 103 HN PHE 103 2.289 -4.156 3.602 845 HA PHE 103 HA PHE 103 2.384 -3.032 6.320 846 HB2 PHE 103 HB2 PHE 103 1.578 -1.731 3.709 847 HB3 PHE 103 HB1 PHE 103 1.571 -0.941 5.277 848 HD1 PHE 103 HD1 PHE 103 4.131 -1.826 6.415 849 HD2 PHE 103 HD2 PHE 103 3.152 -0.618 2.451 850 HE1 PHE 103 HE1 PHE 103 6.440 -1.051 6.082 851 HE2 PHE 103 HE2 PHE 103 5.463 0.143 2.111 852 HZ PHE 103 HZ PHE 103 7.109 -0.068 3.927 853 H ASP 104 HN ASP 104 0.681 -3.677 7.508 854 HA ASP 104 HA ASP 104 -1.838 -4.345 6.230 855 HB2 ASP 104 HB2 ASP 104 -1.095 -4.337 9.163 856 HB3 ASP 104 HB1 ASP 104 -2.607 -4.943 8.502 857 H TYR 105 HN TYR 105 -2.533 -2.417 5.397 858 HA TYR 105 HA TYR 105 -2.766 -0.108 7.166 859 HB2 TYR 105 HB2 TYR 105 -1.874 0.253 4.913 860 HB3 TYR 105 HB1 TYR 105 -3.323 -0.466 4.210 861 HD1 TYR 105 HD1 TYR 105 -2.310 2.376 6.433 862 HD2 TYR 105 HD2 TYR 105 -5.012 0.885 3.520 863 HE1 TYR 105 HE1 TYR 105 -3.380 4.590 6.305 864 HE2 TYR 105 HE2 TYR 105 -6.087 3.073 3.371 865 HH TYR 105 HH TYR 105 -4.726 5.880 4.582 866 H ASP 106 HN ASP 106 -4.681 0.680 7.937 867 HA ASP 106 HA ASP 106 -6.940 -1.117 7.793 868 HB2 ASP 106 HB2 ASP 106 -6.265 0.028 9.910 869 HB3 ASP 106 HB1 ASP 106 -6.770 1.557 9.194 870 H LEU 107 HN LEU 107 -8.263 -1.047 6.100 871 HA LEU 107 HA LEU 107 -8.766 1.436 4.700 872 HB2 LEU 107 HB2 LEU 107 -9.137 -1.398 4.201 873 HB3 LEU 107 HB1 LEU 107 -10.561 -0.468 3.768 874 HG LEU 107 HG LEU 107 -9.034 0.987 2.370 875 HD11 LEU 107 HD11 LEU 107 -6.918 -0.142 1.679 876 HD12 LEU 107 HD12 LEU 107 -7.106 -1.204 3.076 877 HD13 LEU 107 HD13 LEU 107 -6.910 0.535 3.309 878 HD21 LEU 107 HD21 LEU 107 -8.849 -0.747 0.581 879 HD22 LEU 107 HD22 LEU 107 -10.446 -0.599 1.318 880 HD23 LEU 107 HD23 LEU 107 -9.386 -1.934 1.771 881 H PHE 108 HN PHE 108 -10.001 2.779 5.926 882 HA PHE 108 HA PHE 108 -12.527 1.679 6.943 883 HB2 PHE 108 HB2 PHE 108 -12.603 3.511 8.555 884 HB3 PHE 108 HB1 PHE 108 -11.101 2.615 8.725 885 HD1 PHE 108 HD2 PHE 108 -12.626 5.771 7.691 886 HD2 PHE 108 HD1 PHE 108 -8.970 3.651 8.216 887 HE1 PHE 108 HE2 PHE 108 -11.380 7.876 7.485 888 HE2 PHE 108 HE1 PHE 108 -7.719 5.763 8.015 889 HZ PHE 108 HZ PHE 108 -8.927 7.875 7.635 890 H LEU 109 HN LEU 109 -14.426 2.541 6.288 891 HA LEU 109 HA LEU 109 -14.280 4.746 4.327 892 HB2 LEU 109 HB2 LEU 109 -16.471 2.674 4.554 893 HB3 LEU 109 HB1 LEU 109 -16.214 3.818 3.251 894 HG LEU 109 HG LEU 109 -14.488 1.421 3.897 895 HD11 LEU 109 HD11 LEU 109 -16.685 0.983 2.788 896 HD12 LEU 109 HD12 LEU 109 -15.278 0.507 1.842 897 HD13 LEU 109 HD13 LEU 109 -16.143 1.991 1.448 898 HD21 LEU 109 HD21 LEU 109 -14.182 3.497 1.727 899 HD22 LEU 109 HD22 LEU 109 -13.249 2.005 1.863 900 HD23 LEU 109 HD23 LEU 109 -13.103 3.251 3.102 901 H HIS 110 HN HIS 110 -15.844 6.427 4.563 902 HA HIS 110 HA HIS 110 -16.955 6.621 7.252 903 HB2 HIS 110 HB2 HIS 110 -15.667 8.500 6.000 904 HB3 HIS 110 HB1 HIS 110 -17.179 8.756 5.140 905 HD1 HIS 110 HD1 HIS 110 -18.771 10.354 6.225 906 HD2 HIS 110 HD2 HIS 110 -16.000 8.811 8.921 907 HE1 HIS 110 HE1 HIS 110 -19.145 11.598 8.373 908 HE2 HIS 110 HE2 HIS 110 -17.524 10.594 10.016 909 H LEU 111 HN LEU 111 -19.218 7.499 7.467 910 HA LEU 111 HA LEU 111 -20.956 5.558 6.590 911 HB2 LEU 111 HB2 LEU 111 -21.083 7.882 8.205 912 HB3 LEU 111 HB1 LEU 111 -22.472 7.897 7.131 913 HG LEU 111 HG LEU 111 -22.904 6.800 9.325 914 HD11 LEU 111 HD11 LEU 111 -23.822 4.652 8.281 915 HD12 LEU 111 HD12 LEU 111 -23.180 5.275 6.759 916 HD13 LEU 111 HD13 LEU 111 -24.402 6.191 7.643 917 HD21 LEU 111 HD21 LEU 111 -20.962 4.754 8.265 918 HD22 LEU 111 HD22 LEU 111 -21.986 4.552 9.688 919 HD23 LEU 111 HD23 LEU 111 -20.727 5.787 9.676 920 H GLU 112 HN GLU 112 -22.387 5.262 5.085 921 HA GLU 112 HA GLU 112 -22.332 6.278 2.552 922 HB2 GLU 112 HB2 GLU 112 -23.466 4.210 3.206 923 HB3 GLU 112 HB1 GLU 112 -24.657 5.126 4.111 924 HG2 GLU 112 HG2 GLU 112 -25.484 6.105 2.036 925 HG3 GLU 112 HG1 GLU 112 -24.284 5.187 1.131 926 H GLY 113 HN GLY 113 -22.823 8.181 1.716 927 HA2 GLY 113 HA2 GLY 113 -24.679 9.785 1.360 928 HA3 GLY 113 HA1 GLY 113 -24.793 9.871 3.114 929 H HIS 114 HN HIS 114 -22.225 10.135 3.937 930 HA HIS 114 HA HIS 114 -21.045 12.298 2.364 931 HB2 HIS 114 HB2 HIS 114 -22.706 13.329 3.948 932 HB3 HIS 114 HB1 HIS 114 -21.749 12.697 5.281 933 HD1 HIS 114 HD1 HIS 114 -20.030 14.228 6.172 934 HD2 HIS 114 HD2 HIS 114 -21.129 15.210 2.282 935 HE1 HIS 114 HE1 HIS 114 -18.821 16.372 5.645 936 HE2 HIS 114 HE2 HIS 114 -19.716 17.071 3.396 937 HA PRO 115 HA PRO 115 -17.667 10.146 4.503 938 HB2 PRO 115 HB2 PRO 115 -16.881 8.417 2.578 939 HB3 PRO 115 HB1 PRO 115 -18.201 8.048 3.691 940 HG2 PRO 115 HG2 PRO 115 -18.314 8.592 0.831 941 HG3 PRO 115 HG1 PRO 115 -19.578 7.957 1.894 942 HD2 PRO 115 HD2 PRO 115 -19.129 10.714 0.969 943 HD3 PRO 115 HD1 PRO 115 -20.587 9.989 1.686 944 HA PRO 116 HA PRO 116 -14.657 12.393 1.974 945 HB2 PRO 116 HB2 PRO 116 -13.881 14.126 3.946 946 HB3 PRO 116 HB1 PRO 116 -15.200 14.458 2.822 947 HG2 PRO 116 HG2 PRO 116 -15.344 13.970 5.666 948 HG3 PRO 116 HG1 PRO 116 -16.648 14.422 4.558 949 HD2 PRO 116 HD2 PRO 116 -15.903 11.760 5.591 950 HD3 PRO 116 HD1 PRO 116 -17.446 12.316 4.908 951 H VAL 117 HN VAL 117 -13.280 10.518 2.014 952 HA VAL 117 HA VAL 117 -11.574 10.419 4.422 953 HB VAL 117 HB VAL 117 -12.107 8.017 2.692 954 HG11 VAL 117 HG11 VAL 117 -10.252 7.488 3.887 955 HG12 VAL 117 HG12 VAL 117 -11.469 7.024 5.059 956 HG13 VAL 117 HG13 VAL 117 -10.644 8.575 5.207 957 HG21 VAL 117 HG21 VAL 117 -13.496 7.269 4.657 958 HG22 VAL 117 HG22 VAL 117 -14.235 8.437 3.563 959 HG23 VAL 117 HG23 VAL 117 -13.588 8.965 5.120 960 H ASN 118 HN ASN 118 -9.596 11.038 4.034 961 HA ASN 118 HA ASN 118 -8.186 10.008 1.696 962 HB2 ASN 118 HB2 ASN 118 -9.045 12.300 1.102 963 HB3 ASN 118 HB1 ASN 118 -8.092 12.951 2.429 964 HD21 ASN 118 HD21 ASN 118 -5.711 12.466 2.306 965 HD22 ASN 118 HD22 ASN 118 -4.980 12.475 0.740 966 H HIS 119 HN HIS 119 -6.748 8.779 2.879 967 HA HIS 119 HA HIS 119 -5.262 10.190 5.007 968 HB2 HIS 119 HB2 HIS 119 -7.002 8.512 5.823 969 HB3 HIS 119 HB1 HIS 119 -5.978 7.271 5.110 970 HD1 HIS 119 HD1 HIS 119 -5.209 6.118 7.213 971 HD2 HIS 119 HD2 HIS 119 -4.597 10.236 7.307 972 HE1 HIS 119 HE1 HIS 119 -3.784 6.551 9.241 973 HE2 HIS 119 HE2 HIS 119 -3.323 9.029 9.210 974 H LEU 120 HN LEU 120 -3.120 9.945 5.032 975 HA LEU 120 HA LEU 120 -1.819 7.805 3.529 976 HB2 LEU 120 HB2 LEU 120 -1.607 10.724 2.947 977 HB3 LEU 120 HB1 LEU 120 -0.167 9.741 2.797 978 HG LEU 120 HG LEU 120 -2.705 9.030 1.350 979 HD11 LEU 120 HD11 LEU 120 -0.784 10.136 -0.400 980 HD12 LEU 120 HD12 LEU 120 -1.043 11.303 0.898 981 HD13 LEU 120 HD13 LEU 120 -2.411 10.729 -0.058 982 HD21 LEU 120 HD21 LEU 120 -0.698 7.449 1.738 983 HD22 LEU 120 HD22 LEU 120 0.121 8.461 0.547 984 HD23 LEU 120 HD23 LEU 120 -1.358 7.603 0.109 985 H ARG 121 HN ARG 121 -0.071 7.021 4.563 986 HA ARG 121 HA ARG 121 1.158 8.615 6.696 987 HB2 ARG 121 HB2 ARG 121 1.050 6.643 8.229 988 HB3 ARG 121 HB1 ARG 121 -0.507 7.371 7.880 989 HG2 ARG 121 HG2 ARG 121 -1.075 5.188 7.676 990 HG3 ARG 121 HG1 ARG 121 -0.561 5.485 6.022 991 HD2 ARG 121 HD2 ARG 121 0.302 3.370 7.099 992 HD3 ARG 121 HD1 ARG 121 1.525 4.414 6.372 993 HE ARG 121 HE ARG 121 1.882 5.257 8.730 994 HH11 ARG 121 HH11 ARG 121 0.694 2.011 8.094 995 HH12 ARG 121 HH12 ARG 121 1.305 1.369 9.588 996 HH21 ARG 121 HH21 ARG 121 2.658 4.411 10.686 997 HH22 ARG 121 HH22 ARG 121 2.446 2.725 11.048 998 H CYS 122 HN CYS 122 3.322 8.215 7.026 999 HA CYS 122 HA CYS 122 4.554 6.574 4.941 1000 HB2 CYS 122 HB2 CYS 122 5.859 8.627 6.699 1001 HB3 CYS 122 HB1 CYS 122 6.578 7.842 5.308 1002 HG CYS 122 HG CYS 122 4.002 9.079 3.990 1003 H GLU 123 HN GLU 123 5.557 4.761 5.326 1004 HA GLU 123 HA GLU 123 6.295 3.985 8.057 1005 HB2 GLU 123 HB2 GLU 123 6.066 2.460 5.454 1006 HB3 GLU 123 HB1 GLU 123 6.718 1.753 6.929 1007 HG2 GLU 123 HG2 GLU 123 4.066 3.044 7.106 1008 HG3 GLU 123 HG1 GLU 123 4.160 1.511 6.232 1009 H LYS 124 HN LYS 124 8.472 3.009 8.353 1010 HA LYS 124 HA LYS 124 10.427 4.138 6.481 1011 HB2 LYS 124 HB2 LYS 124 10.224 5.678 8.349 1012 HB3 LYS 124 HB1 LYS 124 10.486 4.360 9.483 1013 HG2 LYS 124 HG2 LYS 124 12.760 4.055 8.434 1014 HG3 LYS 124 HG1 LYS 124 12.476 5.554 7.554 1015 HD2 LYS 124 HD2 LYS 124 13.742 6.058 9.476 1016 HD3 LYS 124 HD1 LYS 124 12.106 6.677 9.733 1017 HE2 LYS 124 HE2 LYS 124 11.541 4.913 11.166 1018 HE3 LYS 124 HE1 LYS 124 12.931 3.958 10.651 1019 HZ1 LYS 124 HZ1 LYS 124 14.385 5.526 11.770 1020 HZ2 LYS 124 HZ2 LYS 124 13.239 4.920 12.865 1021 HZ3 LYS 124 HZ3 LYS 124 13.058 6.484 12.225 1022 H LEU 125 HN LEU 125 11.917 2.755 5.866 1023 HA LEU 125 HA LEU 125 12.271 0.280 7.433 1024 HB2 LEU 125 HB2 LEU 125 12.771 0.661 4.487 1025 HB3 LEU 125 HB1 LEU 125 12.713 -0.850 5.363 1026 HG LEU 125 HG LEU 125 10.245 0.807 5.373 1027 HD11 LEU 125 HD11 LEU 125 10.837 1.008 3.049 1028 HD12 LEU 125 HD12 LEU 125 9.564 -0.206 3.203 1029 HD13 LEU 125 HD13 LEU 125 11.238 -0.710 2.966 1030 HD21 LEU 125 HD21 LEU 125 9.278 -1.516 5.074 1031 HD22 LEU 125 HD22 LEU 125 10.151 -1.222 6.581 1032 HD23 LEU 125 HD23 LEU 125 10.924 -2.121 5.276 1033 H THR 126 HN THR 126 14.104 0.621 8.610 1034 HA THR 126 HA THR 126 16.431 1.874 7.350 1035 HB THR 126 HB THR 126 16.482 0.813 10.145 1036 HG1 THR 126 HG1 THR 126 14.521 1.991 10.054 1037 HG21 THR 126 HG21 THR 126 18.408 1.898 8.858 1038 HG22 THR 126 HG22 THR 126 18.072 2.487 10.487 1039 HG23 THR 126 HG23 THR 126 17.532 3.412 9.084 1040 H PHE 127 HN PHE 127 17.928 0.672 6.411 1041 HA PHE 127 HA PHE 127 18.131 -2.165 7.163 1042 HB2 PHE 127 HB2 PHE 127 18.946 -0.780 4.599 1043 HB3 PHE 127 HB1 PHE 127 19.151 -2.499 4.932 1044 HD1 PHE 127 HD1 PHE 127 17.225 -3.992 5.015 1045 HD2 PHE 127 HD2 PHE 127 16.787 0.151 4.146 1046 HE1 PHE 127 HE1 PHE 127 14.930 -4.400 4.233 1047 HE2 PHE 127 HE2 PHE 127 14.497 -0.252 3.368 1048 HZ PHE 127 HZ PHE 127 13.562 -2.526 3.413 1049 H ASN 128 HN ASN 128 19.710 -2.564 8.502 1050 HA ASN 128 HA ASN 128 21.910 -0.713 8.802 1051 HB2 ASN 128 HB2 ASN 128 21.305 -3.299 10.245 1052 HB3 ASN 128 HB1 ASN 128 22.578 -2.163 10.677 1053 HD21 ASN 128 HD21 ASN 128 19.164 -2.753 10.612 1054 HD22 ASN 128 HD22 ASN 128 18.719 -1.474 11.694 1055 H ASN 129 HN ASN 129 23.652 -0.829 7.614 1056 HA ASN 129 HA ASN 129 25.454 -1.573 6.473 1057 HB2 ASN 129 HB2 ASN 129 25.099 -4.022 8.212 1058 HB3 ASN 129 HB1 ASN 129 26.539 -3.645 7.271 1059 HD21 ASN 129 HD21 ASN 129 24.739 -2.982 10.127 1060 HD22 ASN 129 HD22 ASN 129 25.875 -1.900 10.850 1061 HA PRO 130 HA PRO 130 23.045 -4.315 3.649 1062 HB2 PRO 130 HB2 PRO 130 22.248 -2.519 1.816 1063 HB3 PRO 130 HB1 PRO 130 21.358 -2.772 3.321 1064 HG2 PRO 130 HG2 PRO 130 23.117 -0.528 2.521 1065 HG3 PRO 130 HG1 PRO 130 21.745 -0.542 3.638 1066 HD2 PRO 130 HD2 PRO 130 24.507 -0.637 4.296 1067 HD3 PRO 130 HD1 PRO 130 23.131 -0.806 5.399 1068 H THR 131 HN THR 131 23.546 -4.895 1.428 1069 HA THR 131 HA THR 131 26.246 -4.604 0.671 1070 HB THR 131 HB THR 131 25.007 -6.536 -0.109 1071 HG1 THR 131 HG1 THR 131 26.455 -6.290 -1.655 1072 HG21 THR 131 HG21 THR 131 23.179 -6.391 -1.690 1073 HG22 THR 131 HG22 THR 131 23.317 -4.633 -1.734 1074 HG23 THR 131 HG23 THR 131 22.791 -5.439 -0.257 1075 H GLU 132 HN GLU 132 27.053 -3.521 -1.343 1076 HA GLU 132 HA GLU 132 26.404 -0.788 -1.210 1077 HB2 GLU 132 HB2 GLU 132 28.582 -1.851 -2.075 1078 HB3 GLU 132 HB1 GLU 132 27.728 -2.021 -3.605 1079 HG2 GLU 132 HG2 GLU 132 29.031 -0.026 -3.667 1080 HG3 GLU 132 HG1 GLU 132 27.324 0.417 -3.598 1081 H ASP 133 HN ASP 133 25.468 -3.308 -3.499 1082 HA ASP 133 HA ASP 133 24.233 -1.762 -5.447 1083 HB2 ASP 133 HB2 ASP 133 23.497 -4.528 -4.472 1084 HB3 ASP 133 HB1 ASP 133 22.816 -3.784 -5.910 1085 H PHE 134 HN PHE 134 22.911 -3.045 -2.431 1086 HA PHE 134 HA PHE 134 20.256 -2.172 -2.924 1087 HB2 PHE 134 HB2 PHE 134 20.999 -3.990 -1.260 1088 HB3 PHE 134 HB1 PHE 134 21.417 -2.658 -0.184 1089 HD1 PHE 134 HD1 PHE 134 18.573 -2.735 -2.523 1090 HD2 PHE 134 HD2 PHE 134 19.807 -2.967 1.540 1091 HE1 PHE 134 HE1 PHE 134 16.255 -2.543 -1.817 1092 HE2 PHE 134 HE2 PHE 134 17.464 -2.791 2.254 1093 HZ PHE 134 HZ PHE 134 15.689 -2.575 0.567 1094 H ARG 135 HN ARG 135 22.852 -0.944 -0.846 1095 HA ARG 135 HA ARG 135 21.576 1.302 0.167 1096 HB2 ARG 135 HB2 ARG 135 23.682 0.610 1.071 1097 HB3 ARG 135 HB1 ARG 135 24.481 0.815 -0.485 1098 HG2 ARG 135 HG2 ARG 135 24.020 3.236 -0.361 1099 HG3 ARG 135 HG1 ARG 135 23.358 2.983 1.262 1100 HD2 ARG 135 HD2 ARG 135 26.203 2.385 0.404 1101 HD3 ARG 135 HD1 ARG 135 25.663 3.746 1.391 1102 HE ARG 135 HE ARG 135 25.083 2.150 3.121 1103 HH11 ARG 135 HH11 ARG 135 27.132 1.006 0.520 1104 HH12 ARG 135 HH12 ARG 135 27.864 -0.250 1.482 1105 HH21 ARG 135 HH21 ARG 135 26.057 0.516 4.393 1106 HH22 ARG 135 HH22 ARG 135 27.241 -0.539 3.685 1107 H ARG 136 HN ARG 136 23.501 0.949 -2.743 1108 HA ARG 136 HA ARG 136 23.584 3.405 -3.863 1109 HB2 ARG 136 HB2 ARG 136 23.928 0.785 -4.646 1110 HB3 ARG 136 HB1 ARG 136 22.730 1.446 -5.719 1111 HG2 ARG 136 HG2 ARG 136 24.200 3.138 -6.491 1112 HG3 ARG 136 HG1 ARG 136 25.397 2.707 -5.261 1113 HD2 ARG 136 HD2 ARG 136 26.058 1.738 -7.371 1114 HD3 ARG 136 HD1 ARG 136 25.556 0.459 -6.261 1115 HE ARG 136 HE ARG 136 23.693 1.500 -8.290 1116 HH11 ARG 136 HH11 ARG 136 25.556 -1.141 -6.938 1117 HH12 ARG 136 HH12 ARG 136 24.664 -2.373 -7.786 1118 HH21 ARG 136 HH21 ARG 136 22.528 -0.100 -9.410 1119 HH22 ARG 136 HH22 ARG 136 22.961 -1.780 -9.220 1120 H LYS 137 HN LYS 137 20.958 1.070 -4.284 1121 HA LYS 137 HA LYS 137 19.322 2.795 -5.824 1122 HB2 LYS 137 HB2 LYS 137 18.556 0.381 -4.176 1123 HB3 LYS 137 HB1 LYS 137 17.494 1.195 -5.319 1124 HG2 LYS 137 HG2 LYS 137 18.976 0.611 -7.149 1125 HG3 LYS 137 HG1 LYS 137 20.104 -0.140 -6.019 1126 HD2 LYS 137 HD2 LYS 137 18.335 -1.745 -5.373 1127 HD3 LYS 137 HD1 LYS 137 17.271 -1.019 -6.582 1128 HE2 LYS 137 HE2 LYS 137 18.613 -1.752 -8.361 1129 HE3 LYS 137 HE1 LYS 137 19.966 -2.113 -7.303 1130 HZ1 LYS 137 HZ1 LYS 137 17.456 -3.632 -7.627 1131 HZ2 LYS 137 HZ2 LYS 137 18.463 -3.855 -6.288 1132 HZ3 LYS 137 HZ3 LYS 137 19.049 -4.165 -7.846 1133 H LEU 138 HN LEU 138 19.277 1.907 -2.417 1134 HA LEU 138 HA LEU 138 17.026 3.321 -1.590 1135 HB2 LEU 138 HB2 LEU 138 19.530 2.906 0.021 1136 HB3 LEU 138 HB1 LEU 138 17.924 3.212 0.643 1137 HG LEU 138 HG LEU 138 18.917 0.710 -0.699 1138 HD11 LEU 138 HD11 LEU 138 19.477 1.068 1.691 1139 HD12 LEU 138 HD12 LEU 138 18.448 -0.338 1.402 1140 HD13 LEU 138 HD13 LEU 138 17.748 1.151 2.037 1141 HD21 LEU 138 HD21 LEU 138 16.114 1.454 0.079 1142 HD22 LEU 138 HD22 LEU 138 16.641 -0.182 -0.291 1143 HD23 LEU 138 HD23 LEU 138 16.707 1.069 -1.533 1144 H LEU 139 HN LEU 139 20.336 4.416 -2.038 1145 HA LEU 139 HA LEU 139 19.888 6.992 -0.856 1146 HB2 LEU 139 HB2 LEU 139 22.167 5.926 -2.512 1147 HB3 LEU 139 HB1 LEU 139 22.167 7.481 -1.702 1148 HG LEU 139 HG LEU 139 21.970 4.802 -0.333 1149 HD11 LEU 139 HD11 LEU 139 24.158 4.872 -1.024 1150 HD12 LEU 139 HD12 LEU 139 24.250 5.659 0.559 1151 HD13 LEU 139 HD13 LEU 139 24.249 6.636 -0.910 1152 HD21 LEU 139 HD21 LEU 139 20.794 6.607 0.824 1153 HD22 LEU 139 HD22 LEU 139 22.278 7.563 0.827 1154 HD23 LEU 139 HD23 LEU 139 22.203 6.044 1.723 1155 H LYS 140 HN LYS 140 19.710 5.653 -4.057 1156 HA LYS 140 HA LYS 140 19.746 8.118 -5.467 1157 HB2 LYS 140 HB2 LYS 140 19.493 5.324 -6.098 1158 HB3 LYS 140 HB1 LYS 140 18.295 6.270 -6.961 1159 HG2 LYS 140 HG2 LYS 140 19.964 7.611 -7.987 1160 HG3 LYS 140 HG1 LYS 140 21.226 6.896 -6.979 1161 HD2 LYS 140 HD2 LYS 140 19.531 5.280 -8.866 1162 HD3 LYS 140 HD1 LYS 140 21.063 6.004 -9.341 1163 HE2 LYS 140 HE2 LYS 140 20.693 4.116 -7.028 1164 HE3 LYS 140 HE1 LYS 140 21.191 3.630 -8.644 1165 HZ1 LYS 140 HZ1 LYS 140 23.126 5.089 -8.425 1166 HZ2 LYS 140 HZ2 LYS 140 23.104 3.902 -7.228 1167 HZ3 LYS 140 HZ3 LYS 140 22.655 5.490 -6.846 1168 H ALA 141 HN ALA 141 17.371 6.300 -3.801 1169 HA ALA 141 HA ALA 141 14.974 6.981 -4.908 1170 HB1 ALA 141 HB1 ALA 141 13.997 6.373 -2.904 1171 HB2 ALA 141 HB2 ALA 141 15.308 7.053 -1.942 1172 HB3 ALA 141 HB3 ALA 141 15.558 5.555 -2.838 1173 H1 GLY 212 HT1 GLY 212 -21.990 5.137 14.981 1174 H2 GLY 212 HT2 GLY 212 -21.652 5.372 16.623 1175 H3 GLY 212 HT3 GLY 212 -22.644 4.087 16.138 1176 HA2 GLY 212 HA1 GLY 212 -20.498 3.217 16.683 1177 HA3 GLY 212 HA2 GLY 212 -20.768 3.086 14.951 1178 H GLY 213 HN GLY 213 -19.870 4.842 13.598 1179 HA2 GLY 213 HA2 GLY 213 -18.153 6.827 14.266 1180 HA3 GLY 213 HA1 GLY 213 -17.151 5.387 14.414 1181 H LYS 214 HN LYS 214 -17.147 3.920 12.500 1182 HA LYS 214 HA LYS 214 -17.162 5.532 10.037 1183 HB2 LYS 214 HB2 LYS 214 -15.775 2.889 10.527 1184 HB3 LYS 214 HB1 LYS 214 -15.595 3.923 9.118 1185 HG2 LYS 214 HG2 LYS 214 -14.741 4.615 11.922 1186 HG3 LYS 214 HG1 LYS 214 -13.680 4.079 10.621 1187 HD2 LYS 214 HD2 LYS 214 -14.317 6.069 9.313 1188 HD3 LYS 214 HD1 LYS 214 -15.326 6.610 10.658 1189 HE2 LYS 214 HE2 LYS 214 -13.345 6.691 12.100 1190 HE3 LYS 214 HE1 LYS 214 -12.343 6.162 10.751 1191 HZ1 LYS 214 HZ1 LYS 214 -13.840 8.719 10.967 1192 HZ2 LYS 214 HZ2 LYS 214 -13.054 8.202 9.559 1193 HZ3 LYS 214 HZ3 LYS 214 -12.157 8.515 10.964 1194 H ALA 215 HN ALA 215 -17.397 3.826 8.063 1195 HA ALA 215 HA ALA 215 -20.098 2.940 8.100 1196 HB1 ALA 215 HB1 ALA 215 -19.558 2.027 5.861 1197 HB2 ALA 215 HB2 ALA 215 -17.858 2.403 6.141 1198 HB3 ALA 215 HB3 ALA 215 -19.046 3.704 6.052 1199 HA PRO 216 HA PRO 216 -19.871 -1.306 9.403 1200 HB2 PRO 216 HB2 PRO 216 -20.727 -2.390 6.818 1201 HB3 PRO 216 HB1 PRO 216 -21.519 -2.462 8.380 1202 HG2 PRO 216 HG2 PRO 216 -22.353 -0.906 6.290 1203 HG3 PRO 216 HG1 PRO 216 -22.741 -0.599 7.989 1204 HD2 PRO 216 HD2 PRO 216 -20.886 0.814 6.198 1205 HD3 PRO 216 HD1 PRO 216 -21.670 1.375 7.682 1206 H ARG 217 HN ARG 217 -18.618 -3.226 9.198 1207 HA ARG 217 HA ARG 217 -16.609 -3.197 7.067 1208 HB2 ARG 217 HB2 ARG 217 -16.016 -3.303 10.033 1209 HB3 ARG 217 HB1 ARG 217 -14.840 -3.691 8.785 1210 HG2 ARG 217 HG2 ARG 217 -15.005 -1.432 7.901 1211 HG3 ARG 217 HG1 ARG 217 -16.221 -1.035 9.114 1212 HD2 ARG 217 HD2 ARG 217 -14.030 -0.190 9.757 1213 HD3 ARG 217 HD1 ARG 217 -14.588 -1.421 10.887 1214 HE ARG 217 HE ARG 217 -13.076 -2.985 9.673 1215 HH11 ARG 217 HH11 ARG 217 -12.504 0.464 9.539 1216 HH12 ARG 217 HH12 ARG 217 -10.781 0.314 9.345 1217 HH21 ARG 217 HH21 ARG 217 -10.797 -3.199 9.443 1218 HH22 ARG 217 HH22 ARG 217 -9.814 -1.762 9.332 1219 H1 KCR 218 HN KCR 218 -15.686 -5.195 6.598 1220 H4 KCR 218 HA KCR 218 -17.479 -7.385 7.219 1221 H5 KCR 218 HB1 KCR 218 -16.237 -8.601 5.463 1222 H6 KCR 218 HB2 KCR 218 -15.134 -7.239 5.317 1223 H7 KCR 218 HG1 KCR 218 -17.001 -5.812 4.633 1224 H8 KCR 218 HG2 KCR 218 -18.089 -7.196 4.754 1225 H9 KCR 218 HD1 KCR 218 -16.929 -8.340 2.995 1226 H10 KCR 218 HD2 KCR 218 -15.683 -7.090 2.945 1227 H11 KCR 218 HE1 KCR 218 -17.333 -5.451 2.236 1228 H12 KCR 218 HE2 KCR 218 -18.605 -6.670 2.328 1229 H13 KCR 218 HZ1 KCR 218 -17.301 -7.868 0.544 1230 H14 KCR 218 HH1 KCR 218 -16.765 -7.633 -1.781 1231 H15 KCR 218 HJ1 KCR 218 -16.945 -4.653 -2.561 1232 H16 KCR 218 HF3 KCR 218 -17.462 -6.196 -4.698 1233 H17 KCR 218 HF1 KCR 218 -15.785 -5.681 -4.532 1234 H18 KCR 218 HF2 KCR 218 -16.269 -7.292 -4.000 1235 H GLN 219 HN GLN 219 -17.022 -7.981 9.289 1236 HA GLN 219 HA GLN 219 -14.331 -8.697 10.055 1237 HB2 GLN 219 HB2 GLN 219 -15.272 -9.315 12.198 1238 HB3 GLN 219 HB1 GLN 219 -15.909 -7.755 11.710 1239 HG2 GLN 219 HG2 GLN 219 -17.400 -10.345 11.362 1240 HG3 GLN 219 HG1 GLN 219 -17.550 -9.313 12.780 1241 HE21 GLN 219 HE21 GLN 219 -18.415 -9.775 9.480 1242 HE22 GLN 219 HE22 GLN 219 -19.502 -8.431 9.354 1243 H LEU 220 HN LEU 220 -16.597 -10.100 8.162 1244 HA LEU 220 HA LEU 220 -16.075 -12.842 8.993 1245 HB2 LEU 220 HB2 LEU 220 -17.787 -11.724 6.771 1246 HB3 LEU 220 HB1 LEU 220 -17.627 -13.430 7.140 1247 HG LEU 220 HG LEU 220 -18.811 -11.334 8.964 1248 HD11 LEU 220 HD11 LEU 220 -20.246 -11.867 7.069 1249 HD12 LEU 220 HD12 LEU 220 -20.912 -12.514 8.569 1250 HD13 LEU 220 HD13 LEU 220 -20.099 -13.588 7.429 1251 HD21 LEU 220 HD21 LEU 220 -17.675 -13.072 10.229 1252 HD22 LEU 220 HD22 LEU 220 -18.532 -14.316 9.318 1253 HD23 LEU 220 HD23 LEU 220 -19.424 -13.233 10.386 1254 H ALA 221 HN ALA 221 -14.434 -13.936 8.214 1255 HA ALA 221 HA ALA 221 -13.162 -13.008 5.729 1256 HB1 ALA 221 HB1 ALA 221 -11.712 -13.034 7.698 1257 HB2 ALA 221 HB2 ALA 221 -11.171 -14.199 6.490 1258 HB3 ALA 221 HB3 ALA 221 -12.041 -14.751 7.921 1259 H THR 222 HN THR 222 -13.960 -16.002 7.476 1260 HA THR 222 HA THR 222 -14.364 -17.309 4.870 1261 HB THR 222 HB THR 222 -13.473 -19.414 5.909 1262 HG1 THR 222 HG1 THR 222 -12.163 -17.803 7.828 1263 HG21 THR 222 HG21 THR 222 -11.529 -17.109 5.733 1264 HG22 THR 222 HG22 THR 222 -12.097 -18.091 4.381 1265 HG23 THR 222 HG23 THR 222 -11.111 -18.820 5.650 1266 H LYS 223 HN LYS 223 -16.101 -18.650 4.726 1267 HA LYS 223 HA LYS 223 -18.034 -18.522 6.890 1268 HB2 LYS 223 HB2 LYS 223 -18.904 -18.132 4.689 1269 HB3 LYS 223 HB1 LYS 223 -18.163 -19.601 4.071 1270 HG2 LYS 223 HG2 LYS 223 -19.666 -20.943 5.453 1271 HG3 LYS 223 HG1 LYS 223 -20.404 -19.469 6.081 1272 HD2 LYS 223 HD2 LYS 223 -20.322 -20.122 3.147 1273 HD3 LYS 223 HD1 LYS 223 -21.636 -20.646 4.202 1274 HE2 LYS 223 HE2 LYS 223 -20.780 -17.777 3.884 1275 HE3 LYS 223 HE1 LYS 223 -22.071 -18.526 2.946 1276 HZ1 LYS 223 HZ1 LYS 223 -22.004 -18.231 5.904 1277 HZ2 LYS 223 HZ2 LYS 223 -23.222 -19.019 5.031 1278 HZ3 LYS 223 HZ3 LYS 223 -22.979 -17.353 4.829 1279 H ALA 224 HN ALA 224 -15.991 -20.855 5.272 1280 HA ALA 224 HA ALA 224 -17.063 -23.049 6.857 1281 HB1 ALA 224 HB1 ALA 224 -16.565 -23.438 4.490 1282 HB2 ALA 224 HB2 ALA 224 -15.589 -24.470 5.536 1283 HB3 ALA 224 HB3 ALA 224 -14.871 -23.045 4.784 Start of MODEL 4 1 H1 GLY 1 HT1 GLY 1 39.186 -5.486 14.748 2 H2 GLY 1 HT2 GLY 1 39.117 -7.160 14.500 3 H3 GLY 1 HT3 GLY 1 38.431 -6.484 15.892 4 HA2 GLY 1 HA1 GLY 1 37.512 -6.065 13.103 5 HA3 GLY 1 HA2 GLY 1 36.714 -7.062 14.312 6 H SER 2 HN SER 2 36.388 -4.286 12.775 7 HA SER 2 HA SER 2 34.925 -3.099 15.012 8 HB2 SER 2 HB2 SER 2 35.697 -0.815 14.186 9 HB3 SER 2 HB1 SER 2 36.909 -1.785 15.022 10 HG SER 2 HG SER 2 37.357 -2.514 12.683 11 H HIS 3 HN HIS 3 33.074 -3.961 14.021 12 HA HIS 3 HA HIS 3 32.343 -2.777 11.423 13 HB2 HIS 3 HB2 HIS 3 32.393 -5.269 11.568 14 HB3 HIS 3 HB1 HIS 3 31.151 -5.193 12.809 15 HD1 HIS 3 HD1 HIS 3 31.676 -4.603 9.124 16 HD2 HIS 3 HD2 HIS 3 28.564 -4.946 11.866 17 HE1 HIS 3 HE1 HIS 3 29.570 -4.745 7.751 18 HE2 HIS 3 HE2 HIS 3 27.723 -5.142 9.425 19 H MET 4 HN MET 4 31.819 -2.559 14.720 20 HA MET 4 HA MET 4 29.087 -1.523 14.441 21 HB2 MET 4 HB2 MET 4 29.575 -3.157 16.249 22 HB3 MET 4 HB1 MET 4 30.728 -2.027 16.936 23 HG2 MET 4 HG2 MET 4 28.634 -1.983 18.148 24 HG3 MET 4 HG1 MET 4 28.934 -0.435 17.358 25 HE1 MET 4 HE1 MET 4 25.021 -0.799 17.278 26 HE2 MET 4 HE2 MET 4 26.378 0.198 17.803 27 HE3 MET 4 HE3 MET 4 26.102 -1.377 18.546 28 H ALA 5 HN ALA 5 32.215 -0.466 14.296 29 HA ALA 5 HA ALA 5 32.014 2.036 15.647 30 HB1 ALA 5 HB1 ALA 5 34.082 2.607 14.484 31 HB2 ALA 5 HB2 ALA 5 33.895 1.199 13.438 32 HB3 ALA 5 HB3 ALA 5 34.176 0.983 15.165 33 H SER 6 HN SER 6 31.846 1.089 12.225 34 HA SER 6 HA SER 6 30.379 3.588 11.700 35 HB2 SER 6 HB2 SER 6 32.555 3.420 10.510 36 HB3 SER 6 HB1 SER 6 32.006 1.926 9.754 37 HG SER 6 HG SER 6 30.640 4.411 9.498 38 H SER 7 HN SER 7 28.321 2.925 12.009 39 HA SER 7 HA SER 7 27.386 0.590 10.480 40 HB2 SER 7 HB2 SER 7 25.963 2.030 12.739 41 HB3 SER 7 HB1 SER 7 25.528 0.477 12.021 42 HG SER 7 HG SER 7 27.262 -0.470 12.973 43 H CYS 8 HN CYS 8 26.601 1.185 8.556 44 HA CYS 8 HA CYS 8 25.330 3.814 8.304 45 HB2 CYS 8 HB2 CYS 8 27.108 3.378 6.733 46 HB3 CYS 8 HB1 CYS 8 26.341 1.892 6.203 47 HG CYS 8 HG CYS 8 24.504 4.705 5.852 48 H ALA 9 HN ALA 9 23.257 3.733 8.744 49 HA ALA 9 HA ALA 9 21.698 1.473 7.696 50 HB1 ALA 9 HB1 ALA 9 20.046 1.989 9.356 51 HB2 ALA 9 HB2 ALA 9 20.922 3.439 9.840 52 HB3 ALA 9 HB3 ALA 9 21.618 1.846 10.138 53 H VAL 10 HN VAL 10 20.683 1.885 5.868 54 HA VAL 10 HA VAL 10 20.020 4.654 5.190 55 HB VAL 10 HB VAL 10 19.906 2.221 3.401 56 HG11 VAL 10 HG11 VAL 10 18.539 3.815 2.435 57 HG12 VAL 10 HG12 VAL 10 20.092 4.096 1.645 58 HG13 VAL 10 HG13 VAL 10 19.562 5.156 2.952 59 HG21 VAL 10 HG21 VAL 10 22.175 2.357 3.798 60 HG22 VAL 10 HG22 VAL 10 22.143 4.108 3.999 61 HG23 VAL 10 HG23 VAL 10 21.994 3.403 2.390 62 H GLN 11 HN GLN 11 18.021 5.350 5.429 63 HA GLN 11 HA GLN 11 15.919 3.354 5.941 64 HB2 GLN 11 HB2 GLN 11 15.759 6.313 6.550 65 HB3 GLN 11 HB1 GLN 11 14.754 5.031 7.187 66 HG2 GLN 11 HG2 GLN 11 16.268 4.440 8.795 67 HG3 GLN 11 HG1 GLN 11 17.640 4.979 7.827 68 HE21 GLN 11 HE21 GLN 11 16.447 7.557 7.243 69 HE22 GLN 11 HE22 GLN 11 16.523 8.454 8.716 70 H VAL 12 HN VAL 12 14.319 3.096 4.590 71 HA VAL 12 HA VAL 12 13.842 5.199 2.597 72 HB VAL 12 HB VAL 12 12.818 3.357 1.221 73 HG11 VAL 12 HG11 VAL 12 15.295 4.211 1.161 74 HG12 VAL 12 HG12 VAL 12 14.852 2.761 0.265 75 HG13 VAL 12 HG13 VAL 12 15.658 2.621 1.827 76 HG21 VAL 12 HG21 VAL 12 12.430 1.835 3.098 77 HG22 VAL 12 HG22 VAL 12 14.167 1.557 3.211 78 HG23 VAL 12 HG23 VAL 12 13.284 1.072 1.760 79 H LYS 13 HN LYS 13 11.876 6.153 2.605 80 HA LYS 13 HA LYS 13 9.900 5.068 4.459 81 HB2 LYS 13 HB2 LYS 13 10.459 7.792 3.390 82 HB3 LYS 13 HB1 LYS 13 8.814 7.407 3.866 83 HG2 LYS 13 HG2 LYS 13 9.772 6.661 6.079 84 HG3 LYS 13 HG1 LYS 13 11.274 7.437 5.579 85 HD2 LYS 13 HD2 LYS 13 10.056 9.552 5.268 86 HD3 LYS 13 HD1 LYS 13 8.578 8.764 5.826 87 HE2 LYS 13 HE2 LYS 13 9.391 9.865 7.720 88 HE3 LYS 13 HE1 LYS 13 9.898 8.189 7.930 89 HZ1 LYS 13 HZ1 LYS 13 11.632 10.338 6.841 90 HZ2 LYS 13 HZ2 LYS 13 12.099 8.748 7.211 91 HZ3 LYS 13 HZ3 LYS 13 11.650 9.809 8.453 92 H LEU 14 HN LEU 14 8.226 4.023 3.769 93 HA LEU 14 HA LEU 14 7.225 4.537 1.047 94 HB2 LEU 14 HB2 LEU 14 6.873 2.101 2.780 95 HB3 LEU 14 HB1 LEU 14 6.107 2.332 1.226 96 HG LEU 14 HG LEU 14 9.097 2.173 1.648 97 HD11 LEU 14 HD11 LEU 14 7.171 0.123 0.585 98 HD12 LEU 14 HD12 LEU 14 7.964 0.061 2.159 99 HD13 LEU 14 HD13 LEU 14 8.923 -0.045 0.681 100 HD21 LEU 14 HD21 LEU 14 7.547 1.934 -0.918 101 HD22 LEU 14 HD22 LEU 14 9.289 2.125 -0.698 102 HD23 LEU 14 HD23 LEU 14 8.202 3.467 -0.339 103 H GLU 15 HN GLU 15 5.040 4.898 0.798 104 HA GLU 15 HA GLU 15 3.775 5.884 3.261 105 HB2 GLU 15 HB2 GLU 15 4.513 7.626 1.697 106 HB3 GLU 15 HB1 GLU 15 3.546 6.903 0.423 107 HG2 GLU 15 HG2 GLU 15 1.520 7.470 1.547 108 HG3 GLU 15 HG1 GLU 15 2.404 8.004 2.976 109 H LEU 16 HN LEU 16 1.924 5.046 3.849 110 HA LEU 16 HA LEU 16 0.371 3.380 1.998 111 HB2 LEU 16 HB2 LEU 16 0.296 3.774 4.974 112 HB3 LEU 16 HB1 LEU 16 -1.034 3.021 4.134 113 HG LEU 16 HG LEU 16 0.195 1.256 5.016 114 HD11 LEU 16 HD11 LEU 16 1.537 1.225 2.401 115 HD12 LEU 16 HD12 LEU 16 -0.222 1.337 2.415 116 HD13 LEU 16 HD13 LEU 16 0.583 -0.019 3.205 117 HD21 LEU 16 HD21 LEU 16 2.742 2.334 3.898 118 HD22 LEU 16 HD22 LEU 16 2.529 1.045 5.073 119 HD23 LEU 16 HD23 LEU 16 2.192 2.718 5.523 120 H GLY 17 HN GLY 17 -1.762 3.892 1.517 121 HA2 GLY 17 HA2 GLY 17 -2.979 6.227 2.710 122 HA3 GLY 17 HA1 GLY 17 -2.475 6.448 1.036 123 H HIS 18 HN HIS 18 -5.063 6.755 1.769 124 HA HIS 18 HA HIS 18 -6.263 5.217 -0.246 125 HB2 HIS 18 HB2 HIS 18 -7.206 3.448 0.789 126 HB3 HIS 18 HB1 HIS 18 -6.176 3.798 2.169 127 HD1 HIS 18 HD1 HIS 18 -7.309 5.211 4.117 128 HD2 HIS 18 HD2 HIS 18 -9.903 3.775 1.218 129 HE1 HIS 18 HE1 HIS 18 -9.608 5.417 5.102 130 HE2 HIS 18 HE2 HIS 18 -11.127 4.336 3.423 131 H ARG 19 HN ARG 19 -8.239 5.991 -0.809 132 HA ARG 19 HA ARG 19 -9.405 8.103 0.883 133 HB2 ARG 19 HB2 ARG 19 -9.391 8.020 -2.146 134 HB3 ARG 19 HB1 ARG 19 -10.141 9.244 -1.154 135 HG2 ARG 19 HG2 ARG 19 -8.026 10.046 -0.405 136 HG3 ARG 19 HG1 ARG 19 -7.183 8.724 -1.213 137 HD2 ARG 19 HD2 ARG 19 -8.191 9.549 -3.363 138 HD3 ARG 19 HD1 ARG 19 -8.742 10.967 -2.476 139 HE ARG 19 HE ARG 19 -6.084 10.909 -1.957 140 HH11 ARG 19 HH11 ARG 19 -7.977 10.808 -4.892 141 HH12 ARG 19 HH12 ARG 19 -6.779 11.634 -5.849 142 HH21 ARG 19 HH21 ARG 19 -4.476 11.984 -3.226 143 HH22 ARG 19 HH22 ARG 19 -4.803 12.296 -4.907 144 H ALA 20 HN ALA 20 -11.767 8.236 0.667 145 HA ALA 20 HA ALA 20 -13.025 5.912 -0.574 146 HB1 ALA 20 HB1 ALA 20 -13.014 4.877 1.437 147 HB2 ALA 20 HB2 ALA 20 -14.421 5.901 1.716 148 HB3 ALA 20 HB3 ALA 20 -12.841 6.389 2.330 149 H GLN 21 HN GLN 21 -14.981 6.333 -1.402 150 HA GLN 21 HA GLN 21 -16.514 8.619 -0.405 151 HB2 GLN 21 HB2 GLN 21 -16.946 9.440 -2.638 152 HB3 GLN 21 HB1 GLN 21 -15.206 9.349 -2.398 153 HG2 GLN 21 HG2 GLN 21 -14.916 7.790 -3.951 154 HG3 GLN 21 HG1 GLN 21 -16.430 6.970 -3.589 155 HE21 GLN 21 HE21 GLN 21 -18.330 7.690 -4.553 156 HE22 GLN 21 HE22 GLN 21 -18.314 8.699 -5.958 157 H VAL 22 HN VAL 22 -18.780 8.403 -0.795 158 HA VAL 22 HA VAL 22 -19.536 5.683 -1.595 159 HB VAL 22 HB VAL 22 -20.224 6.294 0.703 160 HG11 VAL 22 HG11 VAL 22 -20.623 8.626 0.569 161 HG12 VAL 22 HG12 VAL 22 -22.164 7.856 0.946 162 HG13 VAL 22 HG13 VAL 22 -21.832 8.411 -0.695 163 HG21 VAL 22 HG21 VAL 22 -22.442 5.435 0.527 164 HG22 VAL 22 HG22 VAL 22 -21.453 4.661 -0.703 165 HG23 VAL 22 HG23 VAL 22 -22.569 5.952 -1.148 166 H ARG 23 HN ARG 23 -20.728 5.376 -3.360 167 HA ARG 23 HA ARG 23 -21.729 7.712 -4.806 168 HB2 ARG 23 HB2 ARG 23 -22.599 5.584 -6.287 169 HB3 ARG 23 HB1 ARG 23 -21.036 6.366 -6.494 170 HG2 ARG 23 HG2 ARG 23 -19.883 4.648 -5.610 171 HG3 ARG 23 HG1 ARG 23 -21.164 4.216 -4.481 172 HD2 ARG 23 HD2 ARG 23 -20.878 2.471 -6.135 173 HD3 ARG 23 HD1 ARG 23 -22.446 3.246 -6.341 174 HE ARG 23 HE ARG 23 -21.588 4.341 -8.295 175 HH11 ARG 23 HH11 ARG 23 -19.416 1.973 -6.928 176 HH12 ARG 23 HH12 ARG 23 -18.682 1.564 -8.449 177 HH21 ARG 23 HH21 ARG 23 -20.647 3.801 -10.320 178 HH22 ARG 23 HH22 ARG 23 -19.378 2.608 -10.381 179 H LYS 24 HN LYS 24 -23.844 8.246 -4.959 180 HA LYS 24 HA LYS 24 -25.519 7.367 -2.830 181 HB2 LYS 24 HB2 LYS 24 -25.396 9.679 -3.973 182 HB3 LYS 24 HB1 LYS 24 -26.481 8.985 -5.170 183 HG2 LYS 24 HG2 LYS 24 -27.800 10.154 -3.568 184 HG3 LYS 24 HG1 LYS 24 -28.046 8.422 -3.315 185 HD2 LYS 24 HD2 LYS 24 -26.381 8.485 -1.492 186 HD3 LYS 24 HD1 LYS 24 -26.239 10.229 -1.714 187 HE2 LYS 24 HE2 LYS 24 -27.721 9.764 0.133 188 HE3 LYS 24 HE1 LYS 24 -28.637 10.464 -1.202 189 HZ1 LYS 24 HZ1 LYS 24 -28.471 7.549 -0.643 190 HZ2 LYS 24 HZ2 LYS 24 -29.470 8.312 -1.783 191 HZ3 LYS 24 HZ3 LYS 24 -29.737 8.547 -0.124 192 H LYS 25 HN LYS 25 -24.863 6.088 -5.809 193 HA LYS 25 HA LYS 25 -27.214 4.349 -5.638 194 HB2 LYS 25 HB2 LYS 25 -27.371 6.145 -7.483 195 HB3 LYS 25 HB1 LYS 25 -26.099 5.245 -8.293 196 HG2 LYS 25 HG2 LYS 25 -28.698 3.991 -7.460 197 HG3 LYS 25 HG1 LYS 25 -28.457 4.759 -9.029 198 HD2 LYS 25 HD2 LYS 25 -26.672 3.203 -9.524 199 HD3 LYS 25 HD1 LYS 25 -26.832 2.476 -7.928 200 HE2 LYS 25 HE2 LYS 25 -27.987 1.049 -9.412 201 HE3 LYS 25 HE1 LYS 25 -29.213 1.960 -8.529 202 HZ1 LYS 25 HZ1 LYS 25 -29.697 1.802 -10.904 203 HZ2 LYS 25 HZ2 LYS 25 -28.251 2.606 -11.264 204 HZ3 LYS 25 HZ3 LYS 25 -29.481 3.412 -10.417 205 HA PRO 26 HA PRO 26 -23.684 1.528 -5.342 206 HB2 PRO 26 HB2 PRO 26 -25.941 -0.387 -5.274 207 HB3 PRO 26 HB1 PRO 26 -24.577 -0.216 -4.169 208 HG2 PRO 26 HG2 PRO 26 -27.036 0.580 -3.484 209 HG3 PRO 26 HG1 PRO 26 -25.589 1.465 -2.964 210 HD2 PRO 26 HD2 PRO 26 -27.569 2.141 -5.099 211 HD3 PRO 26 HD1 PRO 26 -26.685 3.212 -3.994 212 H THR 27 HN THR 27 -22.875 -0.168 -6.656 213 HA THR 27 HA THR 27 -23.591 0.144 -9.407 214 HB THR 27 HB THR 27 -21.254 -0.223 -8.808 215 HG1 THR 27 HG1 THR 27 -21.255 -2.502 -10.100 216 HG21 THR 27 HG21 THR 27 -21.343 -1.584 -6.881 217 HG22 THR 27 HG22 THR 27 -20.557 -2.559 -8.123 218 HG23 THR 27 HG23 THR 27 -22.252 -2.838 -7.724 219 H VAL 28 HN VAL 28 -23.664 -2.095 -10.691 220 HA VAL 28 HA VAL 28 -26.173 -3.133 -10.470 221 HB VAL 28 HB VAL 28 -24.990 -3.490 -12.451 222 HG11 VAL 28 HG11 VAL 28 -22.727 -3.502 -11.427 223 HG12 VAL 28 HG12 VAL 28 -22.949 -4.744 -12.666 224 HG13 VAL 28 HG13 VAL 28 -22.995 -5.185 -10.958 225 HG21 VAL 28 HG21 VAL 28 -25.349 -6.135 -11.062 226 HG22 VAL 28 HG22 VAL 28 -25.148 -5.933 -12.804 227 HG23 VAL 28 HG23 VAL 28 -26.560 -5.254 -11.995 228 H GLU 29 HN GLU 29 -23.276 -4.347 -8.845 229 HA GLU 29 HA GLU 29 -24.759 -6.601 -7.756 230 HB2 GLU 29 HB2 GLU 29 -21.866 -5.816 -7.419 231 HB3 GLU 29 HB1 GLU 29 -22.590 -7.313 -6.840 232 HG2 GLU 29 HG2 GLU 29 -23.158 -7.878 -9.206 233 HG3 GLU 29 HG1 GLU 29 -22.286 -6.428 -9.703 234 H GLY 30 HN GLY 30 -24.518 -3.460 -6.926 235 HA2 GLY 30 HA2 GLY 30 -25.525 -2.502 -5.075 236 HA3 GLY 30 HA1 GLY 30 -25.534 -4.073 -4.288 237 H PHE 31 HN PHE 31 -22.659 -2.589 -5.619 238 HA PHE 31 HA PHE 31 -21.515 -2.446 -2.951 239 HB2 PHE 31 HB2 PHE 31 -20.185 -1.828 -5.603 240 HB3 PHE 31 HB1 PHE 31 -19.389 -2.086 -4.052 241 HD1 PHE 31 HD1 PHE 31 -21.218 -4.525 -3.323 242 HD2 PHE 31 HD2 PHE 31 -18.910 -3.511 -6.745 243 HE1 PHE 31 HE1 PHE 31 -20.969 -6.911 -3.859 244 HE2 PHE 31 HE2 PHE 31 -18.656 -5.888 -7.286 245 HZ PHE 31 HZ PHE 31 -19.688 -7.596 -5.844 246 H THR 32 HN THR 32 -21.380 -0.592 -1.854 247 HA THR 32 HA THR 32 -22.611 1.748 -3.102 248 HB THR 32 HB THR 32 -23.074 2.479 -0.813 249 HG1 THR 32 HG1 THR 32 -22.651 0.859 0.882 250 HG21 THR 32 HG21 THR 32 -23.892 -0.284 -1.494 251 HG22 THR 32 HG22 THR 32 -24.771 1.194 -1.827 252 HG23 THR 32 HG23 THR 32 -24.596 0.617 -0.168 253 H HIS 33 HN HIS 33 -19.689 0.761 -1.440 254 HA HIS 33 HA HIS 33 -18.817 3.569 -1.276 255 HB2 HIS 33 HB2 HIS 33 -18.247 1.160 0.417 256 HB3 HIS 33 HB1 HIS 33 -17.130 2.521 0.420 257 HD1 HIS 33 HD1 HIS 33 -20.727 1.672 1.289 258 HD2 HIS 33 HD2 HIS 33 -17.894 4.644 1.966 259 HE1 HIS 33 HE1 HIS 33 -21.688 3.130 3.103 260 HE2 HIS 33 HE2 HIS 33 -19.899 4.832 3.591 261 H ASP 34 HN ASP 34 -17.254 4.202 -2.568 262 HA ASP 34 HA ASP 34 -15.527 2.180 -3.828 263 HB2 ASP 34 HB2 ASP 34 -16.423 4.920 -4.711 264 HB3 ASP 34 HB1 ASP 34 -14.995 4.164 -5.403 265 H TRP 35 HN TRP 35 -13.356 2.300 -3.581 266 HA TRP 35 HA TRP 35 -12.247 4.632 -2.227 267 HB2 TRP 35 HB2 TRP 35 -11.005 3.167 -0.627 268 HB3 TRP 35 HB1 TRP 35 -12.736 3.246 -0.350 269 HD1 TRP 35 HD1 TRP 35 -14.055 0.973 -0.377 270 HE1 TRP 35 HE1 TRP 35 -13.343 -1.496 -0.671 271 HE3 TRP 35 HE3 TRP 35 -9.244 1.684 -1.969 272 HZ2 TRP 35 HZ2 TRP 35 -11.032 -2.935 -1.464 273 HZ3 TRP 35 HZ3 TRP 35 -7.858 -0.293 -2.464 274 HH2 TRP 35 HH2 TRP 35 -8.719 -2.538 -2.178 275 H MET 36 HN MET 36 -9.894 4.587 -2.142 276 HA MET 36 HA MET 36 -8.601 2.886 -4.147 277 HB2 MET 36 HB2 MET 36 -9.011 4.860 -5.407 278 HB3 MET 36 HB1 MET 36 -8.563 5.897 -4.061 279 HG2 MET 36 HG2 MET 36 -6.239 4.988 -4.251 280 HG3 MET 36 HG1 MET 36 -6.744 4.215 -5.757 281 HE1 MET 36 HE1 MET 36 -6.421 7.216 -3.696 282 HE2 MET 36 HE2 MET 36 -7.863 7.903 -4.464 283 HE3 MET 36 HE3 MET 36 -6.274 8.605 -4.783 284 H VAL 37 HN VAL 37 -6.594 2.229 -3.537 285 HA VAL 37 HA VAL 37 -5.594 3.256 -0.970 286 HB VAL 37 HB VAL 37 -4.114 1.052 -1.312 287 HG11 VAL 37 HG11 VAL 37 -6.888 1.159 -0.241 288 HG12 VAL 37 HG12 VAL 37 -5.428 1.575 0.639 289 HG13 VAL 37 HG13 VAL 37 -5.719 -0.092 0.136 290 HG21 VAL 37 HG21 VAL 37 -5.085 0.400 -3.405 291 HG22 VAL 37 HG22 VAL 37 -6.710 0.512 -2.729 292 HG23 VAL 37 HG23 VAL 37 -5.603 -0.738 -2.160 293 H PHE 38 HN PHE 38 -3.368 3.450 -0.636 294 HA PHE 38 HA PHE 38 -1.794 4.151 -3.037 295 HB2 PHE 38 HB2 PHE 38 -2.457 5.678 -0.578 296 HB3 PHE 38 HB1 PHE 38 -0.790 5.779 -1.111 297 HD1 PHE 38 HD1 PHE 38 -0.219 6.851 -3.169 298 HD2 PHE 38 HD2 PHE 38 -4.245 6.748 -1.807 299 HE1 PHE 38 HE1 PHE 38 -0.772 8.676 -4.716 300 HE2 PHE 38 HE2 PHE 38 -4.820 8.559 -3.367 301 HZ PHE 38 HZ PHE 38 -3.098 9.533 -4.824 302 H VAL 39 HN VAL 39 0.068 2.958 -3.136 303 HA VAL 39 HA VAL 39 1.705 3.166 -0.710 304 HB VAL 39 HB VAL 39 2.950 1.080 -1.781 305 HG11 VAL 39 HG11 VAL 39 0.766 1.204 0.225 306 HG12 VAL 39 HG12 VAL 39 2.489 0.903 0.441 307 HG13 VAL 39 HG13 VAL 39 1.450 -0.357 -0.222 308 HG21 VAL 39 HG21 VAL 39 1.732 0.338 -3.526 309 HG22 VAL 39 HG22 VAL 39 0.208 0.911 -2.842 310 HG23 VAL 39 HG23 VAL 39 0.944 -0.572 -2.234 311 H ARG 40 HN ARG 40 3.455 4.330 -1.084 312 HA ARG 40 HA ARG 40 4.960 4.229 -3.518 313 HB2 ARG 40 HB2 ARG 40 4.611 6.516 -4.265 314 HB3 ARG 40 HB1 ARG 40 3.069 5.666 -4.276 315 HG2 ARG 40 HG2 ARG 40 2.256 6.835 -2.443 316 HG3 ARG 40 HG1 ARG 40 3.867 7.282 -1.888 317 HD2 ARG 40 HD2 ARG 40 4.083 8.796 -3.839 318 HD3 ARG 40 HD1 ARG 40 2.420 8.394 -4.301 319 HE ARG 40 HE ARG 40 2.452 9.272 -1.621 320 HH11 ARG 40 HH11 ARG 40 2.950 10.536 -4.855 321 HH12 ARG 40 HH12 ARG 40 2.354 12.126 -4.458 322 HH21 ARG 40 HH21 ARG 40 1.661 11.336 -1.105 323 HH22 ARG 40 HH22 ARG 40 1.597 12.573 -2.329 324 H GLY 41 HN GLY 41 6.466 6.357 -3.467 325 HA2 GLY 41 HA2 GLY 41 7.362 6.641 -0.686 326 HA3 GLY 41 HA1 GLY 41 8.328 6.989 -2.116 327 HA PRO 42 HA PRO 42 5.897 10.722 -0.133 328 HB2 PRO 42 HB2 PRO 42 8.662 11.481 0.648 329 HB3 PRO 42 HB1 PRO 42 7.154 11.649 1.552 330 HG2 PRO 42 HG2 PRO 42 8.938 9.755 2.187 331 HG3 PRO 42 HG1 PRO 42 7.203 9.461 2.284 332 HD2 PRO 42 HD2 PRO 42 9.158 8.548 0.244 333 HD3 PRO 42 HD1 PRO 42 7.732 7.715 0.893 334 H GLU 43 HN GLU 43 5.939 12.810 -0.929 335 HA GLU 43 HA GLU 43 6.654 13.232 -3.522 336 HB2 GLU 43 HB2 GLU 43 6.569 15.719 -2.912 337 HB3 GLU 43 HB1 GLU 43 5.130 14.745 -2.663 338 HG2 GLU 43 HG2 GLU 43 5.906 14.499 -0.254 339 HG3 GLU 43 HG1 GLU 43 7.050 15.791 -0.611 340 H HIS 44 HN HIS 44 8.474 13.223 -4.548 341 HA HIS 44 HA HIS 44 10.509 14.079 -5.233 342 HB2 HIS 44 HB2 HIS 44 10.869 14.949 -2.372 343 HB3 HIS 44 HB1 HIS 44 12.175 14.991 -3.545 344 HD1 HIS 44 HD1 HIS 44 11.558 16.483 -5.784 345 HD2 HIS 44 HD2 HIS 44 9.416 17.230 -2.297 346 HE1 HIS 44 HE1 HIS 44 10.591 18.789 -6.058 347 HE2 HIS 44 HE2 HIS 44 9.518 19.305 -3.835 348 H SER 45 HN SER 45 9.953 11.857 -2.665 349 HA SER 45 HA SER 45 12.482 10.498 -3.283 350 HB2 SER 45 HB2 SER 45 11.579 8.912 -1.409 351 HB3 SER 45 HB1 SER 45 12.218 10.486 -0.952 352 HG SER 45 HG SER 45 9.488 10.174 -1.526 353 H ASN 46 HN ASN 46 12.388 9.238 -5.029 354 HA ASN 46 HA ASN 46 9.886 7.923 -5.741 355 HB2 ASN 46 HB2 ASN 46 12.483 8.426 -7.129 356 HB3 ASN 46 HB1 ASN 46 11.492 7.080 -7.672 357 HD21 ASN 46 HD21 ASN 46 12.197 9.481 -9.094 358 HD22 ASN 46 HD22 ASN 46 10.712 10.284 -9.490 359 H ILE 47 HN ILE 47 9.446 5.871 -5.279 360 HA ILE 47 HA ILE 47 11.472 4.355 -3.886 361 HB ILE 47 HB ILE 47 9.799 2.758 -3.340 362 HG12 ILE 47 HG12 ILE 47 7.862 4.347 -5.023 363 HG13 ILE 47 HG11 ILE 47 8.631 2.845 -5.544 364 HG21 ILE 47 HG21 ILE 47 9.921 4.702 -1.979 365 HG22 ILE 47 HG22 ILE 47 8.236 4.218 -2.134 366 HG23 ILE 47 HG23 ILE 47 8.852 5.588 -3.060 367 HD11 ILE 47 HD11 ILE 47 7.251 2.802 -2.949 368 HD12 ILE 47 HD12 ILE 47 7.350 1.564 -4.201 369 HD13 ILE 47 HD13 ILE 47 6.237 2.923 -4.385 370 H GLN 48 HN GLN 48 10.197 4.517 -7.048 371 HA GLN 48 HA GLN 48 10.397 1.865 -7.900 372 HB2 GLN 48 HB2 GLN 48 9.312 3.635 -9.209 373 HB3 GLN 48 HB1 GLN 48 10.857 4.433 -9.442 374 HG2 GLN 48 HG2 GLN 48 10.295 3.309 -11.453 375 HG3 GLN 48 HG1 GLN 48 11.623 2.448 -10.715 376 HE21 GLN 48 HE21 GLN 48 8.278 2.231 -9.697 377 HE22 GLN 48 HE22 GLN 48 8.054 0.583 -10.170 378 H HIS 49 HN HIS 49 12.806 3.900 -6.829 379 HA HIS 49 HA HIS 49 14.986 2.834 -8.378 380 HB2 HIS 49 HB2 HIS 49 14.729 4.739 -6.099 381 HB3 HIS 49 HB1 HIS 49 16.278 3.918 -6.301 382 HD1 HIS 49 HD1 HIS 49 16.489 3.960 -9.377 383 HD2 HIS 49 HD2 HIS 49 15.330 7.217 -7.070 384 HE1 HIS 49 HE1 HIS 49 16.982 5.994 -10.770 385 HE2 HIS 49 HE2 HIS 49 16.358 7.957 -9.318 386 H PHE 50 HN PHE 50 13.561 2.234 -5.188 387 HA PHE 50 HA PHE 50 15.381 -0.052 -4.928 388 HB2 PHE 50 HB2 PHE 50 15.138 0.129 -2.482 389 HB3 PHE 50 HB1 PHE 50 15.858 1.565 -3.209 390 HD1 PHE 50 HD1 PHE 50 12.783 0.232 -1.637 391 HD2 PHE 50 HD2 PHE 50 14.875 3.655 -3.045 392 HE1 PHE 50 HE1 PHE 50 11.188 1.677 -0.480 393 HE2 PHE 50 HE2 PHE 50 13.255 5.112 -1.901 394 HZ PHE 50 HZ PHE 50 11.405 4.121 -0.613 395 H VAL 51 HN VAL 51 12.326 0.701 -5.679 396 HA VAL 51 HA VAL 51 11.223 -1.778 -4.543 397 HB VAL 51 HB VAL 51 9.871 0.877 -5.073 398 HG11 VAL 51 HG11 VAL 51 7.884 -0.560 -4.005 399 HG12 VAL 51 HG12 VAL 51 8.706 -1.854 -4.888 400 HG13 VAL 51 HG13 VAL 51 8.125 -0.429 -5.752 401 HG21 VAL 51 HG21 VAL 51 9.188 0.484 -2.655 402 HG22 VAL 51 HG22 VAL 51 10.886 0.843 -2.950 403 HG23 VAL 51 HG23 VAL 51 10.377 -0.816 -2.637 404 H GLU 52 HN GLU 52 10.229 -3.159 -5.906 405 HA GLU 52 HA GLU 52 10.828 -2.672 -8.740 406 HB2 GLU 52 HB2 GLU 52 11.931 -4.574 -7.632 407 HB3 GLU 52 HB1 GLU 52 10.360 -5.259 -7.248 408 HG2 GLU 52 HG2 GLU 52 9.891 -5.621 -9.570 409 HG3 GLU 52 HG1 GLU 52 11.366 -4.774 -10.040 410 H LYS 53 HN LYS 53 8.361 -4.381 -6.815 411 HA LYS 53 HA LYS 53 6.297 -3.319 -8.574 412 HB2 LYS 53 HB2 LYS 53 5.260 -5.575 -8.767 413 HB3 LYS 53 HB1 LYS 53 6.833 -5.465 -9.544 414 HG2 LYS 53 HG2 LYS 53 7.867 -6.582 -7.659 415 HG3 LYS 53 HG1 LYS 53 6.317 -6.675 -6.838 416 HD2 LYS 53 HD2 LYS 53 7.003 -7.960 -9.484 417 HD3 LYS 53 HD1 LYS 53 6.955 -8.792 -7.931 418 HE2 LYS 53 HE2 LYS 53 4.603 -8.445 -7.734 419 HE3 LYS 53 HE1 LYS 53 4.605 -7.356 -9.125 420 HZ1 LYS 53 HZ1 LYS 53 3.781 -9.516 -9.772 421 HZ2 LYS 53 HZ2 LYS 53 5.171 -10.275 -9.165 422 HZ3 LYS 53 HZ3 LYS 53 5.284 -9.252 -10.513 423 H VAL 54 HN VAL 54 4.077 -4.229 -7.619 424 HA VAL 54 HA VAL 54 4.105 -4.183 -4.705 425 HB VAL 54 HB VAL 54 3.163 -1.939 -6.426 426 HG11 VAL 54 HG11 VAL 54 1.986 -2.015 -3.727 427 HG12 VAL 54 HG12 VAL 54 1.237 -3.070 -4.922 428 HG13 VAL 54 HG13 VAL 54 1.346 -1.335 -5.222 429 HG21 VAL 54 HG21 VAL 54 3.790 -0.984 -3.968 430 HG22 VAL 54 HG22 VAL 54 4.922 -1.140 -5.304 431 HG23 VAL 54 HG23 VAL 54 4.829 -2.398 -4.072 432 H VAL 55 HN VAL 55 2.074 -4.832 -3.777 433 HA VAL 55 HA VAL 55 0.089 -5.877 -5.643 434 HB VAL 55 HB VAL 55 2.072 -7.534 -4.476 435 HG11 VAL 55 HG11 VAL 55 -0.685 -8.093 -3.413 436 HG12 VAL 55 HG12 VAL 55 0.762 -7.727 -2.468 437 HG13 VAL 55 HG13 VAL 55 0.660 -9.236 -3.377 438 HG21 VAL 55 HG21 VAL 55 -0.438 -8.309 -5.939 439 HG22 VAL 55 HG22 VAL 55 1.048 -9.250 -5.807 440 HG23 VAL 55 HG23 VAL 55 1.043 -7.731 -6.704 441 H PHE 56 HN PHE 56 -1.930 -6.152 -4.755 442 HA PHE 56 HA PHE 56 -2.270 -5.286 -1.961 443 HB2 PHE 56 HB2 PHE 56 -3.823 -4.504 -4.427 444 HB3 PHE 56 HB1 PHE 56 -4.562 -4.435 -2.824 445 HD1 PHE 56 HD1 PHE 56 -1.720 -3.178 -4.847 446 HD2 PHE 56 HD2 PHE 56 -4.195 -2.610 -1.428 447 HE1 PHE 56 HE1 PHE 56 -0.726 -0.964 -4.510 448 HE2 PHE 56 HE2 PHE 56 -3.207 -0.378 -1.090 449 HZ PHE 56 HZ PHE 56 -1.455 0.440 -2.631 450 H HIS 57 HN HIS 57 -3.320 -6.741 -0.731 451 HA HIS 57 HA HIS 57 -4.862 -8.849 -2.115 452 HB2 HIS 57 HB2 HIS 57 -3.884 -8.773 0.764 453 HB3 HIS 57 HB1 HIS 57 -4.734 -10.109 -0.005 454 HD1 HIS 57 HD1 HIS 57 -3.250 -11.932 -0.723 455 HD2 HIS 57 HD2 HIS 57 -1.266 -8.272 -0.680 456 HE1 HIS 57 HE1 HIS 57 -0.858 -12.446 -1.302 457 HE2 HIS 57 HE2 HIS 57 0.362 -10.254 -1.026 458 H LEU 58 HN LEU 58 -6.705 -7.534 -2.449 459 HA LEU 58 HA LEU 58 -8.041 -6.162 -0.366 460 HB2 LEU 58 HB2 LEU 58 -9.496 -7.394 -2.694 461 HB3 LEU 58 HB1 LEU 58 -9.884 -5.922 -1.822 462 HG LEU 58 HG LEU 58 -7.562 -6.254 -3.713 463 HD11 LEU 58 HD11 LEU 58 -8.796 -5.094 -5.252 464 HD12 LEU 58 HD12 LEU 58 -10.034 -4.638 -4.098 465 HD13 LEU 58 HD13 LEU 58 -9.897 -6.312 -4.643 466 HD21 LEU 58 HD21 LEU 58 -7.352 -4.570 -1.784 467 HD22 LEU 58 HD22 LEU 58 -8.646 -3.696 -2.598 468 HD23 LEU 58 HD23 LEU 58 -7.117 -3.980 -3.428 469 H HIS 59 HN HIS 59 -10.554 -6.970 -0.050 470 HA HIS 59 HA HIS 59 -10.242 -9.264 1.656 471 HB2 HIS 59 HB2 HIS 59 -11.751 -7.200 2.040 472 HB3 HIS 59 HB1 HIS 59 -12.873 -7.976 0.929 473 HD1 HIS 59 HD1 HIS 59 -11.210 -8.573 4.286 474 HD2 HIS 59 HD2 HIS 59 -14.484 -9.885 2.071 475 HE1 HIS 59 HE1 HIS 59 -12.567 -10.001 5.850 476 HE2 HIS 59 HE2 HIS 59 -14.431 -10.933 4.441 477 H GLU 60 HN GLU 60 -11.254 -11.224 1.476 478 HA GLU 60 HA GLU 60 -11.047 -12.512 -0.954 479 HB2 GLU 60 HB2 GLU 60 -12.638 -13.300 1.479 480 HB3 GLU 60 HB1 GLU 60 -12.282 -14.381 0.138 481 HG2 GLU 60 HG2 GLU 60 -9.880 -14.088 0.569 482 HG3 GLU 60 HG1 GLU 60 -10.274 -13.070 1.955 483 H SER 61 HN SER 61 -13.790 -10.829 0.322 484 HA SER 61 HA SER 61 -15.797 -11.948 -1.305 485 HB2 SER 61 HB2 SER 61 -16.952 -9.725 -0.810 486 HB3 SER 61 HB1 SER 61 -16.474 -10.690 0.588 487 HG SER 61 HG SER 61 -15.409 -8.292 -0.379 488 H PHE 62 HN PHE 62 -13.217 -9.789 -1.966 489 HA PHE 62 HA PHE 62 -14.435 -8.658 -4.349 490 HB2 PHE 62 HB2 PHE 62 -11.640 -8.401 -3.202 491 HB3 PHE 62 HB1 PHE 62 -12.227 -7.543 -4.615 492 HD1 PHE 62 HD1 PHE 62 -13.119 -8.054 -1.028 493 HD2 PHE 62 HD2 PHE 62 -12.985 -5.401 -4.341 494 HE1 PHE 62 HE1 PHE 62 -13.895 -6.217 0.414 495 HE2 PHE 62 HE2 PHE 62 -13.767 -3.561 -2.912 496 HZ PHE 62 HZ PHE 62 -14.220 -3.968 -0.529 497 HA PRO 63 HA PRO 63 -13.011 -12.174 -6.784 498 HB2 PRO 63 HB2 PRO 63 -13.835 -10.419 -9.016 499 HB3 PRO 63 HB1 PRO 63 -14.369 -12.055 -8.619 500 HG2 PRO 63 HG2 PRO 63 -15.975 -9.951 -8.245 501 HG3 PRO 63 HG1 PRO 63 -15.956 -11.311 -7.105 502 HD2 PRO 63 HD2 PRO 63 -14.666 -8.618 -6.861 503 HD3 PRO 63 HD1 PRO 63 -15.536 -9.564 -5.635 504 H ARG 64 HN ARG 64 -10.978 -12.515 -7.414 505 HA ARG 64 HA ARG 64 -8.773 -12.116 -7.848 506 HB2 ARG 64 HB2 ARG 64 -9.936 -9.967 -9.635 507 HB3 ARG 64 HB1 ARG 64 -8.260 -10.499 -9.663 508 HG2 ARG 64 HG2 ARG 64 -8.877 -12.651 -10.470 509 HG3 ARG 64 HG1 ARG 64 -10.591 -12.325 -10.194 510 HD2 ARG 64 HD2 ARG 64 -10.672 -10.731 -11.932 511 HD3 ARG 64 HD1 ARG 64 -8.912 -10.673 -12.060 512 HE ARG 64 HE ARG 64 -9.554 -13.265 -12.644 513 HH11 ARG 64 HH11 ARG 64 -10.637 -10.161 -13.858 514 HH12 ARG 64 HH12 ARG 64 -10.822 -10.721 -15.496 515 HH21 ARG 64 HH21 ARG 64 -9.802 -14.008 -14.799 516 HH22 ARG 64 HH22 ARG 64 -10.329 -12.900 -16.032 517 HA PRO 65 HA PRO 65 -9.052 -8.468 -4.990 518 HB2 PRO 65 HB2 PRO 65 -8.008 -9.576 -2.757 519 HB3 PRO 65 HB1 PRO 65 -9.712 -9.729 -3.199 520 HG2 PRO 65 HG2 PRO 65 -7.491 -11.692 -3.488 521 HG3 PRO 65 HG1 PRO 65 -9.191 -11.968 -3.071 522 HD2 PRO 65 HD2 PRO 65 -8.102 -12.381 -5.573 523 HD3 PRO 65 HD1 PRO 65 -9.824 -12.089 -5.256 524 H LYS 66 HN LYS 66 -6.382 -10.539 -5.738 525 HA LYS 66 HA LYS 66 -4.430 -8.750 -4.660 526 HB2 LYS 66 HB2 LYS 66 -4.009 -11.142 -4.580 527 HB3 LYS 66 HB1 LYS 66 -4.128 -11.246 -6.330 528 HG2 LYS 66 HG2 LYS 66 -2.110 -10.043 -6.634 529 HG3 LYS 66 HG1 LYS 66 -2.065 -9.563 -4.938 530 HD2 LYS 66 HD2 LYS 66 -1.250 -11.552 -4.249 531 HD3 LYS 66 HD1 LYS 66 -2.133 -12.469 -5.472 532 HE2 LYS 66 HE2 LYS 66 0.282 -10.756 -6.039 533 HE3 LYS 66 HE1 LYS 66 0.352 -12.491 -5.733 534 HZ1 LYS 66 HZ1 LYS 66 -1.058 -12.857 -7.655 535 HZ2 LYS 66 HZ2 LYS 66 0.339 -12.003 -8.098 536 HZ3 LYS 66 HZ3 LYS 66 -1.142 -11.190 -7.951 537 H ARG 67 HN ARG 67 -4.261 -6.879 -5.669 538 HA ARG 67 HA ARG 67 -4.165 -6.847 -8.611 539 HB2 ARG 67 HB2 ARG 67 -4.385 -4.436 -6.794 540 HB3 ARG 67 HB1 ARG 67 -4.756 -4.540 -8.512 541 HG2 ARG 67 HG2 ARG 67 -6.306 -5.792 -6.259 542 HG3 ARG 67 HG1 ARG 67 -6.795 -4.416 -7.249 543 HD2 ARG 67 HD2 ARG 67 -6.725 -5.920 -9.240 544 HD3 ARG 67 HD1 ARG 67 -6.412 -7.273 -8.140 545 HE ARG 67 HE ARG 67 -8.614 -7.319 -7.628 546 HH11 ARG 67 HH11 ARG 67 -7.935 -4.181 -9.061 547 HH12 ARG 67 HH12 ARG 67 -9.608 -3.699 -9.079 548 HH21 ARG 67 HH21 ARG 67 -10.791 -6.676 -7.659 549 HH22 ARG 67 HH22 ARG 67 -11.226 -5.104 -8.267 550 H VAL 68 HN VAL 68 -2.235 -6.502 -9.585 551 HA VAL 68 HA VAL 68 -0.006 -5.753 -7.827 552 HB VAL 68 HB VAL 68 1.455 -6.990 -9.098 553 HG11 VAL 68 HG11 VAL 68 -0.153 -8.529 -8.099 554 HG12 VAL 68 HG12 VAL 68 0.444 -9.151 -9.639 555 HG13 VAL 68 HG13 VAL 68 -1.158 -8.425 -9.547 556 HG21 VAL 68 HG21 VAL 68 1.031 -5.877 -11.209 557 HG22 VAL 68 HG22 VAL 68 -0.432 -6.837 -11.442 558 HG23 VAL 68 HG23 VAL 68 1.147 -7.623 -11.431 559 H CYS 69 HN CYS 69 1.350 -4.079 -8.294 560 HA CYS 69 HA CYS 69 0.880 -2.573 -10.777 561 HB2 CYS 69 HB2 CYS 69 1.335 -1.423 -8.007 562 HB3 CYS 69 HB1 CYS 69 1.352 -0.480 -9.496 563 HG CYS 69 HG CYS 69 -1.433 -2.242 -9.281 564 H LYS 70 HN LYS 70 2.684 -2.617 -11.977 565 HA LYS 70 HA LYS 70 5.257 -3.180 -10.632 566 HB2 LYS 70 HB2 LYS 70 4.618 -3.543 -13.564 567 HB3 LYS 70 HB1 LYS 70 5.993 -4.188 -12.683 568 HG2 LYS 70 HG2 LYS 70 4.670 -5.818 -11.608 569 HG3 LYS 70 HG1 LYS 70 3.173 -5.009 -12.074 570 HD2 LYS 70 HD2 LYS 70 3.643 -5.509 -14.425 571 HD3 LYS 70 HD1 LYS 70 5.131 -6.329 -13.947 572 HE2 LYS 70 HE2 LYS 70 3.865 -7.979 -12.713 573 HE3 LYS 70 HE1 LYS 70 2.362 -7.124 -13.057 574 HZ1 LYS 70 HZ1 LYS 70 4.132 -8.328 -15.117 575 HZ2 LYS 70 HZ2 LYS 70 2.626 -7.597 -15.385 576 HZ3 LYS 70 HZ3 LYS 70 2.722 -9.049 -14.512 577 H ASP 71 HN ASP 71 3.688 -0.630 -11.443 578 HA ASP 71 HA ASP 71 5.923 0.751 -12.744 579 HB2 ASP 71 HB2 ASP 71 3.080 0.523 -13.570 580 HB3 ASP 71 HB1 ASP 71 3.813 2.113 -13.750 581 HA PRO 72 HA PRO 72 5.405 4.532 -10.139 582 HB2 PRO 72 HB2 PRO 72 3.787 5.408 -12.523 583 HB3 PRO 72 HB1 PRO 72 4.839 6.381 -11.486 584 HG2 PRO 72 HG2 PRO 72 5.773 5.463 -13.777 585 HG3 PRO 72 HG1 PRO 72 6.786 5.392 -12.319 586 HD2 PRO 72 HD2 PRO 72 5.445 3.211 -13.784 587 HD3 PRO 72 HD1 PRO 72 6.871 3.159 -12.739 588 HA PRO 73 HA PRO 73 2.267 5.479 -7.471 589 HB2 PRO 73 HB2 PRO 73 0.119 6.060 -9.474 590 HB3 PRO 73 HB1 PRO 73 0.440 6.834 -7.921 591 HG2 PRO 73 HG2 PRO 73 1.357 7.739 -10.406 592 HG3 PRO 73 HG1 PRO 73 1.946 8.253 -8.824 593 HD2 PRO 73 HD2 PRO 73 3.432 6.907 -10.741 594 HD3 PRO 73 HD1 PRO 73 3.858 7.073 -9.028 595 H TYR 74 HN TYR 74 1.988 3.625 -6.620 596 HA TYR 74 HA TYR 74 0.522 1.470 -7.884 597 HB2 TYR 74 HB2 TYR 74 1.674 1.449 -5.104 598 HB3 TYR 74 HB1 TYR 74 1.417 0.086 -6.183 599 HD1 TYR 74 HD2 TYR 74 3.469 3.164 -5.777 600 HD2 TYR 74 HD1 TYR 74 3.184 -0.706 -7.495 601 HE1 TYR 74 HE2 TYR 74 5.804 3.318 -6.482 602 HE2 TYR 74 HE1 TYR 74 5.536 -0.569 -8.209 603 HH TYR 74 HH TYR 74 7.247 0.992 -8.599 604 H LYS 75 HN LYS 75 -1.565 1.184 -7.539 605 HA LYS 75 HA LYS 75 -2.870 1.997 -5.097 606 HB2 LYS 75 HB2 LYS 75 -4.440 3.554 -6.376 607 HB3 LYS 75 HB1 LYS 75 -2.840 4.174 -6.005 608 HG2 LYS 75 HG2 LYS 75 -2.157 4.120 -8.190 609 HG3 LYS 75 HG1 LYS 75 -3.306 2.869 -8.642 610 HD2 LYS 75 HD2 LYS 75 -4.099 4.868 -9.623 611 HD3 LYS 75 HD1 LYS 75 -5.127 4.599 -8.230 612 HE2 LYS 75 HE2 LYS 75 -3.943 6.215 -6.968 613 HE3 LYS 75 HE1 LYS 75 -2.704 6.380 -8.203 614 HZ1 LYS 75 HZ1 LYS 75 -5.563 7.065 -8.639 615 HZ2 LYS 75 HZ2 LYS 75 -4.248 7.416 -9.652 616 HZ3 LYS 75 HZ3 LYS 75 -4.391 8.192 -8.154 617 H VAL 76 HN VAL 76 -4.976 1.339 -4.956 618 HA VAL 76 HA VAL 76 -6.011 -0.280 -7.190 619 HB VAL 76 HB VAL 76 -5.973 -1.009 -4.277 620 HG11 VAL 76 HG11 VAL 76 -8.289 -1.104 -5.240 621 HG12 VAL 76 HG12 VAL 76 -7.666 -2.633 -4.615 622 HG13 VAL 76 HG13 VAL 76 -7.699 -2.335 -6.356 623 HG21 VAL 76 HG21 VAL 76 -4.148 -1.891 -5.566 624 HG22 VAL 76 HG22 VAL 76 -5.245 -2.437 -6.829 625 HG23 VAL 76 HG23 VAL 76 -5.278 -3.202 -5.242 626 H GLU 77 HN GLU 77 -7.931 0.367 -7.880 627 HA GLU 77 HA GLU 77 -9.580 2.028 -6.097 628 HB2 GLU 77 HB2 GLU 77 -9.875 1.946 -9.086 629 HB3 GLU 77 HB1 GLU 77 -10.426 3.178 -7.972 630 HG2 GLU 77 HG2 GLU 77 -8.642 4.320 -8.630 631 HG3 GLU 77 HG1 GLU 77 -7.741 3.219 -7.593 632 H GLU 78 HN GLU 78 -11.238 0.981 -5.289 633 HA GLU 78 HA GLU 78 -12.634 -0.975 -6.965 634 HB2 GLU 78 HB2 GLU 78 -11.039 -1.595 -4.590 635 HB3 GLU 78 HB1 GLU 78 -12.683 -2.212 -4.496 636 HG2 GLU 78 HG2 GLU 78 -10.560 -2.848 -6.520 637 HG3 GLU 78 HG1 GLU 78 -11.410 -3.934 -5.420 638 H SER 79 HN SER 79 -14.521 -1.923 -5.570 639 HA SER 79 HA SER 79 -15.805 0.196 -4.029 640 HB2 SER 79 HB2 SER 79 -16.445 0.524 -6.414 641 HB3 SER 79 HB1 SER 79 -17.128 -1.104 -6.423 642 HG SER 79 HG SER 79 -18.069 1.241 -5.240 643 H GLY 80 HN GLY 80 -17.302 -0.528 -2.579 644 HA2 GLY 80 HA2 GLY 80 -18.157 -3.265 -2.423 645 HA3 GLY 80 HA1 GLY 80 -16.880 -2.881 -1.272 646 H TYR 81 HN TYR 81 -18.332 -3.153 0.540 647 HA TYR 81 HA TYR 81 -19.848 -0.710 1.003 648 HB2 TYR 81 HB2 TYR 81 -21.865 -1.983 1.795 649 HB3 TYR 81 HB1 TYR 81 -21.584 -2.051 0.060 650 HD1 TYR 81 HD2 TYR 81 -21.527 -3.984 3.182 651 HD2 TYR 81 HD1 TYR 81 -20.986 -4.122 -1.035 652 HE1 TYR 81 HE2 TYR 81 -21.590 -6.439 3.258 653 HE2 TYR 81 HE1 TYR 81 -21.048 -6.578 -0.965 654 HH TYR 81 HH TYR 81 -22.068 -8.319 1.782 655 H ALA 82 HN ALA 82 -17.447 -2.210 2.112 656 HA ALA 82 HA ALA 82 -17.981 -1.563 4.851 657 HB1 ALA 82 HB1 ALA 82 -18.903 -3.711 5.050 658 HB2 ALA 82 HB2 ALA 82 -17.255 -3.880 5.649 659 HB3 ALA 82 HB3 ALA 82 -17.666 -4.433 4.027 660 H GLY 83 HN GLY 83 -16.041 -1.892 6.226 661 HA2 GLY 83 HA2 GLY 83 -13.603 -1.470 4.637 662 HA3 GLY 83 HA1 GLY 83 -13.848 -0.941 6.297 663 H PHE 84 HN PHE 84 -11.550 -2.171 5.878 664 HA PHE 84 HA PHE 84 -11.507 -4.471 7.470 665 HB2 PHE 84 HB2 PHE 84 -10.979 -6.204 5.768 666 HB3 PHE 84 HB1 PHE 84 -12.627 -5.608 5.629 667 HD1 PHE 84 HD1 PHE 84 -13.169 -3.964 3.802 668 HD2 PHE 84 HD2 PHE 84 -9.483 -6.079 3.959 669 HE1 PHE 84 HE1 PHE 84 -12.802 -3.481 1.424 670 HE2 PHE 84 HE2 PHE 84 -9.094 -5.599 1.588 671 HZ PHE 84 HZ PHE 84 -10.750 -4.301 0.306 672 H ILE 85 HN ILE 85 -9.353 -5.229 7.846 673 HA ILE 85 HA ILE 85 -7.182 -3.566 7.136 674 HB ILE 85 HB ILE 85 -7.317 -6.373 8.218 675 HG12 ILE 85 HG12 ILE 85 -7.817 -4.465 9.719 676 HG13 ILE 85 HG11 ILE 85 -6.394 -5.374 10.217 677 HG21 ILE 85 HG21 ILE 85 -4.772 -4.851 7.665 678 HG22 ILE 85 HG22 ILE 85 -5.338 -6.253 6.755 679 HG23 ILE 85 HG23 ILE 85 -4.905 -6.422 8.456 680 HD11 ILE 85 HD11 ILE 85 -6.300 -2.805 8.668 681 HD12 ILE 85 HD12 ILE 85 -4.939 -3.681 9.365 682 HD13 ILE 85 HD13 ILE 85 -6.137 -2.929 10.418 683 H LEU 86 HN LEU 86 -5.929 -3.495 5.372 684 HA LEU 86 HA LEU 86 -6.259 -5.648 3.381 685 HB2 LEU 86 HB2 LEU 86 -7.148 -3.192 2.961 686 HB3 LEU 86 HB1 LEU 86 -5.454 -2.880 2.608 687 HG LEU 86 HG LEU 86 -6.746 -5.186 1.231 688 HD11 LEU 86 HD11 LEU 86 -7.066 -2.372 0.221 689 HD12 LEU 86 HD12 LEU 86 -8.331 -3.229 1.104 690 HD13 LEU 86 HD13 LEU 86 -7.752 -3.859 -0.437 691 HD21 LEU 86 HD21 LEU 86 -5.203 -3.336 -0.306 692 HD22 LEU 86 HD22 LEU 86 -4.955 -5.063 -0.061 693 HD23 LEU 86 HD23 LEU 86 -4.305 -3.899 1.100 694 HA PRO 87 HA PRO 87 -1.873 -5.977 4.362 695 HB2 PRO 87 HB2 PRO 87 -2.013 -8.404 2.743 696 HB3 PRO 87 HB1 PRO 87 -1.615 -8.227 4.452 697 HG2 PRO 87 HG2 PRO 87 -3.925 -9.358 3.595 698 HG3 PRO 87 HG1 PRO 87 -3.794 -8.469 5.124 699 HD2 PRO 87 HD2 PRO 87 -4.926 -7.579 2.503 700 HD3 PRO 87 HD1 PRO 87 -5.506 -7.258 4.151 701 H ILE 88 HN ILE 88 -1.017 -4.369 3.106 702 HA ILE 88 HA ILE 88 -0.947 -4.704 0.214 703 HB ILE 88 HB ILE 88 0.085 -2.358 1.825 704 HG12 ILE 88 HG12 ILE 88 -2.546 -2.400 0.365 705 HG13 ILE 88 HG11 ILE 88 -2.449 -3.017 2.013 706 HG21 ILE 88 HG21 ILE 88 0.936 -2.610 -0.477 707 HG22 ILE 88 HG22 ILE 88 -0.052 -1.163 -0.268 708 HG23 ILE 88 HG23 ILE 88 -0.725 -2.582 -1.071 709 HD11 ILE 88 HD11 ILE 88 -1.620 -0.246 1.193 710 HD12 ILE 88 HD12 ILE 88 -1.745 -0.883 2.828 711 HD13 ILE 88 HD13 ILE 88 -3.196 -0.668 1.849 712 H GLU 89 HN GLU 89 0.965 -4.869 -0.952 713 HA GLU 89 HA GLU 89 3.388 -5.340 0.660 714 HB2 GLU 89 HB2 GLU 89 2.414 -6.863 -1.746 715 HB3 GLU 89 HB1 GLU 89 4.059 -6.973 -1.133 716 HG2 GLU 89 HG2 GLU 89 3.111 -7.720 1.046 717 HG3 GLU 89 HG1 GLU 89 1.528 -7.767 0.265 718 H VAL 90 HN VAL 90 5.136 -4.284 0.093 719 HA VAL 90 HA VAL 90 5.233 -3.064 -2.581 720 HB VAL 90 HB VAL 90 6.791 -2.007 -0.229 721 HG11 VAL 90 HG11 VAL 90 7.669 -0.809 -1.917 722 HG12 VAL 90 HG12 VAL 90 6.153 0.085 -1.867 723 HG13 VAL 90 HG13 VAL 90 6.358 -1.236 -3.014 724 HG21 VAL 90 HG21 VAL 90 4.174 -2.104 -0.012 725 HG22 VAL 90 HG22 VAL 90 4.259 -0.693 -1.067 726 HG23 VAL 90 HG23 VAL 90 5.077 -0.679 0.497 727 H TYR 91 HN TYR 91 6.494 -4.343 -3.780 728 HA TYR 91 HA TYR 91 8.397 -6.153 -2.601 729 HB2 TYR 91 HB2 TYR 91 7.484 -5.557 -5.376 730 HB3 TYR 91 HB1 TYR 91 9.006 -6.405 -5.167 731 HD1 TYR 91 HD1 TYR 91 5.695 -6.686 -3.426 732 HD2 TYR 91 HD2 TYR 91 8.728 -8.614 -5.697 733 HE1 TYR 91 HE1 TYR 91 4.490 -8.820 -3.228 734 HE2 TYR 91 HE2 TYR 91 7.520 -10.745 -5.514 735 HH TYR 91 HH TYR 91 5.877 -11.812 -4.063 736 H PHE 92 HN PHE 92 10.570 -6.089 -2.612 737 HA PHE 92 HA PHE 92 11.740 -3.440 -3.162 738 HB2 PHE 92 HB2 PHE 92 12.429 -5.634 -1.196 739 HB3 PHE 92 HB1 PHE 92 13.497 -4.260 -1.502 740 HD1 PHE 92 HD1 PHE 92 11.166 -2.242 -1.853 741 HD2 PHE 92 HD2 PHE 92 12.065 -5.156 1.118 742 HE1 PHE 92 HE1 PHE 92 10.013 -0.881 -0.178 743 HE2 PHE 92 HE2 PHE 92 10.864 -3.797 2.797 744 HZ PHE 92 HZ PHE 92 9.863 -1.657 2.143 745 H LYS 93 HN LYS 93 13.967 -3.390 -3.991 746 HA LYS 93 HA LYS 93 14.636 -5.739 -5.642 747 HB2 LYS 93 HB2 LYS 93 15.843 -2.966 -5.734 748 HB3 LYS 93 HB1 LYS 93 16.145 -4.271 -6.869 749 HG2 LYS 93 HG2 LYS 93 13.952 -4.086 -7.773 750 HG3 LYS 93 HG1 LYS 93 13.468 -2.954 -6.503 751 HD2 LYS 93 HD2 LYS 93 14.974 -1.285 -7.310 752 HD3 LYS 93 HD1 LYS 93 15.745 -2.420 -8.420 753 HE2 LYS 93 HE2 LYS 93 13.358 -2.588 -9.459 754 HE3 LYS 93 HE1 LYS 93 13.064 -1.070 -8.612 755 HZ1 LYS 93 HZ1 LYS 93 13.799 -0.584 -10.815 756 HZ2 LYS 93 HZ2 LYS 93 15.162 -1.583 -10.649 757 HZ3 LYS 93 HZ3 LYS 93 15.042 -0.159 -9.744 758 H ASN 94 HN ASN 94 15.645 -7.016 -4.022 759 HA ASN 94 HA ASN 94 18.382 -6.248 -3.530 760 HB2 ASN 94 HB2 ASN 94 18.130 -6.846 -1.031 761 HB3 ASN 94 HB1 ASN 94 17.640 -5.243 -1.558 762 HD21 ASN 94 HD21 ASN 94 16.396 -5.185 0.394 763 HD22 ASN 94 HD22 ASN 94 14.855 -5.965 0.474 764 H LYS 95 HN LYS 95 19.725 -7.948 -2.909 765 HA LYS 95 HA LYS 95 18.589 -10.631 -3.334 766 HB2 LYS 95 HB2 LYS 95 21.434 -9.659 -3.437 767 HB3 LYS 95 HB1 LYS 95 20.912 -11.302 -3.773 768 HG2 LYS 95 HG2 LYS 95 19.657 -10.554 -5.695 769 HG3 LYS 95 HG1 LYS 95 20.032 -8.871 -5.324 770 HD2 LYS 95 HD2 LYS 95 21.528 -9.463 -7.036 771 HD3 LYS 95 HD1 LYS 95 22.479 -9.530 -5.553 772 HE2 LYS 95 HE2 LYS 95 22.023 -12.000 -5.493 773 HE3 LYS 95 HE1 LYS 95 21.318 -11.837 -7.105 774 HZ1 LYS 95 HZ1 LYS 95 24.109 -11.121 -6.375 775 HZ2 LYS 95 HZ2 LYS 95 23.421 -11.018 -7.921 776 HZ3 LYS 95 HZ3 LYS 95 23.636 -12.533 -7.189 777 H GLU 96 HN GLU 96 19.232 -8.615 -0.951 778 HA GLU 96 HA GLU 96 20.250 -10.628 0.915 779 HB2 GLU 96 HB2 GLU 96 20.886 -8.717 2.386 780 HB3 GLU 96 HB1 GLU 96 21.745 -8.715 0.854 781 HG2 GLU 96 HG2 GLU 96 20.539 -6.885 0.049 782 HG3 GLU 96 HG1 GLU 96 19.289 -7.053 1.288 783 H GLU 97 HN GLU 97 19.403 -8.858 3.128 784 HA GLU 97 HA GLU 97 17.271 -9.988 4.220 785 HB2 GLU 97 HB2 GLU 97 17.922 -7.043 4.247 786 HB3 GLU 97 HB1 GLU 97 16.792 -7.811 5.357 787 HG2 GLU 97 HG2 GLU 97 19.733 -8.421 5.097 788 HG3 GLU 97 HG1 GLU 97 18.964 -7.508 6.393 789 HA PRO 98 HA PRO 98 13.192 -9.901 3.123 790 HB2 PRO 98 HB2 PRO 98 12.650 -7.103 3.998 791 HB3 PRO 98 HB1 PRO 98 11.732 -8.582 4.302 792 HG2 PRO 98 HG2 PRO 98 13.579 -7.384 6.005 793 HG3 PRO 98 HG1 PRO 98 12.907 -9.006 6.181 794 HD2 PRO 98 HD2 PRO 98 15.610 -8.362 5.691 795 HD3 PRO 98 HD1 PRO 98 14.859 -9.965 5.526 796 H ARG 99 HN ARG 99 12.659 -9.939 1.110 797 HA ARG 99 HA ARG 99 13.380 -7.771 -0.672 798 HB2 ARG 99 HB2 ARG 99 12.357 -10.551 -1.151 799 HB3 ARG 99 HB1 ARG 99 12.695 -9.397 -2.442 800 HG2 ARG 99 HG2 ARG 99 14.991 -9.232 -1.778 801 HG3 ARG 99 HG1 ARG 99 14.695 -10.262 -0.386 802 HD2 ARG 99 HD2 ARG 99 15.816 -11.346 -2.348 803 HD3 ARG 99 HD1 ARG 99 14.392 -12.176 -1.793 804 HE ARG 99 HE ARG 99 13.444 -10.542 -3.740 805 HH11 ARG 99 HH11 ARG 99 16.050 -12.879 -3.619 806 HH12 ARG 99 HH12 ARG 99 15.964 -13.247 -5.318 807 HH21 ARG 99 HH21 ARG 99 13.337 -11.016 -5.972 808 HH22 ARG 99 HH22 ARG 99 14.419 -12.193 -6.650 809 H LYS 100 HN LYS 100 10.919 -8.333 1.259 810 HA LYS 100 HA LYS 100 9.133 -6.675 -0.332 811 HB2 LYS 100 HB2 LYS 100 7.164 -8.062 0.131 812 HB3 LYS 100 HB1 LYS 100 8.339 -8.943 -0.837 813 HG2 LYS 100 HG2 LYS 100 8.956 -10.317 0.940 814 HG3 LYS 100 HG1 LYS 100 8.298 -9.211 2.145 815 HD2 LYS 100 HD2 LYS 100 6.799 -11.019 2.086 816 HD3 LYS 100 HD1 LYS 100 6.012 -9.745 1.161 817 HE2 LYS 100 HE2 LYS 100 7.641 -11.919 -0.133 818 HE3 LYS 100 HE1 LYS 100 5.922 -12.097 0.202 819 HZ1 LYS 100 HZ1 LYS 100 5.515 -10.118 -1.157 820 HZ2 LYS 100 HZ2 LYS 100 6.254 -11.367 -2.041 821 HZ3 LYS 100 HZ3 LYS 100 7.174 -10.041 -1.532 822 H VAL 101 HN VAL 101 7.714 -5.467 0.923 823 HA VAL 101 HA VAL 101 7.804 -5.952 3.819 824 HB VAL 101 HB VAL 101 9.010 -3.864 3.159 825 HG11 VAL 101 HG11 VAL 101 7.843 -3.087 1.269 826 HG12 VAL 101 HG12 VAL 101 7.542 -1.902 2.547 827 HG13 VAL 101 HG13 VAL 101 6.298 -3.084 2.134 828 HG21 VAL 101 HG21 VAL 101 7.999 -2.454 4.851 829 HG22 VAL 101 HG22 VAL 101 8.034 -4.139 5.380 830 HG23 VAL 101 HG23 VAL 101 6.527 -3.428 4.803 831 H ARG 102 HN ARG 102 5.825 -6.006 4.839 832 HA ARG 102 HA ARG 102 3.501 -5.684 3.065 833 HB2 ARG 102 HB2 ARG 102 3.987 -8.018 3.885 834 HB3 ARG 102 HB1 ARG 102 3.658 -7.441 5.513 835 HG2 ARG 102 HG2 ARG 102 1.397 -6.870 4.936 836 HG3 ARG 102 HG1 ARG 102 1.669 -7.289 3.251 837 HD2 ARG 102 HD2 ARG 102 0.549 -9.138 4.135 838 HD3 ARG 102 HD1 ARG 102 2.242 -9.630 4.126 839 HE ARG 102 HE ARG 102 1.921 -8.575 6.598 840 HH11 ARG 102 HH11 ARG 102 0.187 -11.020 4.780 841 HH12 ARG 102 HH12 ARG 102 -0.330 -11.886 6.198 842 HH21 ARG 102 HH21 ARG 102 1.202 -9.685 8.459 843 HH22 ARG 102 HH22 ARG 102 0.228 -11.115 8.285 844 H PHE 103 HN PHE 103 2.228 -4.065 3.540 845 HA PHE 103 HA PHE 103 2.295 -3.022 6.290 846 HB2 PHE 103 HB2 PHE 103 1.578 -1.637 3.700 847 HB3 PHE 103 HB1 PHE 103 1.492 -0.893 5.290 848 HD1 PHE 103 HD1 PHE 103 3.996 -1.846 6.523 849 HD2 PHE 103 HD2 PHE 103 3.214 -0.465 2.574 850 HE1 PHE 103 HE1 PHE 103 6.330 -1.084 6.329 851 HE2 PHE 103 HE2 PHE 103 5.545 0.285 2.372 852 HZ PHE 103 HZ PHE 103 7.104 -0.019 4.251 853 H ASP 104 HN ASP 104 0.668 -3.989 7.346 854 HA ASP 104 HA ASP 104 -1.852 -4.592 6.129 855 HB2 ASP 104 HB2 ASP 104 -1.143 -4.492 9.071 856 HB3 ASP 104 HB1 ASP 104 -2.561 -5.258 8.370 857 H TYR 105 HN TYR 105 -2.574 -2.631 5.289 858 HA TYR 105 HA TYR 105 -2.809 -0.365 7.110 859 HB2 TYR 105 HB2 TYR 105 -1.873 0.041 4.879 860 HB3 TYR 105 HB1 TYR 105 -3.339 -0.599 4.135 861 HD1 TYR 105 HD1 TYR 105 -2.203 2.112 6.447 862 HD2 TYR 105 HD2 TYR 105 -5.032 0.830 3.554 863 HE1 TYR 105 HE1 TYR 105 -3.217 4.355 6.459 864 HE2 TYR 105 HE2 TYR 105 -6.043 3.055 3.536 865 HH TYR 105 HH TYR 105 -6.134 5.024 5.453 866 H ASP 106 HN ASP 106 -4.680 0.377 7.914 867 HA ASP 106 HA ASP 106 -6.953 -1.393 7.726 868 HB2 ASP 106 HB2 ASP 106 -6.166 -0.342 9.874 869 HB3 ASP 106 HB1 ASP 106 -6.746 1.202 9.259 870 H LEU 107 HN LEU 107 -8.265 -1.201 6.019 871 HA LEU 107 HA LEU 107 -8.729 1.357 4.757 872 HB2 LEU 107 HB2 LEU 107 -9.191 -1.448 4.153 873 HB3 LEU 107 HB1 LEU 107 -10.585 -0.459 3.760 874 HG LEU 107 HG LEU 107 -9.038 0.987 2.386 875 HD11 LEU 107 HD11 LEU 107 -6.935 -0.095 1.669 876 HD12 LEU 107 HD12 LEU 107 -7.136 -1.263 2.979 877 HD13 LEU 107 HD13 LEU 107 -6.923 0.450 3.348 878 HD21 LEU 107 HD21 LEU 107 -8.867 -0.705 0.554 879 HD22 LEU 107 HD22 LEU 107 -10.466 -0.556 1.291 880 HD23 LEU 107 HD23 LEU 107 -9.424 -1.914 1.716 881 H PHE 108 HN PHE 108 -9.925 2.697 6.055 882 HA PHE 108 HA PHE 108 -12.485 1.615 7.008 883 HB2 PHE 108 HB2 PHE 108 -12.668 3.450 8.551 884 HB3 PHE 108 HB1 PHE 108 -11.079 2.732 8.756 885 HD1 PHE 108 HD2 PHE 108 -12.899 5.611 7.320 886 HD2 PHE 108 HD1 PHE 108 -9.113 4.041 8.474 887 HE1 PHE 108 HE2 PHE 108 -11.900 7.841 7.057 888 HE2 PHE 108 HE1 PHE 108 -8.115 6.278 8.223 889 HZ PHE 108 HZ PHE 108 -9.504 8.177 7.511 890 H LEU 109 HN LEU 109 -14.390 2.469 6.351 891 HA LEU 109 HA LEU 109 -14.259 4.647 4.357 892 HB2 LEU 109 HB2 LEU 109 -16.416 2.530 4.552 893 HB3 LEU 109 HB1 LEU 109 -16.167 3.689 3.259 894 HG LEU 109 HG LEU 109 -14.384 1.337 3.905 895 HD11 LEU 109 HD11 LEU 109 -16.540 0.786 2.811 896 HD12 LEU 109 HD12 LEU 109 -15.132 0.422 1.818 897 HD13 LEU 109 HD13 LEU 109 -16.096 1.860 1.487 898 HD21 LEU 109 HD21 LEU 109 -14.149 3.435 1.756 899 HD22 LEU 109 HD22 LEU 109 -13.194 1.954 1.841 900 HD23 LEU 109 HD23 LEU 109 -13.042 3.174 3.105 901 H HIS 110 HN HIS 110 -15.893 6.292 4.612 902 HA HIS 110 HA HIS 110 -17.063 6.297 7.299 903 HB2 HIS 110 HB2 HIS 110 -16.311 8.505 5.415 904 HB3 HIS 110 HB1 HIS 110 -17.471 8.795 6.706 905 HD1 HIS 110 HD1 HIS 110 -14.884 10.348 6.767 906 HD2 HIS 110 HD2 HIS 110 -15.360 6.653 8.628 907 HE1 HIS 110 HE1 HIS 110 -13.119 10.255 8.555 908 HE2 HIS 110 HE2 HIS 110 -13.351 7.975 9.601 909 H LEU 111 HN LEU 111 -19.172 7.699 7.373 910 HA LEU 111 HA LEU 111 -21.074 6.000 6.075 911 HB2 LEU 111 HB2 LEU 111 -21.049 7.943 8.256 912 HB3 LEU 111 HB1 LEU 111 -22.540 7.950 7.332 913 HG LEU 111 HG LEU 111 -22.543 6.453 9.351 914 HD11 LEU 111 HD11 LEU 111 -23.517 4.499 8.099 915 HD12 LEU 111 HD12 LEU 111 -23.032 5.311 6.611 916 HD13 LEU 111 HD13 LEU 111 -24.195 6.074 7.694 917 HD21 LEU 111 HD21 LEU 111 -20.709 4.767 7.655 918 HD22 LEU 111 HD22 LEU 111 -21.397 4.329 9.222 919 HD23 LEU 111 HD23 LEU 111 -20.226 5.644 9.109 920 H GLU 112 HN GLU 112 -22.855 6.630 4.839 921 HA GLU 112 HA GLU 112 -22.402 8.238 2.628 922 HB2 GLU 112 HB2 GLU 112 -24.211 6.450 3.018 923 HB3 GLU 112 HB1 GLU 112 -25.146 7.729 3.768 924 HG2 GLU 112 HG2 GLU 112 -25.175 8.987 1.718 925 HG3 GLU 112 HG1 GLU 112 -24.120 7.808 0.937 926 H GLY 113 HN GLY 113 -22.097 10.374 2.563 927 HA2 GLY 113 HA2 GLY 113 -23.064 12.598 2.836 928 HA3 GLY 113 HA1 GLY 113 -23.646 12.080 4.414 929 H HIS 114 HN HIS 114 -20.552 11.026 3.481 930 HA HIS 114 HA HIS 114 -19.331 12.745 5.547 931 HB2 HIS 114 HB2 HIS 114 -17.459 11.187 5.566 932 HB3 HIS 114 HB1 HIS 114 -18.930 10.220 5.672 933 HD1 HIS 114 HD1 HIS 114 -15.963 10.894 3.560 934 HD2 HIS 114 HD2 HIS 114 -19.522 8.775 3.261 935 HE1 HIS 114 HE1 HIS 114 -15.676 9.370 1.587 936 HE2 HIS 114 HE2 HIS 114 -17.942 8.330 1.269 937 HA PRO 115 HA PRO 115 -17.105 15.205 2.384 938 HB2 PRO 115 HB2 PRO 115 -15.215 15.311 4.714 939 HB3 PRO 115 HB1 PRO 115 -15.732 16.619 3.642 940 HG2 PRO 115 HG2 PRO 115 -16.762 16.457 6.054 941 HG3 PRO 115 HG1 PRO 115 -17.825 16.799 4.672 942 HD2 PRO 115 HD2 PRO 115 -17.429 14.256 6.180 943 HD3 PRO 115 HD1 PRO 115 -18.931 14.961 5.543 944 HA PRO 116 HA PRO 116 -14.531 12.146 0.467 945 HB2 PRO 116 HB2 PRO 116 -12.532 14.382 0.456 946 HB3 PRO 116 HB1 PRO 116 -12.939 13.237 -0.830 947 HG2 PRO 116 HG2 PRO 116 -13.950 15.702 -0.833 948 HG3 PRO 116 HG1 PRO 116 -14.924 14.312 -1.343 949 HD2 PRO 116 HD2 PRO 116 -15.122 15.952 1.103 950 HD3 PRO 116 HD1 PRO 116 -16.359 14.958 0.300 951 H VAL 117 HN VAL 117 -13.436 10.554 1.332 952 HA VAL 117 HA VAL 117 -11.958 10.863 3.805 953 HB VAL 117 HB VAL 117 -12.770 8.506 2.114 954 HG11 VAL 117 HG11 VAL 117 -10.786 8.414 4.379 955 HG12 VAL 117 HG12 VAL 117 -10.491 7.996 2.700 956 HG13 VAL 117 HG13 VAL 117 -11.577 7.010 3.676 957 HG21 VAL 117 HG21 VAL 117 -13.809 7.742 4.186 958 HG22 VAL 117 HG22 VAL 117 -14.385 9.345 3.721 959 HG23 VAL 117 HG23 VAL 117 -13.202 9.175 5.020 960 H ASN 118 HN ASN 118 -9.820 11.258 3.832 961 HA ASN 118 HA ASN 118 -8.183 10.260 1.639 962 HB2 ASN 118 HB2 ASN 118 -9.025 12.572 1.077 963 HB3 ASN 118 HB1 ASN 118 -8.090 13.171 2.443 964 HD21 ASN 118 HD21 ASN 118 -5.715 12.687 2.375 965 HD22 ASN 118 HD22 ASN 118 -4.941 12.675 0.826 966 H HIS 119 HN HIS 119 -6.770 9.051 2.774 967 HA HIS 119 HA HIS 119 -5.387 10.359 5.017 968 HB2 HIS 119 HB2 HIS 119 -7.097 8.663 5.766 969 HB3 HIS 119 HB1 HIS 119 -6.129 7.442 4.949 970 HD1 HIS 119 HD1 HIS 119 -4.511 6.277 6.389 971 HD2 HIS 119 HD2 HIS 119 -5.407 10.076 7.826 972 HE1 HIS 119 HE1 HIS 119 -3.236 6.504 8.546 973 HE2 HIS 119 HE2 HIS 119 -3.668 8.866 9.316 974 H LEU 120 HN LEU 120 -3.247 10.058 5.132 975 HA LEU 120 HA LEU 120 -1.925 7.964 3.630 976 HB2 LEU 120 HB2 LEU 120 -1.668 10.880 3.049 977 HB3 LEU 120 HB1 LEU 120 -0.237 9.881 2.931 978 HG LEU 120 HG LEU 120 -2.751 9.191 1.437 979 HD11 LEU 120 HD11 LEU 120 -0.852 10.249 -0.321 980 HD12 LEU 120 HD12 LEU 120 -0.988 11.418 0.994 981 HD13 LEU 120 HD13 LEU 120 -2.424 10.932 0.090 982 HD21 LEU 120 HD21 LEU 120 -0.742 7.600 1.873 983 HD22 LEU 120 HD22 LEU 120 0.070 8.590 0.657 984 HD23 LEU 120 HD23 LEU 120 -1.415 7.730 0.246 985 H ARG 121 HN ARG 121 -0.027 7.296 4.534 986 HA ARG 121 HA ARG 121 1.136 8.827 6.721 987 HB2 ARG 121 HB2 ARG 121 1.056 6.862 8.250 988 HB3 ARG 121 HB1 ARG 121 -0.516 7.558 7.911 989 HG2 ARG 121 HG2 ARG 121 -1.018 5.350 7.736 990 HG3 ARG 121 HG1 ARG 121 -0.574 5.675 6.068 991 HD2 ARG 121 HD2 ARG 121 0.393 3.583 7.139 992 HD3 ARG 121 HD1 ARG 121 1.533 4.644 6.311 993 HE ARG 121 HE ARG 121 2.042 5.537 8.610 994 HH11 ARG 121 HH11 ARG 121 0.715 2.313 8.227 995 HH12 ARG 121 HH12 ARG 121 1.514 1.694 9.642 996 HH21 ARG 121 HH21 ARG 121 3.052 4.731 10.471 997 HH22 ARG 121 HH22 ARG 121 2.835 3.063 10.915 998 H CYS 122 HN CYS 122 3.297 8.258 7.184 999 HA CYS 122 HA CYS 122 4.495 6.693 5.008 1000 HB2 CYS 122 HB2 CYS 122 6.547 8.040 5.463 1001 HB3 CYS 122 HB1 CYS 122 5.172 8.974 4.894 1002 HG CYS 122 HG CYS 122 6.027 10.707 6.677 1003 H GLU 123 HN GLU 123 5.634 4.956 5.389 1004 HA GLU 123 HA GLU 123 6.331 4.216 8.144 1005 HB2 GLU 123 HB2 GLU 123 6.077 2.647 5.572 1006 HB3 GLU 123 HB1 GLU 123 6.735 1.958 7.053 1007 HG2 GLU 123 HG2 GLU 123 4.090 3.280 7.191 1008 HG3 GLU 123 HG1 GLU 123 4.181 1.702 6.397 1009 H LYS 124 HN LYS 124 8.482 3.213 8.471 1010 HA LYS 124 HA LYS 124 10.476 4.160 6.534 1011 HB2 LYS 124 HB2 LYS 124 10.620 5.739 8.323 1012 HB3 LYS 124 HB1 LYS 124 10.568 4.455 9.529 1013 HG2 LYS 124 HG2 LYS 124 12.731 3.610 8.465 1014 HG3 LYS 124 HG1 LYS 124 12.804 5.173 7.658 1015 HD2 LYS 124 HD2 LYS 124 14.165 5.128 9.653 1016 HD3 LYS 124 HD1 LYS 124 12.845 6.280 9.799 1017 HE2 LYS 124 HE2 LYS 124 11.580 4.762 11.139 1018 HE3 LYS 124 HE1 LYS 124 12.712 3.459 10.774 1019 HZ1 LYS 124 HZ1 LYS 124 14.422 4.752 12.004 1020 HZ2 LYS 124 HZ2 LYS 124 13.129 4.246 12.977 1021 HZ3 LYS 124 HZ3 LYS 124 13.218 5.857 12.456 1022 H LEU 125 HN LEU 125 12.021 2.765 6.037 1023 HA LEU 125 HA LEU 125 12.273 0.311 7.651 1024 HB2 LEU 125 HB2 LEU 125 12.807 0.566 4.695 1025 HB3 LEU 125 HB1 LEU 125 12.669 -0.908 5.629 1026 HG LEU 125 HG LEU 125 10.270 0.839 5.567 1027 HD11 LEU 125 HD11 LEU 125 10.880 0.999 3.246 1028 HD12 LEU 125 HD12 LEU 125 9.569 -0.175 3.404 1029 HD13 LEU 125 HD13 LEU 125 11.225 -0.733 3.182 1030 HD21 LEU 125 HD21 LEU 125 9.200 -1.429 5.308 1031 HD22 LEU 125 HD22 LEU 125 10.119 -1.186 6.797 1032 HD23 LEU 125 HD23 LEU 125 10.817 -2.119 5.474 1033 H THR 126 HN THR 126 14.135 0.600 8.797 1034 HA THR 126 HA THR 126 16.409 1.984 7.571 1035 HB THR 126 HB THR 126 16.491 0.817 10.326 1036 HG1 THR 126 HG1 THR 126 15.697 3.200 10.747 1037 HG21 THR 126 HG21 THR 126 18.404 1.955 9.060 1038 HG22 THR 126 HG22 THR 126 18.081 2.472 10.718 1039 HG23 THR 126 HG23 THR 126 17.525 3.455 9.361 1040 H PHE 127 HN PHE 127 17.873 0.834 6.489 1041 HA PHE 127 HA PHE 127 18.252 -1.985 7.240 1042 HB2 PHE 127 HB2 PHE 127 18.943 -0.597 4.643 1043 HB3 PHE 127 HB1 PHE 127 19.134 -2.320 4.979 1044 HD1 PHE 127 HD1 PHE 127 17.198 -3.775 5.152 1045 HD2 PHE 127 HD2 PHE 127 16.782 0.353 4.234 1046 HE1 PHE 127 HE1 PHE 127 14.878 -4.169 4.451 1047 HE2 PHE 127 HE2 PHE 127 14.468 -0.022 3.529 1048 HZ PHE 127 HZ PHE 127 13.502 -2.287 3.646 1049 H ASN 128 HN ASN 128 19.921 -2.332 8.482 1050 HA ASN 128 HA ASN 128 22.066 -0.389 8.663 1051 HB2 ASN 128 HB2 ASN 128 21.538 -2.937 10.192 1052 HB3 ASN 128 HB1 ASN 128 22.858 -1.821 10.523 1053 HD21 ASN 128 HD21 ASN 128 19.401 -2.285 10.614 1054 HD22 ASN 128 HD22 ASN 128 19.063 -0.966 11.695 1055 H ASN 129 HN ASN 129 23.748 -0.482 7.386 1056 HA ASN 129 HA ASN 129 25.495 -1.197 6.142 1057 HB2 ASN 129 HB2 ASN 129 25.322 -3.628 7.939 1058 HB3 ASN 129 HB1 ASN 129 26.682 -3.228 6.879 1059 HD21 ASN 129 HD21 ASN 129 26.125 -3.373 9.973 1060 HD22 ASN 129 HD22 ASN 129 26.897 -1.934 10.541 1061 HA PRO 130 HA PRO 130 23.054 -4.059 3.466 1062 HB2 PRO 130 HB2 PRO 130 22.152 -2.303 1.633 1063 HB3 PRO 130 HB1 PRO 130 21.298 -2.597 3.150 1064 HG2 PRO 130 HG2 PRO 130 22.918 -0.268 2.321 1065 HG3 PRO 130 HG1 PRO 130 21.585 -0.360 3.481 1066 HD2 PRO 130 HD2 PRO 130 24.373 -0.313 4.043 1067 HD3 PRO 130 HD1 PRO 130 23.046 -0.540 5.193 1068 H THR 131 HN THR 131 23.686 -4.836 1.415 1069 HA THR 131 HA THR 131 26.361 -4.382 0.662 1070 HB THR 131 HB THR 131 25.291 -6.508 0.121 1071 HG1 THR 131 HG1 THR 131 26.986 -5.919 -1.256 1072 HG21 THR 131 HG21 THR 131 23.016 -5.816 -0.318 1073 HG22 THR 131 HG22 THR 131 23.644 -6.641 -1.747 1074 HG23 THR 131 HG23 THR 131 23.534 -4.880 -1.723 1075 H GLU 132 HN GLU 132 27.142 -3.520 -1.439 1076 HA GLU 132 HA GLU 132 26.525 -0.849 -1.761 1077 HB2 GLU 132 HB2 GLU 132 28.549 -2.040 -2.686 1078 HB3 GLU 132 HB1 GLU 132 27.524 -2.589 -4.008 1079 HG2 GLU 132 HG2 GLU 132 27.032 -0.231 -4.547 1080 HG3 GLU 132 HG1 GLU 132 28.193 0.251 -3.312 1081 H ASP 133 HN ASP 133 25.258 -3.597 -3.621 1082 HA ASP 133 HA ASP 133 23.877 -2.149 -5.591 1083 HB2 ASP 133 HB2 ASP 133 24.037 -4.436 -6.069 1084 HB3 ASP 133 HB1 ASP 133 23.448 -4.921 -4.478 1085 H PHE 134 HN PHE 134 22.625 -3.458 -2.530 1086 HA PHE 134 HA PHE 134 20.034 -2.361 -2.831 1087 HB2 PHE 134 HB2 PHE 134 20.805 -4.235 -1.189 1088 HB3 PHE 134 HB1 PHE 134 21.374 -2.912 -0.169 1089 HD1 PHE 134 HD1 PHE 134 18.415 -2.930 -2.299 1090 HD2 PHE 134 HD2 PHE 134 19.872 -3.062 1.676 1091 HE1 PHE 134 HE1 PHE 134 16.153 -2.604 -1.472 1092 HE2 PHE 134 HE2 PHE 134 17.588 -2.756 2.525 1093 HZ PHE 134 HZ PHE 134 15.723 -2.529 0.934 1094 H ARG 135 HN ARG 135 22.846 -1.367 -0.992 1095 HA ARG 135 HA ARG 135 22.060 0.996 0.142 1096 HB2 ARG 135 HB2 ARG 135 24.093 0.154 0.731 1097 HB3 ARG 135 HB1 ARG 135 24.616 -0.030 -0.947 1098 HG2 ARG 135 HG2 ARG 135 25.670 1.953 -0.786 1099 HG3 ARG 135 HG1 ARG 135 24.124 2.714 -0.456 1100 HD2 ARG 135 HD2 ARG 135 26.078 2.877 1.284 1101 HD3 ARG 135 HD1 ARG 135 24.419 2.619 1.824 1102 HE ARG 135 HE ARG 135 25.245 0.113 1.635 1103 HH11 ARG 135 HH11 ARG 135 26.925 2.885 2.938 1104 HH12 ARG 135 HH12 ARG 135 27.845 1.951 4.081 1105 HH21 ARG 135 HH21 ARG 135 26.434 -1.127 3.122 1106 HH22 ARG 135 HH22 ARG 135 27.547 -0.338 4.209 1107 H ARG 136 HN ARG 136 23.421 0.585 -3.088 1108 HA ARG 136 HA ARG 136 23.516 3.207 -3.913 1109 HB2 ARG 136 HB2 ARG 136 23.436 0.544 -5.150 1110 HB3 ARG 136 HB1 ARG 136 23.059 1.910 -6.155 1111 HG2 ARG 136 HG2 ARG 136 25.163 2.798 -6.030 1112 HG3 ARG 136 HG1 ARG 136 25.501 2.000 -4.491 1113 HD2 ARG 136 HD2 ARG 136 26.771 1.003 -6.334 1114 HD3 ARG 136 HD1 ARG 136 25.650 -0.140 -5.597 1115 HE ARG 136 HE ARG 136 24.279 0.918 -7.722 1116 HH11 ARG 136 HH11 ARG 136 27.352 -0.735 -7.304 1117 HH12 ARG 136 HH12 ARG 136 27.265 -1.538 -8.843 1118 HH21 ARG 136 HH21 ARG 136 24.183 -0.137 -9.764 1119 HH22 ARG 136 HH22 ARG 136 25.487 -1.188 -10.239 1120 H LYS 137 HN LYS 137 20.923 0.829 -4.317 1121 HA LYS 137 HA LYS 137 19.246 2.499 -5.851 1122 HB2 LYS 137 HB2 LYS 137 18.506 0.167 -4.086 1123 HB3 LYS 137 HB1 LYS 137 17.472 0.904 -5.300 1124 HG2 LYS 137 HG2 LYS 137 18.949 0.193 -7.063 1125 HG3 LYS 137 HG1 LYS 137 20.110 -0.424 -5.884 1126 HD2 LYS 137 HD2 LYS 137 18.298 -1.964 -5.067 1127 HD3 LYS 137 HD1 LYS 137 17.339 -1.450 -6.460 1128 HE2 LYS 137 HE2 LYS 137 18.677 -2.536 -7.960 1129 HE3 LYS 137 HE1 LYS 137 20.108 -2.428 -6.936 1130 HZ1 LYS 137 HZ1 LYS 137 18.075 -4.011 -5.726 1131 HZ2 LYS 137 HZ2 LYS 137 19.689 -4.404 -6.065 1132 HZ3 LYS 137 HZ3 LYS 137 18.494 -4.617 -7.254 1133 H LEU 138 HN LEU 138 19.325 1.712 -2.429 1134 HA LEU 138 HA LEU 138 17.144 3.219 -1.561 1135 HB2 LEU 138 HB2 LEU 138 19.696 2.763 -0.037 1136 HB3 LEU 138 HB1 LEU 138 18.132 3.159 0.639 1137 HG LEU 138 HG LEU 138 18.986 0.568 -0.622 1138 HD11 LEU 138 HD11 LEU 138 19.517 1.159 1.782 1139 HD12 LEU 138 HD12 LEU 138 18.665 -0.359 1.502 1140 HD13 LEU 138 HD13 LEU 138 17.783 1.057 2.078 1141 HD21 LEU 138 HD21 LEU 138 16.227 1.436 0.179 1142 HD22 LEU 138 HD22 LEU 138 16.692 -0.222 -0.175 1143 HD23 LEU 138 HD23 LEU 138 16.769 1.006 -1.438 1144 H LEU 139 HN LEU 139 20.536 4.154 -1.958 1145 HA LEU 139 HA LEU 139 20.195 6.774 -0.893 1146 HB2 LEU 139 HB2 LEU 139 22.392 5.623 -2.612 1147 HB3 LEU 139 HB1 LEU 139 22.467 7.168 -1.781 1148 HG LEU 139 HG LEU 139 22.156 4.502 -0.401 1149 HD11 LEU 139 HD11 LEU 139 24.321 4.258 -0.982 1150 HD12 LEU 139 HD12 LEU 139 24.576 5.378 0.367 1151 HD13 LEU 139 HD13 LEU 139 24.540 5.988 -1.289 1152 HD21 LEU 139 HD21 LEU 139 21.207 6.434 0.768 1153 HD22 LEU 139 HD22 LEU 139 22.780 7.232 0.706 1154 HD23 LEU 139 HD23 LEU 139 22.584 5.737 1.623 1155 H LYS 140 HN LYS 140 19.931 5.384 -4.076 1156 HA LYS 140 HA LYS 140 19.966 7.804 -5.541 1157 HB2 LYS 140 HB2 LYS 140 19.428 4.987 -6.073 1158 HB3 LYS 140 HB1 LYS 140 18.453 6.081 -7.041 1159 HG2 LYS 140 HG2 LYS 140 20.421 7.167 -7.901 1160 HG3 LYS 140 HG1 LYS 140 21.448 6.211 -6.827 1161 HD2 LYS 140 HD2 LYS 140 19.794 4.451 -8.359 1162 HD3 LYS 140 HD1 LYS 140 20.610 5.561 -9.436 1163 HE2 LYS 140 HE2 LYS 140 21.828 3.704 -7.468 1164 HE3 LYS 140 HE1 LYS 140 21.958 3.635 -9.210 1165 HZ1 LYS 140 HZ1 LYS 140 23.091 5.767 -7.475 1166 HZ2 LYS 140 HZ2 LYS 140 23.194 5.714 -9.167 1167 HZ3 LYS 140 HZ3 LYS 140 23.968 4.531 -8.235 1168 H ALA 141 HN ALA 141 17.524 6.074 -3.823 1169 HA ALA 141 HA ALA 141 15.200 7.244 -4.867 1170 HB1 ALA 141 HB1 ALA 141 14.102 6.394 -2.966 1171 HB2 ALA 141 HB2 ALA 141 15.575 6.437 -2.000 1172 HB3 ALA 141 HB3 ALA 141 15.412 5.266 -3.309 1173 H1 GLY 212 HT1 GLY 212 -21.917 11.515 10.522 1174 H2 GLY 212 HT2 GLY 212 -21.090 12.997 10.461 1175 H3 GLY 212 HT3 GLY 212 -21.322 12.219 11.947 1176 HA2 GLY 212 HA1 GLY 212 -19.689 11.170 9.704 1177 HA3 GLY 212 HA2 GLY 212 -19.049 11.960 11.138 1178 H GLY 213 HN GLY 213 -18.908 9.128 9.956 1179 HA2 GLY 213 HA2 GLY 213 -18.773 7.827 12.481 1180 HA3 GLY 213 HA1 GLY 213 -20.195 7.306 11.591 1181 H LYS 214 HN LYS 214 -18.266 5.526 12.305 1182 HA LYS 214 HA LYS 214 -16.622 5.008 9.955 1183 HB2 LYS 214 HB2 LYS 214 -15.740 4.611 12.253 1184 HB3 LYS 214 HB1 LYS 214 -16.977 3.387 12.491 1185 HG2 LYS 214 HG2 LYS 214 -16.006 2.123 10.580 1186 HG3 LYS 214 HG1 LYS 214 -14.701 3.308 10.523 1187 HD2 LYS 214 HD2 LYS 214 -15.391 1.555 12.882 1188 HD3 LYS 214 HD1 LYS 214 -14.047 1.302 11.770 1189 HE2 LYS 214 HE2 LYS 214 -14.419 3.724 13.531 1190 HE3 LYS 214 HE1 LYS 214 -13.352 2.367 13.886 1191 HZ1 LYS 214 HZ1 LYS 214 -12.102 2.876 11.871 1192 HZ2 LYS 214 HZ2 LYS 214 -12.133 4.204 12.923 1193 HZ3 LYS 214 HZ3 LYS 214 -13.125 4.192 11.551 1194 H ALA 215 HN ALA 215 -17.331 3.805 8.312 1195 HA ALA 215 HA ALA 215 -19.910 2.640 8.276 1196 HB1 ALA 215 HB1 ALA 215 -19.272 1.755 6.088 1197 HB2 ALA 215 HB2 ALA 215 -17.588 2.180 6.398 1198 HB3 ALA 215 HB3 ALA 215 -18.805 3.449 6.245 1199 HA PRO 216 HA PRO 216 -19.329 -1.328 10.084 1200 HB2 PRO 216 HB2 PRO 216 -20.770 -2.875 8.288 1201 HB3 PRO 216 HB1 PRO 216 -21.456 -1.988 9.650 1202 HG2 PRO 216 HG2 PRO 216 -21.373 -1.269 6.767 1203 HG3 PRO 216 HG1 PRO 216 -22.630 -0.947 7.971 1204 HD2 PRO 216 HD2 PRO 216 -20.906 0.949 7.103 1205 HD3 PRO 216 HD1 PRO 216 -21.564 0.948 8.751 1206 H ARG 217 HN ARG 217 -18.341 -3.407 9.737 1207 HA ARG 217 HA ARG 217 -16.652 -3.476 7.327 1208 HB2 ARG 217 HB2 ARG 217 -15.795 -3.979 10.187 1209 HB3 ARG 217 HB1 ARG 217 -14.782 -4.252 8.774 1210 HG2 ARG 217 HG2 ARG 217 -14.793 -1.917 8.240 1211 HG3 ARG 217 HG1 ARG 217 -15.961 -1.587 9.519 1212 HD2 ARG 217 HD2 ARG 217 -13.749 -0.949 10.240 1213 HD3 ARG 217 HD1 ARG 217 -14.314 -2.326 11.184 1214 HE ARG 217 HE ARG 217 -12.869 -3.724 9.743 1215 HH11 ARG 217 HH11 ARG 217 -12.281 -0.283 9.859 1216 HH12 ARG 217 HH12 ARG 217 -10.567 -0.423 9.606 1217 HH21 ARG 217 HH21 ARG 217 -10.591 -3.922 9.419 1218 HH22 ARG 217 HH22 ARG 217 -9.611 -2.482 9.390 1219 H1 KCR 218 HN KCR 218 -15.511 -5.674 7.178 1220 H4 KCR 218 HA KCR 218 -17.614 -7.690 7.534 1221 H5 KCR 218 HB1 KCR 218 -16.519 -8.905 5.695 1222 H6 KCR 218 HB2 KCR 218 -15.278 -7.658 5.613 1223 H7 KCR 218 HG1 KCR 218 -16.951 -6.009 4.997 1224 H8 KCR 218 HG2 KCR 218 -18.217 -7.230 5.121 1225 H9 KCR 218 HD1 KCR 218 -17.257 -8.481 3.296 1226 H10 KCR 218 HD2 KCR 218 -15.888 -7.367 3.215 1227 H11 KCR 218 HE1 KCR 218 -17.369 -5.548 2.593 1228 H12 KCR 218 HE2 KCR 218 -18.771 -6.606 2.750 1229 H13 KCR 218 HZ1 KCR 218 -17.861 -7.888 0.876 1230 H14 KCR 218 HH1 KCR 218 -17.256 -7.708 -1.456 1231 H15 KCR 218 HJ1 KCR 218 -16.979 -4.719 -2.165 1232 H16 KCR 218 HF3 KCR 218 -16.630 -5.527 -4.398 1233 H17 KCR 218 HF1 KCR 218 -16.135 -7.077 -3.721 1234 H18 KCR 218 HF2 KCR 218 -17.839 -6.767 -4.058 1235 H GLN 219 HN GLN 219 -16.088 -7.087 9.731 1236 HA GLN 219 HA GLN 219 -14.628 -9.613 10.088 1237 HB2 GLN 219 HB2 GLN 219 -13.924 -6.868 11.106 1238 HB3 GLN 219 HB1 GLN 219 -13.375 -8.309 11.948 1239 HG2 GLN 219 HG2 GLN 219 -11.603 -7.704 10.562 1240 HG3 GLN 219 HG1 GLN 219 -12.387 -9.047 9.734 1241 HE21 GLN 219 HE21 GLN 219 -11.721 -8.542 7.717 1242 HE22 GLN 219 HE22 GLN 219 -12.228 -7.123 6.865 1243 H LEU 220 HN LEU 220 -17.298 -9.541 10.454 1244 HA LEU 220 HA LEU 220 -17.840 -9.080 13.275 1245 HB2 LEU 220 HB2 LEU 220 -19.520 -8.567 11.498 1246 HB3 LEU 220 HB1 LEU 220 -19.631 -10.285 11.164 1247 HG LEU 220 HG LEU 220 -20.447 -10.656 13.475 1248 HD11 LEU 220 HD11 LEU 220 -19.411 -8.716 14.535 1249 HD12 LEU 220 HD12 LEU 220 -21.152 -8.742 14.815 1250 HD13 LEU 220 HD13 LEU 220 -20.468 -7.643 13.618 1251 HD21 LEU 220 HD21 LEU 220 -22.017 -10.389 11.623 1252 HD22 LEU 220 HD22 LEU 220 -22.026 -8.643 11.876 1253 HD23 LEU 220 HD23 LEU 220 -22.671 -9.718 13.118 1254 H ALA 221 HN ALA 221 -17.261 -11.696 11.045 1255 HA ALA 221 HA ALA 221 -17.411 -13.621 13.271 1256 HB1 ALA 221 HB1 ALA 221 -18.841 -14.151 11.349 1257 HB2 ALA 221 HB2 ALA 221 -17.578 -15.361 11.573 1258 HB3 ALA 221 HB3 ALA 221 -17.425 -14.152 10.299 1259 H THR 222 HN THR 222 -15.436 -12.403 10.636 1260 HA THR 222 HA THR 222 -13.149 -14.006 11.447 1261 HB THR 222 HB THR 222 -12.019 -12.770 9.540 1262 HG1 THR 222 HG1 THR 222 -13.093 -11.205 8.597 1263 HG21 THR 222 HG21 THR 222 -13.180 -14.053 7.801 1264 HG22 THR 222 HG22 THR 222 -14.531 -14.322 8.902 1265 HG23 THR 222 HG23 THR 222 -12.950 -15.015 9.261 1266 H LYS 223 HN LYS 223 -11.006 -12.819 11.614 1267 HA LYS 223 HA LYS 223 -11.264 -10.151 12.796 1268 HB2 LYS 223 HB2 LYS 223 -11.356 -11.858 14.622 1269 HB3 LYS 223 HB1 LYS 223 -9.769 -12.422 14.122 1270 HG2 LYS 223 HG2 LYS 223 -8.811 -10.253 14.667 1271 HG3 LYS 223 HG1 LYS 223 -10.405 -9.660 15.136 1272 HD2 LYS 223 HD2 LYS 223 -10.521 -11.372 16.887 1273 HD3 LYS 223 HD1 LYS 223 -8.919 -11.949 16.423 1274 HE2 LYS 223 HE2 LYS 223 -9.598 -9.217 17.505 1275 HE3 LYS 223 HE1 LYS 223 -8.771 -10.510 18.371 1276 HZ1 LYS 223 HZ1 LYS 223 -7.774 -9.010 16.013 1277 HZ2 LYS 223 HZ2 LYS 223 -7.007 -10.381 16.652 1278 HZ3 LYS 223 HZ3 LYS 223 -7.148 -8.974 17.589 1279 H ALA 224 HN ALA 224 -9.766 -8.836 11.991 1280 HA ALA 224 HA ALA 224 -7.281 -10.001 10.929 1281 HB1 ALA 224 HB1 ALA 224 -8.969 -7.927 9.528 1282 HB2 ALA 224 HB2 ALA 224 -8.818 -9.620 9.057 1283 HB3 ALA 224 HB3 ALA 224 -7.417 -8.552 8.971 Start of MODEL 5 1 H1 GLY 1 HT1 GLY 1 35.228 -10.649 9.493 2 H2 GLY 1 HT2 GLY 1 34.657 -10.437 11.076 3 H3 GLY 1 HT3 GLY 1 36.148 -11.200 10.810 4 HA2 GLY 1 HA1 GLY 1 36.532 -8.966 11.560 5 HA3 GLY 1 HA2 GLY 1 37.047 -9.142 9.887 6 H SER 2 HN SER 2 34.929 -7.565 12.069 7 HA SER 2 HA SER 2 33.963 -5.872 9.891 8 HB2 SER 2 HB2 SER 2 31.669 -5.908 11.049 9 HB3 SER 2 HB1 SER 2 32.112 -7.328 10.102 10 HG SER 2 HG SER 2 31.337 -7.316 12.574 11 H HIS 3 HN HIS 3 35.678 -4.571 10.876 12 HA HIS 3 HA HIS 3 34.570 -2.822 12.913 13 HB2 HIS 3 HB2 HIS 3 36.492 -2.958 14.410 14 HB3 HIS 3 HB1 HIS 3 35.743 -4.540 14.248 15 HD1 HIS 3 HD1 HIS 3 38.953 -2.883 14.109 16 HD2 HIS 3 HD2 HIS 3 37.262 -6.260 12.354 17 HE1 HIS 3 HE1 HIS 3 40.886 -4.274 13.299 18 HE2 HIS 3 HE2 HIS 3 39.843 -6.254 12.140 19 H MET 4 HN MET 4 35.869 -3.094 10.035 20 HA MET 4 HA MET 4 37.346 -0.561 10.237 21 HB2 MET 4 HB2 MET 4 38.209 -3.023 8.717 22 HB3 MET 4 HB1 MET 4 38.912 -1.431 8.474 23 HG2 MET 4 HG2 MET 4 39.673 -1.391 10.777 24 HG3 MET 4 HG1 MET 4 38.923 -2.961 11.065 25 HE1 MET 4 HE1 MET 4 41.718 -1.018 9.103 26 HE2 MET 4 HE2 MET 4 40.800 -1.805 7.819 27 HE3 MET 4 HE3 MET 4 42.453 -2.317 8.164 28 H ALA 5 HN ALA 5 34.648 -1.796 9.142 29 HA ALA 5 HA ALA 5 34.840 -0.580 6.468 30 HB1 ALA 5 HB1 ALA 5 32.653 -1.688 6.045 31 HB2 ALA 5 HB2 ALA 5 32.819 -2.496 7.610 32 HB3 ALA 5 HB3 ALA 5 33.995 -2.803 6.329 33 H SER 6 HN SER 6 32.680 0.399 5.792 34 HA SER 6 HA SER 6 31.966 2.392 7.786 35 HB2 SER 6 HB2 SER 6 31.303 2.230 4.840 36 HB3 SER 6 HB1 SER 6 31.044 3.612 5.894 37 HG SER 6 HG SER 6 32.951 4.132 5.128 38 H SER 7 HN SER 7 30.581 1.160 9.102 39 HA SER 7 HA SER 7 28.361 -0.288 8.025 40 HB2 SER 7 HB2 SER 7 28.658 0.710 10.869 41 HB3 SER 7 HB1 SER 7 27.781 -0.714 10.300 42 HG SER 7 HG SER 7 29.697 -1.745 9.898 43 H CYS 8 HN CYS 8 26.736 0.758 7.041 44 HA CYS 8 HA CYS 8 25.702 3.200 8.301 45 HB2 CYS 8 HB2 CYS 8 27.099 3.969 6.513 46 HB3 CYS 8 HB1 CYS 8 26.374 2.841 5.379 47 HG CYS 8 HG CYS 8 24.635 5.387 6.860 48 H ALA 9 HN ALA 9 23.662 2.946 8.768 49 HA ALA 9 HA ALA 9 21.991 1.045 7.372 50 HB1 ALA 9 HB1 ALA 9 20.239 1.809 8.933 51 HB2 ALA 9 HB2 ALA 9 21.352 3.027 9.556 52 HB3 ALA 9 HB3 ALA 9 21.714 1.314 9.766 53 H VAL 10 HN VAL 10 20.903 1.498 5.584 54 HA VAL 10 HA VAL 10 20.463 4.311 4.883 55 HB VAL 10 HB VAL 10 20.129 1.888 3.110 56 HG11 VAL 10 HG11 VAL 10 18.850 3.566 2.162 57 HG12 VAL 10 HG12 VAL 10 20.409 3.779 1.362 58 HG13 VAL 10 HG13 VAL 10 19.947 4.843 2.690 59 HG21 VAL 10 HG21 VAL 10 22.437 1.942 3.544 60 HG22 VAL 10 HG22 VAL 10 22.479 3.703 3.563 61 HG23 VAL 10 HG23 VAL 10 22.258 2.844 2.040 62 H GLN 11 HN GLN 11 18.475 5.167 4.778 63 HA GLN 11 HA GLN 11 16.285 3.406 5.666 64 HB2 GLN 11 HB2 GLN 11 16.392 6.409 5.982 65 HB3 GLN 11 HB1 GLN 11 15.346 5.271 6.815 66 HG2 GLN 11 HG2 GLN 11 16.823 4.969 8.446 67 HG3 GLN 11 HG1 GLN 11 18.126 4.682 7.292 68 HE21 GLN 11 HE21 GLN 11 16.485 7.037 9.240 69 HE22 GLN 11 HE22 GLN 11 17.666 8.293 9.074 70 H VAL 12 HN VAL 12 14.617 3.116 4.378 71 HA VAL 12 HA VAL 12 14.194 5.037 2.192 72 HB VAL 12 HB VAL 12 13.009 3.141 1.059 73 HG11 VAL 12 HG11 VAL 12 15.531 3.673 0.851 74 HG12 VAL 12 HG12 VAL 12 14.950 2.119 0.257 75 HG13 VAL 12 HG13 VAL 12 15.755 2.220 1.822 76 HG21 VAL 12 HG21 VAL 12 12.441 1.977 3.121 77 HG22 VAL 12 HG22 VAL 12 14.123 1.478 3.283 78 HG23 VAL 12 HG23 VAL 12 13.163 0.926 1.906 79 H LYS 13 HN LYS 13 11.907 5.598 1.762 80 HA LYS 13 HA LYS 13 10.254 5.076 4.146 81 HB2 LYS 13 HB2 LYS 13 11.378 7.517 3.967 82 HB3 LYS 13 HB1 LYS 13 10.034 7.781 2.868 83 HG2 LYS 13 HG2 LYS 13 8.455 7.371 4.575 84 HG3 LYS 13 HG1 LYS 13 9.692 6.734 5.659 85 HD2 LYS 13 HD2 LYS 13 10.765 8.995 5.627 86 HD3 LYS 13 HD1 LYS 13 9.369 9.582 4.721 87 HE2 LYS 13 HE2 LYS 13 7.899 8.931 6.561 88 HE3 LYS 13 HE1 LYS 13 9.287 8.328 7.464 89 HZ1 LYS 13 HZ1 LYS 13 10.203 10.614 7.391 90 HZ2 LYS 13 HZ2 LYS 13 8.746 10.496 8.256 91 HZ3 LYS 13 HZ3 LYS 13 8.751 11.144 6.690 92 H LEU 14 HN LEU 14 8.310 4.323 3.671 93 HA LEU 14 HA LEU 14 7.279 4.752 0.948 94 HB2 LEU 14 HB2 LEU 14 6.943 2.415 2.823 95 HB3 LEU 14 HB1 LEU 14 6.002 2.618 1.353 96 HG LEU 14 HG LEU 14 9.016 2.374 1.450 97 HD11 LEU 14 HD11 LEU 14 6.945 0.355 0.634 98 HD12 LEU 14 HD12 LEU 14 7.883 0.307 2.125 99 HD13 LEU 14 HD13 LEU 14 8.694 0.145 0.568 100 HD21 LEU 14 HD21 LEU 14 7.136 2.243 -0.902 101 HD22 LEU 14 HD22 LEU 14 8.899 2.174 -0.937 102 HD23 LEU 14 HD23 LEU 14 8.085 3.664 -0.459 103 H GLU 15 HN GLU 15 4.782 4.528 0.941 104 HA GLU 15 HA GLU 15 3.630 5.816 3.309 105 HB2 GLU 15 HB2 GLU 15 4.356 7.613 1.855 106 HB3 GLU 15 HB1 GLU 15 3.574 6.861 0.476 107 HG2 GLU 15 HG2 GLU 15 1.406 7.334 1.362 108 HG3 GLU 15 HG1 GLU 15 2.099 7.894 2.887 109 H LEU 16 HN LEU 16 1.703 5.051 3.813 110 HA LEU 16 HA LEU 16 0.200 3.439 1.856 111 HB2 LEU 16 HB2 LEU 16 -0.037 3.671 4.852 112 HB3 LEU 16 HB1 LEU 16 -1.233 2.866 3.870 113 HG LEU 16 HG LEU 16 0.095 1.185 4.831 114 HD11 LEU 16 HD11 LEU 16 1.499 1.228 2.265 115 HD12 LEU 16 HD12 LEU 16 -0.259 1.313 2.197 116 HD13 LEU 16 HD13 LEU 16 0.531 -0.040 3.009 117 HD21 LEU 16 HD21 LEU 16 2.568 2.460 3.755 118 HD22 LEU 16 HD22 LEU 16 2.445 1.117 4.884 119 HD23 LEU 16 HD23 LEU 16 1.985 2.745 5.389 120 H GLY 17 HN GLY 17 -1.900 4.005 1.341 121 HA2 GLY 17 HA2 GLY 17 -3.163 6.213 2.733 122 HA3 GLY 17 HA1 GLY 17 -2.695 6.552 1.068 123 H HIS 18 HN HIS 18 -5.290 6.741 1.808 124 HA HIS 18 HA HIS 18 -6.450 5.222 -0.238 125 HB2 HIS 18 HB2 HIS 18 -7.310 3.383 0.735 126 HB3 HIS 18 HB1 HIS 18 -6.243 3.711 2.092 127 HD1 HIS 18 HD1 HIS 18 -7.402 5.275 4.022 128 HD2 HIS 18 HD2 HIS 18 -9.939 3.284 1.402 129 HE1 HIS 18 HE1 HIS 18 -9.663 5.278 5.131 130 HE2 HIS 18 HE2 HIS 18 -11.147 3.966 3.585 131 H ARG 19 HN ARG 19 -8.376 6.041 -0.838 132 HA ARG 19 HA ARG 19 -9.607 8.060 0.931 133 HB2 ARG 19 HB2 ARG 19 -9.759 7.913 -2.087 134 HB3 ARG 19 HB1 ARG 19 -10.481 9.140 -1.075 135 HG2 ARG 19 HG2 ARG 19 -8.300 9.940 -0.418 136 HG3 ARG 19 HG1 ARG 19 -7.529 8.672 -1.375 137 HD2 ARG 19 HD2 ARG 19 -7.502 10.685 -2.666 138 HD3 ARG 19 HD1 ARG 19 -8.683 9.592 -3.386 139 HE ARG 19 HE ARG 19 -9.510 11.749 -1.559 140 HH11 ARG 19 HH11 ARG 19 -9.774 10.071 -4.622 141 HH12 ARG 19 HH12 ARG 19 -11.081 11.060 -5.198 142 HH21 ARG 19 HH21 ARG 19 -11.234 13.029 -2.286 143 HH22 ARG 19 HH22 ARG 19 -11.911 12.755 -3.869 144 H ALA 20 HN ALA 20 -11.980 8.168 0.772 145 HA ALA 20 HA ALA 20 -13.282 5.948 -0.585 146 HB1 ALA 20 HB1 ALA 20 -13.090 4.785 1.375 147 HB2 ALA 20 HB2 ALA 20 -14.650 5.580 1.595 148 HB3 ALA 20 HB3 ALA 20 -13.210 6.233 2.376 149 H GLN 21 HN GLN 21 -15.189 6.470 -1.371 150 HA GLN 21 HA GLN 21 -16.792 8.576 -0.125 151 HB2 GLN 21 HB2 GLN 21 -17.276 9.647 -2.219 152 HB3 GLN 21 HB1 GLN 21 -15.526 9.526 -2.095 153 HG2 GLN 21 HG2 GLN 21 -15.343 8.136 -3.819 154 HG3 GLN 21 HG1 GLN 21 -16.846 7.296 -3.464 155 HE21 GLN 21 HE21 GLN 21 -18.775 8.102 -4.287 156 HE22 GLN 21 HE22 GLN 21 -18.822 9.272 -5.565 157 H VAL 22 HN VAL 22 -19.071 8.337 -0.620 158 HA VAL 22 HA VAL 22 -19.708 5.625 -1.548 159 HB VAL 22 HB VAL 22 -20.453 6.257 0.770 160 HG11 VAL 22 HG11 VAL 22 -22.426 7.645 1.018 161 HG12 VAL 22 HG12 VAL 22 -22.399 8.020 -0.703 162 HG13 VAL 22 HG13 VAL 22 -21.088 8.569 0.343 163 HG21 VAL 22 HG21 VAL 22 -22.580 5.172 0.579 164 HG22 VAL 22 HG22 VAL 22 -21.463 4.436 -0.567 165 HG23 VAL 22 HG23 VAL 22 -22.685 5.576 -1.131 166 H ARG 23 HN ARG 23 -21.007 5.299 -3.249 167 HA ARG 23 HA ARG 23 -21.865 7.644 -4.776 168 HB2 ARG 23 HB2 ARG 23 -22.757 5.551 -6.263 169 HB3 ARG 23 HB1 ARG 23 -21.136 6.227 -6.391 170 HG2 ARG 23 HG2 ARG 23 -20.149 4.467 -5.361 171 HG3 ARG 23 HG1 ARG 23 -21.568 4.095 -4.387 172 HD2 ARG 23 HD2 ARG 23 -21.089 2.378 -6.099 173 HD3 ARG 23 HD1 ARG 23 -22.674 3.121 -6.294 174 HE ARG 23 HE ARG 23 -21.820 4.342 -8.166 175 HH11 ARG 23 HH11 ARG 23 -19.623 1.935 -6.903 176 HH12 ARG 23 HH12 ARG 23 -18.796 1.702 -8.413 177 HH21 ARG 23 HH21 ARG 23 -20.734 4.052 -10.158 178 HH22 ARG 23 HH22 ARG 23 -19.453 2.880 -10.279 179 H LYS 24 HN LYS 24 -24.024 8.013 -5.362 180 HA LYS 24 HA LYS 24 -25.809 7.521 -3.185 181 HB2 LYS 24 HB2 LYS 24 -25.556 9.602 -4.737 182 HB3 LYS 24 HB1 LYS 24 -26.703 8.745 -5.759 183 HG2 LYS 24 HG2 LYS 24 -27.857 10.297 -4.303 184 HG3 LYS 24 HG1 LYS 24 -28.270 8.634 -3.876 185 HD2 LYS 24 HD2 LYS 24 -26.622 8.700 -2.061 186 HD3 LYS 24 HD1 LYS 24 -26.242 10.372 -2.476 187 HE2 LYS 24 HE2 LYS 24 -28.566 10.998 -1.999 188 HE3 LYS 24 HE1 LYS 24 -28.915 9.329 -1.551 189 HZ1 LYS 24 HZ1 LYS 24 -26.904 11.055 -0.207 190 HZ2 LYS 24 HZ2 LYS 24 -27.356 9.485 0.254 191 HZ3 LYS 24 HZ3 LYS 24 -28.467 10.757 0.374 192 H LYS 25 HN LYS 25 -25.010 5.668 -5.766 193 HA LYS 25 HA LYS 25 -27.345 4.002 -5.356 194 HB2 LYS 25 HB2 LYS 25 -27.913 5.362 -7.331 195 HB3 LYS 25 HB1 LYS 25 -26.440 4.850 -8.125 196 HG2 LYS 25 HG2 LYS 25 -28.170 3.561 -9.034 197 HG3 LYS 25 HG1 LYS 25 -27.324 2.519 -7.902 198 HD2 LYS 25 HD2 LYS 25 -29.040 3.029 -6.197 199 HD3 LYS 25 HD1 LYS 25 -29.929 3.928 -7.432 200 HE2 LYS 25 HE2 LYS 25 -30.180 1.949 -8.768 201 HE3 LYS 25 HE1 LYS 25 -29.148 1.031 -7.673 202 HZ1 LYS 25 HZ1 LYS 25 -30.833 1.436 -5.917 203 HZ2 LYS 25 HZ2 LYS 25 -31.413 0.508 -7.209 204 HZ3 LYS 25 HZ3 LYS 25 -31.840 2.144 -7.087 205 HA PRO 26 HA PRO 26 -23.834 1.151 -5.202 206 HB2 PRO 26 HB2 PRO 26 -26.054 -0.804 -5.104 207 HB3 PRO 26 HB1 PRO 26 -24.670 -0.616 -4.026 208 HG2 PRO 26 HG2 PRO 26 -27.127 0.125 -3.272 209 HG3 PRO 26 HG1 PRO 26 -25.691 1.051 -2.790 210 HD2 PRO 26 HD2 PRO 26 -27.723 1.655 -4.901 211 HD3 PRO 26 HD1 PRO 26 -26.884 2.760 -3.795 212 H THR 27 HN THR 27 -23.017 -0.450 -6.580 213 HA THR 27 HA THR 27 -23.888 -0.165 -9.300 214 HB THR 27 HB THR 27 -21.504 -0.296 -8.812 215 HG1 THR 27 HG1 THR 27 -21.277 -2.515 -10.135 216 HG21 THR 27 HG21 THR 27 -21.313 -1.663 -6.910 217 HG22 THR 27 HG22 THR 27 -20.567 -2.593 -8.212 218 HG23 THR 27 HG23 THR 27 -22.200 -2.984 -7.676 219 H VAL 28 HN VAL 28 -23.750 -2.408 -10.594 220 HA VAL 28 HA VAL 28 -26.116 -3.725 -10.345 221 HB VAL 28 HB VAL 28 -24.866 -3.951 -12.322 222 HG11 VAL 28 HG11 VAL 28 -22.621 -3.797 -11.282 223 HG12 VAL 28 HG12 VAL 28 -22.736 -5.067 -12.505 224 HG13 VAL 28 HG13 VAL 28 -22.770 -5.488 -10.793 225 HG21 VAL 28 HG21 VAL 28 -25.069 -6.620 -10.944 226 HG22 VAL 28 HG22 VAL 28 -24.825 -6.406 -12.678 227 HG23 VAL 28 HG23 VAL 28 -26.308 -5.828 -11.918 228 H GLU 29 HN GLU 29 -23.090 -4.601 -8.745 229 HA GLU 29 HA GLU 29 -24.366 -6.958 -7.596 230 HB2 GLU 29 HB2 GLU 29 -21.486 -6.055 -7.556 231 HB3 GLU 29 HB1 GLU 29 -22.078 -7.542 -6.820 232 HG2 GLU 29 HG2 GLU 29 -22.889 -8.249 -9.078 233 HG3 GLU 29 HG1 GLU 29 -22.113 -6.815 -9.744 234 H GLY 30 HN GLY 30 -24.349 -3.842 -6.812 235 HA2 GLY 30 HA2 GLY 30 -25.344 -2.981 -4.901 236 HA3 GLY 30 HA1 GLY 30 -25.140 -4.538 -4.117 237 H PHE 31 HN PHE 31 -22.531 -2.741 -5.607 238 HA PHE 31 HA PHE 31 -21.246 -2.538 -3.005 239 HB2 PHE 31 HB2 PHE 31 -20.118 -1.822 -5.725 240 HB3 PHE 31 HB1 PHE 31 -19.220 -1.991 -4.219 241 HD1 PHE 31 HD1 PHE 31 -20.817 -4.567 -3.390 242 HD2 PHE 31 HD2 PHE 31 -18.737 -3.404 -6.901 243 HE1 PHE 31 HE1 PHE 31 -20.387 -6.927 -3.906 244 HE2 PHE 31 HE2 PHE 31 -18.301 -5.756 -7.431 245 HZ PHE 31 HZ PHE 31 -19.129 -7.527 -5.935 246 H THR 32 HN THR 32 -21.258 -0.719 -1.881 247 HA THR 32 HA THR 32 -22.653 1.570 -3.039 248 HB THR 32 HB THR 32 -23.040 2.235 -0.705 249 HG1 THR 32 HG1 THR 32 -22.503 0.208 0.741 250 HG21 THR 32 HG21 THR 32 -23.773 -0.532 -1.461 251 HG22 THR 32 HG22 THR 32 -24.724 0.922 -1.694 252 HG23 THR 32 HG23 THR 32 -24.458 0.285 -0.069 253 H HIS 33 HN HIS 33 -19.612 0.718 -1.536 254 HA HIS 33 HA HIS 33 -18.866 3.566 -1.381 255 HB2 HIS 33 HB2 HIS 33 -18.201 1.193 0.318 256 HB3 HIS 33 HB1 HIS 33 -17.099 2.563 0.274 257 HD1 HIS 33 HD1 HIS 33 -20.627 1.655 1.318 258 HD2 HIS 33 HD2 HIS 33 -17.858 4.728 1.769 259 HE1 HIS 33 HE1 HIS 33 -21.525 3.120 3.164 260 HE2 HIS 33 HE2 HIS 33 -19.743 4.861 3.533 261 H ASP 34 HN ASP 34 -17.259 4.256 -2.627 262 HA ASP 34 HA ASP 34 -15.520 2.276 -3.957 263 HB2 ASP 34 HB2 ASP 34 -16.332 5.088 -4.705 264 HB3 ASP 34 HB1 ASP 34 -14.974 4.272 -5.467 265 H TRP 35 HN TRP 35 -13.378 2.295 -3.613 266 HA TRP 35 HA TRP 35 -12.225 4.583 -2.232 267 HB2 TRP 35 HB2 TRP 35 -11.037 3.103 -0.629 268 HB3 TRP 35 HB1 TRP 35 -12.773 3.169 -0.392 269 HD1 TRP 35 HD1 TRP 35 -14.062 0.881 -0.404 270 HE1 TRP 35 HE1 TRP 35 -13.321 -1.580 -0.666 271 HE3 TRP 35 HE3 TRP 35 -9.245 1.624 -1.986 272 HZ2 TRP 35 HZ2 TRP 35 -10.990 -3.011 -1.428 273 HZ3 TRP 35 HZ3 TRP 35 -7.833 -0.342 -2.449 274 HH2 TRP 35 HH2 TRP 35 -8.676 -2.603 -2.145 275 H MET 36 HN MET 36 -9.910 4.570 -2.164 276 HA MET 36 HA MET 36 -8.573 2.906 -4.176 277 HB2 MET 36 HB2 MET 36 -8.996 4.874 -5.432 278 HB3 MET 36 HB1 MET 36 -8.619 5.918 -4.069 279 HG2 MET 36 HG2 MET 36 -6.259 5.067 -4.209 280 HG3 MET 36 HG1 MET 36 -6.707 4.324 -5.746 281 HE1 MET 36 HE1 MET 36 -6.474 7.282 -3.606 282 HE2 MET 36 HE2 MET 36 -7.898 7.991 -4.382 283 HE3 MET 36 HE3 MET 36 -6.301 8.694 -4.655 284 H VAL 37 HN VAL 37 -6.556 2.275 -3.545 285 HA VAL 37 HA VAL 37 -5.583 3.341 -0.980 286 HB VAL 37 HB VAL 37 -4.108 1.135 -1.234 287 HG11 VAL 37 HG11 VAL 37 -6.930 1.214 -0.291 288 HG12 VAL 37 HG12 VAL 37 -5.525 1.690 0.648 289 HG13 VAL 37 HG13 VAL 37 -5.749 0.003 0.171 290 HG21 VAL 37 HG21 VAL 37 -5.000 0.460 -3.364 291 HG22 VAL 37 HG22 VAL 37 -6.647 0.551 -2.740 292 HG23 VAL 37 HG23 VAL 37 -5.537 -0.675 -2.127 293 H PHE 38 HN PHE 38 -3.356 3.548 -0.630 294 HA PHE 38 HA PHE 38 -1.798 4.321 -3.028 295 HB2 PHE 38 HB2 PHE 38 -2.412 5.710 -0.470 296 HB3 PHE 38 HB1 PHE 38 -0.759 5.843 -1.037 297 HD1 PHE 38 HD2 PHE 38 -4.269 6.753 -1.716 298 HD2 PHE 38 HD1 PHE 38 -0.195 7.149 -2.908 299 HE1 PHE 38 HE2 PHE 38 -4.871 8.651 -3.152 300 HE2 PHE 38 HE1 PHE 38 -0.790 9.067 -4.320 301 HZ PHE 38 HZ PHE 38 -3.148 9.819 -4.454 302 H VAL 39 HN VAL 39 0.114 3.255 -3.215 303 HA VAL 39 HA VAL 39 1.748 3.223 -0.790 304 HB VAL 39 HB VAL 39 2.905 1.133 -1.966 305 HG11 VAL 39 HG11 VAL 39 0.772 1.310 0.075 306 HG12 VAL 39 HG12 VAL 39 2.456 0.814 0.228 307 HG13 VAL 39 HG13 VAL 39 1.274 -0.285 -0.482 308 HG21 VAL 39 HG21 VAL 39 1.652 0.525 -3.733 309 HG22 VAL 39 HG22 VAL 39 0.164 1.172 -3.034 310 HG23 VAL 39 HG23 VAL 39 0.797 -0.380 -2.481 311 H ARG 40 HN ARG 40 3.485 4.397 -1.093 312 HA ARG 40 HA ARG 40 5.037 4.436 -3.488 313 HB2 ARG 40 HB2 ARG 40 4.689 6.708 -4.177 314 HB3 ARG 40 HB1 ARG 40 3.108 5.939 -4.135 315 HG2 ARG 40 HG2 ARG 40 2.451 7.105 -2.233 316 HG3 ARG 40 HG1 ARG 40 4.112 7.492 -1.778 317 HD2 ARG 40 HD2 ARG 40 4.218 8.892 -3.888 318 HD3 ARG 40 HD1 ARG 40 2.469 8.678 -4.007 319 HE ARG 40 HE ARG 40 2.775 9.602 -1.487 320 HH11 ARG 40 HH11 ARG 40 3.968 10.724 -4.593 321 HH12 ARG 40 HH12 ARG 40 3.984 12.399 -4.119 322 HH21 ARG 40 HH21 ARG 40 2.806 11.802 -0.872 323 HH22 ARG 40 HH22 ARG 40 3.328 13.004 -2.012 324 H GLY 41 HN GLY 41 6.532 6.647 -3.187 325 HA2 GLY 41 HA2 GLY 41 7.391 6.537 -0.366 326 HA3 GLY 41 HA1 GLY 41 8.422 6.968 -1.719 327 HA PRO 42 HA PRO 42 6.488 10.734 0.594 328 HB2 PRO 42 HB2 PRO 42 9.367 11.313 1.004 329 HB3 PRO 42 HB1 PRO 42 8.016 11.487 2.129 330 HG2 PRO 42 HG2 PRO 42 9.798 9.493 2.386 331 HG3 PRO 42 HG1 PRO 42 8.078 9.270 2.747 332 HD2 PRO 42 HD2 PRO 42 9.638 8.393 0.373 333 HD3 PRO 42 HD1 PRO 42 8.304 7.586 1.215 334 H GLU 43 HN GLU 43 6.719 12.914 -0.008 335 HA GLU 43 HA GLU 43 7.065 13.404 -2.706 336 HB2 GLU 43 HB2 GLU 43 7.379 15.415 -0.470 337 HB3 GLU 43 HB1 GLU 43 6.997 15.773 -2.148 338 HG2 GLU 43 HG2 GLU 43 4.927 15.910 -1.210 339 HG3 GLU 43 HG1 GLU 43 4.941 14.217 -1.693 340 H HIS 44 HN HIS 44 8.762 13.380 -3.898 341 HA HIS 44 HA HIS 44 10.709 14.219 -4.788 342 HB2 HIS 44 HB2 HIS 44 11.534 14.945 -1.974 343 HB3 HIS 44 HB1 HIS 44 12.490 15.250 -3.417 344 HD1 HIS 44 HD1 HIS 44 11.041 16.767 -5.291 345 HD2 HIS 44 HD2 HIS 44 10.048 17.084 -1.262 346 HE1 HIS 44 HE1 HIS 44 9.776 18.932 -5.066 347 HE2 HIS 44 HE2 HIS 44 9.011 18.990 -2.661 348 H SER 45 HN SER 45 10.365 11.846 -2.386 349 HA SER 45 HA SER 45 12.906 10.599 -3.163 350 HB2 SER 45 HB2 SER 45 12.096 8.851 -1.412 351 HB3 SER 45 HB1 SER 45 12.699 10.404 -0.845 352 HG SER 45 HG SER 45 9.964 10.107 -1.388 353 H ASN 46 HN ASN 46 12.834 9.484 -4.971 354 HA ASN 46 HA ASN 46 10.529 8.156 -6.012 355 HB2 ASN 46 HB2 ASN 46 12.048 7.206 -7.663 356 HB3 ASN 46 HB1 ASN 46 12.625 8.841 -7.364 357 HD21 ASN 46 HD21 ASN 46 14.575 9.179 -6.572 358 HD22 ASN 46 HD22 ASN 46 15.691 7.914 -6.193 359 H ILE 47 HN ILE 47 9.812 6.043 -5.590 360 HA ILE 47 HA ILE 47 11.579 4.436 -3.914 361 HB ILE 47 HB ILE 47 9.826 2.915 -3.521 362 HG12 ILE 47 HG12 ILE 47 8.064 4.567 -5.328 363 HG13 ILE 47 HG11 ILE 47 8.807 3.031 -5.786 364 HG21 ILE 47 HG21 ILE 47 9.898 4.841 -2.135 365 HG22 ILE 47 HG22 ILE 47 8.215 4.410 -2.416 366 HG23 ILE 47 HG23 ILE 47 8.937 5.769 -3.280 367 HD11 ILE 47 HD11 ILE 47 7.306 2.997 -3.270 368 HD12 ILE 47 HD12 ILE 47 7.344 1.823 -4.588 369 HD13 ILE 47 HD13 ILE 47 6.340 3.268 -4.723 370 H GLN 48 HN GLN 48 10.606 4.700 -7.188 371 HA GLN 48 HA GLN 48 10.585 2.025 -8.008 372 HB2 GLN 48 HB2 GLN 48 9.645 3.821 -9.352 373 HB3 GLN 48 HB1 GLN 48 11.220 4.581 -9.501 374 HG2 GLN 48 HG2 GLN 48 10.630 3.520 -11.564 375 HG3 GLN 48 HG1 GLN 48 11.986 2.686 -10.852 376 HE21 GLN 48 HE21 GLN 48 8.650 2.298 -9.837 377 HE22 GLN 48 HE22 GLN 48 8.498 0.659 -10.363 378 H HIS 49 HN HIS 49 13.168 3.864 -6.942 379 HA HIS 49 HA HIS 49 15.183 2.490 -8.500 380 HB2 HIS 49 HB2 HIS 49 15.225 4.624 -6.418 381 HB3 HIS 49 HB1 HIS 49 16.694 3.687 -6.675 382 HD1 HIS 49 HD1 HIS 49 16.865 3.457 -9.663 383 HD2 HIS 49 HD2 HIS 49 15.546 6.935 -7.776 384 HE1 HIS 49 HE1 HIS 49 17.077 5.295 -11.370 385 HE2 HIS 49 HE2 HIS 49 16.174 7.349 -10.253 386 H PHE 50 HN PHE 50 13.740 2.241 -5.287 387 HA PHE 50 HA PHE 50 15.451 -0.099 -4.863 388 HB2 PHE 50 HB2 PHE 50 15.144 0.180 -2.444 389 HB3 PHE 50 HB1 PHE 50 15.933 1.564 -3.195 390 HD1 PHE 50 HD1 PHE 50 12.758 0.383 -1.692 391 HD2 PHE 50 HD2 PHE 50 15.025 3.702 -3.083 392 HE1 PHE 50 HE1 PHE 50 11.204 1.907 -0.592 393 HE2 PHE 50 HE2 PHE 50 13.432 5.236 -2.003 394 HZ PHE 50 HZ PHE 50 11.517 4.336 -0.751 395 H VAL 51 HN VAL 51 12.479 0.723 -5.792 396 HA VAL 51 HA VAL 51 11.227 -1.682 -4.642 397 HB VAL 51 HB VAL 51 10.013 1.035 -5.217 398 HG11 VAL 51 HG11 VAL 51 7.982 -0.396 -4.083 399 HG12 VAL 51 HG12 VAL 51 8.725 -1.613 -5.141 400 HG13 VAL 51 HG13 VAL 51 8.151 -0.089 -5.822 401 HG21 VAL 51 HG21 VAL 51 9.271 0.721 -2.812 402 HG22 VAL 51 HG22 VAL 51 10.991 0.989 -3.080 403 HG23 VAL 51 HG23 VAL 51 10.392 -0.635 -2.746 404 H GLU 52 HN GLU 52 9.948 -2.912 -6.066 405 HA GLU 52 HA GLU 52 10.662 -2.414 -8.890 406 HB2 GLU 52 HB2 GLU 52 11.727 -4.396 -7.842 407 HB3 GLU 52 HB1 GLU 52 10.136 -5.051 -7.493 408 HG2 GLU 52 HG2 GLU 52 11.063 -6.133 -9.426 409 HG3 GLU 52 HG1 GLU 52 9.671 -5.162 -9.905 410 H LYS 53 HN LYS 53 8.260 -4.232 -7.005 411 HA LYS 53 HA LYS 53 6.137 -3.103 -8.666 412 HB2 LYS 53 HB2 LYS 53 5.076 -5.332 -8.852 413 HB3 LYS 53 HB1 LYS 53 6.637 -5.261 -9.657 414 HG2 LYS 53 HG2 LYS 53 7.681 -6.421 -7.831 415 HG3 LYS 53 HG1 LYS 53 6.180 -6.422 -6.918 416 HD2 LYS 53 HD2 LYS 53 6.636 -7.781 -9.577 417 HD3 LYS 53 HD1 LYS 53 6.660 -8.590 -8.013 418 HE2 LYS 53 HE2 LYS 53 4.331 -8.083 -7.661 419 HE3 LYS 53 HE1 LYS 53 4.305 -7.095 -9.121 420 HZ1 LYS 53 HZ1 LYS 53 4.772 -10.025 -8.995 421 HZ2 LYS 53 HZ2 LYS 53 4.790 -9.100 -10.412 422 HZ3 LYS 53 HZ3 LYS 53 3.352 -9.273 -9.533 423 H VAL 54 HN VAL 54 3.971 -4.085 -7.646 424 HA VAL 54 HA VAL 54 4.090 -4.012 -4.739 425 HB VAL 54 HB VAL 54 3.052 -1.808 -6.449 426 HG11 VAL 54 HG11 VAL 54 1.959 -1.829 -3.736 427 HG12 VAL 54 HG12 VAL 54 1.225 -2.997 -4.830 428 HG13 VAL 54 HG13 VAL 54 1.230 -1.282 -5.243 429 HG21 VAL 54 HG21 VAL 54 3.736 -0.785 -4.061 430 HG22 VAL 54 HG22 VAL 54 4.865 -1.020 -5.387 431 HG23 VAL 54 HG23 VAL 54 4.754 -2.217 -4.094 432 H VAL 55 HN VAL 55 2.081 -4.693 -3.754 433 HA VAL 55 HA VAL 55 0.116 -5.839 -5.583 434 HB VAL 55 HB VAL 55 2.184 -7.408 -4.489 435 HG11 VAL 55 HG11 VAL 55 -0.488 -8.069 -3.272 436 HG12 VAL 55 HG12 VAL 55 0.989 -7.627 -2.408 437 HG13 VAL 55 HG13 VAL 55 0.907 -9.151 -3.293 438 HG21 VAL 55 HG21 VAL 55 -0.364 -8.253 -5.839 439 HG22 VAL 55 HG22 VAL 55 1.117 -9.202 -5.716 440 HG23 VAL 55 HG23 VAL 55 1.102 -7.707 -6.651 441 H PHE 56 HN PHE 56 -1.859 -6.217 -4.667 442 HA PHE 56 HA PHE 56 -2.214 -5.396 -1.862 443 HB2 PHE 56 HB2 PHE 56 -3.807 -4.594 -4.307 444 HB3 PHE 56 HB1 PHE 56 -4.514 -4.551 -2.691 445 HD1 PHE 56 HD1 PHE 56 -1.696 -3.241 -4.728 446 HD2 PHE 56 HD2 PHE 56 -4.201 -2.704 -1.325 447 HE1 PHE 56 HE1 PHE 56 -0.757 -1.001 -4.402 448 HE2 PHE 56 HE2 PHE 56 -3.262 -0.449 -0.997 449 HZ PHE 56 HZ PHE 56 -1.520 0.396 -2.535 450 H HIS 57 HN HIS 57 -3.168 -6.986 -0.695 451 HA HIS 57 HA HIS 57 -4.693 -9.028 -2.184 452 HB2 HIS 57 HB2 HIS 57 -3.732 -9.155 0.694 453 HB3 HIS 57 HB1 HIS 57 -4.497 -10.453 -0.219 454 HD1 HIS 57 HD1 HIS 57 -2.968 -12.096 -1.192 455 HD2 HIS 57 HD2 HIS 57 -1.066 -8.454 -0.512 456 HE1 HIS 57 HE1 HIS 57 -0.527 -12.501 -1.648 457 HE2 HIS 57 HE2 HIS 57 0.620 -10.376 -0.921 458 H LEU 58 HN LEU 58 -6.534 -7.698 -2.436 459 HA LEU 58 HA LEU 58 -7.920 -6.547 -0.234 460 HB2 LEU 58 HB2 LEU 58 -9.385 -7.541 -2.662 461 HB3 LEU 58 HB1 LEU 58 -9.709 -6.117 -1.692 462 HG LEU 58 HG LEU 58 -7.372 -6.350 -3.581 463 HD11 LEU 58 HD11 LEU 58 -8.627 -5.195 -5.128 464 HD12 LEU 58 HD12 LEU 58 -9.939 -4.893 -4.008 465 HD13 LEU 58 HD13 LEU 58 -9.641 -6.526 -4.612 466 HD21 LEU 58 HD21 LEU 58 -7.344 -4.676 -1.616 467 HD22 LEU 58 HD22 LEU 58 -8.629 -3.860 -2.500 468 HD23 LEU 58 HD23 LEU 58 -7.045 -4.070 -3.242 469 H HIS 59 HN HIS 59 -10.435 -7.481 -0.060 470 HA HIS 59 HA HIS 59 -10.043 -10.080 1.161 471 HB2 HIS 59 HB2 HIS 59 -11.952 -7.944 1.419 472 HB3 HIS 59 HB1 HIS 59 -12.799 -9.462 1.136 473 HD1 HIS 59 HD1 HIS 59 -12.892 -11.125 3.049 474 HD2 HIS 59 HD2 HIS 59 -10.341 -7.924 3.793 475 HE1 HIS 59 HE1 HIS 59 -12.276 -11.295 5.484 476 HE2 HIS 59 HE2 HIS 59 -10.680 -9.388 5.899 477 H GLU 60 HN GLU 60 -11.237 -11.925 0.682 478 HA GLU 60 HA GLU 60 -11.263 -12.693 -1.994 479 HB2 GLU 60 HB2 GLU 60 -12.879 -13.939 0.228 480 HB3 GLU 60 HB1 GLU 60 -12.281 -14.741 -1.216 481 HG2 GLU 60 HG2 GLU 60 -10.819 -15.484 0.397 482 HG3 GLU 60 HG1 GLU 60 -9.938 -14.117 -0.272 483 H SER 61 HN SER 61 -13.683 -11.128 -0.113 484 HA SER 61 HA SER 61 -15.961 -11.565 -1.678 485 HB2 SER 61 HB2 SER 61 -15.951 -10.490 0.553 486 HB3 SER 61 HB1 SER 61 -15.150 -9.082 -0.135 487 HG SER 61 HG SER 61 -17.743 -10.055 -0.793 488 H PHE 62 HN PHE 62 -13.084 -9.827 -2.324 489 HA PHE 62 HA PHE 62 -14.245 -8.316 -4.540 490 HB2 PHE 62 HB2 PHE 62 -11.435 -8.348 -3.399 491 HB3 PHE 62 HB1 PHE 62 -11.993 -7.302 -4.691 492 HD1 PHE 62 HD1 PHE 62 -12.824 -8.174 -1.163 493 HD2 PHE 62 HD2 PHE 62 -12.639 -5.175 -4.164 494 HE1 PHE 62 HE1 PHE 62 -13.474 -6.476 0.497 495 HE2 PHE 62 HE2 PHE 62 -13.299 -3.471 -2.520 496 HZ PHE 62 HZ PHE 62 -13.717 -4.121 -0.183 497 HA PRO 63 HA PRO 63 -12.990 -11.671 -7.288 498 HB2 PRO 63 HB2 PRO 63 -13.507 -9.597 -9.337 499 HB3 PRO 63 HB1 PRO 63 -14.191 -11.219 -9.181 500 HG2 PRO 63 HG2 PRO 63 -15.655 -9.061 -8.633 501 HG3 PRO 63 HG1 PRO 63 -15.802 -10.536 -7.659 502 HD2 PRO 63 HD2 PRO 63 -14.338 -7.994 -7.043 503 HD3 PRO 63 HD1 PRO 63 -15.340 -9.004 -5.976 504 H ARG 64 HN ARG 64 -10.971 -12.165 -7.894 505 HA ARG 64 HA ARG 64 -8.704 -11.955 -8.077 506 HB2 ARG 64 HB2 ARG 64 -9.533 -9.565 -9.738 507 HB3 ARG 64 HB1 ARG 64 -7.888 -10.172 -9.646 508 HG2 ARG 64 HG2 ARG 64 -8.537 -12.239 -10.680 509 HG3 ARG 64 HG1 ARG 64 -10.237 -11.770 -10.638 510 HD2 ARG 64 HD2 ARG 64 -8.042 -10.408 -12.189 511 HD3 ARG 64 HD1 ARG 64 -9.337 -11.411 -12.847 512 HE ARG 64 HE ARG 64 -10.830 -9.613 -11.737 513 HH11 ARG 64 HH11 ARG 64 -7.789 -9.039 -13.392 514 HH12 ARG 64 HH12 ARG 64 -8.193 -7.399 -13.813 515 HH21 ARG 64 HH21 ARG 64 -11.345 -7.480 -12.261 516 HH22 ARG 64 HH22 ARG 64 -10.233 -6.518 -13.190 517 HA PRO 65 HA PRO 65 -8.929 -8.665 -4.827 518 HB2 PRO 65 HB2 PRO 65 -7.850 -10.086 -2.767 519 HB3 PRO 65 HB1 PRO 65 -9.570 -10.079 -3.165 520 HG2 PRO 65 HG2 PRO 65 -7.494 -12.124 -3.760 521 HG3 PRO 65 HG1 PRO 65 -9.208 -12.335 -3.357 522 HD2 PRO 65 HD2 PRO 65 -8.175 -12.510 -5.902 523 HD3 PRO 65 HD1 PRO 65 -9.860 -12.113 -5.529 524 H LYS 66 HN LYS 66 -6.275 -10.682 -5.797 525 HA LYS 66 HA LYS 66 -4.327 -8.893 -4.670 526 HB2 LYS 66 HB2 LYS 66 -3.885 -11.298 -4.606 527 HB3 LYS 66 HB1 LYS 66 -3.941 -11.360 -6.361 528 HG2 LYS 66 HG2 LYS 66 -1.951 -10.091 -6.572 529 HG3 LYS 66 HG1 LYS 66 -1.981 -9.640 -4.869 530 HD2 LYS 66 HD2 LYS 66 -1.005 -11.546 -4.219 531 HD3 LYS 66 HD1 LYS 66 -1.953 -12.530 -5.335 532 HE2 LYS 66 HE2 LYS 66 0.330 -10.791 -6.238 533 HE3 LYS 66 HE1 LYS 66 0.562 -12.458 -5.711 534 HZ1 LYS 66 HZ1 LYS 66 0.319 -12.245 -8.135 535 HZ2 LYS 66 HZ2 LYS 66 -1.242 -11.622 -7.924 536 HZ3 LYS 66 HZ3 LYS 66 -0.891 -13.213 -7.449 537 H ARG 67 HN ARG 67 -4.230 -7.025 -5.661 538 HA ARG 67 HA ARG 67 -4.073 -6.963 -8.595 539 HB2 ARG 67 HB2 ARG 67 -4.270 -4.568 -6.751 540 HB3 ARG 67 HB1 ARG 67 -4.618 -4.646 -8.476 541 HG2 ARG 67 HG2 ARG 67 -6.224 -5.897 -6.264 542 HG3 ARG 67 HG1 ARG 67 -6.672 -4.495 -7.237 543 HD2 ARG 67 HD2 ARG 67 -6.518 -6.029 -9.255 544 HD3 ARG 67 HD1 ARG 67 -6.416 -7.371 -8.100 545 HE ARG 67 HE ARG 67 -8.643 -7.144 -7.666 546 HH11 ARG 67 HH11 ARG 67 -7.555 -4.367 -9.501 547 HH12 ARG 67 HH12 ARG 67 -9.149 -3.682 -9.658 548 HH21 ARG 67 HH21 ARG 67 -10.745 -6.265 -7.893 549 HH22 ARG 67 HH22 ARG 67 -10.963 -4.762 -8.733 550 H VAL 68 HN VAL 68 -2.172 -6.455 -9.591 551 HA VAL 68 HA VAL 68 0.041 -5.712 -7.798 552 HB VAL 68 HB VAL 68 1.529 -7.012 -8.935 553 HG11 VAL 68 HG11 VAL 68 -0.153 -8.515 -8.027 554 HG12 VAL 68 HG12 VAL 68 0.550 -9.173 -9.508 555 HG13 VAL 68 HG13 VAL 68 -1.053 -8.439 -9.545 556 HG21 VAL 68 HG21 VAL 68 1.408 -6.007 -11.076 557 HG22 VAL 68 HG22 VAL 68 -0.177 -6.719 -11.395 558 HG23 VAL 68 HG23 VAL 68 1.251 -7.751 -11.304 559 H CYS 69 HN CYS 69 1.285 -3.994 -8.254 560 HA CYS 69 HA CYS 69 0.667 -2.471 -10.695 561 HB2 CYS 69 HB2 CYS 69 1.183 -1.400 -7.910 562 HB3 CYS 69 HB1 CYS 69 1.074 -0.400 -9.356 563 HG CYS 69 HG CYS 69 -1.614 -2.144 -9.406 564 H LYS 70 HN LYS 70 2.376 -2.252 -11.959 565 HA LYS 70 HA LYS 70 5.051 -2.739 -10.805 566 HB2 LYS 70 HB2 LYS 70 4.127 -2.962 -13.682 567 HB3 LYS 70 HB1 LYS 70 5.707 -3.420 -13.062 568 HG2 LYS 70 HG2 LYS 70 4.899 -5.330 -12.035 569 HG3 LYS 70 HG1 LYS 70 3.254 -4.695 -11.948 570 HD2 LYS 70 HD2 LYS 70 2.837 -5.140 -14.197 571 HD3 LYS 70 HD1 LYS 70 4.554 -5.250 -14.588 572 HE2 LYS 70 HE2 LYS 70 3.145 -7.198 -12.777 573 HE3 LYS 70 HE1 LYS 70 3.296 -7.437 -14.521 574 HZ1 LYS 70 HZ1 LYS 70 5.721 -7.302 -14.264 575 HZ2 LYS 70 HZ2 LYS 70 5.064 -8.593 -13.385 576 HZ3 LYS 70 HZ3 LYS 70 5.541 -7.177 -12.584 577 H ASP 71 HN ASP 71 3.184 -0.235 -11.617 578 HA ASP 71 HA ASP 71 5.298 1.287 -12.971 579 HB2 ASP 71 HB2 ASP 71 2.286 1.599 -13.017 580 HB3 ASP 71 HB1 ASP 71 3.387 2.773 -13.729 581 HA PRO 72 HA PRO 72 5.457 4.695 -9.884 582 HB2 PRO 72 HB2 PRO 72 3.952 6.041 -12.119 583 HB3 PRO 72 HB1 PRO 72 5.174 6.727 -11.040 584 HG2 PRO 72 HG2 PRO 72 5.906 5.916 -13.435 585 HG3 PRO 72 HG1 PRO 72 6.917 5.503 -12.032 586 HD2 PRO 72 HD2 PRO 72 5.129 3.774 -13.646 587 HD3 PRO 72 HD1 PRO 72 6.597 3.355 -12.742 588 HA PRO 73 HA PRO 73 2.606 5.767 -7.032 589 HB2 PRO 73 HB2 PRO 73 0.449 6.796 -8.833 590 HB3 PRO 73 HB1 PRO 73 0.874 7.310 -7.195 591 HG2 PRO 73 HG2 PRO 73 1.776 8.557 -9.480 592 HG3 PRO 73 HG1 PRO 73 2.614 8.610 -7.924 593 HD2 PRO 73 HD2 PRO 73 3.510 7.405 -10.343 594 HD3 PRO 73 HD1 PRO 73 4.312 7.375 -8.762 595 H TYR 74 HN TYR 74 2.133 3.863 -6.319 596 HA TYR 74 HA TYR 74 0.622 1.942 -7.861 597 HB2 TYR 74 HB2 TYR 74 1.817 1.633 -5.103 598 HB3 TYR 74 HB1 TYR 74 1.371 0.340 -6.207 599 HD1 TYR 74 HD2 TYR 74 3.689 3.259 -5.927 600 HD2 TYR 74 HD1 TYR 74 3.008 -0.593 -7.576 601 HE1 TYR 74 HE2 TYR 74 5.980 3.236 -6.795 602 HE2 TYR 74 HE1 TYR 74 5.313 -0.632 -8.453 603 HH TYR 74 HH TYR 74 7.075 0.830 -9.010 604 H LYS 75 HN LYS 75 -1.441 1.391 -7.492 605 HA LYS 75 HA LYS 75 -2.801 2.087 -5.040 606 HB2 LYS 75 HB2 LYS 75 -4.473 3.516 -6.350 607 HB3 LYS 75 HB1 LYS 75 -2.928 4.250 -5.952 608 HG2 LYS 75 HG2 LYS 75 -2.156 4.111 -8.141 609 HG3 LYS 75 HG1 LYS 75 -3.373 2.925 -8.600 610 HD2 LYS 75 HD2 LYS 75 -4.025 5.009 -9.543 611 HD3 LYS 75 HD1 LYS 75 -5.108 4.720 -8.193 612 HE2 LYS 75 HE2 LYS 75 -3.722 6.168 -6.809 613 HE3 LYS 75 HE1 LYS 75 -2.668 6.487 -8.177 614 HZ1 LYS 75 HZ1 LYS 75 -4.459 7.552 -9.322 615 HZ2 LYS 75 HZ2 LYS 75 -4.343 8.239 -7.777 616 HZ3 LYS 75 HZ3 LYS 75 -5.569 7.117 -8.117 617 H VAL 76 HN VAL 76 -4.834 1.257 -4.876 618 HA VAL 76 HA VAL 76 -5.830 -0.344 -7.144 619 HB VAL 76 HB VAL 76 -5.839 -1.057 -4.227 620 HG11 VAL 76 HG11 VAL 76 -8.163 -1.100 -5.204 621 HG12 VAL 76 HG12 VAL 76 -7.583 -2.624 -4.532 622 HG13 VAL 76 HG13 VAL 76 -7.598 -2.377 -6.280 623 HG21 VAL 76 HG21 VAL 76 -4.043 -1.998 -5.530 624 HG22 VAL 76 HG22 VAL 76 -5.170 -2.538 -6.767 625 HG23 VAL 76 HG23 VAL 76 -5.198 -3.273 -5.165 626 H GLU 77 HN GLU 77 -7.758 0.229 -7.864 627 HA GLU 77 HA GLU 77 -9.411 1.991 -6.183 628 HB2 GLU 77 HB2 GLU 77 -9.564 1.804 -9.182 629 HB3 GLU 77 HB1 GLU 77 -10.225 3.049 -8.148 630 HG2 GLU 77 HG2 GLU 77 -8.439 4.218 -8.774 631 HG3 GLU 77 HG1 GLU 77 -7.592 3.230 -7.589 632 H GLU 78 HN GLU 78 -11.142 1.008 -5.400 633 HA GLU 78 HA GLU 78 -12.487 -0.995 -7.061 634 HB2 GLU 78 HB2 GLU 78 -11.063 -1.523 -4.522 635 HB3 GLU 78 HB1 GLU 78 -12.667 -2.240 -4.650 636 HG2 GLU 78 HG2 GLU 78 -10.265 -2.709 -6.386 637 HG3 GLU 78 HG1 GLU 78 -11.165 -3.856 -5.397 638 H SER 79 HN SER 79 -14.398 -1.899 -5.605 639 HA SER 79 HA SER 79 -15.685 0.252 -4.135 640 HB2 SER 79 HB2 SER 79 -16.282 0.622 -6.523 641 HB3 SER 79 HB1 SER 79 -16.976 -1.000 -6.578 642 HG SER 79 HG SER 79 -17.923 1.324 -5.352 643 H GLY 80 HN GLY 80 -17.198 -0.480 -2.681 644 HA2 GLY 80 HA2 GLY 80 -17.986 -3.245 -2.534 645 HA3 GLY 80 HA1 GLY 80 -16.727 -2.819 -1.380 646 H TYR 81 HN TYR 81 -18.172 -3.134 0.437 647 HA TYR 81 HA TYR 81 -19.910 -0.807 0.778 648 HB2 TYR 81 HB2 TYR 81 -21.718 -2.274 1.761 649 HB3 TYR 81 HB1 TYR 81 -21.509 -2.367 0.013 650 HD1 TYR 81 HD2 TYR 81 -21.015 -4.163 3.192 651 HD2 TYR 81 HD1 TYR 81 -20.782 -4.397 -1.050 652 HE1 TYR 81 HE2 TYR 81 -20.784 -6.603 3.342 653 HE2 TYR 81 HE1 TYR 81 -20.565 -6.843 -0.908 654 HH TYR 81 HH TYR 81 -21.258 -8.581 1.879 655 H ALA 82 HN ALA 82 -17.388 -2.335 2.033 656 HA ALA 82 HA ALA 82 -17.804 -1.230 4.632 657 HB1 ALA 82 HB1 ALA 82 -17.707 -4.214 4.423 658 HB2 ALA 82 HB2 ALA 82 -19.087 -3.262 4.937 659 HB3 ALA 82 HB3 ALA 82 -17.620 -3.299 5.917 660 H GLY 83 HN GLY 83 -15.924 -1.765 6.106 661 HA2 GLY 83 HA2 GLY 83 -13.509 -1.541 4.458 662 HA3 GLY 83 HA1 GLY 83 -13.678 -1.002 6.120 663 H PHE 84 HN PHE 84 -11.493 -2.178 5.968 664 HA PHE 84 HA PHE 84 -11.450 -4.468 7.509 665 HB2 PHE 84 HB2 PHE 84 -10.797 -6.223 5.868 666 HB3 PHE 84 HB1 PHE 84 -12.461 -5.697 5.659 667 HD1 PHE 84 HD1 PHE 84 -12.932 -3.995 3.804 668 HD2 PHE 84 HD2 PHE 84 -9.316 -6.219 4.068 669 HE1 PHE 84 HE1 PHE 84 -12.513 -3.569 1.427 670 HE2 PHE 84 HE2 PHE 84 -8.874 -5.795 1.691 671 HZ PHE 84 HZ PHE 84 -10.471 -4.467 0.355 672 H ILE 85 HN ILE 85 -9.283 -5.183 7.934 673 HA ILE 85 HA ILE 85 -7.157 -3.416 7.279 674 HB ILE 85 HB ILE 85 -7.229 -6.200 8.429 675 HG12 ILE 85 HG12 ILE 85 -7.811 -4.284 9.884 676 HG13 ILE 85 HG11 ILE 85 -6.364 -5.132 10.418 677 HG21 ILE 85 HG21 ILE 85 -4.721 -4.630 7.832 678 HG22 ILE 85 HG22 ILE 85 -5.231 -6.116 7.031 679 HG23 ILE 85 HG23 ILE 85 -4.808 -6.139 8.743 680 HD11 ILE 85 HD11 ILE 85 -6.310 -2.605 8.806 681 HD12 ILE 85 HD12 ILE 85 -4.954 -3.407 9.591 682 HD13 ILE 85 HD13 ILE 85 -6.221 -2.663 10.563 683 H LEU 86 HN LEU 86 -6.021 -3.273 5.427 684 HA LEU 86 HA LEU 86 -6.230 -5.550 3.569 685 HB2 LEU 86 HB2 LEU 86 -7.118 -3.104 3.039 686 HB3 LEU 86 HB1 LEU 86 -5.428 -2.837 2.642 687 HG LEU 86 HG LEU 86 -6.775 -5.204 1.428 688 HD11 LEU 86 HD11 LEU 86 -7.070 -2.438 0.282 689 HD12 LEU 86 HD12 LEU 86 -8.342 -3.262 1.187 690 HD13 LEU 86 HD13 LEU 86 -7.750 -3.948 -0.326 691 HD21 LEU 86 HD21 LEU 86 -5.224 -3.466 -0.231 692 HD22 LEU 86 HD22 LEU 86 -5.012 -5.185 0.090 693 HD23 LEU 86 HD23 LEU 86 -4.314 -3.985 1.183 694 HA PRO 87 HA PRO 87 -1.830 -5.935 4.518 695 HB2 PRO 87 HB2 PRO 87 -1.662 -8.308 3.134 696 HB3 PRO 87 HB1 PRO 87 -2.127 -8.183 4.833 697 HG2 PRO 87 HG2 PRO 87 -3.867 -8.431 2.407 698 HG3 PRO 87 HG1 PRO 87 -4.013 -9.247 3.978 699 HD2 PRO 87 HD2 PRO 87 -5.551 -7.139 3.371 700 HD3 PRO 87 HD1 PRO 87 -4.910 -7.371 5.008 701 H ILE 88 HN ILE 88 -1.022 -4.307 3.213 702 HA ILE 88 HA ILE 88 -0.976 -4.711 0.326 703 HB ILE 88 HB ILE 88 0.017 -2.315 1.882 704 HG12 ILE 88 HG12 ILE 88 -2.610 -2.455 0.418 705 HG13 ILE 88 HG11 ILE 88 -2.497 -2.996 2.092 706 HG21 ILE 88 HG21 ILE 88 0.916 -2.538 -0.386 707 HG22 ILE 88 HG22 ILE 88 -0.186 -1.165 -0.261 708 HG23 ILE 88 HG23 ILE 88 -0.726 -2.661 -1.021 709 HD11 ILE 88 HD11 ILE 88 -1.761 -0.247 1.125 710 HD12 ILE 88 HD12 ILE 88 -1.803 -0.804 2.792 711 HD13 ILE 88 HD13 ILE 88 -3.297 -0.686 1.862 712 H GLU 89 HN GLU 89 0.938 -4.898 -0.824 713 HA GLU 89 HA GLU 89 3.376 -5.222 0.788 714 HB2 GLU 89 HB2 GLU 89 2.383 -6.920 -1.488 715 HB3 GLU 89 HB1 GLU 89 4.060 -6.924 -0.961 716 HG2 GLU 89 HG2 GLU 89 3.329 -7.625 1.269 717 HG3 GLU 89 HG1 GLU 89 1.666 -7.685 0.694 718 H VAL 90 HN VAL 90 5.088 -4.138 0.136 719 HA VAL 90 HA VAL 90 5.140 -3.153 -2.634 720 HB VAL 90 HB VAL 90 6.787 -2.040 -0.378 721 HG11 VAL 90 HG11 VAL 90 7.378 -0.382 -1.942 722 HG12 VAL 90 HG12 VAL 90 6.174 -0.920 -3.091 723 HG13 VAL 90 HG13 VAL 90 7.588 -1.919 -2.754 724 HG21 VAL 90 HG21 VAL 90 4.237 -1.727 -0.237 725 HG22 VAL 90 HG22 VAL 90 4.429 -0.686 -1.648 726 HG23 VAL 90 HG23 VAL 90 5.253 -0.290 -0.138 727 H TYR 91 HN TYR 91 6.537 -4.122 -3.928 728 HA TYR 91 HA TYR 91 8.393 -6.062 -2.790 729 HB2 TYR 91 HB2 TYR 91 7.483 -5.399 -5.549 730 HB3 TYR 91 HB1 TYR 91 8.987 -6.284 -5.338 731 HD1 TYR 91 HD1 TYR 91 5.789 -6.523 -3.442 732 HD2 TYR 91 HD2 TYR 91 8.551 -8.441 -6.033 733 HE1 TYR 91 HE1 TYR 91 4.540 -8.623 -3.217 734 HE2 TYR 91 HE2 TYR 91 7.294 -10.545 -5.833 735 HH TYR 91 HH TYR 91 5.746 -11.624 -4.312 736 H PHE 92 HN PHE 92 10.516 -5.909 -2.689 737 HA PHE 92 HA PHE 92 11.676 -3.274 -3.295 738 HB2 PHE 92 HB2 PHE 92 12.414 -5.457 -1.329 739 HB3 PHE 92 HB1 PHE 92 13.470 -4.082 -1.662 740 HD1 PHE 92 HD1 PHE 92 11.266 -2.014 -1.941 741 HD2 PHE 92 HD2 PHE 92 11.971 -5.041 0.957 742 HE1 PHE 92 HE1 PHE 92 10.116 -0.654 -0.256 743 HE2 PHE 92 HE2 PHE 92 10.791 -3.683 2.648 744 HZ PHE 92 HZ PHE 92 9.880 -1.488 2.037 745 H LYS 93 HN LYS 93 13.992 -3.305 -3.994 746 HA LYS 93 HA LYS 93 14.529 -5.583 -5.780 747 HB2 LYS 93 HB2 LYS 93 15.935 -2.893 -5.775 748 HB3 LYS 93 HB1 LYS 93 16.136 -4.165 -6.972 749 HG2 LYS 93 HG2 LYS 93 13.556 -3.681 -7.450 750 HG3 LYS 93 HG1 LYS 93 13.912 -2.174 -6.617 751 HD2 LYS 93 HD2 LYS 93 15.630 -1.564 -8.120 752 HD3 LYS 93 HD1 LYS 93 15.583 -3.127 -8.932 753 HE2 LYS 93 HE2 LYS 93 13.498 -2.596 -10.039 754 HE3 LYS 93 HE1 LYS 93 13.094 -1.350 -8.854 755 HZ1 LYS 93 HZ1 LYS 93 15.406 -1.100 -10.699 756 HZ2 LYS 93 HZ2 LYS 93 14.631 0.121 -9.817 757 HZ3 LYS 93 HZ3 LYS 93 13.845 -0.606 -11.125 758 H ASN 94 HN ASN 94 15.442 -6.995 -4.260 759 HA ASN 94 HA ASN 94 18.201 -6.418 -3.701 760 HB2 ASN 94 HB2 ASN 94 18.007 -6.985 -1.261 761 HB3 ASN 94 HB1 ASN 94 17.321 -5.430 -1.713 762 HD21 ASN 94 HD21 ASN 94 16.064 -5.443 0.172 763 HD22 ASN 94 HD22 ASN 94 14.656 -6.435 0.320 764 H LYS 95 HN LYS 95 19.356 -8.251 -2.839 765 HA LYS 95 HA LYS 95 18.129 -10.843 -3.549 766 HB2 LYS 95 HB2 LYS 95 21.055 -10.208 -3.291 767 HB3 LYS 95 HB1 LYS 95 20.326 -11.621 -4.044 768 HG2 LYS 95 HG2 LYS 95 19.464 -10.289 -5.829 769 HG3 LYS 95 HG1 LYS 95 20.027 -8.808 -5.055 770 HD2 LYS 95 HD2 LYS 95 21.737 -11.034 -6.157 771 HD3 LYS 95 HD1 LYS 95 21.561 -9.409 -6.817 772 HE2 LYS 95 HE2 LYS 95 22.827 -10.192 -4.194 773 HE3 LYS 95 HE1 LYS 95 23.639 -9.537 -5.614 774 HZ1 LYS 95 HZ1 LYS 95 22.207 -7.505 -5.283 775 HZ2 LYS 95 HZ2 LYS 95 23.406 -7.767 -4.110 776 HZ3 LYS 95 HZ3 LYS 95 21.789 -8.138 -3.762 777 H GLU 96 HN GLU 96 18.715 -8.876 -1.145 778 HA GLU 96 HA GLU 96 19.873 -10.742 0.771 779 HB2 GLU 96 HB2 GLU 96 19.595 -8.187 1.955 780 HB3 GLU 96 HB1 GLU 96 21.095 -8.883 1.351 781 HG2 GLU 96 HG2 GLU 96 19.191 -7.280 -0.346 782 HG3 GLU 96 HG1 GLU 96 20.561 -6.589 0.519 783 H GLU 97 HN GLU 97 18.800 -9.168 3.005 784 HA GLU 97 HA GLU 97 16.667 -10.554 3.875 785 HB2 GLU 97 HB2 GLU 97 16.118 -8.558 5.284 786 HB3 GLU 97 HB1 GLU 97 17.802 -9.070 5.340 787 HG2 GLU 97 HG2 GLU 97 18.248 -7.273 3.607 788 HG3 GLU 97 HG1 GLU 97 16.622 -6.687 3.950 789 HA PRO 98 HA PRO 98 12.756 -10.418 2.515 790 HB2 PRO 98 HB2 PRO 98 11.481 -8.051 3.537 791 HB3 PRO 98 HB1 PRO 98 11.309 -9.716 4.106 792 HG2 PRO 98 HG2 PRO 98 13.111 -7.565 5.066 793 HG3 PRO 98 HG1 PRO 98 12.364 -8.899 5.970 794 HD2 PRO 98 HD2 PRO 98 14.944 -9.000 5.417 795 HD3 PRO 98 HD1 PRO 98 13.951 -10.459 5.178 796 H ARG 99 HN ARG 99 12.222 -10.152 0.517 797 HA ARG 99 HA ARG 99 13.005 -7.770 -0.964 798 HB2 ARG 99 HB2 ARG 99 11.676 -10.297 -1.961 799 HB3 ARG 99 HB1 ARG 99 12.519 -9.084 -2.925 800 HG2 ARG 99 HG2 ARG 99 14.588 -9.618 -1.733 801 HG3 ARG 99 HG1 ARG 99 13.740 -10.879 -0.847 802 HD2 ARG 99 HD2 ARG 99 14.049 -10.815 -3.853 803 HD3 ARG 99 HD1 ARG 99 15.026 -11.785 -2.754 804 HE ARG 99 HE ARG 99 12.153 -12.177 -2.600 805 HH11 ARG 99 HH11 ARG 99 15.196 -13.236 -3.971 806 HH12 ARG 99 HH12 ARG 99 14.678 -14.885 -4.179 807 HH21 ARG 99 HH21 ARG 99 11.467 -14.351 -2.870 808 HH22 ARG 99 HH22 ARG 99 12.558 -15.519 -3.558 809 H LYS 100 HN LYS 100 10.698 -8.203 0.948 810 HA LYS 100 HA LYS 100 8.761 -6.612 -0.511 811 HB2 LYS 100 HB2 LYS 100 6.867 -8.085 0.139 812 HB3 LYS 100 HB1 LYS 100 7.951 -8.831 -1.031 813 HG2 LYS 100 HG2 LYS 100 8.889 -10.257 0.594 814 HG3 LYS 100 HG1 LYS 100 8.214 -9.319 1.924 815 HD2 LYS 100 HD2 LYS 100 6.895 -11.261 1.802 816 HD3 LYS 100 HD1 LYS 100 5.927 -10.000 1.042 817 HE2 LYS 100 HE2 LYS 100 7.655 -11.910 -0.519 818 HE3 LYS 100 HE1 LYS 100 5.974 -12.249 -0.121 819 HZ1 LYS 100 HZ1 LYS 100 6.982 -9.978 -1.738 820 HZ2 LYS 100 HZ2 LYS 100 5.359 -10.193 -1.282 821 HZ3 LYS 100 HZ3 LYS 100 6.118 -11.320 -2.303 822 H VAL 101 HN VAL 101 7.589 -5.305 0.803 823 HA VAL 101 HA VAL 101 7.776 -5.799 3.694 824 HB VAL 101 HB VAL 101 8.996 -3.754 3.000 825 HG11 VAL 101 HG11 VAL 101 7.889 -2.935 1.115 826 HG12 VAL 101 HG12 VAL 101 7.510 -1.763 2.388 827 HG13 VAL 101 HG13 VAL 101 6.313 -2.972 1.921 828 HG21 VAL 101 HG21 VAL 101 8.037 -2.278 4.666 829 HG22 VAL 101 HG22 VAL 101 8.031 -3.952 5.231 830 HG23 VAL 101 HG23 VAL 101 6.539 -3.212 4.649 831 H ARG 102 HN ARG 102 5.873 -5.881 4.803 832 HA ARG 102 HA ARG 102 3.456 -5.608 3.163 833 HB2 ARG 102 HB2 ARG 102 3.964 -7.902 3.944 834 HB3 ARG 102 HB1 ARG 102 3.901 -7.323 5.604 835 HG2 ARG 102 HG2 ARG 102 1.589 -6.926 5.510 836 HG3 ARG 102 HG1 ARG 102 1.557 -7.011 3.759 837 HD2 ARG 102 HD2 ARG 102 2.169 -9.342 5.531 838 HD3 ARG 102 HD1 ARG 102 0.573 -8.979 4.907 839 HE ARG 102 HE ARG 102 1.922 -9.113 2.647 840 HH11 ARG 102 HH11 ARG 102 2.169 -11.176 5.464 841 HH12 ARG 102 HH12 ARG 102 2.541 -12.606 4.541 842 HH21 ARG 102 HH21 ARG 102 2.397 -10.989 1.417 843 HH22 ARG 102 HH22 ARG 102 2.703 -12.494 2.248 844 H PHE 103 HN PHE 103 2.239 -3.967 3.623 845 HA PHE 103 HA PHE 103 2.298 -2.855 6.342 846 HB2 PHE 103 HB2 PHE 103 1.531 -1.556 3.721 847 HB3 PHE 103 HB1 PHE 103 1.495 -0.763 5.286 848 HD1 PHE 103 HD1 PHE 103 4.044 -1.682 6.463 849 HD2 PHE 103 HD2 PHE 103 3.121 -0.420 2.502 850 HE1 PHE 103 HE1 PHE 103 6.365 -0.913 6.167 851 HE2 PHE 103 HE2 PHE 103 5.440 0.334 2.201 852 HZ PHE 103 HZ PHE 103 7.063 0.093 4.033 853 H ASP 104 HN ASP 104 0.653 -3.747 7.447 854 HA ASP 104 HA ASP 104 -1.856 -4.426 6.200 855 HB2 ASP 104 HB2 ASP 104 -1.032 -4.348 9.109 856 HB3 ASP 104 HB1 ASP 104 -2.603 -4.898 8.546 857 H TYR 105 HN TYR 105 -2.583 -2.497 5.315 858 HA TYR 105 HA TYR 105 -2.835 -0.194 7.078 859 HB2 TYR 105 HB2 TYR 105 -1.949 0.191 4.832 860 HB3 TYR 105 HB1 TYR 105 -3.399 -0.523 4.121 861 HD1 TYR 105 HD1 TYR 105 -2.416 2.237 6.446 862 HD2 TYR 105 HD2 TYR 105 -5.083 0.854 3.452 863 HE1 TYR 105 HE1 TYR 105 -3.543 4.424 6.445 864 HE2 TYR 105 HE2 TYR 105 -6.206 3.026 3.427 865 HH TYR 105 HH TYR 105 -6.387 4.991 5.496 866 H ASP 106 HN ASP 106 -4.695 0.514 7.927 867 HA ASP 106 HA ASP 106 -6.967 -1.237 7.840 868 HB2 ASP 106 HB2 ASP 106 -6.254 -0.074 9.908 869 HB3 ASP 106 HB1 ASP 106 -6.673 1.466 9.165 870 H LEU 107 HN LEU 107 -8.336 -1.205 6.170 871 HA LEU 107 HA LEU 107 -8.832 1.273 4.738 872 HB2 LEU 107 HB2 LEU 107 -9.118 -1.556 4.198 873 HB3 LEU 107 HB1 LEU 107 -10.587 -0.686 3.801 874 HG LEU 107 HG LEU 107 -9.146 0.863 2.408 875 HD11 LEU 107 HD11 LEU 107 -7.009 -0.135 1.633 876 HD12 LEU 107 HD12 LEU 107 -7.124 -1.286 2.969 877 HD13 LEU 107 HD13 LEU 107 -6.983 0.442 3.302 878 HD21 LEU 107 HD21 LEU 107 -8.920 -0.852 0.583 879 HD22 LEU 107 HD22 LEU 107 -10.518 -0.712 1.323 880 HD23 LEU 107 HD23 LEU 107 -9.456 -2.048 1.765 881 H PHE 108 HN PHE 108 -10.113 2.586 6.004 882 HA PHE 108 HA PHE 108 -12.676 1.405 6.831 883 HB2 PHE 108 HB2 PHE 108 -12.939 3.126 8.486 884 HB3 PHE 108 HB1 PHE 108 -11.350 2.409 8.701 885 HD1 PHE 108 HD2 PHE 108 -13.169 5.378 7.496 886 HD2 PHE 108 HD1 PHE 108 -9.371 3.724 8.476 887 HE1 PHE 108 HE2 PHE 108 -12.177 7.623 7.421 888 HE2 PHE 108 HE1 PHE 108 -8.379 5.973 8.412 889 HZ PHE 108 HZ PHE 108 -9.778 7.923 7.882 890 H LEU 109 HN LEU 109 -14.576 2.385 6.250 891 HA LEU 109 HA LEU 109 -14.350 4.541 4.241 892 HB2 LEU 109 HB2 LEU 109 -16.560 2.482 4.419 893 HB3 LEU 109 HB1 LEU 109 -16.248 3.604 3.107 894 HG LEU 109 HG LEU 109 -14.553 1.217 3.857 895 HD11 LEU 109 HD11 LEU 109 -16.727 0.797 2.663 896 HD12 LEU 109 HD12 LEU 109 -15.277 0.233 1.835 897 HD13 LEU 109 HD13 LEU 109 -16.069 1.720 1.314 898 HD21 LEU 109 HD21 LEU 109 -14.163 3.315 1.731 899 HD22 LEU 109 HD22 LEU 109 -13.299 1.776 1.784 900 HD23 LEU 109 HD23 LEU 109 -13.093 2.948 3.087 901 H HIS 110 HN HIS 110 -15.996 6.220 4.440 902 HA HIS 110 HA HIS 110 -17.015 6.360 7.167 903 HB2 HIS 110 HB2 HIS 110 -16.286 8.350 5.141 904 HB3 HIS 110 HB1 HIS 110 -17.748 8.743 6.039 905 HD1 HIS 110 HD1 HIS 110 -17.328 10.034 8.102 906 HD2 HIS 110 HD2 HIS 110 -14.086 7.618 7.101 907 HE1 HIS 110 HE1 HIS 110 -15.556 10.517 9.825 908 HE2 HIS 110 HE2 HIS 110 -13.621 9.011 9.236 909 H LEU 111 HN LEU 111 -19.188 7.410 7.465 910 HA LEU 111 HA LEU 111 -21.000 5.436 6.659 911 HB2 LEU 111 HB2 LEU 111 -20.917 7.609 8.506 912 HB3 LEU 111 HB1 LEU 111 -22.457 7.628 7.668 913 HG LEU 111 HG LEU 111 -22.475 6.330 9.797 914 HD11 LEU 111 HD11 LEU 111 -23.500 4.260 8.752 915 HD12 LEU 111 HD12 LEU 111 -23.079 4.967 7.190 916 HD13 LEU 111 HD13 LEU 111 -24.188 5.813 8.272 917 HD21 LEU 111 HD21 LEU 111 -20.781 4.351 8.278 918 HD22 LEU 111 HD22 LEU 111 -21.380 4.209 9.935 919 HD23 LEU 111 HD23 LEU 111 -20.164 5.424 9.540 920 H GLU 112 HN GLU 112 -22.579 5.292 5.317 921 HA GLU 112 HA GLU 112 -22.667 6.462 2.858 922 HB2 GLU 112 HB2 GLU 112 -23.825 4.378 3.529 923 HB3 GLU 112 HB1 GLU 112 -25.006 5.333 4.410 924 HG2 GLU 112 HG2 GLU 112 -25.733 6.368 2.322 925 HG3 GLU 112 HG1 GLU 112 -24.550 5.409 1.438 926 H GLY 113 HN GLY 113 -23.194 8.370 2.111 927 HA2 GLY 113 HA2 GLY 113 -25.063 9.986 1.889 928 HA3 GLY 113 HA1 GLY 113 -25.064 10.054 3.646 929 H HIS 114 HN HIS 114 -22.484 10.315 4.334 930 HA HIS 114 HA HIS 114 -21.285 12.384 2.678 931 HB2 HIS 114 HB2 HIS 114 -22.387 12.961 5.411 932 HB3 HIS 114 HB1 HIS 114 -20.935 13.790 4.863 933 HD1 HIS 114 HD1 HIS 114 -24.236 14.599 5.189 934 HD2 HIS 114 HD2 HIS 114 -21.699 14.649 1.893 935 HE1 HIS 114 HE1 HIS 114 -25.257 16.227 3.567 936 HE2 HIS 114 HE2 HIS 114 -23.777 16.145 1.527 937 HA PRO 115 HA PRO 115 -17.990 10.087 4.773 938 HB2 PRO 115 HB2 PRO 115 -17.185 8.540 2.717 939 HB3 PRO 115 HB1 PRO 115 -18.536 8.089 3.759 940 HG2 PRO 115 HG2 PRO 115 -18.566 8.926 0.962 941 HG3 PRO 115 HG1 PRO 115 -19.847 8.164 1.915 942 HD2 PRO 115 HD2 PRO 115 -19.456 10.990 1.274 943 HD3 PRO 115 HD1 PRO 115 -20.883 10.183 1.960 944 HA PRO 116 HA PRO 116 -14.934 12.557 2.481 945 HB2 PRO 116 HB2 PRO 116 -13.975 13.988 4.525 946 HB3 PRO 116 HB1 PRO 116 -15.498 14.429 3.747 947 HG2 PRO 116 HG2 PRO 116 -15.024 13.150 6.380 948 HG3 PRO 116 HG1 PRO 116 -16.351 14.202 5.862 949 HD2 PRO 116 HD2 PRO 116 -16.353 11.354 6.022 950 HD3 PRO 116 HD1 PRO 116 -17.632 12.408 5.384 951 H VAL 117 HN VAL 117 -13.663 10.634 2.145 952 HA VAL 117 HA VAL 117 -11.857 10.063 4.409 953 HB VAL 117 HB VAL 117 -12.826 8.150 2.292 954 HG11 VAL 117 HG11 VAL 117 -10.800 7.821 4.478 955 HG12 VAL 117 HG12 VAL 117 -10.566 7.598 2.750 956 HG13 VAL 117 HG13 VAL 117 -11.565 6.465 3.662 957 HG21 VAL 117 HG21 VAL 117 -13.775 6.945 4.247 958 HG22 VAL 117 HG22 VAL 117 -14.511 8.520 3.955 959 HG23 VAL 117 HG23 VAL 117 -13.337 8.323 5.256 960 H ASN 118 HN ASN 118 -9.994 10.997 4.035 961 HA ASN 118 HA ASN 118 -8.492 10.086 1.703 962 HB2 ASN 118 HB2 ASN 118 -9.403 12.432 1.258 963 HB3 ASN 118 HB1 ASN 118 -8.377 12.985 2.572 964 HD21 ASN 118 HD21 ASN 118 -6.002 12.580 2.311 965 HD22 ASN 118 HD22 ASN 118 -5.358 12.589 0.704 966 H HIS 119 HN HIS 119 -7.135 8.805 2.928 967 HA HIS 119 HA HIS 119 -5.787 10.121 5.201 968 HB2 HIS 119 HB2 HIS 119 -7.528 8.373 5.829 969 HB3 HIS 119 HB1 HIS 119 -6.459 7.188 5.084 970 HD1 HIS 119 HD1 HIS 119 -4.702 6.204 6.537 971 HD2 HIS 119 HD2 HIS 119 -6.260 9.718 8.118 972 HE1 HIS 119 HE1 HIS 119 -3.689 6.422 8.831 973 HE2 HIS 119 HE2 HIS 119 -4.737 8.495 9.816 974 H LEU 120 HN LEU 120 -3.649 9.778 5.458 975 HA LEU 120 HA LEU 120 -2.249 7.819 3.830 976 HB2 LEU 120 HB2 LEU 120 -1.990 10.783 3.569 977 HB3 LEU 120 HB1 LEU 120 -0.564 9.794 3.359 978 HG LEU 120 HG LEU 120 -3.049 9.252 1.775 979 HD11 LEU 120 HD11 LEU 120 -1.301 10.550 0.111 980 HD12 LEU 120 HD12 LEU 120 -1.232 11.518 1.585 981 HD13 LEU 120 HD13 LEU 120 -2.780 11.236 0.781 982 HD21 LEU 120 HD21 LEU 120 -0.985 7.680 2.012 983 HD22 LEU 120 HD22 LEU 120 -0.209 8.845 0.938 984 HD23 LEU 120 HD23 LEU 120 -1.663 7.996 0.414 985 H ARG 121 HN ARG 121 -0.391 7.076 4.748 986 HA ARG 121 HA ARG 121 0.731 8.445 7.066 987 HB2 ARG 121 HB2 ARG 121 0.779 6.250 8.341 988 HB3 ARG 121 HB1 ARG 121 -0.784 7.046 8.229 989 HG2 ARG 121 HG2 ARG 121 -1.419 4.917 7.758 990 HG3 ARG 121 HG1 ARG 121 -1.033 5.447 6.130 991 HD2 ARG 121 HD2 ARG 121 -0.095 3.257 6.517 992 HD3 ARG 121 HD1 ARG 121 1.215 4.423 6.356 993 HE ARG 121 HE ARG 121 1.462 4.331 8.781 994 HH11 ARG 121 HH11 ARG 121 -0.438 1.789 7.278 995 HH12 ARG 121 HH12 ARG 121 -0.197 0.670 8.577 996 HH21 ARG 121 HH21 ARG 121 1.777 2.842 10.482 997 HH22 ARG 121 HH22 ARG 121 1.057 1.262 10.399 998 H CYS 122 HN CYS 122 2.909 8.070 7.339 999 HA CYS 122 HA CYS 122 4.108 6.734 5.035 1000 HB2 CYS 122 HB2 CYS 122 4.410 9.218 5.540 1001 HB3 CYS 122 HB1 CYS 122 5.516 8.683 6.794 1002 HG CYS 122 HG CYS 122 6.271 7.156 3.995 1003 H GLU 123 HN GLU 123 5.652 5.210 5.213 1004 HA GLU 123 HA GLU 123 6.245 4.199 7.919 1005 HB2 GLU 123 HB2 GLU 123 5.987 2.740 5.283 1006 HB3 GLU 123 HB1 GLU 123 6.538 1.993 6.783 1007 HG2 GLU 123 HG2 GLU 123 3.934 3.419 6.665 1008 HG3 GLU 123 HG1 GLU 123 4.061 1.758 6.084 1009 H LYS 124 HN LYS 124 8.345 3.297 8.249 1010 HA LYS 124 HA LYS 124 10.373 4.369 6.404 1011 HB2 LYS 124 HB2 LYS 124 10.105 5.866 8.342 1012 HB3 LYS 124 HB1 LYS 124 10.396 4.507 9.420 1013 HG2 LYS 124 HG2 LYS 124 12.647 4.293 8.180 1014 HG3 LYS 124 HG1 LYS 124 12.326 5.936 7.631 1015 HD2 LYS 124 HD2 LYS 124 13.634 6.130 9.561 1016 HD3 LYS 124 HD1 LYS 124 11.988 6.542 10.050 1017 HE2 LYS 124 HE2 LYS 124 11.661 4.479 11.100 1018 HE3 LYS 124 HE1 LYS 124 13.042 3.752 10.281 1019 HZ1 LYS 124 HZ1 LYS 124 14.457 5.335 11.581 1020 HZ2 LYS 124 HZ2 LYS 124 13.677 4.152 12.510 1021 HZ3 LYS 124 HZ3 LYS 124 13.079 5.742 12.488 1022 H LEU 125 HN LEU 125 12.010 3.000 5.945 1023 HA LEU 125 HA LEU 125 12.273 0.572 7.612 1024 HB2 LEU 125 HB2 LEU 125 12.786 0.717 4.650 1025 HB3 LEU 125 HB1 LEU 125 12.669 -0.721 5.641 1026 HG LEU 125 HG LEU 125 10.236 0.965 5.560 1027 HD11 LEU 125 HD11 LEU 125 10.881 1.126 3.226 1028 HD12 LEU 125 HD12 LEU 125 9.524 0.009 3.405 1029 HD13 LEU 125 HD13 LEU 125 11.153 -0.619 3.165 1030 HD21 LEU 125 HD21 LEU 125 9.254 -1.371 5.239 1031 HD22 LEU 125 HD22 LEU 125 10.066 -1.036 6.773 1032 HD23 LEU 125 HD23 LEU 125 10.894 -1.966 5.525 1033 H THR 126 HN THR 126 14.235 0.500 8.556 1034 HA THR 126 HA THR 126 16.471 1.913 7.240 1035 HB THR 126 HB THR 126 16.631 1.015 10.088 1036 HG1 THR 126 HG1 THR 126 14.702 2.165 10.118 1037 HG21 THR 126 HG21 THR 126 18.486 2.064 8.642 1038 HG22 THR 126 HG22 THR 126 18.236 2.680 10.275 1039 HG23 THR 126 HG23 THR 126 17.610 3.574 8.889 1040 H PHE 127 HN PHE 127 17.945 0.680 6.303 1041 HA PHE 127 HA PHE 127 18.189 -2.126 7.153 1042 HB2 PHE 127 HB2 PHE 127 19.000 -0.835 4.536 1043 HB3 PHE 127 HB1 PHE 127 19.092 -2.554 4.914 1044 HD1 PHE 127 HD1 PHE 127 17.094 -3.914 5.055 1045 HD2 PHE 127 HD2 PHE 127 16.887 0.221 4.074 1046 HE1 PHE 127 HE1 PHE 127 14.779 -4.213 4.300 1047 HE2 PHE 127 HE2 PHE 127 14.569 -0.068 3.318 1048 HZ PHE 127 HZ PHE 127 13.508 -2.286 3.436 1049 H ASN 128 HN ASN 128 19.806 -2.405 8.524 1050 HA ASN 128 HA ASN 128 21.875 -0.437 8.796 1051 HB2 ASN 128 HB2 ASN 128 21.393 -3.048 10.220 1052 HB3 ASN 128 HB1 ASN 128 22.722 -1.957 10.594 1053 HD21 ASN 128 HD21 ASN 128 19.316 -2.501 10.820 1054 HD22 ASN 128 HD22 ASN 128 18.967 -1.168 11.870 1055 H ASN 129 HN ASN 129 23.561 -0.333 7.596 1056 HA ASN 129 HA ASN 129 25.253 -0.832 6.164 1057 HB2 ASN 129 HB2 ASN 129 26.086 -1.451 8.468 1058 HB3 ASN 129 HB1 ASN 129 25.791 -3.141 8.024 1059 HD21 ASN 129 HD21 ASN 129 27.841 -3.968 7.771 1060 HD22 ASN 129 HD22 ASN 129 29.019 -3.291 6.689 1061 HA PRO 130 HA PRO 130 23.342 -4.390 3.962 1062 HB2 PRO 130 HB2 PRO 130 22.257 -3.068 1.886 1063 HB3 PRO 130 HB1 PRO 130 21.431 -3.210 3.441 1064 HG2 PRO 130 HG2 PRO 130 22.793 -0.874 2.234 1065 HG3 PRO 130 HG1 PRO 130 21.456 -0.927 3.392 1066 HD2 PRO 130 HD2 PRO 130 24.203 -0.469 3.947 1067 HD3 PRO 130 HD1 PRO 130 22.887 -0.674 5.117 1068 H THR 131 HN THR 131 23.757 -5.110 1.664 1069 HA THR 131 HA THR 131 26.433 -4.723 0.877 1070 HB THR 131 HB THR 131 25.185 -6.750 0.216 1071 HG1 THR 131 HG1 THR 131 26.993 -5.843 -1.093 1072 HG21 THR 131 HG21 THR 131 22.995 -5.959 -0.257 1073 HG22 THR 131 HG22 THR 131 23.647 -6.529 -1.795 1074 HG23 THR 131 HG23 THR 131 23.598 -4.802 -1.447 1075 H GLU 132 HN GLU 132 27.189 -3.750 -1.210 1076 HA GLU 132 HA GLU 132 26.482 -1.041 -1.240 1077 HB2 GLU 132 HB2 GLU 132 28.665 -2.084 -2.085 1078 HB3 GLU 132 HB1 GLU 132 27.800 -2.400 -3.584 1079 HG2 GLU 132 HG2 GLU 132 28.997 -0.375 -3.868 1080 HG3 GLU 132 HG1 GLU 132 27.291 0.053 -3.706 1081 H ASP 133 HN ASP 133 25.619 -3.645 -3.509 1082 HA ASP 133 HA ASP 133 24.258 -2.221 -5.436 1083 HB2 ASP 133 HB2 ASP 133 23.531 -4.930 -4.307 1084 HB3 ASP 133 HB1 ASP 133 22.909 -4.266 -5.811 1085 H PHE 134 HN PHE 134 23.036 -3.354 -2.311 1086 HA PHE 134 HA PHE 134 20.359 -2.525 -2.823 1087 HB2 PHE 134 HB2 PHE 134 21.071 -4.304 -1.123 1088 HB3 PHE 134 HB1 PHE 134 21.547 -2.961 -0.085 1089 HD1 PHE 134 HD1 PHE 134 18.657 -2.949 -2.366 1090 HD2 PHE 134 HD2 PHE 134 19.962 -3.255 1.674 1091 HE1 PHE 134 HE1 PHE 134 16.354 -2.680 -1.604 1092 HE2 PHE 134 HE2 PHE 134 17.642 -2.995 2.438 1093 HZ PHE 134 HZ PHE 134 15.833 -2.705 0.792 1094 H ARG 135 HN ARG 135 22.900 -1.269 -0.697 1095 HA ARG 135 HA ARG 135 21.690 1.058 0.181 1096 HB2 ARG 135 HB2 ARG 135 23.773 0.333 1.111 1097 HB3 ARG 135 HB1 ARG 135 24.576 0.443 -0.450 1098 HG2 ARG 135 HG2 ARG 135 24.169 2.902 -0.405 1099 HG3 ARG 135 HG1 ARG 135 23.580 2.705 1.252 1100 HD2 ARG 135 HD2 ARG 135 26.354 1.999 0.263 1101 HD3 ARG 135 HD1 ARG 135 25.910 3.388 1.259 1102 HE ARG 135 HE ARG 135 25.327 1.800 3.019 1103 HH11 ARG 135 HH11 ARG 135 27.308 0.638 0.371 1104 HH12 ARG 135 HH12 ARG 135 28.081 -0.590 1.331 1105 HH21 ARG 135 HH21 ARG 135 26.360 0.175 4.279 1106 HH22 ARG 135 HH22 ARG 135 27.536 -0.864 3.536 1107 H ARG 136 HN ARG 136 23.674 0.545 -2.645 1108 HA ARG 136 HA ARG 136 23.863 3.024 -3.771 1109 HB2 ARG 136 HB2 ARG 136 25.026 1.074 -4.541 1110 HB3 ARG 136 HB1 ARG 136 23.531 0.314 -5.050 1111 HG2 ARG 136 HG2 ARG 136 23.356 2.357 -6.639 1112 HG3 ARG 136 HG1 ARG 136 25.095 2.490 -6.319 1113 HD2 ARG 136 HD2 ARG 136 25.207 0.003 -6.841 1114 HD3 ARG 136 HD1 ARG 136 23.592 0.187 -7.515 1115 HE ARG 136 HE ARG 136 24.636 1.932 -9.011 1116 HH11 ARG 136 HH11 ARG 136 26.478 -0.744 -7.692 1117 HH12 ARG 136 HH12 ARG 136 27.621 -0.765 -9.001 1118 HH21 ARG 136 HH21 ARG 136 26.137 1.900 -10.737 1119 HH22 ARG 136 HH22 ARG 136 27.407 0.709 -10.747 1120 H LYS 137 HN LYS 137 21.198 0.683 -4.242 1121 HA LYS 137 HA LYS 137 19.737 2.449 -5.944 1122 HB2 LYS 137 HB2 LYS 137 18.899 -0.015 -4.416 1123 HB3 LYS 137 HB1 LYS 137 17.782 0.906 -5.428 1124 HG2 LYS 137 HG2 LYS 137 19.361 0.526 -7.344 1125 HG3 LYS 137 HG1 LYS 137 20.272 -0.561 -6.296 1126 HD2 LYS 137 HD2 LYS 137 17.396 -1.109 -6.363 1127 HD3 LYS 137 HD1 LYS 137 18.190 -1.286 -7.925 1128 HE2 LYS 137 HE2 LYS 137 18.092 -3.381 -6.573 1129 HE3 LYS 137 HE1 LYS 137 19.713 -2.902 -7.062 1130 HZ1 LYS 137 HZ1 LYS 137 20.121 -2.051 -4.863 1131 HZ2 LYS 137 HZ2 LYS 137 19.587 -3.656 -4.741 1132 HZ3 LYS 137 HZ3 LYS 137 18.528 -2.385 -4.388 1133 H LEU 138 HN LEU 138 19.500 1.595 -2.528 1134 HA LEU 138 HA LEU 138 17.292 3.108 -1.788 1135 HB2 LEU 138 HB2 LEU 138 19.753 2.678 -0.111 1136 HB3 LEU 138 HB1 LEU 138 18.139 3.026 0.463 1137 HG LEU 138 HG LEU 138 19.115 0.471 -0.789 1138 HD11 LEU 138 HD11 LEU 138 19.637 0.876 1.600 1139 HD12 LEU 138 HD12 LEU 138 18.585 -0.513 1.329 1140 HD13 LEU 138 HD13 LEU 138 17.906 1.007 1.913 1141 HD21 LEU 138 HD21 LEU 138 16.322 1.293 -0.070 1142 HD22 LEU 138 HD22 LEU 138 16.821 -0.367 -0.387 1143 HD23 LEU 138 HD23 LEU 138 16.928 0.844 -1.664 1144 H LEU 139 HN LEU 139 20.671 4.074 -2.118 1145 HA LEU 139 HA LEU 139 20.300 6.688 -1.034 1146 HB2 LEU 139 HB2 LEU 139 22.540 5.495 -2.656 1147 HB3 LEU 139 HB1 LEU 139 22.589 7.099 -1.947 1148 HG LEU 139 HG LEU 139 22.347 4.509 -0.418 1149 HD11 LEU 139 HD11 LEU 139 24.546 4.503 -1.030 1150 HD12 LEU 139 HD12 LEU 139 24.629 5.473 0.445 1151 HD13 LEU 139 HD13 LEU 139 24.639 6.264 -1.131 1152 HD21 LEU 139 HD21 LEU 139 21.173 6.393 0.622 1153 HD22 LEU 139 HD22 LEU 139 22.668 7.329 0.592 1154 HD23 LEU 139 HD23 LEU 139 22.565 5.862 1.568 1155 H LYS 140 HN LYS 140 20.215 5.345 -4.282 1156 HA LYS 140 HA LYS 140 20.220 7.803 -5.671 1157 HB2 LYS 140 HB2 LYS 140 19.932 5.059 -6.354 1158 HB3 LYS 140 HB1 LYS 140 18.605 5.956 -7.057 1159 HG2 LYS 140 HG2 LYS 140 20.012 7.318 -8.319 1160 HG3 LYS 140 HG1 LYS 140 21.432 6.871 -7.370 1161 HD2 LYS 140 HD2 LYS 140 19.896 4.888 -9.030 1162 HD3 LYS 140 HD1 LYS 140 21.249 5.820 -9.665 1163 HE2 LYS 140 HE2 LYS 140 21.360 4.035 -7.249 1164 HE3 LYS 140 HE1 LYS 140 21.843 3.563 -8.873 1165 HZ1 LYS 140 HZ1 LYS 140 23.419 5.506 -8.793 1166 HZ2 LYS 140 HZ2 LYS 140 23.801 4.220 -7.766 1167 HZ3 LYS 140 HZ3 LYS 140 23.083 5.617 -7.133 1168 H ALA 141 HN ALA 141 17.857 6.133 -3.859 1169 HA ALA 141 HA ALA 141 15.570 7.477 -4.908 1170 HB1 ALA 141 HB1 ALA 141 14.364 6.384 -3.263 1171 HB2 ALA 141 HB2 ALA 141 15.737 6.309 -2.161 1172 HB3 ALA 141 HB3 ALA 141 15.697 5.282 -3.596 1173 H1 GLY 212 HT1 GLY 212 -16.385 7.664 16.000 1174 H2 GLY 212 HT2 GLY 212 -17.659 7.206 17.020 1175 H3 GLY 212 HT3 GLY 212 -17.756 8.653 16.139 1176 HA2 GLY 212 HA1 GLY 212 -17.754 5.903 15.023 1177 HA3 GLY 212 HA2 GLY 212 -19.134 6.991 15.106 1178 H GLY 213 HN GLY 213 -19.352 6.819 12.811 1179 HA2 GLY 213 HA2 GLY 213 -19.195 8.355 10.974 1180 HA3 GLY 213 HA1 GLY 213 -17.540 8.706 11.450 1181 H LYS 214 HN LYS 214 -17.210 5.705 11.864 1182 HA LYS 214 HA LYS 214 -16.430 5.157 9.108 1183 HB2 LYS 214 HB2 LYS 214 -15.747 3.812 11.722 1184 HB3 LYS 214 HB1 LYS 214 -15.241 3.192 10.158 1185 HG2 LYS 214 HG2 LYS 214 -13.994 5.240 9.736 1186 HG3 LYS 214 HG1 LYS 214 -14.519 5.885 11.294 1187 HD2 LYS 214 HD2 LYS 214 -13.363 4.088 12.450 1188 HD3 LYS 214 HD1 LYS 214 -12.893 3.373 10.908 1189 HE2 LYS 214 HE2 LYS 214 -11.037 4.608 11.842 1190 HE3 LYS 214 HE1 LYS 214 -11.612 5.402 10.378 1191 HZ1 LYS 214 HZ1 LYS 214 -12.865 6.948 11.814 1192 HZ2 LYS 214 HZ2 LYS 214 -11.189 7.035 12.050 1193 HZ3 LYS 214 HZ3 LYS 214 -12.162 6.227 13.177 1194 H ALA 215 HN ALA 215 -17.319 3.665 7.883 1195 HA ALA 215 HA ALA 215 -19.818 2.483 8.563 1196 HB1 ALA 215 HB1 ALA 215 -19.576 1.401 6.318 1197 HB2 ALA 215 HB2 ALA 215 -17.965 2.108 6.203 1198 HB3 ALA 215 HB3 ALA 215 -19.383 3.154 6.291 1199 HA PRO 216 HA PRO 216 -18.761 -1.497 10.189 1200 HB2 PRO 216 HB2 PRO 216 -20.003 -3.220 8.391 1201 HB3 PRO 216 HB1 PRO 216 -20.773 -2.464 9.789 1202 HG2 PRO 216 HG2 PRO 216 -20.851 -1.672 6.920 1203 HG3 PRO 216 HG1 PRO 216 -22.126 -1.582 8.147 1204 HD2 PRO 216 HD2 PRO 216 -20.767 0.592 7.343 1205 HD3 PRO 216 HD1 PRO 216 -21.310 0.404 9.022 1206 H ARG 217 HN ARG 217 -17.777 -3.675 9.599 1207 HA ARG 217 HA ARG 217 -16.172 -3.595 7.176 1208 HB2 ARG 217 HB2 ARG 217 -14.089 -4.088 8.560 1209 HB3 ARG 217 HB1 ARG 217 -14.673 -2.432 8.552 1210 HG2 ARG 217 HG2 ARG 217 -15.736 -2.828 10.735 1211 HG3 ARG 217 HG1 ARG 217 -15.059 -4.458 10.742 1212 HD2 ARG 217 HD2 ARG 217 -13.717 -2.819 12.038 1213 HD3 ARG 217 HD1 ARG 217 -12.822 -3.593 10.730 1214 HE ARG 217 HE ARG 217 -14.034 -1.010 10.141 1215 HH11 ARG 217 HH11 ARG 217 -11.158 -2.775 11.077 1216 HH12 ARG 217 HH12 ARG 217 -10.063 -1.534 10.516 1217 HH21 ARG 217 HH21 ARG 217 -12.599 0.617 9.414 1218 HH22 ARG 217 HH22 ARG 217 -10.877 0.390 9.591 1219 H1 KCR 218 HN KCR 218 -15.155 -5.555 6.640 1220 H4 KCR 218 HA KCR 218 -16.854 -7.787 7.379 1221 H5 KCR 218 HB1 KCR 218 -15.823 -8.921 5.457 1222 H6 KCR 218 HB2 KCR 218 -14.680 -7.586 5.289 1223 H7 KCR 218 HG1 KCR 218 -16.550 -6.043 4.820 1224 H8 KCR 218 HG2 KCR 218 -17.666 -7.411 4.925 1225 H9 KCR 218 HD1 KCR 218 -16.668 -8.471 3.030 1226 H10 KCR 218 HD2 KCR 218 -15.358 -7.288 2.995 1227 H11 KCR 218 HE1 KCR 218 -16.934 -5.525 2.448 1228 H12 KCR 218 HE2 KCR 218 -18.275 -6.666 2.542 1229 H13 KCR 218 HZ1 KCR 218 -17.138 -7.838 0.634 1230 H14 KCR 218 HH1 KCR 218 -16.669 -7.529 -1.683 1231 H15 KCR 218 HJ1 KCR 218 -16.564 -4.518 -2.324 1232 H16 KCR 218 HF3 KCR 218 -15.588 -5.569 -4.367 1233 H17 KCR 218 HF1 KCR 218 -16.219 -7.145 -3.891 1234 H18 KCR 218 HF2 KCR 218 -17.312 -5.907 -4.512 1235 H GLN 219 HN GLN 219 -15.917 -7.988 9.553 1236 HA GLN 219 HA GLN 219 -13.231 -9.040 9.736 1237 HB2 GLN 219 HB2 GLN 219 -15.418 -8.871 11.819 1238 HB3 GLN 219 HB1 GLN 219 -13.750 -9.331 12.131 1239 HG2 GLN 219 HG2 GLN 219 -14.741 -6.653 11.188 1240 HG3 GLN 219 HG1 GLN 219 -14.101 -7.049 12.782 1241 HE21 GLN 219 HE21 GLN 219 -11.878 -7.501 12.991 1242 HE22 GLN 219 HE22 GLN 219 -10.736 -6.918 11.822 1243 H LEU 220 HN LEU 220 -13.072 -10.941 8.661 1244 HA LEU 220 HA LEU 220 -13.329 -13.133 8.134 1245 HB2 LEU 220 HB2 LEU 220 -14.621 -13.272 10.860 1246 HB3 LEU 220 HB1 LEU 220 -14.165 -14.665 9.900 1247 HG LEU 220 HG LEU 220 -12.274 -12.610 11.047 1248 HD11 LEU 220 HD11 LEU 220 -11.516 -14.464 12.457 1249 HD12 LEU 220 HD12 LEU 220 -12.776 -15.492 11.778 1250 HD13 LEU 220 HD13 LEU 220 -13.213 -14.081 12.740 1251 HD21 LEU 220 HD21 LEU 220 -11.717 -15.121 9.472 1252 HD22 LEU 220 HD22 LEU 220 -10.505 -14.100 10.245 1253 HD23 LEU 220 HD23 LEU 220 -11.472 -13.466 8.913 1254 H ALA 221 HN ALA 221 -15.223 -11.399 7.103 1255 HA ALA 221 HA ALA 221 -17.869 -12.438 7.441 1256 HB1 ALA 221 HB1 ALA 221 -17.493 -10.112 6.782 1257 HB2 ALA 221 HB2 ALA 221 -18.474 -10.969 5.591 1258 HB3 ALA 221 HB3 ALA 221 -16.769 -10.658 5.269 1259 H THR 222 HN THR 222 -18.746 -14.133 6.506 1260 HA THR 222 HA THR 222 -19.167 -15.855 5.097 1261 HB THR 222 HB THR 222 -17.139 -14.622 3.217 1262 HG1 THR 222 HG1 THR 222 -19.065 -13.792 2.189 1263 HG21 THR 222 HG21 THR 222 -17.595 -16.980 2.731 1264 HG22 THR 222 HG22 THR 222 -18.288 -15.932 1.492 1265 HG23 THR 222 HG23 THR 222 -19.328 -16.648 2.724 1266 H LYS 223 HN LYS 223 -15.648 -15.159 4.887 1267 HA LYS 223 HA LYS 223 -15.173 -18.012 5.392 1268 HB2 LYS 223 HB2 LYS 223 -14.105 -16.985 3.388 1269 HB3 LYS 223 HB1 LYS 223 -13.204 -15.917 4.457 1270 HG2 LYS 223 HG2 LYS 223 -12.224 -17.944 5.534 1271 HG3 LYS 223 HG1 LYS 223 -13.008 -18.915 4.288 1272 HD2 LYS 223 HD2 LYS 223 -10.993 -16.723 3.802 1273 HD3 LYS 223 HD1 LYS 223 -10.658 -18.454 3.756 1274 HE2 LYS 223 HE2 LYS 223 -12.292 -18.686 1.921 1275 HE3 LYS 223 HE1 LYS 223 -12.531 -16.938 1.944 1276 HZ1 LYS 223 HZ1 LYS 223 -10.145 -16.688 1.456 1277 HZ2 LYS 223 HZ2 LYS 223 -10.980 -17.507 0.228 1278 HZ3 LYS 223 HZ3 LYS 223 -10.008 -18.371 1.313 1279 H ALA 224 HN ALA 224 -15.337 -18.209 7.572 1280 HA ALA 224 HA ALA 224 -13.563 -16.540 9.225 1281 HB1 ALA 224 HB1 ALA 224 -15.912 -18.239 10.067 1282 HB2 ALA 224 HB2 ALA 224 -15.921 -16.485 9.881 1283 HB3 ALA 224 HB3 ALA 224 -14.926 -17.233 11.130 Start of MODEL 6 1 H1 GLY 1 HT1 GLY 1 39.944 -0.252 14.423 2 H2 GLY 1 HT2 GLY 1 40.216 0.262 16.015 3 H3 GLY 1 HT3 GLY 1 40.436 -1.367 15.602 4 HA2 GLY 1 HA1 GLY 1 42.560 -0.252 15.823 5 HA3 GLY 1 HA2 GLY 1 42.283 -0.805 14.177 6 H SER 2 HN SER 2 43.524 0.656 13.121 7 HA SER 2 HA SER 2 43.516 3.446 13.708 8 HB2 SER 2 HB2 SER 2 45.414 2.185 12.649 9 HB3 SER 2 HB1 SER 2 44.450 2.067 11.178 10 HG SER 2 HG SER 2 44.806 4.609 12.295 11 H HIS 3 HN HIS 3 42.059 1.472 11.129 12 HA HIS 3 HA HIS 3 40.515 3.817 10.265 13 HB2 HIS 3 HB2 HIS 3 41.057 1.156 8.947 14 HB3 HIS 3 HB1 HIS 3 39.894 2.317 8.319 15 HD1 HIS 3 HD1 HIS 3 43.483 1.513 8.367 16 HD2 HIS 3 HD2 HIS 3 41.083 4.779 7.422 17 HE1 HIS 3 HE1 HIS 3 44.942 3.068 7.034 18 HE2 HIS 3 HE2 HIS 3 43.442 4.990 6.388 19 H MET 4 HN MET 4 38.655 4.046 11.300 20 HA MET 4 HA MET 4 37.136 1.624 11.997 21 HB2 MET 4 HB2 MET 4 37.001 4.412 13.155 22 HB3 MET 4 HB1 MET 4 35.908 3.105 13.589 23 HG2 MET 4 HG2 MET 4 37.872 1.796 14.354 24 HG3 MET 4 HG1 MET 4 38.877 3.212 14.048 25 HE1 MET 4 HE1 MET 4 35.449 3.148 17.139 26 HE2 MET 4 HE2 MET 4 35.883 1.760 16.141 27 HE3 MET 4 HE3 MET 4 35.188 3.200 15.395 28 H ALA 5 HN ALA 5 35.441 1.180 10.795 29 HA ALA 5 HA ALA 5 34.443 3.131 8.902 30 HB1 ALA 5 HB1 ALA 5 33.094 1.300 8.026 31 HB2 ALA 5 HB2 ALA 5 33.577 0.281 9.383 32 HB3 ALA 5 HB3 ALA 5 34.779 0.807 8.203 33 H SER 6 HN SER 6 32.236 3.741 8.746 34 HA SER 6 HA SER 6 30.997 3.951 11.393 35 HB2 SER 6 HB2 SER 6 31.625 6.041 10.138 36 HB3 SER 6 HB1 SER 6 30.431 5.601 8.919 37 HG SER 6 HG SER 6 28.899 6.287 10.185 38 H SER 7 HN SER 7 29.081 3.035 11.807 39 HA SER 7 HA SER 7 27.864 1.255 9.973 40 HB2 SER 7 HB2 SER 7 27.707 0.980 12.430 41 HB3 SER 7 HB1 SER 7 26.728 2.445 12.528 42 HG SER 7 HG SER 7 25.975 -0.087 11.945 43 H CYS 8 HN CYS 8 26.814 1.883 8.214 44 HA CYS 8 HA CYS 8 25.313 4.411 8.317 45 HB2 CYS 8 HB2 CYS 8 26.390 3.015 5.859 46 HB3 CYS 8 HB1 CYS 8 25.663 4.620 5.937 47 HG CYS 8 HG CYS 8 28.622 3.762 7.436 48 H ALA 9 HN ALA 9 23.288 3.891 8.816 49 HA ALA 9 HA ALA 9 21.992 1.644 7.461 50 HB1 ALA 9 HB1 ALA 9 20.131 2.036 9.033 51 HB2 ALA 9 HB2 ALA 9 20.996 3.437 9.680 52 HB3 ALA 9 HB3 ALA 9 21.670 1.820 9.877 53 H VAL 10 HN VAL 10 20.827 1.978 5.689 54 HA VAL 10 HA VAL 10 20.065 4.727 5.005 55 HB VAL 10 HB VAL 10 19.992 2.287 3.223 56 HG11 VAL 10 HG11 VAL 10 18.553 3.829 2.271 57 HG12 VAL 10 HG12 VAL 10 20.083 4.192 1.472 58 HG13 VAL 10 HG13 VAL 10 19.518 5.208 2.797 59 HG21 VAL 10 HG21 VAL 10 22.276 2.553 3.643 60 HG22 VAL 10 HG22 VAL 10 22.156 4.311 3.693 61 HG23 VAL 10 HG23 VAL 10 22.015 3.462 2.155 62 H GLN 11 HN GLN 11 18.023 5.356 5.203 63 HA GLN 11 HA GLN 11 16.019 3.267 5.750 64 HB2 GLN 11 HB2 GLN 11 15.726 6.204 6.410 65 HB3 GLN 11 HB1 GLN 11 14.802 4.861 7.044 66 HG2 GLN 11 HG2 GLN 11 16.409 4.285 8.584 67 HG3 GLN 11 HG1 GLN 11 17.706 4.996 7.625 68 HE21 GLN 11 HE21 GLN 11 18.484 6.165 9.383 69 HE22 GLN 11 HE22 GLN 11 17.641 7.544 10.012 70 H VAL 12 HN VAL 12 14.394 2.981 4.461 71 HA VAL 12 HA VAL 12 13.915 4.962 2.354 72 HB VAL 12 HB VAL 12 12.713 3.074 1.213 73 HG11 VAL 12 HG11 VAL 12 15.231 3.650 0.959 74 HG12 VAL 12 HG12 VAL 12 14.662 2.098 0.352 75 HG13 VAL 12 HG13 VAL 12 15.496 2.184 1.901 76 HG21 VAL 12 HG21 VAL 12 12.208 1.843 3.256 77 HG22 VAL 12 HG22 VAL 12 13.908 1.395 3.390 78 HG23 VAL 12 HG23 VAL 12 12.949 0.838 2.014 79 H LYS 13 HN LYS 13 11.727 5.652 1.982 80 HA LYS 13 HA LYS 13 10.026 5.189 4.360 81 HB2 LYS 13 HB2 LYS 13 11.026 7.548 4.243 82 HB3 LYS 13 HB1 LYS 13 10.122 7.758 2.755 83 HG2 LYS 13 HG2 LYS 13 8.085 7.804 3.854 84 HG3 LYS 13 HG1 LYS 13 8.733 6.999 5.290 85 HD2 LYS 13 HD2 LYS 13 9.955 8.940 5.928 86 HD3 LYS 13 HD1 LYS 13 9.642 9.725 4.382 87 HE2 LYS 13 HE2 LYS 13 7.403 8.964 6.224 88 HE3 LYS 13 HE1 LYS 13 8.295 10.468 6.444 89 HZ1 LYS 13 HZ1 LYS 13 6.900 9.690 3.934 90 HZ2 LYS 13 HZ2 LYS 13 7.664 11.171 4.251 91 HZ3 LYS 13 HZ3 LYS 13 6.270 10.738 5.106 92 H LEU 14 HN LEU 14 8.299 4.016 3.785 93 HA LEU 14 HA LEU 14 7.142 4.531 1.133 94 HB2 LEU 14 HB2 LEU 14 6.884 2.109 2.906 95 HB3 LEU 14 HB1 LEU 14 6.024 2.332 1.397 96 HG LEU 14 HG LEU 14 9.038 2.201 1.636 97 HD11 LEU 14 HD11 LEU 14 7.115 0.123 0.627 98 HD12 LEU 14 HD12 LEU 14 7.903 0.078 2.205 99 HD13 LEU 14 HD13 LEU 14 8.870 -0.016 0.731 100 HD21 LEU 14 HD21 LEU 14 7.405 1.879 -0.861 101 HD22 LEU 14 HD22 LEU 14 9.124 2.250 -0.692 102 HD23 LEU 14 HD23 LEU 14 7.916 3.475 -0.301 103 H GLU 15 HN GLU 15 4.912 4.787 0.990 104 HA GLU 15 HA GLU 15 3.721 5.827 3.473 105 HB2 GLU 15 HB2 GLU 15 4.613 7.560 1.932 106 HB3 GLU 15 HB1 GLU 15 3.542 6.966 0.675 107 HG2 GLU 15 HG2 GLU 15 1.614 7.666 1.904 108 HG3 GLU 15 HG1 GLU 15 2.607 8.095 3.300 109 H LEU 16 HN LEU 16 1.800 5.028 3.975 110 HA LEU 16 HA LEU 16 0.209 3.663 1.913 111 HB2 LEU 16 HB2 LEU 16 -0.070 3.717 4.903 112 HB3 LEU 16 HB1 LEU 16 -1.267 3.019 3.850 113 HG LEU 16 HG LEU 16 -0.064 1.209 4.699 114 HD11 LEU 16 HD11 LEU 16 1.578 1.334 2.306 115 HD12 LEU 16 HD12 LEU 16 -0.137 1.636 2.038 116 HD13 LEU 16 HD13 LEU 16 0.385 0.138 2.807 117 HD21 LEU 16 HD21 LEU 16 2.495 2.553 3.974 118 HD22 LEU 16 HD22 LEU 16 2.309 1.038 4.836 119 HD23 LEU 16 HD23 LEU 16 1.811 2.555 5.588 120 H GLY 17 HN GLY 17 -1.602 4.537 1.192 121 HA2 GLY 17 HA2 GLY 17 -2.975 6.576 2.758 122 HA3 GLY 17 HA1 GLY 17 -2.364 7.093 1.188 123 H HIS 18 HN HIS 18 -5.127 6.868 2.192 124 HA HIS 18 HA HIS 18 -6.185 5.500 -0.116 125 HB2 HIS 18 HB2 HIS 18 -6.897 3.598 0.841 126 HB3 HIS 18 HB1 HIS 18 -5.948 4.017 2.257 127 HD1 HIS 18 HD1 HIS 18 -7.316 5.345 4.178 128 HD2 HIS 18 HD2 HIS 18 -9.594 3.455 1.260 129 HE1 HIS 18 HE1 HIS 18 -9.655 5.214 5.119 130 HE2 HIS 18 HE2 HIS 18 -10.977 3.961 3.388 131 H ARG 19 HN ARG 19 -8.182 6.185 -0.682 132 HA ARG 19 HA ARG 19 -9.495 8.150 1.081 133 HB2 ARG 19 HB2 ARG 19 -9.484 8.181 -1.940 134 HB3 ARG 19 HB1 ARG 19 -10.227 9.359 -0.890 135 HG2 ARG 19 HG2 ARG 19 -8.051 10.073 -0.097 136 HG3 ARG 19 HG1 ARG 19 -7.270 8.858 -1.113 137 HD2 ARG 19 HD2 ARG 19 -7.200 11.003 -2.228 138 HD3 ARG 19 HD1 ARG 19 -8.285 9.910 -3.093 139 HE ARG 19 HE ARG 19 -9.535 11.669 -1.146 140 HH11 ARG 19 HH11 ARG 19 -8.672 11.198 -4.519 141 HH12 ARG 19 HH12 ARG 19 -9.931 12.243 -5.105 142 HH21 ARG 19 HH21 ARG 19 -11.145 13.050 -1.911 143 HH22 ARG 19 HH22 ARG 19 -11.311 13.337 -3.622 144 H ALA 20 HN ALA 20 -11.836 8.208 0.846 145 HA ALA 20 HA ALA 20 -13.033 6.002 -0.646 146 HB1 ALA 20 HB1 ALA 20 -12.982 4.854 1.339 147 HB2 ALA 20 HB2 ALA 20 -14.548 5.658 1.446 148 HB3 ALA 20 HB3 ALA 20 -13.158 6.314 2.311 149 H GLN 21 HN GLN 21 -14.944 6.480 -1.516 150 HA GLN 21 HA GLN 21 -16.513 8.728 -0.476 151 HB2 GLN 21 HB2 GLN 21 -16.825 9.678 -2.666 152 HB3 GLN 21 HB1 GLN 21 -15.095 9.498 -2.417 153 HG2 GLN 21 HG2 GLN 21 -14.866 7.934 -3.998 154 HG3 GLN 21 HG1 GLN 21 -16.475 7.267 -3.753 155 HE21 GLN 21 HE21 GLN 21 -18.240 8.250 -4.767 156 HE22 GLN 21 HE22 GLN 21 -18.041 9.307 -6.124 157 H VAL 22 HN VAL 22 -18.773 8.583 -1.145 158 HA VAL 22 HA VAL 22 -19.470 5.850 -1.965 159 HB VAL 22 HB VAL 22 -20.371 6.592 0.238 160 HG11 VAL 22 HG11 VAL 22 -22.208 8.136 0.355 161 HG12 VAL 22 HG12 VAL 22 -22.127 8.420 -1.387 162 HG13 VAL 22 HG13 VAL 22 -20.803 8.945 -0.345 163 HG21 VAL 22 HG21 VAL 22 -22.547 5.655 -0.110 164 HG22 VAL 22 HG22 VAL 22 -21.389 4.810 -1.126 165 HG23 VAL 22 HG23 VAL 22 -22.474 6.008 -1.831 166 H ARG 23 HN ARG 23 -20.561 5.484 -3.793 167 HA ARG 23 HA ARG 23 -21.122 7.750 -5.536 168 HB2 ARG 23 HB2 ARG 23 -22.101 5.659 -6.940 169 HB3 ARG 23 HB1 ARG 23 -20.408 6.127 -6.956 170 HG2 ARG 23 HG2 ARG 23 -19.735 4.325 -5.789 171 HG3 ARG 23 HG1 ARG 23 -21.214 4.245 -4.837 172 HD2 ARG 23 HD2 ARG 23 -20.883 2.331 -6.408 173 HD3 ARG 23 HD1 ARG 23 -22.396 3.206 -6.633 174 HE ARG 23 HE ARG 23 -21.567 4.101 -8.643 175 HH11 ARG 23 HH11 ARG 23 -19.248 1.945 -7.140 176 HH12 ARG 23 HH12 ARG 23 -18.448 1.564 -8.630 177 HH21 ARG 23 HH21 ARG 23 -20.522 3.603 -10.598 178 HH22 ARG 23 HH22 ARG 23 -19.186 2.493 -10.616 179 H LYS 24 HN LYS 24 -23.158 8.310 -6.293 180 HA LYS 24 HA LYS 24 -25.086 8.341 -4.220 181 HB2 LYS 24 HB2 LYS 24 -24.572 10.105 -6.018 182 HB3 LYS 24 HB1 LYS 24 -25.640 9.168 -7.053 183 HG2 LYS 24 HG2 LYS 24 -26.903 10.941 -6.085 184 HG3 LYS 24 HG1 LYS 24 -27.418 9.428 -5.337 185 HD2 LYS 24 HD2 LYS 24 -25.999 9.892 -3.405 186 HD3 LYS 24 HD1 LYS 24 -25.470 11.401 -4.153 187 HE2 LYS 24 HE2 LYS 24 -27.819 12.175 -4.149 188 HE3 LYS 24 HE1 LYS 24 -28.276 10.698 -3.302 189 HZ1 LYS 24 HZ1 LYS 24 -27.962 12.591 -1.797 190 HZ2 LYS 24 HZ2 LYS 24 -26.341 12.710 -2.282 191 HZ3 LYS 24 HZ3 LYS 24 -26.882 11.329 -1.459 192 H LYS 25 HN LYS 25 -24.491 6.046 -6.575 193 HA LYS 25 HA LYS 25 -26.901 4.643 -5.793 194 HB2 LYS 25 HB2 LYS 25 -27.519 5.842 -7.871 195 HB3 LYS 25 HB1 LYS 25 -26.239 4.992 -8.717 196 HG2 LYS 25 HG2 LYS 25 -27.319 2.925 -8.353 197 HG3 LYS 25 HG1 LYS 25 -28.487 3.644 -7.259 198 HD2 LYS 25 HD2 LYS 25 -29.452 4.897 -9.043 199 HD3 LYS 25 HD1 LYS 25 -28.210 4.343 -10.172 200 HE2 LYS 25 HE2 LYS 25 -30.205 3.050 -10.533 201 HE3 LYS 25 HE1 LYS 25 -28.973 2.025 -9.792 202 HZ1 LYS 25 HZ1 LYS 25 -31.165 1.698 -8.805 203 HZ2 LYS 25 HZ2 LYS 25 -31.210 3.326 -8.330 204 HZ3 LYS 25 HZ3 LYS 25 -30.055 2.279 -7.665 205 HA PRO 26 HA PRO 26 -23.705 1.477 -5.598 206 HB2 PRO 26 HB2 PRO 26 -26.055 -0.303 -5.364 207 HB3 PRO 26 HB1 PRO 26 -24.660 -0.135 -4.298 208 HG2 PRO 26 HG2 PRO 26 -27.065 0.812 -3.611 209 HG3 PRO 26 HG1 PRO 26 -25.568 1.656 -3.169 210 HD2 PRO 26 HD2 PRO 26 -27.544 2.288 -5.323 211 HD3 PRO 26 HD1 PRO 26 -26.628 3.384 -4.274 212 H THR 27 HN THR 27 -23.046 -0.286 -6.864 213 HA THR 27 HA THR 27 -23.897 -0.108 -9.601 214 HB THR 27 HB THR 27 -21.536 -0.431 -9.140 215 HG1 THR 27 HG1 THR 27 -21.582 -2.832 -10.195 216 HG21 THR 27 HG21 THR 27 -21.555 -1.600 -7.063 217 HG22 THR 27 HG22 THR 27 -20.734 -2.626 -8.242 218 HG23 THR 27 HG23 THR 27 -22.401 -2.971 -7.783 219 H VAL 28 HN VAL 28 -24.008 -2.446 -10.726 220 HA VAL 28 HA VAL 28 -26.498 -3.486 -10.310 221 HB VAL 28 HB VAL 28 -25.395 -3.975 -12.317 222 HG11 VAL 28 HG11 VAL 28 -23.089 -3.920 -11.404 223 HG12 VAL 28 HG12 VAL 28 -23.365 -5.258 -12.525 224 HG13 VAL 28 HG13 VAL 28 -23.333 -5.558 -10.786 225 HG21 VAL 28 HG21 VAL 28 -25.714 -6.511 -10.726 226 HG22 VAL 28 HG22 VAL 28 -25.559 -6.447 -12.482 227 HG23 VAL 28 HG23 VAL 28 -26.947 -5.699 -11.691 228 H GLU 29 HN GLU 29 -23.512 -4.510 -8.750 229 HA GLU 29 HA GLU 29 -24.894 -6.718 -7.446 230 HB2 GLU 29 HB2 GLU 29 -21.978 -5.941 -7.398 231 HB3 GLU 29 HB1 GLU 29 -22.658 -7.419 -6.723 232 HG2 GLU 29 HG2 GLU 29 -23.383 -8.106 -8.975 233 HG3 GLU 29 HG1 GLU 29 -22.723 -6.610 -9.632 234 H GLY 30 HN GLY 30 -24.694 -3.561 -6.822 235 HA2 GLY 30 HA2 GLY 30 -25.590 -2.515 -4.972 236 HA3 GLY 30 HA1 GLY 30 -25.534 -4.044 -4.107 237 H PHE 31 HN PHE 31 -22.756 -2.579 -5.649 238 HA PHE 31 HA PHE 31 -21.468 -2.313 -3.057 239 HB2 PHE 31 HB2 PHE 31 -20.315 -1.745 -5.801 240 HB3 PHE 31 HB1 PHE 31 -19.421 -1.930 -4.294 241 HD1 PHE 31 HD1 PHE 31 -21.157 -4.392 -3.392 242 HD2 PHE 31 HD2 PHE 31 -19.041 -3.431 -6.948 243 HE1 PHE 31 HE1 PHE 31 -20.865 -6.785 -3.856 244 HE2 PHE 31 HE2 PHE 31 -18.747 -5.820 -7.424 245 HZ PHE 31 HZ PHE 31 -19.662 -7.503 -5.880 246 H THR 32 HN THR 32 -21.422 -0.436 -1.995 247 HA THR 32 HA THR 32 -22.630 1.880 -3.310 248 HB THR 32 HB THR 32 -23.090 2.700 -1.054 249 HG1 THR 32 HG1 THR 32 -22.688 1.121 0.700 250 HG21 THR 32 HG21 THR 32 -23.920 -0.085 -1.626 251 HG22 THR 32 HG22 THR 32 -24.798 1.386 -1.995 252 HG23 THR 32 HG23 THR 32 -24.609 0.859 -0.321 253 H HIS 33 HN HIS 33 -19.720 0.918 -1.614 254 HA HIS 33 HA HIS 33 -18.823 3.720 -1.531 255 HB2 HIS 33 HB2 HIS 33 -18.360 1.362 0.247 256 HB3 HIS 33 HB1 HIS 33 -17.134 2.626 0.188 257 HD1 HIS 33 HD1 HIS 33 -20.788 2.124 1.076 258 HD2 HIS 33 HD2 HIS 33 -17.708 4.861 1.640 259 HE1 HIS 33 HE1 HIS 33 -21.631 3.758 2.805 260 HE2 HIS 33 HE2 HIS 33 -19.659 5.244 3.289 261 H ASP 34 HN ASP 34 -17.174 4.325 -2.732 262 HA ASP 34 HA ASP 34 -15.473 2.255 -3.958 263 HB2 ASP 34 HB2 ASP 34 -16.365 4.964 -4.935 264 HB3 ASP 34 HB1 ASP 34 -14.935 4.184 -5.596 265 H TRP 35 HN TRP 35 -13.313 2.371 -3.653 266 HA TRP 35 HA TRP 35 -12.278 4.731 -2.282 267 HB2 TRP 35 HB2 TRP 35 -11.028 3.243 -0.689 268 HB3 TRP 35 HB1 TRP 35 -12.764 3.325 -0.441 269 HD1 TRP 35 HD1 TRP 35 -14.102 1.050 -0.527 270 HE1 TRP 35 HE1 TRP 35 -13.383 -1.413 -0.835 271 HE3 TRP 35 HE3 TRP 35 -9.246 1.772 -2.001 272 HZ2 TRP 35 HZ2 TRP 35 -11.067 -2.848 -1.591 273 HZ3 TRP 35 HZ3 TRP 35 -7.849 -0.200 -2.486 274 HH2 TRP 35 HH2 TRP 35 -8.728 -2.453 -2.252 275 H MET 36 HN MET 36 -9.930 4.742 -2.128 276 HA MET 36 HA MET 36 -8.571 3.223 -4.227 277 HB2 MET 36 HB2 MET 36 -9.149 5.305 -5.313 278 HB3 MET 36 HB1 MET 36 -8.563 6.238 -3.943 279 HG2 MET 36 HG2 MET 36 -6.285 5.249 -4.411 280 HG3 MET 36 HG1 MET 36 -6.957 4.673 -5.937 281 HE1 MET 36 HE1 MET 36 -6.326 7.401 -3.594 282 HE2 MET 36 HE2 MET 36 -7.694 8.350 -4.192 283 HE3 MET 36 HE3 MET 36 -6.043 8.866 -4.541 284 H VAL 37 HN VAL 37 -6.630 2.528 -3.586 285 HA VAL 37 HA VAL 37 -5.379 3.765 -1.214 286 HB VAL 37 HB VAL 37 -4.003 1.515 -1.364 287 HG11 VAL 37 HG11 VAL 37 -6.795 1.589 -0.337 288 HG12 VAL 37 HG12 VAL 37 -5.400 2.235 0.511 289 HG13 VAL 37 HG13 VAL 37 -5.531 0.501 0.205 290 HG21 VAL 37 HG21 VAL 37 -4.988 0.707 -3.417 291 HG22 VAL 37 HG22 VAL 37 -6.602 0.819 -2.718 292 HG23 VAL 37 HG23 VAL 37 -5.447 -0.355 -2.086 293 H PHE 38 HN PHE 38 -3.233 4.437 -1.350 294 HA PHE 38 HA PHE 38 -1.781 3.764 -3.775 295 HB2 PHE 38 HB2 PHE 38 -1.188 6.064 -4.300 296 HB3 PHE 38 HB1 PHE 38 -2.938 6.006 -4.074 297 HD1 PHE 38 HD1 PHE 38 0.226 7.032 -2.543 298 HD2 PHE 38 HD2 PHE 38 -4.000 7.370 -2.486 299 HE1 PHE 38 HE1 PHE 38 0.425 8.956 -1.040 300 HE2 PHE 38 HE2 PHE 38 -3.835 9.292 -0.965 301 HZ PHE 38 HZ PHE 38 -1.629 10.099 -0.234 302 H VAL 39 HN VAL 39 0.072 2.998 -3.365 303 HA VAL 39 HA VAL 39 1.444 3.581 -0.817 304 HB VAL 39 HB VAL 39 2.718 1.438 -1.476 305 HG11 VAL 39 HG11 VAL 39 0.887 1.684 0.246 306 HG12 VAL 39 HG12 VAL 39 1.101 0.069 -0.425 307 HG13 VAL 39 HG13 VAL 39 -0.225 1.089 -0.986 308 HG21 VAL 39 HG21 VAL 39 1.954 0.092 -3.141 309 HG22 VAL 39 HG22 VAL 39 1.645 1.668 -3.852 310 HG23 VAL 39 HG23 VAL 39 0.331 0.765 -3.100 311 H ARG 40 HN ARG 40 3.556 4.429 -0.937 312 HA ARG 40 HA ARG 40 5.065 4.537 -3.346 313 HB2 ARG 40 HB2 ARG 40 4.829 6.869 -3.933 314 HB3 ARG 40 HB1 ARG 40 3.226 6.141 -3.938 315 HG2 ARG 40 HG2 ARG 40 2.583 7.234 -1.987 316 HG3 ARG 40 HG1 ARG 40 4.248 7.553 -1.503 317 HD2 ARG 40 HD2 ARG 40 4.422 9.075 -3.508 318 HD3 ARG 40 HD1 ARG 40 2.670 8.891 -3.696 319 HE ARG 40 HE ARG 40 2.796 9.685 -1.163 320 HH11 ARG 40 HH11 ARG 40 4.479 10.904 -4.002 321 HH12 ARG 40 HH12 ARG 40 4.637 12.515 -3.354 322 HH21 ARG 40 HH21 ARG 40 3.007 11.805 -0.341 323 HH22 ARG 40 HH22 ARG 40 3.814 13.018 -1.293 324 H GLY 41 HN GLY 41 6.644 6.609 -3.111 325 HA2 GLY 41 HA2 GLY 41 7.599 6.612 -0.327 326 HA3 GLY 41 HA1 GLY 41 8.610 6.884 -1.738 327 HA PRO 42 HA PRO 42 7.055 10.939 0.353 328 HB2 PRO 42 HB2 PRO 42 10.002 11.318 0.496 329 HB3 PRO 42 HB1 PRO 42 8.760 11.714 1.690 330 HG2 PRO 42 HG2 PRO 42 10.354 9.598 2.060 331 HG3 PRO 42 HG1 PRO 42 8.634 9.531 2.469 332 HD2 PRO 42 HD2 PRO 42 10.047 8.408 0.095 333 HD3 PRO 42 HD1 PRO 42 8.730 7.715 1.065 334 H GLU 43 HN GLU 43 7.672 13.141 -0.276 335 HA GLU 43 HA GLU 43 7.460 13.507 -3.013 336 HB2 GLU 43 HB2 GLU 43 8.408 15.390 -0.860 337 HB3 GLU 43 HB1 GLU 43 8.094 15.886 -2.517 338 HG2 GLU 43 HG2 GLU 43 6.067 14.663 -0.662 339 HG3 GLU 43 HG1 GLU 43 6.232 16.380 -1.012 340 H HIS 44 HN HIS 44 8.820 13.265 -4.566 341 HA HIS 44 HA HIS 44 10.631 13.643 -5.898 342 HB2 HIS 44 HB2 HIS 44 11.958 14.709 -3.408 343 HB3 HIS 44 HB1 HIS 44 12.729 14.655 -4.987 344 HD1 HIS 44 HD1 HIS 44 10.891 15.827 -6.894 345 HD2 HIS 44 HD2 HIS 44 11.052 17.214 -2.971 346 HE1 HIS 44 HE1 HIS 44 9.919 18.148 -6.948 347 HE2 HIS 44 HE2 HIS 44 10.233 19.035 -4.611 348 H SER 45 HN SER 45 10.821 11.794 -2.988 349 HA SER 45 HA SER 45 13.079 10.254 -3.942 350 HB2 SER 45 HB2 SER 45 12.507 8.780 -1.952 351 HB3 SER 45 HB1 SER 45 12.917 10.447 -1.554 352 HG SER 45 HG SER 45 10.237 9.868 -2.027 353 H ASN 46 HN ASN 46 12.828 8.864 -5.554 354 HA ASN 46 HA ASN 46 10.180 7.761 -6.114 355 HB2 ASN 46 HB2 ASN 46 12.788 7.757 -7.629 356 HB3 ASN 46 HB1 ASN 46 11.430 6.756 -8.122 357 HD21 ASN 46 HD21 ASN 46 9.464 8.770 -7.285 358 HD22 ASN 46 HD22 ASN 46 9.523 10.009 -8.488 359 H ILE 47 HN ILE 47 9.592 5.729 -5.603 360 HA ILE 47 HA ILE 47 11.519 4.193 -4.100 361 HB ILE 47 HB ILE 47 9.787 2.741 -3.430 362 HG12 ILE 47 HG12 ILE 47 7.919 4.212 -5.287 363 HG13 ILE 47 HG11 ILE 47 8.633 2.629 -5.619 364 HG21 ILE 47 HG21 ILE 47 9.934 4.760 -2.213 365 HG22 ILE 47 HG22 ILE 47 8.230 4.350 -2.390 366 HG23 ILE 47 HG23 ILE 47 8.944 5.615 -3.393 367 HD11 ILE 47 HD11 ILE 47 7.260 2.893 -3.045 368 HD12 ILE 47 HD12 ILE 47 7.253 1.565 -4.205 369 HD13 ILE 47 HD13 ILE 47 6.230 2.978 -4.472 370 H GLN 48 HN GLN 48 10.180 4.205 -7.267 371 HA GLN 48 HA GLN 48 10.342 1.505 -7.973 372 HB2 GLN 48 HB2 GLN 48 9.302 3.298 -9.353 373 HB3 GLN 48 HB1 GLN 48 10.898 3.936 -9.704 374 HG2 GLN 48 HG2 GLN 48 10.452 2.747 -11.603 375 HG3 GLN 48 HG1 GLN 48 11.341 1.568 -10.671 376 HE21 GLN 48 HE21 GLN 48 7.983 2.510 -10.182 377 HE22 GLN 48 HE22 GLN 48 7.309 0.972 -10.587 378 H HIS 49 HN HIS 49 12.791 3.562 -7.035 379 HA HIS 49 HA HIS 49 14.943 2.348 -8.503 380 HB2 HIS 49 HB2 HIS 49 14.749 4.359 -6.291 381 HB3 HIS 49 HB1 HIS 49 16.300 3.599 -6.647 382 HD1 HIS 49 HD1 HIS 49 16.059 3.569 -9.758 383 HD2 HIS 49 HD2 HIS 49 15.207 6.844 -7.341 384 HE1 HIS 49 HE1 HIS 49 16.318 5.594 -11.231 385 HE2 HIS 49 HE2 HIS 49 15.633 7.546 -9.788 386 H PHE 50 HN PHE 50 13.581 2.069 -5.219 387 HA PHE 50 HA PHE 50 15.338 -0.242 -4.838 388 HB2 PHE 50 HB2 PHE 50 15.072 0.068 -2.406 389 HB3 PHE 50 HB1 PHE 50 15.854 1.425 -3.206 390 HD1 PHE 50 HD1 PHE 50 12.734 0.290 -1.590 391 HD2 PHE 50 HD2 PHE 50 14.924 3.576 -3.173 392 HE1 PHE 50 HE1 PHE 50 11.183 1.834 -0.514 393 HE2 PHE 50 HE2 PHE 50 13.338 5.135 -2.112 394 HZ PHE 50 HZ PHE 50 11.464 4.263 -0.778 395 H VAL 51 HN VAL 51 12.328 0.483 -5.683 396 HA VAL 51 HA VAL 51 11.159 -1.931 -4.470 397 HB VAL 51 HB VAL 51 9.848 0.743 -5.073 398 HG11 VAL 51 HG11 VAL 51 7.830 -0.555 -3.968 399 HG12 VAL 51 HG12 VAL 51 8.630 -1.953 -4.702 400 HG13 VAL 51 HG13 VAL 51 8.109 -0.606 -5.715 401 HG21 VAL 51 HG21 VAL 51 9.209 0.567 -2.667 402 HG22 VAL 51 HG22 VAL 51 10.944 0.701 -2.951 403 HG23 VAL 51 HG23 VAL 51 10.234 -0.862 -2.551 404 H GLU 52 HN GLU 52 9.926 -3.232 -5.867 405 HA GLU 52 HA GLU 52 10.655 -2.779 -8.696 406 HB2 GLU 52 HB2 GLU 52 11.792 -4.682 -7.639 407 HB3 GLU 52 HB1 GLU 52 10.242 -5.367 -7.180 408 HG2 GLU 52 HG2 GLU 52 11.061 -6.553 -9.069 409 HG3 GLU 52 HG1 GLU 52 9.684 -5.585 -9.589 410 H LYS 53 HN LYS 53 8.256 -4.553 -6.770 411 HA LYS 53 HA LYS 53 6.168 -3.563 -8.555 412 HB2 LYS 53 HB2 LYS 53 5.143 -5.816 -8.635 413 HB3 LYS 53 HB1 LYS 53 6.725 -5.767 -9.400 414 HG2 LYS 53 HG2 LYS 53 7.727 -6.798 -7.457 415 HG3 LYS 53 HG1 LYS 53 6.176 -6.804 -6.627 416 HD2 LYS 53 HD2 LYS 53 6.788 -8.247 -9.210 417 HD3 LYS 53 HD1 LYS 53 6.775 -9.000 -7.615 418 HE2 LYS 53 HE2 LYS 53 4.447 -8.650 -7.366 419 HE3 LYS 53 HE1 LYS 53 4.406 -7.555 -8.751 420 HZ1 LYS 53 HZ1 LYS 53 3.525 -9.720 -9.348 421 HZ2 LYS 53 HZ2 LYS 53 4.958 -10.476 -8.842 422 HZ3 LYS 53 HZ3 LYS 53 4.977 -9.436 -10.183 423 H VAL 54 HN VAL 54 3.974 -4.081 -7.582 424 HA VAL 54 HA VAL 54 4.066 -4.078 -4.654 425 HB VAL 54 HB VAL 54 3.106 -1.876 -6.423 426 HG11 VAL 54 HG11 VAL 54 2.071 -1.796 -3.677 427 HG12 VAL 54 HG12 VAL 54 1.255 -2.923 -4.755 428 HG13 VAL 54 HG13 VAL 54 1.351 -1.214 -5.174 429 HG21 VAL 54 HG21 VAL 54 3.904 -0.884 -4.003 430 HG22 VAL 54 HG22 VAL 54 4.919 -1.049 -5.429 431 HG23 VAL 54 HG23 VAL 54 4.921 -2.307 -4.192 432 H VAL 55 HN VAL 55 2.036 -4.659 -3.670 433 HA VAL 55 HA VAL 55 0.077 -5.813 -5.498 434 HB VAL 55 HB VAL 55 2.108 -7.378 -4.350 435 HG11 VAL 55 HG11 VAL 55 -0.559 -7.925 -3.069 436 HG12 VAL 55 HG12 VAL 55 0.943 -7.484 -2.250 437 HG13 VAL 55 HG13 VAL 55 0.808 -9.043 -3.065 438 HG21 VAL 55 HG21 VAL 55 -0.477 -8.286 -5.589 439 HG22 VAL 55 HG22 VAL 55 1.048 -9.173 -5.524 440 HG23 VAL 55 HG23 VAL 55 0.927 -7.701 -6.486 441 H PHE 56 HN PHE 56 -1.916 -6.160 -4.599 442 HA PHE 56 HA PHE 56 -2.304 -5.255 -1.833 443 HB2 PHE 56 HB2 PHE 56 -3.813 -4.458 -4.327 444 HB3 PHE 56 HB1 PHE 56 -4.562 -4.367 -2.733 445 HD1 PHE 56 HD1 PHE 56 -1.625 -3.177 -4.686 446 HD2 PHE 56 HD2 PHE 56 -4.259 -2.501 -1.410 447 HE1 PHE 56 HE1 PHE 56 -0.633 -0.957 -4.355 448 HE2 PHE 56 HE2 PHE 56 -3.269 -0.273 -1.076 449 HZ PHE 56 HZ PHE 56 -1.448 0.494 -2.548 450 H HIS 57 HN HIS 57 -3.115 -6.924 -0.697 451 HA HIS 57 HA HIS 57 -4.694 -8.969 -2.103 452 HB2 HIS 57 HB2 HIS 57 -3.748 -8.902 0.786 453 HB3 HIS 57 HB1 HIS 57 -4.552 -10.254 -0.006 454 HD1 HIS 57 HD1 HIS 57 -3.070 -11.956 -1.048 455 HD2 HIS 57 HD2 HIS 57 -1.072 -8.370 -0.335 456 HE1 HIS 57 HE1 HIS 57 -0.643 -12.408 -1.554 457 HE2 HIS 57 HE2 HIS 57 0.564 -10.293 -0.881 458 H LEU 58 HN LEU 58 -6.494 -7.546 -2.457 459 HA LEU 58 HA LEU 58 -7.818 -6.231 -0.339 460 HB2 LEU 58 HB2 LEU 58 -9.257 -7.190 -2.792 461 HB3 LEU 58 HB1 LEU 58 -9.560 -5.747 -1.833 462 HG LEU 58 HG LEU 58 -7.316 -6.214 -3.789 463 HD11 LEU 58 HD11 LEU 58 -8.954 -5.518 -5.112 464 HD12 LEU 58 HD12 LEU 58 -8.444 -3.931 -4.535 465 HD13 LEU 58 HD13 LEU 58 -9.843 -4.728 -3.812 466 HD21 LEU 58 HD21 LEU 58 -7.674 -3.964 -1.825 467 HD22 LEU 58 HD22 LEU 58 -6.664 -3.854 -3.264 468 HD23 LEU 58 HD23 LEU 58 -6.288 -5.037 -2.013 469 H HIS 59 HN HIS 59 -10.334 -6.852 -0.077 470 HA HIS 59 HA HIS 59 -10.238 -9.183 1.553 471 HB2 HIS 59 HB2 HIS 59 -11.748 -6.998 1.650 472 HB3 HIS 59 HB1 HIS 59 -12.841 -7.990 0.692 473 HD1 HIS 59 HD1 HIS 59 -10.918 -8.285 3.971 474 HD2 HIS 59 HD2 HIS 59 -14.507 -9.475 2.225 475 HE1 HIS 59 HE1 HIS 59 -12.229 -9.406 5.800 476 HE2 HIS 59 HE2 HIS 59 -14.346 -10.219 4.700 477 H GLU 60 HN GLU 60 -11.137 -11.163 1.259 478 HA GLU 60 HA GLU 60 -10.891 -12.285 -1.275 479 HB2 GLU 60 HB2 GLU 60 -12.325 -13.345 1.153 480 HB3 GLU 60 HB1 GLU 60 -11.928 -14.306 -0.267 481 HG2 GLU 60 HG2 GLU 60 -9.547 -13.881 0.122 482 HG3 GLU 60 HG1 GLU 60 -9.957 -12.943 1.556 483 H SER 61 HN SER 61 -13.652 -10.838 0.212 484 HA SER 61 HA SER 61 -15.677 -11.897 -1.431 485 HB2 SER 61 HB2 SER 61 -15.660 -9.145 -0.278 486 HB3 SER 61 HB1 SER 61 -17.054 -10.158 -0.613 487 HG SER 61 HG SER 61 -15.461 -11.509 1.014 488 H PHE 62 HN PHE 62 -13.143 -9.723 -2.093 489 HA PHE 62 HA PHE 62 -14.462 -8.454 -4.349 490 HB2 PHE 62 HB2 PHE 62 -11.650 -8.253 -3.240 491 HB3 PHE 62 HB1 PHE 62 -12.205 -7.374 -4.654 492 HD1 PHE 62 HD1 PHE 62 -13.306 -7.950 -1.133 493 HD2 PHE 62 HD2 PHE 62 -12.785 -5.189 -4.317 494 HE1 PHE 62 HE1 PHE 62 -14.082 -6.125 0.326 495 HE2 PHE 62 HE2 PHE 62 -13.566 -3.359 -2.874 496 HZ PHE 62 HZ PHE 62 -14.213 -3.825 -0.545 497 HA PRO 63 HA PRO 63 -13.191 -11.677 -7.175 498 HB2 PRO 63 HB2 PRO 63 -13.507 -9.545 -9.200 499 HB3 PRO 63 HB1 PRO 63 -14.294 -11.123 -9.098 500 HG2 PRO 63 HG2 PRO 63 -15.639 -8.876 -8.565 501 HG3 PRO 63 HG1 PRO 63 -15.927 -10.362 -7.640 502 HD2 PRO 63 HD2 PRO 63 -14.344 -7.934 -6.884 503 HD3 PRO 63 HD1 PRO 63 -15.440 -8.917 -5.892 504 H ARG 64 HN ARG 64 -11.177 -12.255 -7.593 505 HA ARG 64 HA ARG 64 -8.904 -12.171 -7.803 506 HB2 ARG 64 HB2 ARG 64 -9.228 -9.773 -9.579 507 HB3 ARG 64 HB1 ARG 64 -8.115 -11.123 -9.737 508 HG2 ARG 64 HG2 ARG 64 -9.944 -12.574 -10.414 509 HG3 ARG 64 HG1 ARG 64 -11.086 -11.249 -10.200 510 HD2 ARG 64 HD2 ARG 64 -8.791 -11.336 -12.150 511 HD3 ARG 64 HD1 ARG 64 -10.502 -11.514 -12.536 512 HE ARG 64 HE ARG 64 -10.598 -9.139 -11.449 513 HH11 ARG 64 HH11 ARG 64 -8.054 -10.401 -13.506 514 HH12 ARG 64 HH12 ARG 64 -7.652 -8.843 -14.177 515 HH21 ARG 64 HH21 ARG 64 -10.048 -7.097 -12.289 516 HH22 ARG 64 HH22 ARG 64 -8.793 -6.964 -13.486 517 HA PRO 65 HA PRO 65 -9.046 -8.488 -4.964 518 HB2 PRO 65 HB2 PRO 65 -7.988 -9.660 -2.745 519 HB3 PRO 65 HB1 PRO 65 -9.706 -9.680 -3.148 520 HG2 PRO 65 HG2 PRO 65 -7.652 -11.806 -3.490 521 HG3 PRO 65 HG1 PRO 65 -9.365 -11.948 -3.053 522 HD2 PRO 65 HD2 PRO 65 -8.364 -12.455 -5.558 523 HD3 PRO 65 HD1 PRO 65 -10.033 -11.964 -5.235 524 H LYS 66 HN LYS 66 -6.380 -10.630 -5.660 525 HA LYS 66 HA LYS 66 -4.391 -8.855 -4.640 526 HB2 LYS 66 HB2 LYS 66 -3.897 -11.224 -4.739 527 HB3 LYS 66 HB1 LYS 66 -4.146 -11.233 -6.480 528 HG2 LYS 66 HG2 LYS 66 -2.215 -9.825 -6.815 529 HG3 LYS 66 HG1 LYS 66 -2.003 -9.654 -5.073 530 HD2 LYS 66 HD2 LYS 66 -1.372 -11.892 -4.819 531 HD3 LYS 66 HD1 LYS 66 -1.948 -12.335 -6.427 532 HE2 LYS 66 HE2 LYS 66 -0.171 -11.012 -7.432 533 HE3 LYS 66 HE1 LYS 66 0.370 -10.498 -5.836 534 HZ1 LYS 66 HZ1 LYS 66 0.793 -12.872 -5.334 535 HZ2 LYS 66 HZ2 LYS 66 1.768 -12.251 -6.571 536 HZ3 LYS 66 HZ3 LYS 66 0.449 -13.244 -6.953 537 H ARG 67 HN ARG 67 -4.342 -6.915 -5.530 538 HA ARG 67 HA ARG 67 -4.289 -6.724 -8.462 539 HB2 ARG 67 HB2 ARG 67 -4.521 -4.403 -6.541 540 HB3 ARG 67 HB1 ARG 67 -4.947 -4.453 -8.248 541 HG2 ARG 67 HG2 ARG 67 -6.382 -5.805 -5.983 542 HG3 ARG 67 HG1 ARG 67 -6.945 -4.425 -6.929 543 HD2 ARG 67 HD2 ARG 67 -6.913 -5.869 -8.952 544 HD3 ARG 67 HD1 ARG 67 -6.486 -7.241 -7.914 545 HE ARG 67 HE ARG 67 -8.656 -7.421 -7.332 546 HH11 ARG 67 HH11 ARG 67 -8.207 -4.147 -8.541 547 HH12 ARG 67 HH12 ARG 67 -9.910 -3.790 -8.511 548 HH21 ARG 67 HH21 ARG 67 -10.875 -6.937 -7.329 549 HH22 ARG 67 HH22 ARG 67 -11.421 -5.374 -7.851 550 H VAL 68 HN VAL 68 -2.349 -6.518 -9.370 551 HA VAL 68 HA VAL 68 -0.124 -5.743 -7.612 552 HB VAL 68 HB VAL 68 1.263 -7.219 -8.660 553 HG11 VAL 68 HG11 VAL 68 -0.522 -8.560 -7.738 554 HG12 VAL 68 HG12 VAL 68 0.096 -9.309 -9.212 555 HG13 VAL 68 HG13 VAL 68 -1.433 -8.430 -9.244 556 HG21 VAL 68 HG21 VAL 68 1.235 -6.268 -10.847 557 HG22 VAL 68 HG22 VAL 68 -0.376 -6.918 -11.169 558 HG23 VAL 68 HG23 VAL 68 0.999 -8.011 -11.001 559 H CYS 69 HN CYS 69 1.319 -4.171 -8.203 560 HA CYS 69 HA CYS 69 0.942 -3.022 -10.892 561 HB2 CYS 69 HB2 CYS 69 0.231 -1.218 -9.727 562 HB3 CYS 69 HB1 CYS 69 1.177 -1.570 -8.294 563 HG CYS 69 HG CYS 69 1.889 0.241 -11.033 564 H LYS 70 HN LYS 70 2.631 -3.105 -12.115 565 HA LYS 70 HA LYS 70 5.282 -3.508 -10.898 566 HB2 LYS 70 HB2 LYS 70 4.471 -4.040 -13.768 567 HB3 LYS 70 HB1 LYS 70 5.944 -4.563 -12.964 568 HG2 LYS 70 HG2 LYS 70 4.829 -6.225 -11.745 569 HG3 LYS 70 HG1 LYS 70 3.257 -5.485 -12.021 570 HD2 LYS 70 HD2 LYS 70 3.396 -6.067 -14.392 571 HD3 LYS 70 HD1 LYS 70 4.976 -6.806 -14.117 572 HE2 LYS 70 HE2 LYS 70 4.030 -8.498 -12.733 573 HE3 LYS 70 HE1 LYS 70 2.472 -7.674 -12.687 574 HZ1 LYS 70 HZ1 LYS 70 3.714 -8.898 -15.093 575 HZ2 LYS 70 HZ2 LYS 70 2.222 -8.093 -15.053 576 HZ3 LYS 70 HZ3 LYS 70 2.425 -9.544 -14.202 577 H ASP 71 HN ASP 71 3.504 -1.043 -11.625 578 HA ASP 71 HA ASP 71 5.509 0.294 -13.351 579 HB2 ASP 71 HB2 ASP 71 3.721 1.417 -14.548 580 HB3 ASP 71 HB1 ASP 71 3.159 -0.244 -14.381 581 HA PRO 72 HA PRO 72 5.636 4.057 -10.649 582 HB2 PRO 72 HB2 PRO 72 3.933 5.168 -12.867 583 HB3 PRO 72 HB1 PRO 72 5.206 5.973 -11.941 584 HG2 PRO 72 HG2 PRO 72 5.809 5.031 -14.302 585 HG3 PRO 72 HG1 PRO 72 6.907 4.692 -12.945 586 HD2 PRO 72 HD2 PRO 72 4.961 2.899 -14.300 587 HD3 PRO 72 HD1 PRO 72 6.544 2.517 -13.599 588 HA PRO 73 HA PRO 73 2.552 5.515 -7.914 589 HB2 PRO 73 HB2 PRO 73 0.551 6.161 -10.044 590 HB3 PRO 73 HB1 PRO 73 0.797 6.942 -8.475 591 HG2 PRO 73 HG2 PRO 73 1.918 7.826 -10.828 592 HG3 PRO 73 HG1 PRO 73 2.595 8.150 -9.226 593 HD2 PRO 73 HD2 PRO 73 3.751 6.607 -11.312 594 HD3 PRO 73 HD1 PRO 73 4.366 6.813 -9.662 595 H TYR 74 HN TYR 74 1.981 3.856 -6.842 596 HA TYR 74 HA TYR 74 0.616 1.583 -8.038 597 HB2 TYR 74 HB2 TYR 74 1.660 1.899 -5.228 598 HB3 TYR 74 HB1 TYR 74 1.356 0.392 -6.074 599 HD1 TYR 74 HD2 TYR 74 3.585 3.345 -5.936 600 HD2 TYR 74 HD1 TYR 74 3.006 -0.571 -7.447 601 HE1 TYR 74 HE2 TYR 74 5.917 3.295 -6.681 602 HE2 TYR 74 HE1 TYR 74 5.331 -0.641 -8.206 603 HH TYR 74 HH TYR 74 7.153 0.832 -8.727 604 H LYS 75 HN LYS 75 -1.498 1.198 -7.742 605 HA LYS 75 HA LYS 75 -2.899 2.080 -5.382 606 HB2 LYS 75 HB2 LYS 75 -4.557 3.436 -6.736 607 HB3 LYS 75 HB1 LYS 75 -2.990 4.180 -6.465 608 HG2 LYS 75 HG2 LYS 75 -2.387 4.043 -8.655 609 HG3 LYS 75 HG1 LYS 75 -3.376 2.617 -8.962 610 HD2 LYS 75 HD2 LYS 75 -4.344 4.490 -10.103 611 HD3 LYS 75 HD1 LYS 75 -5.405 4.072 -8.766 612 HE2 LYS 75 HE2 LYS 75 -4.413 5.876 -7.459 613 HE3 LYS 75 HE1 LYS 75 -3.384 6.305 -8.818 614 HZ1 LYS 75 HZ1 LYS 75 -5.369 7.707 -8.667 615 HZ2 LYS 75 HZ2 LYS 75 -6.360 6.341 -8.856 616 HZ3 LYS 75 HZ3 LYS 75 -5.327 6.825 -10.112 617 H VAL 76 HN VAL 76 -4.891 1.305 -5.130 618 HA VAL 76 HA VAL 76 -6.041 -0.396 -7.222 619 HB VAL 76 HB VAL 76 -5.972 -0.880 -4.251 620 HG11 VAL 76 HG11 VAL 76 -8.276 -1.067 -5.205 621 HG12 VAL 76 HG12 VAL 76 -7.648 -2.552 -4.492 622 HG13 VAL 76 HG13 VAL 76 -7.677 -2.358 -6.246 623 HG21 VAL 76 HG21 VAL 76 -4.132 -1.846 -5.471 624 HG22 VAL 76 HG22 VAL 76 -5.232 -2.544 -6.651 625 HG23 VAL 76 HG23 VAL 76 -5.235 -3.129 -4.988 626 H GLU 77 HN GLU 77 -7.977 0.321 -7.865 627 HA GLU 77 HA GLU 77 -9.504 2.029 -6.015 628 HB2 GLU 77 HB2 GLU 77 -9.431 2.185 -9.027 629 HB3 GLU 77 HB1 GLU 77 -10.410 3.178 -7.976 630 HG2 GLU 77 HG2 GLU 77 -8.603 4.304 -7.104 631 HG3 GLU 77 HG1 GLU 77 -7.492 3.075 -7.666 632 H GLU 78 HN GLU 78 -11.128 1.010 -5.274 633 HA GLU 78 HA GLU 78 -12.501 -0.943 -6.998 634 HB2 GLU 78 HB2 GLU 78 -11.155 -1.412 -4.402 635 HB3 GLU 78 HB1 GLU 78 -12.728 -2.182 -4.599 636 HG2 GLU 78 HG2 GLU 78 -10.233 -2.574 -6.217 637 HG3 GLU 78 HG1 GLU 78 -11.149 -3.750 -5.276 638 H SER 79 HN SER 79 -14.431 -1.869 -5.608 639 HA SER 79 HA SER 79 -15.834 0.298 -4.254 640 HB2 SER 79 HB2 SER 79 -16.323 0.463 -6.721 641 HB3 SER 79 HB1 SER 79 -17.047 -1.145 -6.628 642 HG SER 79 HG SER 79 -17.944 1.301 -5.557 643 H GLY 80 HN GLY 80 -17.422 -0.415 -2.867 644 HA2 GLY 80 HA2 GLY 80 -18.255 -3.129 -2.634 645 HA3 GLY 80 HA1 GLY 80 -16.946 -2.773 -1.511 646 H TYR 81 HN TYR 81 -18.359 -3.004 0.336 647 HA TYR 81 HA TYR 81 -19.867 -0.551 0.783 648 HB2 TYR 81 HB2 TYR 81 -21.854 -1.787 1.651 649 HB3 TYR 81 HB1 TYR 81 -21.600 -1.960 -0.082 650 HD1 TYR 81 HD2 TYR 81 -21.372 -3.706 3.163 651 HD2 TYR 81 HD1 TYR 81 -21.128 -4.091 -1.069 652 HE1 TYR 81 HE2 TYR 81 -21.426 -6.151 3.387 653 HE2 TYR 81 HE1 TYR 81 -21.187 -6.542 -0.853 654 HH TYR 81 HH TYR 81 -22.084 -8.113 1.985 655 H ALA 82 HN ALA 82 -17.445 -2.137 1.876 656 HA ALA 82 HA ALA 82 -17.860 -1.323 4.587 657 HB1 ALA 82 HB1 ALA 82 -18.916 -3.406 4.894 658 HB2 ALA 82 HB2 ALA 82 -17.279 -3.627 5.503 659 HB3 ALA 82 HB3 ALA 82 -17.721 -4.247 3.913 660 H GLY 83 HN GLY 83 -15.920 -1.703 5.938 661 HA2 GLY 83 HA2 GLY 83 -13.499 -1.495 4.292 662 HA3 GLY 83 HA1 GLY 83 -13.668 -0.943 5.953 663 H PHE 84 HN PHE 84 -11.483 -2.242 5.723 664 HA PHE 84 HA PHE 84 -11.595 -4.576 7.245 665 HB2 PHE 84 HB2 PHE 84 -10.997 -6.287 5.526 666 HB3 PHE 84 HB1 PHE 84 -12.634 -5.671 5.337 667 HD1 PHE 84 HD1 PHE 84 -13.062 -3.929 3.546 668 HD2 PHE 84 HD2 PHE 84 -9.459 -6.177 3.763 669 HE1 PHE 84 HE1 PHE 84 -12.591 -3.385 1.200 670 HE2 PHE 84 HE2 PHE 84 -8.966 -5.633 1.428 671 HZ PHE 84 HZ PHE 84 -10.527 -4.238 0.130 672 H ILE 85 HN ILE 85 -9.465 -5.450 7.658 673 HA ILE 85 HA ILE 85 -7.252 -3.772 7.151 674 HB ILE 85 HB ILE 85 -7.406 -6.660 8.016 675 HG12 ILE 85 HG12 ILE 85 -8.055 -4.942 9.660 676 HG13 ILE 85 HG11 ILE 85 -6.586 -5.787 10.137 677 HG21 ILE 85 HG21 ILE 85 -4.896 -5.013 7.684 678 HG22 ILE 85 HG22 ILE 85 -5.358 -6.413 6.713 679 HG23 ILE 85 HG23 ILE 85 -4.995 -6.610 8.428 680 HD11 ILE 85 HD11 ILE 85 -6.592 -3.115 8.771 681 HD12 ILE 85 HD12 ILE 85 -5.228 -3.939 9.524 682 HD13 ILE 85 HD13 ILE 85 -6.550 -3.331 10.521 683 H LEU 86 HN LEU 86 -6.095 -3.501 5.370 684 HA LEU 86 HA LEU 86 -6.269 -5.595 3.308 685 HB2 LEU 86 HB2 LEU 86 -7.161 -3.114 2.979 686 HB3 LEU 86 HB1 LEU 86 -5.464 -2.809 2.637 687 HG LEU 86 HG LEU 86 -6.736 -5.084 1.225 688 HD11 LEU 86 HD11 LEU 86 -7.109 -2.283 0.209 689 HD12 LEU 86 HD12 LEU 86 -8.345 -3.114 1.155 690 HD13 LEU 86 HD13 LEU 86 -7.820 -3.782 -0.388 691 HD21 LEU 86 HD21 LEU 86 -5.264 -3.249 -0.352 692 HD22 LEU 86 HD22 LEU 86 -4.901 -4.935 0.013 693 HD23 LEU 86 HD23 LEU 86 -4.341 -3.653 1.092 694 HA PRO 87 HA PRO 87 -1.927 -5.919 4.402 695 HB2 PRO 87 HB2 PRO 87 -2.003 -8.333 2.775 696 HB3 PRO 87 HB1 PRO 87 -1.697 -8.170 4.504 697 HG2 PRO 87 HG2 PRO 87 -3.960 -9.293 3.505 698 HG3 PRO 87 HG1 PRO 87 -3.907 -8.436 5.056 699 HD2 PRO 87 HD2 PRO 87 -4.891 -7.486 2.394 700 HD3 PRO 87 HD1 PRO 87 -5.571 -7.209 4.013 701 H ILE 88 HN ILE 88 -1.156 -4.245 3.156 702 HA ILE 88 HA ILE 88 -0.989 -4.583 0.275 703 HB ILE 88 HB ILE 88 -0.041 -2.230 1.929 704 HG12 ILE 88 HG12 ILE 88 -2.611 -2.321 0.357 705 HG13 ILE 88 HG11 ILE 88 -2.570 -2.916 2.016 706 HG21 ILE 88 HG21 ILE 88 0.924 -2.449 -0.327 707 HG22 ILE 88 HG22 ILE 88 -0.120 -1.035 -0.178 708 HG23 ILE 88 HG23 ILE 88 -0.705 -2.478 -1.004 709 HD11 ILE 88 HD11 ILE 88 -1.697 -0.160 1.226 710 HD12 ILE 88 HD12 ILE 88 -1.981 -0.778 2.848 711 HD13 ILE 88 HD13 ILE 88 -3.332 -0.559 1.736 712 H GLU 89 HN GLU 89 0.907 -4.854 -0.816 713 HA GLU 89 HA GLU 89 3.296 -5.177 0.842 714 HB2 GLU 89 HB2 GLU 89 2.275 -7.023 -1.294 715 HB3 GLU 89 HB1 GLU 89 3.940 -7.069 -0.721 716 HG2 GLU 89 HG2 GLU 89 3.016 -7.454 1.583 717 HG3 GLU 89 HG1 GLU 89 1.431 -7.633 0.839 718 H VAL 90 HN VAL 90 5.043 -4.241 0.200 719 HA VAL 90 HA VAL 90 5.124 -3.136 -2.523 720 HB VAL 90 HB VAL 90 6.626 -1.979 -0.175 721 HG11 VAL 90 HG11 VAL 90 7.572 -0.853 -1.875 722 HG12 VAL 90 HG12 VAL 90 6.061 0.049 -1.908 723 HG13 VAL 90 HG13 VAL 90 6.299 -1.311 -3.003 724 HG21 VAL 90 HG21 VAL 90 4.033 -2.071 0.003 725 HG22 VAL 90 HG22 VAL 90 4.092 -0.769 -1.185 726 HG23 VAL 90 HG23 VAL 90 4.885 -0.575 0.379 727 H TYR 91 HN TYR 91 6.444 -4.378 -3.701 728 HA TYR 91 HA TYR 91 8.368 -6.119 -2.430 729 HB2 TYR 91 HB2 TYR 91 7.463 -5.699 -5.246 730 HB3 TYR 91 HB1 TYR 91 8.957 -6.573 -4.948 731 HD1 TYR 91 HD1 TYR 91 5.645 -6.634 -3.202 732 HD2 TYR 91 HD2 TYR 91 8.588 -8.807 -5.367 733 HE1 TYR 91 HE1 TYR 91 4.375 -8.704 -2.858 734 HE2 TYR 91 HE2 TYR 91 7.309 -10.886 -5.035 735 HH TYR 91 HH TYR 91 5.646 -11.803 -3.530 736 H PHE 92 HN PHE 92 10.525 -6.006 -2.440 737 HA PHE 92 HA PHE 92 11.645 -3.379 -3.118 738 HB2 PHE 92 HB2 PHE 92 12.473 -5.543 -1.168 739 HB3 PHE 92 HB1 PHE 92 13.486 -4.138 -1.523 740 HD1 PHE 92 HD1 PHE 92 11.151 -2.155 -1.748 741 HD2 PHE 92 HD2 PHE 92 12.146 -5.117 1.143 742 HE1 PHE 92 HE1 PHE 92 10.003 -0.847 -0.020 743 HE2 PHE 92 HE2 PHE 92 10.968 -3.806 2.880 744 HZ PHE 92 HZ PHE 92 9.908 -1.677 2.286 745 H LYS 93 HN LYS 93 13.990 -3.443 -3.804 746 HA LYS 93 HA LYS 93 14.429 -5.693 -5.661 747 HB2 LYS 93 HB2 LYS 93 15.896 -3.046 -5.729 748 HB3 LYS 93 HB1 LYS 93 15.881 -4.279 -6.988 749 HG2 LYS 93 HG2 LYS 93 13.296 -3.638 -7.142 750 HG3 LYS 93 HG1 LYS 93 13.839 -2.203 -6.270 751 HD2 LYS 93 HD2 LYS 93 15.174 -1.444 -7.983 752 HD3 LYS 93 HD1 LYS 93 15.310 -3.028 -8.740 753 HE2 LYS 93 HE2 LYS 93 12.808 -2.809 -9.263 754 HE3 LYS 93 HE1 LYS 93 12.947 -1.117 -8.787 755 HZ1 LYS 93 HZ1 LYS 93 14.429 -2.441 -10.983 756 HZ2 LYS 93 HZ2 LYS 93 14.661 -0.841 -10.484 757 HZ3 LYS 93 HZ3 LYS 93 13.173 -1.317 -11.136 758 H ASN 94 HN ASN 94 15.408 -7.082 -4.180 759 HA ASN 94 HA ASN 94 18.094 -6.433 -3.391 760 HB2 ASN 94 HB2 ASN 94 16.420 -5.492 -1.643 761 HB3 ASN 94 HB1 ASN 94 16.255 -7.173 -1.188 762 HD21 ASN 94 HD21 ASN 94 17.143 -6.843 0.843 763 HD22 ASN 94 HD22 ASN 94 18.835 -6.542 1.052 764 H LYS 95 HN LYS 95 19.283 -8.315 -2.701 765 HA LYS 95 HA LYS 95 17.756 -10.830 -2.927 766 HB2 LYS 95 HB2 LYS 95 20.660 -10.311 -3.561 767 HB3 LYS 95 HB1 LYS 95 19.922 -11.905 -3.549 768 HG2 LYS 95 HG2 LYS 95 18.422 -11.241 -5.341 769 HG3 LYS 95 HG1 LYS 95 19.118 -9.625 -5.339 770 HD2 LYS 95 HD2 LYS 95 20.108 -10.804 -7.134 771 HD3 LYS 95 HD1 LYS 95 21.322 -10.665 -5.864 772 HE2 LYS 95 HE2 LYS 95 19.590 -13.089 -5.987 773 HE3 LYS 95 HE1 LYS 95 20.937 -12.924 -7.103 774 HZ1 LYS 95 HZ1 LYS 95 22.408 -12.624 -5.170 775 HZ2 LYS 95 HZ2 LYS 95 21.635 -14.133 -5.172 776 HZ3 LYS 95 HZ3 LYS 95 21.094 -12.909 -4.137 777 H GLU 96 HN GLU 96 19.242 -8.795 -0.851 778 HA GLU 96 HA GLU 96 20.014 -10.877 1.047 779 HB2 GLU 96 HB2 GLU 96 20.464 -8.362 2.242 780 HB3 GLU 96 HB1 GLU 96 21.701 -9.400 1.549 781 HG2 GLU 96 HG2 GLU 96 20.183 -7.312 0.007 782 HG3 GLU 96 HG1 GLU 96 21.747 -7.047 0.771 783 H GLU 97 HN GLU 97 19.433 -8.944 3.293 784 HA GLU 97 HA GLU 97 17.266 -9.815 4.484 785 HB2 GLU 97 HB2 GLU 97 17.955 -6.891 4.244 786 HB3 GLU 97 HB1 GLU 97 16.793 -7.544 5.397 787 HG2 GLU 97 HG2 GLU 97 19.746 -8.122 5.257 788 HG3 GLU 97 HG1 GLU 97 18.898 -7.196 6.495 789 HA PRO 98 HA PRO 98 13.453 -10.096 3.009 790 HB2 PRO 98 HB2 PRO 98 12.034 -7.818 4.031 791 HB3 PRO 98 HB1 PRO 98 11.980 -9.486 4.608 792 HG2 PRO 98 HG2 PRO 98 13.609 -7.208 5.548 793 HG3 PRO 98 HG1 PRO 98 13.023 -8.617 6.451 794 HD2 PRO 98 HD2 PRO 98 15.599 -8.417 5.813 795 HD3 PRO 98 HD1 PRO 98 14.765 -9.984 5.661 796 H ARG 99 HN ARG 99 12.891 -9.875 0.988 797 HA ARG 99 HA ARG 99 13.539 -7.383 -0.375 798 HB2 ARG 99 HB2 ARG 99 12.606 -9.975 -1.618 799 HB3 ARG 99 HB1 ARG 99 13.370 -8.625 -2.413 800 HG2 ARG 99 HG2 ARG 99 15.184 -9.946 -2.268 801 HG3 ARG 99 HG1 ARG 99 15.300 -9.166 -0.688 802 HD2 ARG 99 HD2 ARG 99 14.202 -11.000 0.339 803 HD3 ARG 99 HD1 ARG 99 13.918 -11.787 -1.199 804 HE ARG 99 HE ARG 99 16.654 -11.320 -0.220 805 HH11 ARG 99 HH11 ARG 99 14.117 -13.465 -1.285 806 HH12 ARG 99 HH12 ARG 99 15.103 -14.894 -1.239 807 HH21 ARG 99 HH21 ARG 99 17.978 -13.204 -0.128 808 HH22 ARG 99 HH22 ARG 99 17.295 -14.747 -0.558 809 H LYS 100 HN LYS 100 11.157 -7.940 1.405 810 HA LYS 100 HA LYS 100 9.286 -6.465 -0.210 811 HB2 LYS 100 HB2 LYS 100 7.404 -8.004 0.081 812 HB3 LYS 100 HB1 LYS 100 8.691 -8.743 -0.860 813 HG2 LYS 100 HG2 LYS 100 9.262 -10.222 0.819 814 HG3 LYS 100 HG1 LYS 100 8.566 -9.200 2.087 815 HD2 LYS 100 HD2 LYS 100 7.180 -11.194 1.679 816 HD3 LYS 100 HD1 LYS 100 6.307 -9.715 1.295 817 HE2 LYS 100 HE2 LYS 100 6.666 -10.101 -1.122 818 HE3 LYS 100 HE1 LYS 100 7.653 -11.528 -0.735 819 HZ1 LYS 100 HZ1 LYS 100 5.437 -12.183 -1.355 820 HZ2 LYS 100 HZ2 LYS 100 4.755 -11.171 -0.176 821 HZ3 LYS 100 HZ3 LYS 100 5.673 -12.520 0.290 822 H VAL 101 HN VAL 101 7.617 -5.528 1.017 823 HA VAL 101 HA VAL 101 7.798 -5.903 3.922 824 HB VAL 101 HB VAL 101 8.976 -3.837 3.182 825 HG11 VAL 101 HG11 VAL 101 7.808 -3.104 1.291 826 HG12 VAL 101 HG12 VAL 101 7.461 -1.900 2.539 827 HG13 VAL 101 HG13 VAL 101 6.257 -3.125 2.140 828 HG21 VAL 101 HG21 VAL 101 7.986 -2.366 4.829 829 HG22 VAL 101 HG22 VAL 101 8.027 -4.029 5.425 830 HG23 VAL 101 HG23 VAL 101 6.513 -3.339 4.838 831 H ARG 102 HN ARG 102 5.822 -5.866 5.007 832 HA ARG 102 HA ARG 102 3.467 -5.678 3.242 833 HB2 ARG 102 HB2 ARG 102 4.116 -7.990 4.202 834 HB3 ARG 102 HB1 ARG 102 3.535 -7.353 5.736 835 HG2 ARG 102 HG2 ARG 102 1.337 -6.922 4.762 836 HG3 ARG 102 HG1 ARG 102 1.924 -7.442 3.186 837 HD2 ARG 102 HD2 ARG 102 1.903 -9.236 5.599 838 HD3 ARG 102 HD1 ARG 102 0.586 -9.158 4.427 839 HE ARG 102 HE ARG 102 2.932 -9.577 2.995 840 HH11 ARG 102 HH11 ARG 102 0.968 -11.273 5.348 841 HH12 ARG 102 HH12 ARG 102 1.474 -12.848 4.813 842 HH21 ARG 102 HH21 ARG 102 3.555 -11.621 2.266 843 HH22 ARG 102 HH22 ARG 102 2.928 -13.046 3.039 844 H PHE 103 HN PHE 103 2.333 -3.923 3.641 845 HA PHE 103 HA PHE 103 2.268 -2.863 6.377 846 HB2 PHE 103 HB2 PHE 103 1.534 -1.550 3.745 847 HB3 PHE 103 HB1 PHE 103 1.468 -0.765 5.314 848 HD1 PHE 103 HD1 PHE 103 3.994 -1.748 6.522 849 HD2 PHE 103 HD2 PHE 103 3.132 -0.354 2.594 850 HE1 PHE 103 HE1 PHE 103 6.340 -1.038 6.259 851 HE2 PHE 103 HE2 PHE 103 5.473 0.349 2.329 852 HZ PHE 103 HZ PHE 103 7.072 0.014 4.161 853 H ASP 104 HN ASP 104 0.678 -4.011 7.377 854 HA ASP 104 HA ASP 104 -1.851 -4.589 6.200 855 HB2 ASP 104 HB2 ASP 104 -2.554 -5.152 8.536 856 HB3 ASP 104 HB1 ASP 104 -1.105 -5.991 8.012 857 H TYR 105 HN TYR 105 -2.681 -2.725 5.355 858 HA TYR 105 HA TYR 105 -2.976 -0.443 7.151 859 HB2 TYR 105 HB2 TYR 105 -2.003 -0.047 4.921 860 HB3 TYR 105 HB1 TYR 105 -3.482 -0.656 4.169 861 HD1 TYR 105 HD1 TYR 105 -2.427 1.873 6.696 862 HD2 TYR 105 HD2 TYR 105 -5.043 0.883 3.506 863 HE1 TYR 105 HE1 TYR 105 -3.414 4.116 6.836 864 HE2 TYR 105 HE2 TYR 105 -6.041 3.112 3.614 865 HH TYR 105 HH TYR 105 -6.166 4.916 5.896 866 H ASP 106 HN ASP 106 -4.808 0.018 8.119 867 HA ASP 106 HA ASP 106 -7.136 -1.593 7.732 868 HB2 ASP 106 HB2 ASP 106 -6.501 -0.636 9.937 869 HB3 ASP 106 HB1 ASP 106 -6.849 0.974 9.315 870 H LEU 107 HN LEU 107 -8.442 -1.344 6.032 871 HA LEU 107 HA LEU 107 -8.705 1.241 4.734 872 HB2 LEU 107 HB2 LEU 107 -9.031 -1.509 3.996 873 HB3 LEU 107 HB1 LEU 107 -10.519 -0.648 3.664 874 HG LEU 107 HG LEU 107 -9.106 1.026 2.375 875 HD11 LEU 107 HD11 LEU 107 -6.970 0.099 1.501 876 HD12 LEU 107 HD12 LEU 107 -7.065 -1.151 2.747 877 HD13 LEU 107 HD13 LEU 107 -6.926 0.546 3.210 878 HD21 LEU 107 HD21 LEU 107 -8.897 -0.568 0.429 879 HD22 LEU 107 HD22 LEU 107 -10.486 -0.460 1.192 880 HD23 LEU 107 HD23 LEU 107 -9.433 -1.832 1.538 881 H PHE 108 HN PHE 108 -9.999 2.569 6.008 882 HA PHE 108 HA PHE 108 -12.616 1.455 6.749 883 HB2 PHE 108 HB2 PHE 108 -12.839 3.158 8.443 884 HB3 PHE 108 HB1 PHE 108 -11.298 2.343 8.665 885 HD1 PHE 108 HD2 PHE 108 -12.949 5.454 7.666 886 HD2 PHE 108 HD1 PHE 108 -9.217 3.531 8.368 887 HE1 PHE 108 HE2 PHE 108 -11.826 7.641 7.671 888 HE2 PHE 108 HE1 PHE 108 -8.092 5.717 8.373 889 HZ PHE 108 HZ PHE 108 -9.395 7.773 8.025 890 H LEU 109 HN LEU 109 -14.485 2.472 6.175 891 HA LEU 109 HA LEU 109 -14.226 4.674 4.219 892 HB2 LEU 109 HB2 LEU 109 -16.511 2.698 4.421 893 HB3 LEU 109 HB1 LEU 109 -16.180 3.820 3.116 894 HG LEU 109 HG LEU 109 -14.570 1.355 3.802 895 HD11 LEU 109 HD11 LEU 109 -16.727 0.922 2.682 896 HD12 LEU 109 HD12 LEU 109 -15.341 0.501 1.682 897 HD13 LEU 109 HD13 LEU 109 -16.233 1.989 1.372 898 HD21 LEU 109 HD21 LEU 109 -14.158 3.422 1.649 899 HD22 LEU 109 HD22 LEU 109 -13.315 1.872 1.740 900 HD23 LEU 109 HD23 LEU 109 -13.082 3.078 3.006 901 H HIS 110 HN HIS 110 -15.959 6.331 4.391 902 HA HIS 110 HA HIS 110 -17.036 6.446 7.112 903 HB2 HIS 110 HB2 HIS 110 -16.548 8.584 5.057 904 HB3 HIS 110 HB1 HIS 110 -17.650 8.863 6.401 905 HD1 HIS 110 HD1 HIS 110 -14.868 10.353 5.924 906 HD2 HIS 110 HD2 HIS 110 -15.576 7.248 8.598 907 HE1 HIS 110 HE1 HIS 110 -13.089 10.558 7.681 908 HE2 HIS 110 HE2 HIS 110 -13.640 8.783 9.377 909 H LEU 111 HN LEU 111 -19.263 7.794 7.081 910 HA LEU 111 HA LEU 111 -21.006 5.712 6.335 911 HB2 LEU 111 HB2 LEU 111 -21.112 8.085 7.943 912 HB3 LEU 111 HB1 LEU 111 -22.582 7.925 6.996 913 HG LEU 111 HG LEU 111 -22.658 6.874 9.284 914 HD11 LEU 111 HD11 LEU 111 -23.629 4.706 8.419 915 HD12 LEU 111 HD12 LEU 111 -23.132 5.232 6.810 916 HD13 LEU 111 HD13 LEU 111 -24.297 6.186 7.727 917 HD21 LEU 111 HD21 LEU 111 -20.802 4.877 7.992 918 HD22 LEU 111 HD22 LEU 111 -21.559 4.725 9.582 919 HD23 LEU 111 HD23 LEU 111 -20.367 5.992 9.289 920 H GLU 112 HN GLU 112 -22.406 5.410 4.846 921 HA GLU 112 HA GLU 112 -22.408 6.462 2.331 922 HB2 GLU 112 HB2 GLU 112 -23.466 4.352 2.955 923 HB3 GLU 112 HB1 GLU 112 -24.675 5.209 3.893 924 HG2 GLU 112 HG2 GLU 112 -25.589 6.179 1.860 925 HG3 GLU 112 HG1 GLU 112 -24.357 5.354 0.911 926 H GLY 113 HN GLY 113 -23.006 8.304 1.472 927 HA2 GLY 113 HA2 GLY 113 -24.822 9.924 1.129 928 HA3 GLY 113 HA1 GLY 113 -24.987 9.974 2.879 929 H HIS 114 HN HIS 114 -22.483 10.248 3.804 930 HA HIS 114 HA HIS 114 -21.178 12.367 2.286 931 HB2 HIS 114 HB2 HIS 114 -22.288 12.811 5.064 932 HB3 HIS 114 HB1 HIS 114 -21.031 13.819 4.358 933 HD1 HIS 114 HD1 HIS 114 -21.733 15.110 2.109 934 HD2 HIS 114 HD2 HIS 114 -24.838 13.506 4.365 935 HE1 HIS 114 HE1 HIS 114 -23.822 16.256 1.302 936 HE2 HIS 114 HE2 HIS 114 -25.683 15.321 2.723 937 HA PRO 115 HA PRO 115 -17.912 10.197 4.537 938 HB2 PRO 115 HB2 PRO 115 -17.083 8.474 2.633 939 HB3 PRO 115 HB1 PRO 115 -18.425 8.101 3.717 940 HG2 PRO 115 HG2 PRO 115 -18.477 8.639 0.855 941 HG3 PRO 115 HG1 PRO 115 -19.763 8.003 1.893 942 HD2 PRO 115 HD2 PRO 115 -19.302 10.757 0.970 943 HD3 PRO 115 HD1 PRO 115 -20.771 10.033 1.662 944 HA PRO 116 HA PRO 116 -14.846 12.405 2.034 945 HB2 PRO 116 HB2 PRO 116 -13.982 14.113 3.937 946 HB3 PRO 116 HB1 PRO 116 -15.391 14.465 2.933 947 HG2 PRO 116 HG2 PRO 116 -15.257 13.739 5.778 948 HG3 PRO 116 HG1 PRO 116 -16.550 14.553 4.886 949 HD2 PRO 116 HD2 PRO 116 -16.368 11.775 5.641 950 HD3 PRO 116 HD1 PRO 116 -17.694 12.613 4.809 951 H VAL 117 HN VAL 117 -13.531 10.550 2.006 952 HA VAL 117 HA VAL 117 -11.986 10.087 4.477 953 HB VAL 117 HB VAL 117 -12.751 8.145 2.303 954 HG11 VAL 117 HG11 VAL 117 -10.824 7.796 4.582 955 HG12 VAL 117 HG12 VAL 117 -10.487 7.644 2.862 956 HG13 VAL 117 HG13 VAL 117 -11.517 6.461 3.670 957 HG21 VAL 117 HG21 VAL 117 -13.769 6.914 4.186 958 HG22 VAL 117 HG22 VAL 117 -14.495 8.499 3.920 959 HG23 VAL 117 HG23 VAL 117 -13.361 8.260 5.250 960 H ASN 118 HN ASN 118 -10.048 10.926 4.344 961 HA ASN 118 HA ASN 118 -8.344 10.079 2.128 962 HB2 ASN 118 HB2 ASN 118 -9.210 12.462 1.734 963 HB3 ASN 118 HB1 ASN 118 -8.251 12.931 3.130 964 HD21 ASN 118 HD21 ASN 118 -5.873 12.381 2.991 965 HD22 ASN 118 HD22 ASN 118 -5.128 12.499 1.427 966 H HIS 119 HN HIS 119 -7.042 8.762 3.366 967 HA HIS 119 HA HIS 119 -5.891 9.964 5.807 968 HB2 HIS 119 HB2 HIS 119 -7.593 8.131 6.228 969 HB3 HIS 119 HB1 HIS 119 -6.458 7.025 5.457 970 HD1 HIS 119 HD1 HIS 119 -4.592 6.111 6.859 971 HD2 HIS 119 HD2 HIS 119 -6.602 9.246 8.708 972 HE1 HIS 119 HE1 HIS 119 -3.684 6.207 9.204 973 HE2 HIS 119 HE2 HIS 119 -4.845 8.174 10.275 974 H LEU 120 HN LEU 120 -3.762 9.536 6.269 975 HA LEU 120 HA LEU 120 -2.192 7.916 4.413 976 HB2 LEU 120 HB2 LEU 120 -2.080 10.869 4.717 977 HB3 LEU 120 HB1 LEU 120 -0.559 10.018 4.535 978 HG LEU 120 HG LEU 120 -2.791 9.599 2.587 979 HD11 LEU 120 HD11 LEU 120 -0.958 11.273 1.418 980 HD12 LEU 120 HD12 LEU 120 -1.179 11.977 3.014 981 HD13 LEU 120 HD13 LEU 120 -2.568 11.730 1.955 982 HD21 LEU 120 HD21 LEU 120 -0.709 8.112 2.836 983 HD22 LEU 120 HD22 LEU 120 0.175 9.484 2.164 984 HD23 LEU 120 HD23 LEU 120 -1.110 8.718 1.229 985 H ARG 121 HN ARG 121 -0.284 7.146 5.248 986 HA ARG 121 HA ARG 121 0.850 8.269 7.628 987 HB2 ARG 121 HB2 ARG 121 0.863 6.140 8.894 988 HB3 ARG 121 HB1 ARG 121 -0.713 6.866 8.728 989 HG2 ARG 121 HG2 ARG 121 -1.126 4.620 8.399 990 HG3 ARG 121 HG1 ARG 121 -1.106 5.265 6.786 991 HD2 ARG 121 HD2 ARG 121 1.020 4.259 6.374 992 HD3 ARG 121 HD1 ARG 121 1.237 3.834 8.059 993 HE ARG 121 HE ARG 121 -0.949 2.684 6.485 994 HH11 ARG 121 HH11 ARG 121 1.887 2.312 8.510 995 HH12 ARG 121 HH12 ARG 121 1.618 0.615 8.780 996 HH21 ARG 121 HH21 ARG 121 -1.291 0.442 6.852 997 HH22 ARG 121 HH22 ARG 121 -0.180 -0.443 7.851 998 H CYS 122 HN CYS 122 2.997 7.529 8.028 999 HA CYS 122 HA CYS 122 4.180 6.464 5.558 1000 HB2 CYS 122 HB2 CYS 122 5.387 8.423 7.483 1001 HB3 CYS 122 HB1 CYS 122 6.081 7.913 5.955 1002 HG CYS 122 HG CYS 122 3.244 8.968 5.040 1003 H GLU 123 HN GLU 123 5.541 4.797 5.642 1004 HA GLU 123 HA GLU 123 6.273 3.737 8.283 1005 HB2 GLU 123 HB2 GLU 123 6.153 2.447 5.559 1006 HB3 GLU 123 HB1 GLU 123 6.795 1.658 6.998 1007 HG2 GLU 123 HG2 GLU 123 3.942 2.403 6.369 1008 HG3 GLU 123 HG1 GLU 123 4.649 0.868 6.812 1009 H LYS 124 HN LYS 124 8.432 2.925 8.572 1010 HA LYS 124 HA LYS 124 10.424 4.201 6.816 1011 HB2 LYS 124 HB2 LYS 124 10.146 5.605 8.788 1012 HB3 LYS 124 HB1 LYS 124 10.380 4.210 9.834 1013 HG2 LYS 124 HG2 LYS 124 12.677 3.997 8.727 1014 HG3 LYS 124 HG1 LYS 124 12.404 5.632 8.133 1015 HD2 LYS 124 HD2 LYS 124 13.635 5.820 10.124 1016 HD3 LYS 124 HD1 LYS 124 11.979 6.303 10.510 1017 HE2 LYS 124 HE2 LYS 124 11.512 4.258 11.563 1018 HE3 LYS 124 HE1 LYS 124 12.941 3.495 10.869 1019 HZ1 LYS 124 HZ1 LYS 124 13.228 4.010 13.225 1020 HZ2 LYS 124 HZ2 LYS 124 12.961 5.659 12.916 1021 HZ3 LYS 124 HZ3 LYS 124 14.328 4.885 12.275 1022 H LEU 125 HN LEU 125 11.915 2.779 6.126 1023 HA LEU 125 HA LEU 125 12.343 0.349 7.756 1024 HB2 LEU 125 HB2 LEU 125 12.708 0.567 4.775 1025 HB3 LEU 125 HB1 LEU 125 12.680 -0.892 5.739 1026 HG LEU 125 HG LEU 125 10.212 0.734 5.837 1027 HD11 LEU 125 HD11 LEU 125 10.809 0.943 3.459 1028 HD12 LEU 125 HD12 LEU 125 9.394 -0.087 3.703 1029 HD13 LEU 125 HD13 LEU 125 10.962 -0.816 3.364 1030 HD21 LEU 125 HD21 LEU 125 9.275 -1.619 5.492 1031 HD22 LEU 125 HD22 LEU 125 10.151 -1.303 6.996 1032 HD23 LEU 125 HD23 LEU 125 10.942 -2.173 5.681 1033 H THR 126 HN THR 126 14.270 0.483 8.731 1034 HA THR 126 HA THR 126 16.462 1.980 7.470 1035 HB THR 126 HB THR 126 16.630 0.815 10.222 1036 HG1 THR 126 HG1 THR 126 14.598 1.953 10.101 1037 HG21 THR 126 HG21 THR 126 18.480 2.034 8.919 1038 HG22 THR 126 HG22 THR 126 18.181 2.502 10.593 1039 HG23 THR 126 HG23 THR 126 17.559 3.495 9.274 1040 H PHE 127 HN PHE 127 18.100 0.936 6.539 1041 HA PHE 127 HA PHE 127 18.528 -1.890 7.248 1042 HB2 PHE 127 HB2 PHE 127 19.110 -0.530 4.606 1043 HB3 PHE 127 HB1 PHE 127 19.349 -2.239 4.970 1044 HD1 PHE 127 HD1 PHE 127 17.429 -3.737 5.230 1045 HD2 PHE 127 HD2 PHE 127 16.928 0.362 4.204 1046 HE1 PHE 127 HE1 PHE 127 15.100 -4.186 4.575 1047 HE2 PHE 127 HE2 PHE 127 14.607 -0.075 3.549 1048 HZ PHE 127 HZ PHE 127 13.684 -2.353 3.739 1049 H ASN 128 HN ASN 128 20.129 -1.900 8.660 1050 HA ASN 128 HA ASN 128 22.272 -0.008 8.678 1051 HB2 ASN 128 HB2 ASN 128 21.889 -2.594 10.189 1052 HB3 ASN 128 HB1 ASN 128 23.216 -1.470 10.459 1053 HD21 ASN 128 HD21 ASN 128 19.805 -2.016 10.817 1054 HD22 ASN 128 HD22 ASN 128 19.509 -0.706 11.909 1055 H ASN 129 HN ASN 129 23.926 -0.007 7.363 1056 HA ASN 129 HA ASN 129 25.607 -0.642 5.987 1057 HB2 ASN 129 HB2 ASN 129 25.690 -2.961 7.928 1058 HB3 ASN 129 HB1 ASN 129 26.929 -2.631 6.709 1059 HD21 ASN 129 HD21 ASN 129 26.717 -2.537 9.834 1060 HD22 ASN 129 HD22 ASN 129 27.509 -1.040 10.198 1061 HA PRO 130 HA PRO 130 23.270 -3.753 3.529 1062 HB2 PRO 130 HB2 PRO 130 22.169 -2.129 1.686 1063 HB3 PRO 130 HB1 PRO 130 21.407 -2.418 3.252 1064 HG2 PRO 130 HG2 PRO 130 22.827 -0.025 2.260 1065 HG3 PRO 130 HG1 PRO 130 21.565 -0.156 3.494 1066 HD2 PRO 130 HD2 PRO 130 24.375 0.074 3.894 1067 HD3 PRO 130 HD1 PRO 130 23.124 -0.165 5.128 1068 H THR 131 HN THR 131 24.019 -4.641 1.612 1069 HA THR 131 HA THR 131 26.582 -4.032 0.726 1070 HB THR 131 HB THR 131 25.623 -6.224 0.262 1071 HG1 THR 131 HG1 THR 131 26.617 -6.435 -1.640 1072 HG21 THR 131 HG21 THR 131 23.306 -5.626 -0.147 1073 HG22 THR 131 HG22 THR 131 23.940 -6.498 -1.543 1074 HG23 THR 131 HG23 THR 131 23.760 -4.746 -1.607 1075 H GLU 132 HN GLU 132 27.245 -3.336 -1.493 1076 HA GLU 132 HA GLU 132 26.562 -0.670 -1.839 1077 HB2 GLU 132 HB2 GLU 132 28.632 -1.818 -2.738 1078 HB3 GLU 132 HB1 GLU 132 27.629 -2.410 -4.054 1079 HG2 GLU 132 HG2 GLU 132 28.822 -0.477 -4.786 1080 HG3 GLU 132 HG1 GLU 132 27.103 -0.088 -4.672 1081 H ASP 133 HN ASP 133 25.433 -3.477 -3.736 1082 HA ASP 133 HA ASP 133 23.964 -2.098 -5.661 1083 HB2 ASP 133 HB2 ASP 133 23.517 -4.826 -4.436 1084 HB3 ASP 133 HB1 ASP 133 22.509 -4.198 -5.731 1085 H PHE 134 HN PHE 134 22.955 -3.189 -2.444 1086 HA PHE 134 HA PHE 134 20.251 -2.385 -2.823 1087 HB2 PHE 134 HB2 PHE 134 21.086 -4.140 -1.144 1088 HB3 PHE 134 HB1 PHE 134 21.576 -2.772 -0.144 1089 HD1 PHE 134 HD1 PHE 134 18.572 -2.944 -2.293 1090 HD2 PHE 134 HD2 PHE 134 20.093 -2.990 1.685 1091 HE1 PHE 134 HE1 PHE 134 16.311 -2.699 -1.428 1092 HE2 PHE 134 HE2 PHE 134 17.804 -2.765 2.553 1093 HZ PHE 134 HZ PHE 134 15.910 -2.622 0.983 1094 H ARG 135 HN ARG 135 22.912 -1.089 -0.902 1095 HA ARG 135 HA ARG 135 21.720 1.220 0.059 1096 HB2 ARG 135 HB2 ARG 135 23.885 0.441 0.817 1097 HB3 ARG 135 HB1 ARG 135 24.577 0.714 -0.777 1098 HG2 ARG 135 HG2 ARG 135 24.082 3.124 -0.524 1099 HG3 ARG 135 HG1 ARG 135 23.560 2.792 1.137 1100 HD2 ARG 135 HD2 ARG 135 26.337 2.462 -0.019 1101 HD3 ARG 135 HD1 ARG 135 25.812 3.515 1.298 1102 HE ARG 135 HE ARG 135 25.668 0.592 1.586 1103 HH11 ARG 135 HH11 ARG 135 26.790 3.711 2.692 1104 HH12 ARG 135 HH12 ARG 135 27.674 3.058 4.038 1105 HH21 ARG 135 HH21 ARG 135 26.802 -0.277 3.384 1106 HH22 ARG 135 HH22 ARG 135 27.658 0.800 4.452 1107 H ARG 136 HN ARG 136 23.587 0.746 -2.862 1108 HA ARG 136 HA ARG 136 23.632 3.211 -4.025 1109 HB2 ARG 136 HB2 ARG 136 24.769 1.243 -4.841 1110 HB3 ARG 136 HB1 ARG 136 23.249 0.495 -5.287 1111 HG2 ARG 136 HG2 ARG 136 22.985 2.473 -6.892 1112 HG3 ARG 136 HG1 ARG 136 24.705 2.749 -6.581 1113 HD2 ARG 136 HD2 ARG 136 24.819 1.353 -8.405 1114 HD3 ARG 136 HD1 ARG 136 24.922 0.214 -7.057 1115 HE ARG 136 HE ARG 136 22.325 0.737 -8.339 1116 HH11 ARG 136 HH11 ARG 136 24.955 -1.435 -7.542 1117 HH12 ARG 136 HH12 ARG 136 24.079 -2.869 -7.985 1118 HH21 ARG 136 HH21 ARG 136 21.171 -1.147 -8.957 1119 HH22 ARG 136 HH22 ARG 136 21.927 -2.707 -8.784 1120 H LYS 137 HN LYS 137 21.013 0.799 -4.293 1121 HA LYS 137 HA LYS 137 19.416 2.468 -5.969 1122 HB2 LYS 137 HB2 LYS 137 18.747 -0.009 -4.378 1123 HB3 LYS 137 HB1 LYS 137 17.565 0.843 -5.369 1124 HG2 LYS 137 HG2 LYS 137 19.123 0.510 -7.321 1125 HG3 LYS 137 HG1 LYS 137 20.071 -0.556 -6.283 1126 HD2 LYS 137 HD2 LYS 137 17.200 -1.145 -6.310 1127 HD3 LYS 137 HD1 LYS 137 17.988 -1.337 -7.873 1128 HE2 LYS 137 HE2 LYS 137 17.918 -3.407 -6.484 1129 HE3 LYS 137 HE1 LYS 137 19.529 -2.922 -6.991 1130 HZ1 LYS 137 HZ1 LYS 137 19.455 -3.625 -4.663 1131 HZ2 LYS 137 HZ2 LYS 137 18.342 -2.399 -4.321 1132 HZ3 LYS 137 HZ3 LYS 137 19.915 -1.998 -4.801 1133 H LEU 138 HN LEU 138 19.347 1.673 -2.523 1134 HA LEU 138 HA LEU 138 17.116 3.125 -1.723 1135 HB2 LEU 138 HB2 LEU 138 19.672 2.839 -0.161 1136 HB3 LEU 138 HB1 LEU 138 18.084 3.182 0.488 1137 HG LEU 138 HG LEU 138 19.075 0.595 -0.677 1138 HD11 LEU 138 HD11 LEU 138 19.574 1.213 1.707 1139 HD12 LEU 138 HD12 LEU 138 18.683 -0.291 1.483 1140 HD13 LEU 138 HD13 LEU 138 17.836 1.168 2.000 1141 HD21 LEU 138 HD21 LEU 138 16.266 1.352 0.068 1142 HD22 LEU 138 HD22 LEU 138 16.820 -0.290 -0.248 1143 HD23 LEU 138 HD23 LEU 138 16.851 0.917 -1.535 1144 H LEU 139 HN LEU 139 20.416 4.205 -2.278 1145 HA LEU 139 HA LEU 139 19.971 6.843 -1.266 1146 HB2 LEU 139 HB2 LEU 139 22.225 5.663 -2.881 1147 HB3 LEU 139 HB1 LEU 139 22.236 7.285 -2.209 1148 HG LEU 139 HG LEU 139 22.069 4.729 -0.612 1149 HD11 LEU 139 HD11 LEU 139 24.261 4.721 -1.241 1150 HD12 LEU 139 HD12 LEU 139 24.352 5.760 0.187 1151 HD13 LEU 139 HD13 LEU 139 24.328 6.478 -1.424 1152 HD21 LEU 139 HD21 LEU 139 20.890 6.615 0.399 1153 HD22 LEU 139 HD22 LEU 139 22.364 7.583 0.305 1154 HD23 LEU 139 HD23 LEU 139 22.313 6.146 1.329 1155 H LYS 140 HN LYS 140 19.707 5.331 -4.398 1156 HA LYS 140 HA LYS 140 19.707 7.746 -5.902 1157 HB2 LYS 140 HB2 LYS 140 19.617 4.979 -6.481 1158 HB3 LYS 140 HB1 LYS 140 18.227 5.740 -7.224 1159 HG2 LYS 140 HG2 LYS 140 19.562 7.233 -8.467 1160 HG3 LYS 140 HG1 LYS 140 21.011 6.769 -7.570 1161 HD2 LYS 140 HD2 LYS 140 19.429 4.809 -9.207 1162 HD3 LYS 140 HD1 LYS 140 20.742 5.767 -9.882 1163 HE2 LYS 140 HE2 LYS 140 20.991 3.971 -7.485 1164 HE3 LYS 140 HE1 LYS 140 21.375 3.493 -9.133 1165 HZ1 LYS 140 HZ1 LYS 140 23.401 4.143 -8.181 1166 HZ2 LYS 140 HZ2 LYS 140 22.734 5.516 -7.451 1167 HZ3 LYS 140 HZ3 LYS 140 22.945 5.466 -9.133 1168 H ALA 141 HN ALA 141 17.370 6.062 -4.071 1169 HA ALA 141 HA ALA 141 14.946 6.619 -5.158 1170 HB1 ALA 141 HB1 ALA 141 14.075 6.115 -3.148 1171 HB2 ALA 141 HB2 ALA 141 15.157 7.201 -2.277 1172 HB3 ALA 141 HB3 ALA 141 15.736 5.626 -2.818 1173 H1 GLY 212 HT1 GLY 212 -20.273 6.601 15.739 1174 H2 GLY 212 HT2 GLY 212 -19.063 5.893 16.691 1175 H3 GLY 212 HT3 GLY 212 -19.665 5.073 15.335 1176 HA2 GLY 212 HA1 GLY 212 -18.088 7.584 15.320 1177 HA3 GLY 212 HA2 GLY 212 -17.518 5.997 14.817 1178 H GLY 213 HN GLY 213 -17.273 8.013 13.045 1179 HA2 GLY 213 HA2 GLY 213 -19.618 8.009 11.303 1180 HA3 GLY 213 HA1 GLY 213 -18.174 8.991 11.106 1181 H LYS 214 HN LYS 214 -17.424 5.773 11.760 1182 HA LYS 214 HA LYS 214 -16.574 5.372 9.015 1183 HB2 LYS 214 HB2 LYS 214 -16.192 3.620 11.450 1184 HB3 LYS 214 HB1 LYS 214 -15.448 3.367 9.878 1185 HG2 LYS 214 HG2 LYS 214 -14.290 5.543 10.132 1186 HG3 LYS 214 HG1 LYS 214 -14.958 5.662 11.761 1187 HD2 LYS 214 HD2 LYS 214 -13.107 3.519 10.719 1188 HD3 LYS 214 HD1 LYS 214 -12.700 4.799 11.862 1189 HE2 LYS 214 HE2 LYS 214 -14.737 2.624 12.340 1190 HE3 LYS 214 HE1 LYS 214 -13.087 2.621 12.959 1191 HZ1 LYS 214 HZ1 LYS 214 -15.166 4.647 13.603 1192 HZ2 LYS 214 HZ2 LYS 214 -13.582 4.622 14.207 1193 HZ3 LYS 214 HZ3 LYS 214 -14.665 3.385 14.619 1194 H ALA 215 HN ALA 215 -17.362 3.911 7.645 1195 HA ALA 215 HA ALA 215 -19.995 2.878 8.040 1196 HB1 ALA 215 HB1 ALA 215 -19.617 1.875 5.786 1197 HB2 ALA 215 HB2 ALA 215 -17.960 2.473 5.842 1198 HB3 ALA 215 HB3 ALA 215 -19.308 3.609 5.848 1199 HA PRO 216 HA PRO 216 -19.356 -1.228 9.578 1200 HB2 PRO 216 HB2 PRO 216 -20.390 -2.466 7.114 1201 HB3 PRO 216 HB1 PRO 216 -20.977 -2.576 8.760 1202 HG2 PRO 216 HG2 PRO 216 -22.188 -1.132 6.788 1203 HG3 PRO 216 HG1 PRO 216 -22.377 -0.816 8.519 1204 HD2 PRO 216 HD2 PRO 216 -20.919 0.710 6.482 1205 HD3 PRO 216 HD1 PRO 216 -21.492 1.221 8.078 1206 H ARG 217 HN ARG 217 -18.211 -3.289 9.183 1207 HA ARG 217 HA ARG 217 -16.404 -3.252 6.903 1208 HB2 ARG 217 HB2 ARG 217 -14.443 -3.671 8.464 1209 HB3 ARG 217 HB1 ARG 217 -15.061 -2.028 8.397 1210 HG2 ARG 217 HG2 ARG 217 -16.259 -2.380 10.490 1211 HG3 ARG 217 HG1 ARG 217 -15.663 -4.042 10.553 1212 HD2 ARG 217 HD2 ARG 217 -14.382 -2.392 11.951 1213 HD3 ARG 217 HD1 ARG 217 -13.415 -3.318 10.803 1214 HE ARG 217 HE ARG 217 -14.350 -0.697 9.934 1215 HH11 ARG 217 HH11 ARG 217 -11.741 -2.588 11.292 1216 HH12 ARG 217 HH12 ARG 217 -10.493 -1.521 10.704 1217 HH21 ARG 217 HH21 ARG 217 -12.722 0.716 9.192 1218 HH22 ARG 217 HH22 ARG 217 -11.048 0.367 9.532 1219 H1 KCR 218 HN KCR 218 -15.340 -5.194 6.491 1220 H4 KCR 218 HA KCR 218 -16.844 -7.512 7.475 1221 H5 KCR 218 HB1 KCR 218 -16.135 -8.629 5.468 1222 H6 KCR 218 HB2 KCR 218 -14.972 -7.361 5.108 1223 H7 KCR 218 HG1 KCR 218 -16.843 -5.783 4.791 1224 H8 KCR 218 HG2 KCR 218 -17.971 -7.115 5.050 1225 H9 KCR 218 HD1 KCR 218 -17.161 -8.265 3.118 1226 H10 KCR 218 HD2 KCR 218 -15.847 -7.107 2.917 1227 H11 KCR 218 HE1 KCR 218 -17.450 -5.340 2.438 1228 H12 KCR 218 HE2 KCR 218 -18.785 -6.474 2.675 1229 H13 KCR 218 HZ1 KCR 218 -18.032 -7.663 0.719 1230 H14 KCR 218 HH1 KCR 218 -17.438 -7.544 -1.599 1231 H15 KCR 218 HJ1 KCR 218 -16.793 -4.611 -2.308 1232 H16 KCR 218 HF3 KCR 218 -17.871 -6.166 -4.355 1233 H17 KCR 218 HF1 KCR 218 -16.188 -5.646 -4.435 1234 H18 KCR 218 HF2 KCR 218 -16.587 -7.247 -3.812 1235 H GLN 219 HN GLN 219 -15.913 -8.656 9.032 1236 HA GLN 219 HA GLN 219 -12.967 -8.797 9.088 1237 HB2 GLN 219 HB2 GLN 219 -13.177 -8.820 11.590 1238 HB3 GLN 219 HB1 GLN 219 -13.621 -7.300 10.825 1239 HG2 GLN 219 HG2 GLN 219 -16.022 -8.135 10.932 1240 HG3 GLN 219 HG1 GLN 219 -15.417 -9.376 12.030 1241 HE21 GLN 219 HE21 GLN 219 -16.027 -5.998 11.575 1242 HE22 GLN 219 HE22 GLN 219 -15.841 -5.519 13.230 1243 H LEU 220 HN LEU 220 -15.267 -10.634 8.188 1244 HA LEU 220 HA LEU 220 -14.685 -12.933 9.915 1245 HB2 LEU 220 HB2 LEU 220 -16.917 -12.317 8.013 1246 HB3 LEU 220 HB1 LEU 220 -16.566 -13.978 8.440 1247 HG LEU 220 HG LEU 220 -18.366 -13.179 9.812 1248 HD11 LEU 220 HD11 LEU 220 -15.813 -13.344 11.397 1249 HD12 LEU 220 HD12 LEU 220 -16.807 -14.702 10.869 1250 HD13 LEU 220 HD13 LEU 220 -17.441 -13.549 12.044 1251 HD21 LEU 220 HD21 LEU 220 -16.511 -10.970 10.683 1252 HD22 LEU 220 HD22 LEU 220 -18.111 -11.297 11.348 1253 HD23 LEU 220 HD23 LEU 220 -17.942 -10.789 9.668 1254 H ALA 221 HN ALA 221 -12.746 -11.944 8.017 1255 HA ALA 221 HA ALA 221 -12.572 -14.341 6.308 1256 HB1 ALA 221 HB1 ALA 221 -11.404 -13.037 4.626 1257 HB2 ALA 221 HB2 ALA 221 -11.540 -11.591 5.627 1258 HB3 ALA 221 HB3 ALA 221 -12.990 -12.340 4.957 1259 H THR 222 HN THR 222 -11.346 -12.944 8.971 1260 HA THR 222 HA THR 222 -8.540 -13.283 8.565 1261 HB THR 222 HB THR 222 -10.041 -13.318 11.193 1262 HG1 THR 222 HG1 THR 222 -9.013 -11.134 9.659 1263 HG21 THR 222 HG21 THR 222 -7.709 -14.061 11.331 1264 HG22 THR 222 HG22 THR 222 -7.927 -12.499 12.120 1265 HG23 THR 222 HG23 THR 222 -7.188 -12.583 10.521 1266 H LYS 223 HN LYS 223 -11.075 -15.189 10.171 1267 HA LYS 223 HA LYS 223 -11.217 -17.395 10.728 1268 HB2 LYS 223 HB2 LYS 223 -9.541 -17.716 8.229 1269 HB3 LYS 223 HB1 LYS 223 -10.493 -18.978 8.996 1270 HG2 LYS 223 HG2 LYS 223 -11.588 -16.460 7.761 1271 HG3 LYS 223 HG1 LYS 223 -11.609 -18.065 7.030 1272 HD2 LYS 223 HD2 LYS 223 -12.962 -18.867 8.946 1273 HD3 LYS 223 HD1 LYS 223 -13.007 -17.215 9.565 1274 HE2 LYS 223 HE2 LYS 223 -15.047 -17.747 8.340 1275 HE3 LYS 223 HE1 LYS 223 -14.133 -16.478 7.526 1276 HZ1 LYS 223 HZ1 LYS 223 -15.047 -18.254 6.049 1277 HZ2 LYS 223 HZ2 LYS 223 -13.963 -19.344 6.770 1278 HZ3 LYS 223 HZ3 LYS 223 -13.376 -18.005 5.903 1279 H ALA 224 HN ALA 224 -9.422 -16.304 12.342 1280 HA ALA 224 HA ALA 224 -6.951 -17.850 12.211 1281 HB1 ALA 224 HB1 ALA 224 -6.192 -16.448 14.052 1282 HB2 ALA 224 HB2 ALA 224 -7.791 -15.713 14.168 1283 HB3 ALA 224 HB3 ALA 224 -6.806 -15.457 12.728 Start of MODEL 7 1 H1 GLY 1 HT1 GLY 1 36.284 -13.052 10.752 2 H2 GLY 1 HT2 GLY 1 35.753 -13.655 9.257 3 H3 GLY 1 HT3 GLY 1 34.837 -13.928 10.659 4 HA2 GLY 1 HA1 GLY 1 35.342 -11.295 9.389 5 HA3 GLY 1 HA2 GLY 1 33.833 -12.196 9.320 6 H SER 2 HN SER 2 35.448 -9.765 10.879 7 HA SER 2 HA SER 2 34.193 -10.188 13.478 8 HB2 SER 2 HB2 SER 2 35.934 -7.894 12.543 9 HB3 SER 2 HB1 SER 2 35.518 -8.299 14.209 10 HG SER 2 HG SER 2 36.586 -10.373 13.769 11 H HIS 3 HN HIS 3 32.725 -8.704 14.408 12 HA HIS 3 HA HIS 3 31.040 -7.378 12.429 13 HB2 HIS 3 HB2 HIS 3 30.627 -8.189 15.295 14 HB3 HIS 3 HB1 HIS 3 29.539 -7.051 14.513 15 HD1 HIS 3 HD1 HIS 3 28.362 -8.022 12.257 16 HD2 HIS 3 HD2 HIS 3 29.989 -10.803 14.886 17 HE1 HIS 3 HE1 HIS 3 27.270 -10.213 11.685 18 HE2 HIS 3 HE2 HIS 3 28.138 -11.841 13.399 19 H MET 4 HN MET 4 33.375 -6.039 12.686 20 HA MET 4 HA MET 4 32.558 -3.638 14.182 21 HB2 MET 4 HB2 MET 4 34.537 -4.714 15.208 22 HB3 MET 4 HB1 MET 4 35.392 -4.566 13.677 23 HG2 MET 4 HG2 MET 4 35.096 -2.100 13.825 24 HG3 MET 4 HG1 MET 4 34.420 -2.329 15.437 25 HE1 MET 4 HE1 MET 4 37.397 -4.217 13.661 26 HE2 MET 4 HE2 MET 4 38.774 -3.285 14.249 27 HE3 MET 4 HE3 MET 4 37.595 -2.532 13.175 28 H ALA 5 HN ALA 5 31.802 -2.295 12.699 29 HA ALA 5 HA ALA 5 33.523 -1.372 10.577 30 HB1 ALA 5 HB1 ALA 5 31.949 -1.841 8.757 31 HB2 ALA 5 HB2 ALA 5 30.909 -2.720 9.878 32 HB3 ALA 5 HB3 ALA 5 32.520 -3.333 9.504 33 H SER 6 HN SER 6 32.851 0.636 9.757 34 HA SER 6 HA SER 6 31.370 2.280 11.476 35 HB2 SER 6 HB2 SER 6 33.100 3.029 9.797 36 HB3 SER 6 HB1 SER 6 31.893 2.785 8.536 37 HG SER 6 HG SER 6 31.998 4.714 10.575 38 H SER 7 HN SER 7 29.331 1.702 11.920 39 HA SER 7 HA SER 7 27.628 0.425 10.051 40 HB2 SER 7 HB2 SER 7 27.587 0.113 12.550 41 HB3 SER 7 HB1 SER 7 26.831 1.702 12.678 42 HG SER 7 HG SER 7 25.174 0.275 12.615 43 H CYS 8 HN CYS 8 26.357 1.243 8.590 44 HA CYS 8 HA CYS 8 25.147 3.868 8.987 45 HB2 CYS 8 HB2 CYS 8 25.621 4.362 6.543 46 HB3 CYS 8 HB1 CYS 8 26.987 4.464 7.644 47 HG CYS 8 HG CYS 8 28.096 3.346 5.445 48 H ALA 9 HN ALA 9 23.145 3.186 9.247 49 HA ALA 9 HA ALA 9 21.980 1.197 7.476 50 HB1 ALA 9 HB1 ALA 9 19.971 1.459 8.893 51 HB2 ALA 9 HB2 ALA 9 20.777 2.772 9.758 52 HB3 ALA 9 HB3 ALA 9 21.419 1.133 9.852 53 H VAL 10 HN VAL 10 20.779 1.661 5.731 54 HA VAL 10 HA VAL 10 20.147 4.481 5.222 55 HB VAL 10 HB VAL 10 20.004 2.182 3.264 56 HG11 VAL 10 HG11 VAL 10 18.614 3.859 2.454 57 HG12 VAL 10 HG12 VAL 10 20.151 4.182 1.648 58 HG13 VAL 10 HG13 VAL 10 19.663 5.150 3.040 59 HG21 VAL 10 HG21 VAL 10 22.308 2.402 3.828 60 HG22 VAL 10 HG22 VAL 10 22.218 4.161 3.789 61 HG23 VAL 10 HG23 VAL 10 22.081 3.238 2.293 62 H GLN 11 HN GLN 11 18.118 5.166 5.400 63 HA GLN 11 HA GLN 11 16.097 3.115 5.972 64 HB2 GLN 11 HB2 GLN 11 15.770 5.966 6.813 65 HB3 GLN 11 HB1 GLN 11 15.165 4.501 7.576 66 HG2 GLN 11 HG2 GLN 11 16.801 4.894 9.060 67 HG3 GLN 11 HG1 GLN 11 17.817 4.124 7.845 68 HE21 GLN 11 HE21 GLN 11 16.932 7.101 9.364 69 HE22 GLN 11 HE22 GLN 11 18.212 8.062 8.693 70 H VAL 12 HN VAL 12 14.375 2.939 4.742 71 HA VAL 12 HA VAL 12 13.821 5.104 2.834 72 HB VAL 12 HB VAL 12 12.737 3.327 1.447 73 HG11 VAL 12 HG11 VAL 12 15.208 4.072 1.249 74 HG12 VAL 12 HG12 VAL 12 14.740 2.562 0.471 75 HG13 VAL 12 HG13 VAL 12 15.582 2.532 2.019 76 HG21 VAL 12 HG21 VAL 12 12.325 1.806 3.309 77 HG22 VAL 12 HG22 VAL 12 14.045 1.429 3.364 78 HG23 VAL 12 HG23 VAL 12 13.092 1.020 1.933 79 H LYS 13 HN LYS 13 11.701 5.822 2.635 80 HA LYS 13 HA LYS 13 9.837 4.739 4.629 81 HB2 LYS 13 HB2 LYS 13 10.359 7.529 3.693 82 HB3 LYS 13 HB1 LYS 13 8.762 7.105 4.291 83 HG2 LYS 13 HG2 LYS 13 9.744 6.356 6.390 84 HG3 LYS 13 HG1 LYS 13 11.347 6.805 5.799 85 HD2 LYS 13 HD2 LYS 13 10.574 9.137 5.554 86 HD3 LYS 13 HD1 LYS 13 9.016 8.671 6.239 87 HE2 LYS 13 HE2 LYS 13 11.639 8.298 7.669 88 HE3 LYS 13 HE1 LYS 13 10.642 9.740 7.839 89 HZ1 LYS 13 HZ1 LYS 13 10.315 8.036 9.594 90 HZ2 LYS 13 HZ2 LYS 13 9.661 7.001 8.422 91 HZ3 LYS 13 HZ3 LYS 13 8.896 8.467 8.778 92 H LEU 14 HN LEU 14 8.052 3.857 3.944 93 HA LEU 14 HA LEU 14 7.155 4.435 1.199 94 HB2 LEU 14 HB2 LEU 14 6.667 1.980 2.870 95 HB3 LEU 14 HB1 LEU 14 5.986 2.260 1.285 96 HG LEU 14 HG LEU 14 8.945 2.005 1.861 97 HD11 LEU 14 HD11 LEU 14 7.015 0.044 0.645 98 HD12 LEU 14 HD12 LEU 14 7.737 -0.086 2.249 99 HD13 LEU 14 HD13 LEU 14 8.756 -0.179 0.812 100 HD21 LEU 14 HD21 LEU 14 7.500 1.921 -0.778 101 HD22 LEU 14 HD22 LEU 14 9.240 1.967 -0.491 102 HD23 LEU 14 HD23 LEU 14 8.250 3.380 -0.124 103 H GLU 15 HN GLU 15 5.000 4.842 0.866 104 HA GLU 15 HA GLU 15 3.643 5.863 3.267 105 HB2 GLU 15 HB2 GLU 15 4.488 7.556 1.669 106 HB3 GLU 15 HB1 GLU 15 3.506 6.837 0.405 107 HG2 GLU 15 HG2 GLU 15 1.487 7.467 1.563 108 HG3 GLU 15 HG1 GLU 15 2.426 8.087 2.921 109 H LEU 16 HN LEU 16 1.817 4.927 3.801 110 HA LEU 16 HA LEU 16 0.304 3.348 1.847 111 HB2 LEU 16 HB2 LEU 16 0.057 3.637 4.833 112 HB3 LEU 16 HB1 LEU 16 -1.153 2.832 3.869 113 HG LEU 16 HG LEU 16 0.121 1.128 4.828 114 HD11 LEU 16 HD11 LEU 16 1.673 1.104 2.370 115 HD12 LEU 16 HD12 LEU 16 -0.060 1.331 2.147 116 HD13 LEU 16 HD13 LEU 16 0.543 -0.085 3.012 117 HD21 LEU 16 HD21 LEU 16 2.665 2.329 3.854 118 HD22 LEU 16 HD22 LEU 16 2.447 1.038 5.027 119 HD23 LEU 16 HD23 LEU 16 2.011 2.698 5.443 120 H GLY 17 HN GLY 17 -1.751 3.915 1.274 121 HA2 GLY 17 HA2 GLY 17 -2.994 6.227 2.526 122 HA3 GLY 17 HA1 GLY 17 -2.495 6.441 0.853 123 H HIS 18 HN HIS 18 -5.108 6.704 1.677 124 HA HIS 18 HA HIS 18 -6.280 5.244 -0.402 125 HB2 HIS 18 HB2 HIS 18 -7.258 3.430 0.533 126 HB3 HIS 18 HB1 HIS 18 -6.117 3.644 1.853 127 HD1 HIS 18 HD1 HIS 18 -7.087 5.139 3.920 128 HD2 HIS 18 HD2 HIS 18 -9.866 3.487 1.296 129 HE1 HIS 18 HE1 HIS 18 -9.318 5.317 5.078 130 HE2 HIS 18 HE2 HIS 18 -10.933 4.128 3.563 131 H ARG 19 HN ARG 19 -8.216 6.053 -0.964 132 HA ARG 19 HA ARG 19 -9.392 8.100 0.804 133 HB2 ARG 19 HB2 ARG 19 -9.403 7.995 -2.218 134 HB3 ARG 19 HB1 ARG 19 -10.202 9.205 -1.245 135 HG2 ARG 19 HG2 ARG 19 -8.071 10.002 -0.422 136 HG3 ARG 19 HG1 ARG 19 -7.237 8.743 -1.338 137 HD2 ARG 19 HD2 ARG 19 -7.147 10.829 -2.558 138 HD3 ARG 19 HD1 ARG 19 -8.167 9.666 -3.411 139 HE ARG 19 HE ARG 19 -9.766 11.260 -1.720 140 HH11 ARG 19 HH11 ARG 19 -7.883 11.524 -4.665 141 HH12 ARG 19 HH12 ARG 19 -8.930 12.727 -5.368 142 HH21 ARG 19 HH21 ARG 19 -11.103 12.846 -2.607 143 HH22 ARG 19 HH22 ARG 19 -10.757 13.500 -4.178 144 H ALA 20 HN ALA 20 -11.714 8.227 0.741 145 HA ALA 20 HA ALA 20 -13.074 6.093 -0.702 146 HB1 ALA 20 HB1 ALA 20 -12.959 4.935 1.278 147 HB2 ALA 20 HB2 ALA 20 -14.504 5.772 1.443 148 HB3 ALA 20 HB3 ALA 20 -13.071 6.395 2.262 149 H GLN 21 HN GLN 21 -14.982 6.635 -1.461 150 HA GLN 21 HA GLN 21 -16.473 8.875 -0.374 151 HB2 GLN 21 HB2 GLN 21 -16.695 10.042 -2.452 152 HB3 GLN 21 HB1 GLN 21 -14.986 9.785 -2.177 153 HG2 GLN 21 HG2 GLN 21 -15.035 9.275 -4.338 154 HG3 GLN 21 HG1 GLN 21 -15.428 7.685 -3.730 155 HE21 GLN 21 HE21 GLN 21 -17.456 6.835 -4.097 156 HE22 GLN 21 HE22 GLN 21 -18.609 7.586 -5.143 157 H VAL 22 HN VAL 22 -18.708 8.715 -0.798 158 HA VAL 22 HA VAL 22 -19.444 6.056 -1.800 159 HB VAL 22 HB VAL 22 -20.085 6.710 0.579 160 HG11 VAL 22 HG11 VAL 22 -22.098 8.020 0.884 161 HG12 VAL 22 HG12 VAL 22 -22.177 8.341 -0.849 162 HG13 VAL 22 HG13 VAL 22 -20.845 8.990 0.110 163 HG21 VAL 22 HG21 VAL 22 -22.136 5.497 0.470 164 HG22 VAL 22 HG22 VAL 22 -21.039 4.829 -0.732 165 HG23 VAL 22 HG23 VAL 22 -22.348 5.901 -1.229 166 H ARG 23 HN ARG 23 -20.847 5.796 -3.409 167 HA ARG 23 HA ARG 23 -21.732 8.193 -4.851 168 HB2 ARG 23 HB2 ARG 23 -22.534 6.143 -6.436 169 HB3 ARG 23 HB1 ARG 23 -20.929 6.864 -6.513 170 HG2 ARG 23 HG2 ARG 23 -19.912 5.072 -5.621 171 HG3 ARG 23 HG1 ARG 23 -21.262 4.693 -4.559 172 HD2 ARG 23 HD2 ARG 23 -20.950 2.954 -6.232 173 HD3 ARG 23 HD1 ARG 23 -22.493 3.776 -6.468 174 HE ARG 23 HE ARG 23 -21.435 4.998 -8.303 175 HH11 ARG 23 HH11 ARG 23 -19.859 2.081 -7.169 176 HH12 ARG 23 HH12 ARG 23 -19.093 1.744 -8.691 177 HH21 ARG 23 HH21 ARG 23 -20.423 4.562 -10.305 178 HH22 ARG 23 HH22 ARG 23 -19.425 3.154 -10.479 179 H LYS 24 HN LYS 24 -23.868 8.652 -5.178 180 HA LYS 24 HA LYS 24 -25.617 7.822 -3.099 181 HB2 LYS 24 HB2 LYS 24 -25.557 10.099 -4.223 182 HB3 LYS 24 HB1 LYS 24 -26.352 9.356 -5.600 183 HG2 LYS 24 HG2 LYS 24 -28.183 10.148 -4.564 184 HG3 LYS 24 HG1 LYS 24 -28.063 8.622 -3.686 185 HD2 LYS 24 HD2 LYS 24 -26.801 9.789 -1.906 186 HD3 LYS 24 HD1 LYS 24 -27.007 11.302 -2.784 187 HE2 LYS 24 HE2 LYS 24 -29.447 11.050 -2.590 188 HE3 LYS 24 HE1 LYS 24 -29.202 9.578 -1.650 189 HZ1 LYS 24 HZ1 LYS 24 -29.576 11.402 -0.167 190 HZ2 LYS 24 HZ2 LYS 24 -28.355 12.323 -0.901 191 HZ3 LYS 24 HZ3 LYS 24 -27.952 10.930 -0.026 192 H LYS 25 HN LYS 25 -24.860 6.531 -6.094 193 HA LYS 25 HA LYS 25 -27.210 4.779 -5.968 194 HB2 LYS 25 HB2 LYS 25 -27.486 6.431 -7.803 195 HB3 LYS 25 HB1 LYS 25 -25.973 5.883 -8.509 196 HG2 LYS 25 HG2 LYS 25 -28.082 3.851 -8.044 197 HG3 LYS 25 HG1 LYS 25 -28.334 5.019 -9.339 198 HD2 LYS 25 HD2 LYS 25 -26.231 4.372 -10.357 199 HD3 LYS 25 HD1 LYS 25 -25.902 3.265 -9.022 200 HE2 LYS 25 HE2 LYS 25 -26.744 1.969 -10.836 201 HE3 LYS 25 HE1 LYS 25 -28.003 2.068 -9.601 202 HZ1 LYS 25 HZ1 LYS 25 -27.896 3.847 -11.973 203 HZ2 LYS 25 HZ2 LYS 25 -29.172 3.677 -10.866 204 HZ3 LYS 25 HZ3 LYS 25 -28.790 2.407 -11.920 205 HA PRO 26 HA PRO 26 -23.674 1.964 -5.560 206 HB2 PRO 26 HB2 PRO 26 -25.950 0.079 -5.358 207 HB3 PRO 26 HB1 PRO 26 -24.550 0.270 -4.305 208 HG2 PRO 26 HG2 PRO 26 -26.967 1.124 -3.560 209 HG3 PRO 26 HG1 PRO 26 -25.496 2.024 -3.139 210 HD2 PRO 26 HD2 PRO 26 -27.543 2.600 -5.242 211 HD3 PRO 26 HD1 PRO 26 -26.639 3.726 -4.212 212 H THR 27 HN THR 27 -22.891 0.267 -6.854 213 HA THR 27 HA THR 27 -23.613 0.513 -9.597 214 HB THR 27 HB THR 27 -21.297 0.114 -9.010 215 HG1 THR 27 HG1 THR 27 -21.266 -2.200 -10.180 216 HG21 THR 27 HG21 THR 27 -21.404 -1.137 -7.012 217 HG22 THR 27 HG22 THR 27 -20.635 -2.192 -8.199 218 HG23 THR 27 HG23 THR 27 -22.334 -2.422 -7.784 219 H VAL 28 HN VAL 28 -23.628 -1.820 -10.806 220 HA VAL 28 HA VAL 28 -26.181 -2.770 -10.704 221 HB VAL 28 HB VAL 28 -24.820 -3.231 -12.568 222 HG11 VAL 28 HG11 VAL 28 -22.671 -3.383 -11.359 223 HG12 VAL 28 HG12 VAL 28 -22.882 -4.678 -12.541 224 HG13 VAL 28 HG13 VAL 28 -23.116 -5.007 -10.824 225 HG21 VAL 28 HG21 VAL 28 -25.550 -5.794 -11.163 226 HG22 VAL 28 HG22 VAL 28 -25.140 -5.674 -12.874 227 HG23 VAL 28 HG23 VAL 28 -26.569 -4.849 -12.250 228 H GLU 29 HN GLU 29 -23.437 -3.952 -8.808 229 HA GLU 29 HA GLU 29 -25.157 -6.026 -7.660 230 HB2 GLU 29 HB2 GLU 29 -22.168 -5.657 -7.525 231 HB3 GLU 29 HB1 GLU 29 -23.049 -6.963 -6.736 232 HG2 GLU 29 HG2 GLU 29 -23.910 -7.626 -9.000 233 HG3 GLU 29 HG1 GLU 29 -22.814 -6.429 -9.689 234 H GLY 30 HN GLY 30 -24.643 -2.937 -6.989 235 HA2 GLY 30 HA2 GLY 30 -25.578 -1.863 -5.157 236 HA3 GLY 30 HA1 GLY 30 -25.632 -3.401 -4.312 237 H PHE 31 HN PHE 31 -22.692 -2.145 -5.726 238 HA PHE 31 HA PHE 31 -21.511 -1.968 -3.088 239 HB2 PHE 31 HB2 PHE 31 -20.208 -1.374 -5.758 240 HB3 PHE 31 HB1 PHE 31 -19.398 -1.668 -4.223 241 HD1 PHE 31 HD1 PHE 31 -21.364 -4.058 -3.540 242 HD2 PHE 31 HD2 PHE 31 -18.926 -3.089 -6.878 243 HE1 PHE 31 HE1 PHE 31 -21.187 -6.443 -4.108 244 HE2 PHE 31 HE2 PHE 31 -18.743 -5.460 -7.449 245 HZ PHE 31 HZ PHE 31 -19.877 -7.146 -6.062 246 H THR 32 HN THR 32 -21.303 -0.129 -1.993 247 HA THR 32 HA THR 32 -22.470 2.261 -3.200 248 HB THR 32 HB THR 32 -22.838 3.006 -0.885 249 HG1 THR 32 HG1 THR 32 -22.464 1.359 0.780 250 HG21 THR 32 HG21 THR 32 -23.820 0.306 -1.605 251 HG22 THR 32 HG22 THR 32 -24.626 1.839 -1.874 252 HG23 THR 32 HG23 THR 32 -24.442 1.205 -0.236 253 H HIS 33 HN HIS 33 -19.556 1.154 -1.586 254 HA HIS 33 HA HIS 33 -18.572 3.926 -1.419 255 HB2 HIS 33 HB2 HIS 33 -18.112 1.474 0.235 256 HB3 HIS 33 HB1 HIS 33 -16.875 2.725 0.204 257 HD1 HIS 33 HD1 HIS 33 -20.343 2.021 1.458 258 HD2 HIS 33 HD2 HIS 33 -17.519 5.071 1.557 259 HE1 HIS 33 HE1 HIS 33 -21.100 3.594 3.277 260 HE2 HIS 33 HE2 HIS 33 -19.248 5.282 3.469 261 H ASP 34 HN ASP 34 -17.095 4.494 -2.846 262 HA ASP 34 HA ASP 34 -15.402 2.453 -4.117 263 HB2 ASP 34 HB2 ASP 34 -15.803 5.380 -4.813 264 HB3 ASP 34 HB1 ASP 34 -14.799 4.246 -5.708 265 H TRP 35 HN TRP 35 -13.256 2.356 -3.684 266 HA TRP 35 HA TRP 35 -12.057 4.634 -2.318 267 HB2 TRP 35 HB2 TRP 35 -10.913 3.146 -0.692 268 HB3 TRP 35 HB1 TRP 35 -12.650 3.250 -0.471 269 HD1 TRP 35 HD1 TRP 35 -13.988 0.994 -0.486 270 HE1 TRP 35 HE1 TRP 35 -13.295 -1.488 -0.709 271 HE3 TRP 35 HE3 TRP 35 -9.145 1.619 -2.020 272 HZ2 TRP 35 HZ2 TRP 35 -10.990 -2.974 -1.422 273 HZ3 TRP 35 HZ3 TRP 35 -7.768 -0.380 -2.446 274 HH2 TRP 35 HH2 TRP 35 -8.659 -2.622 -2.127 275 H MET 36 HN MET 36 -9.769 4.633 -2.268 276 HA MET 36 HA MET 36 -8.444 2.964 -4.282 277 HB2 MET 36 HB2 MET 36 -8.951 4.938 -5.517 278 HB3 MET 36 HB1 MET 36 -8.494 5.978 -4.175 279 HG2 MET 36 HG2 MET 36 -6.152 5.100 -4.439 280 HG3 MET 36 HG1 MET 36 -6.692 4.370 -5.955 281 HE1 MET 36 HE1 MET 36 -6.402 7.316 -3.801 282 HE2 MET 36 HE2 MET 36 -7.868 7.989 -4.532 283 HE3 MET 36 HE3 MET 36 -6.301 8.739 -4.847 284 H VAL 37 HN VAL 37 -6.524 2.232 -3.578 285 HA VAL 37 HA VAL 37 -5.474 3.355 -1.080 286 HB VAL 37 HB VAL 37 -4.003 1.150 -1.337 287 HG11 VAL 37 HG11 VAL 37 -6.814 1.251 -0.369 288 HG12 VAL 37 HG12 VAL 37 -5.390 1.687 0.560 289 HG13 VAL 37 HG13 VAL 37 -5.654 0.012 0.066 290 HG21 VAL 37 HG21 VAL 37 -4.879 0.433 -3.439 291 HG22 VAL 37 HG22 VAL 37 -6.536 0.583 -2.854 292 HG23 VAL 37 HG23 VAL 37 -5.476 -0.664 -2.194 293 H PHE 38 HN PHE 38 -3.282 3.604 -0.752 294 HA PHE 38 HA PHE 38 -1.679 4.242 -3.153 295 HB2 PHE 38 HB2 PHE 38 -2.287 5.770 -0.667 296 HB3 PHE 38 HB1 PHE 38 -0.647 5.874 -1.277 297 HD1 PHE 38 HD2 PHE 38 -4.160 6.759 -1.896 298 HD2 PHE 38 HD1 PHE 38 -0.141 7.021 -3.270 299 HE1 PHE 38 HE2 PHE 38 -4.804 8.572 -3.425 300 HE2 PHE 38 HE1 PHE 38 -0.767 8.853 -4.784 301 HZ PHE 38 HZ PHE 38 -3.122 9.628 -4.871 302 H VAL 39 HN VAL 39 0.183 3.097 -3.246 303 HA VAL 39 HA VAL 39 1.754 3.041 -0.785 304 HB VAL 39 HB VAL 39 2.791 0.854 -1.564 305 HG11 VAL 39 HG11 VAL 39 1.001 1.308 0.262 306 HG12 VAL 39 HG12 VAL 39 1.365 -0.349 -0.221 307 HG13 VAL 39 HG13 VAL 39 -0.074 0.458 -0.848 308 HG21 VAL 39 HG21 VAL 39 2.099 0.413 -3.707 309 HG22 VAL 39 HG22 VAL 39 0.475 1.036 -3.421 310 HG23 VAL 39 HG23 VAL 39 0.939 -0.543 -2.784 311 H ARG 40 HN ARG 40 3.405 4.310 -1.107 312 HA ARG 40 HA ARG 40 5.102 4.167 -3.422 313 HB2 ARG 40 HB2 ARG 40 4.740 6.432 -4.241 314 HB3 ARG 40 HB1 ARG 40 3.222 5.542 -4.330 315 HG2 ARG 40 HG2 ARG 40 2.233 6.774 -2.686 316 HG3 ARG 40 HG1 ARG 40 3.757 7.111 -1.868 317 HD2 ARG 40 HD2 ARG 40 4.321 8.608 -3.847 318 HD3 ARG 40 HD1 ARG 40 2.621 8.435 -4.324 319 HE ARG 40 HE ARG 40 2.518 9.185 -1.693 320 HH11 ARG 40 HH11 ARG 40 3.936 10.540 -4.605 321 HH12 ARG 40 HH12 ARG 40 3.833 12.181 -4.034 322 HH21 ARG 40 HH21 ARG 40 2.384 11.296 -0.952 323 HH22 ARG 40 HH22 ARG 40 2.974 12.619 -1.933 324 H GLY 41 HN GLY 41 6.507 6.439 -3.264 325 HA2 GLY 41 HA2 GLY 41 7.314 6.541 -0.442 326 HA3 GLY 41 HA1 GLY 41 8.316 7.010 -1.806 327 HA PRO 42 HA PRO 42 5.924 10.618 0.400 328 HB2 PRO 42 HB2 PRO 42 8.675 11.296 1.275 329 HB3 PRO 42 HB1 PRO 42 7.158 11.376 2.177 330 HG2 PRO 42 HG2 PRO 42 8.950 9.452 2.661 331 HG3 PRO 42 HG1 PRO 42 7.214 9.144 2.716 332 HD2 PRO 42 HD2 PRO 42 9.184 8.424 0.607 333 HD3 PRO 42 HD1 PRO 42 7.783 7.513 1.203 334 H GLU 43 HN GLU 43 6.484 12.944 0.151 335 HA GLU 43 HA GLU 43 6.760 13.695 -2.450 336 HB2 GLU 43 HB2 GLU 43 7.576 15.249 0.002 337 HB3 GLU 43 HB1 GLU 43 7.350 15.948 -1.592 338 HG2 GLU 43 HG2 GLU 43 5.283 14.723 0.210 339 HG3 GLU 43 HG1 GLU 43 5.387 16.388 -0.355 340 H HIS 44 HN HIS 44 8.298 13.570 -3.843 341 HA HIS 44 HA HIS 44 10.247 13.928 -4.920 342 HB2 HIS 44 HB2 HIS 44 11.561 15.604 -4.154 343 HB3 HIS 44 HB1 HIS 44 10.515 15.646 -2.740 344 HD1 HIS 44 HD1 HIS 44 13.928 14.644 -3.866 345 HD2 HIS 44 HD2 HIS 44 11.625 14.580 -0.405 346 HE1 HIS 44 HE1 HIS 44 15.531 14.138 -1.997 347 HE2 HIS 44 HE2 HIS 44 14.073 13.850 0.036 348 H SER 45 HN SER 45 10.150 11.948 -2.087 349 HA SER 45 HA SER 45 12.510 10.443 -2.848 350 HB2 SER 45 HB2 SER 45 11.545 8.853 -1.021 351 HB3 SER 45 HB1 SER 45 12.181 10.412 -0.513 352 HG SER 45 HG SER 45 9.470 10.165 -1.182 353 H ASN 46 HN ASN 46 12.442 9.085 -4.528 354 HA ASN 46 HA ASN 46 9.847 7.988 -5.334 355 HB2 ASN 46 HB2 ASN 46 12.504 8.208 -6.738 356 HB3 ASN 46 HB1 ASN 46 11.193 7.218 -7.370 357 HD21 ASN 46 HD21 ASN 46 9.116 9.033 -6.450 358 HD22 ASN 46 HD22 ASN 46 9.164 10.397 -7.515 359 H ILE 47 HN ILE 47 9.314 5.939 -5.031 360 HA ILE 47 HA ILE 47 11.249 4.275 -3.667 361 HB ILE 47 HB ILE 47 9.541 2.729 -3.127 362 HG12 ILE 47 HG12 ILE 47 7.276 4.302 -4.068 363 HG13 ILE 47 HG11 ILE 47 8.142 3.495 -5.365 364 HG21 ILE 47 HG21 ILE 47 9.867 4.589 -1.706 365 HG22 ILE 47 HG22 ILE 47 8.153 4.200 -1.750 366 HG23 ILE 47 HG23 ILE 47 8.772 5.581 -2.659 367 HD11 ILE 47 HD11 ILE 47 7.044 2.275 -2.869 368 HD12 ILE 47 HD12 ILE 47 7.792 1.401 -4.207 369 HD13 ILE 47 HD13 ILE 47 6.253 2.236 -4.443 370 H GLN 48 HN GLN 48 9.807 4.502 -6.771 371 HA GLN 48 HA GLN 48 10.069 1.858 -7.634 372 HB2 GLN 48 HB2 GLN 48 8.853 3.740 -8.776 373 HB3 GLN 48 HB1 GLN 48 10.414 4.333 -9.325 374 HG2 GLN 48 HG2 GLN 48 10.710 2.585 -10.797 375 HG3 GLN 48 HG1 GLN 48 9.603 1.528 -9.930 376 HE21 GLN 48 HE21 GLN 48 7.318 1.844 -10.195 377 HE22 GLN 48 HE22 GLN 48 6.741 2.681 -11.586 378 H HIS 49 HN HIS 49 12.482 3.980 -6.728 379 HA HIS 49 HA HIS 49 14.583 2.931 -8.388 380 HB2 HIS 49 HB2 HIS 49 14.453 4.806 -6.062 381 HB3 HIS 49 HB1 HIS 49 16.003 4.063 -6.461 382 HD1 HIS 49 HD1 HIS 49 15.881 4.212 -9.541 383 HD2 HIS 49 HD2 HIS 49 14.832 7.319 -6.987 384 HE1 HIS 49 HE1 HIS 49 16.087 6.315 -10.904 385 HE2 HIS 49 HE2 HIS 49 15.259 8.158 -9.397 386 H PHE 50 HN PHE 50 13.333 2.289 -5.127 387 HA PHE 50 HA PHE 50 15.213 0.035 -4.968 388 HB2 PHE 50 HB2 PHE 50 15.051 0.189 -2.501 389 HB3 PHE 50 HB1 PHE 50 15.765 1.614 -3.249 390 HD1 PHE 50 HD1 PHE 50 12.761 0.303 -1.552 391 HD2 PHE 50 HD2 PHE 50 14.768 3.731 -3.067 392 HE1 PHE 50 HE1 PHE 50 11.201 1.751 -0.342 393 HE2 PHE 50 HE2 PHE 50 13.187 5.183 -1.866 394 HZ PHE 50 HZ PHE 50 11.403 4.193 -0.497 395 H VAL 51 HN VAL 51 12.157 0.732 -5.602 396 HA VAL 51 HA VAL 51 11.056 -1.722 -4.412 397 HB VAL 51 HB VAL 51 9.738 0.935 -4.977 398 HG11 VAL 51 HG11 VAL 51 7.707 -0.186 -3.953 399 HG12 VAL 51 HG12 VAL 51 8.487 -1.724 -4.370 400 HG13 VAL 51 HG13 VAL 51 8.074 -0.569 -5.642 401 HG21 VAL 51 HG21 VAL 51 9.148 0.768 -2.565 402 HG22 VAL 51 HG22 VAL 51 10.880 0.895 -2.882 403 HG23 VAL 51 HG23 VAL 51 10.172 -0.667 -2.466 404 H GLU 52 HN GLU 52 9.982 -3.087 -5.761 405 HA GLU 52 HA GLU 52 10.641 -2.667 -8.594 406 HB2 GLU 52 HB2 GLU 52 11.618 -4.610 -7.399 407 HB3 GLU 52 HB1 GLU 52 9.997 -5.214 -7.096 408 HG2 GLU 52 HG2 GLU 52 9.636 -5.492 -9.481 409 HG3 GLU 52 HG1 GLU 52 11.242 -4.837 -9.811 410 H LYS 53 HN LYS 53 8.187 -4.554 -6.889 411 HA LYS 53 HA LYS 53 6.122 -3.395 -8.621 412 HB2 LYS 53 HB2 LYS 53 5.098 -5.675 -8.769 413 HB3 LYS 53 HB1 LYS 53 6.657 -5.550 -9.574 414 HG2 LYS 53 HG2 LYS 53 7.739 -6.631 -7.702 415 HG3 LYS 53 HG1 LYS 53 6.215 -6.714 -6.828 416 HD2 LYS 53 HD2 LYS 53 6.818 -8.049 -9.470 417 HD3 LYS 53 HD1 LYS 53 6.844 -8.845 -7.899 418 HE2 LYS 53 HE2 LYS 53 4.491 -8.484 -7.607 419 HE3 LYS 53 HE1 LYS 53 4.439 -7.472 -9.052 420 HZ1 LYS 53 HZ1 LYS 53 3.608 -9.635 -9.593 421 HZ2 LYS 53 HZ2 LYS 53 4.973 -10.392 -8.927 422 HZ3 LYS 53 HZ3 LYS 53 5.122 -9.463 -10.338 423 H VAL 54 HN VAL 54 3.898 -4.295 -7.667 424 HA VAL 54 HA VAL 54 3.982 -4.239 -4.754 425 HB VAL 54 HB VAL 54 2.916 -2.075 -6.497 426 HG11 VAL 54 HG11 VAL 54 1.862 -2.004 -3.780 427 HG12 VAL 54 HG12 VAL 54 1.146 -3.267 -4.779 428 HG13 VAL 54 HG13 VAL 54 1.083 -1.583 -5.304 429 HG21 VAL 54 HG21 VAL 54 3.648 -0.983 -4.173 430 HG22 VAL 54 HG22 VAL 54 4.772 -1.306 -5.481 431 HG23 VAL 54 HG23 VAL 54 4.633 -2.435 -4.133 432 H VAL 55 HN VAL 55 2.005 -4.919 -3.761 433 HA VAL 55 HA VAL 55 -0.000 -6.058 -5.538 434 HB VAL 55 HB VAL 55 2.045 -7.670 -4.406 435 HG11 VAL 55 HG11 VAL 55 -0.665 -8.209 -3.209 436 HG12 VAL 55 HG12 VAL 55 0.829 -7.838 -2.345 437 HG13 VAL 55 HG13 VAL 55 0.672 -9.362 -3.219 438 HG21 VAL 55 HG21 VAL 55 -0.519 -8.521 -5.748 439 HG22 VAL 55 HG22 VAL 55 0.997 -9.425 -5.664 440 HG23 VAL 55 HG23 VAL 55 0.916 -7.926 -6.589 441 H PHE 56 HN PHE 56 -1.977 -6.320 -4.611 442 HA PHE 56 HA PHE 56 -2.277 -5.424 -1.824 443 HB2 PHE 56 HB2 PHE 56 -3.844 -4.642 -4.281 444 HB3 PHE 56 HB1 PHE 56 -4.571 -4.559 -2.674 445 HD1 PHE 56 HD1 PHE 56 -1.732 -3.327 -4.723 446 HD2 PHE 56 HD2 PHE 56 -4.191 -2.719 -1.300 447 HE1 PHE 56 HE1 PHE 56 -0.746 -1.098 -4.422 448 HE2 PHE 56 HE2 PHE 56 -3.210 -0.482 -0.998 449 HZ PHE 56 HZ PHE 56 -1.479 0.327 -2.558 450 H HIS 57 HN HIS 57 -3.192 -6.963 -0.599 451 HA HIS 57 HA HIS 57 -4.801 -9.043 -1.933 452 HB2 HIS 57 HB2 HIS 57 -3.761 -8.920 0.923 453 HB3 HIS 57 HB1 HIS 57 -4.627 -10.271 0.202 454 HD1 HIS 57 HD1 HIS 57 -3.199 -12.075 -0.699 455 HD2 HIS 57 HD2 HIS 57 -1.132 -8.472 -0.433 456 HE1 HIS 57 HE1 HIS 57 -0.802 -12.626 -1.230 457 HE2 HIS 57 HE2 HIS 57 0.459 -10.483 -0.796 458 H LEU 58 HN LEU 58 -6.642 -7.673 -2.259 459 HA LEU 58 HA LEU 58 -7.933 -6.328 -0.125 460 HB2 LEU 58 HB2 LEU 58 -9.477 -7.433 -2.452 461 HB3 LEU 58 HB1 LEU 58 -9.758 -5.952 -1.556 462 HG LEU 58 HG LEU 58 -7.506 -6.379 -3.513 463 HD11 LEU 58 HD11 LEU 58 -8.745 -5.163 -5.021 464 HD12 LEU 58 HD12 LEU 58 -9.953 -4.706 -3.836 465 HD13 LEU 58 HD13 LEU 58 -9.847 -6.375 -4.401 466 HD21 LEU 58 HD21 LEU 58 -7.341 -4.654 -1.535 467 HD22 LEU 58 HD22 LEU 58 -8.448 -3.730 -2.545 468 HD23 LEU 58 HD23 LEU 58 -6.871 -4.206 -3.172 469 H HIS 59 HN HIS 59 -10.459 -7.085 0.140 470 HA HIS 59 HA HIS 59 -10.229 -9.482 1.732 471 HB2 HIS 59 HB2 HIS 59 -11.614 -7.331 2.211 472 HB3 HIS 59 HB1 HIS 59 -12.802 -8.040 1.125 473 HD1 HIS 59 HD1 HIS 59 -10.858 -10.151 3.568 474 HD2 HIS 59 HD2 HIS 59 -14.658 -8.519 3.119 475 HE1 HIS 59 HE1 HIS 59 -12.249 -11.156 5.399 476 HE2 HIS 59 HE2 HIS 59 -14.586 -10.313 4.984 477 H GLU 60 HN GLU 60 -11.302 -11.408 1.408 478 HA GLU 60 HA GLU 60 -11.241 -12.416 -1.187 479 HB2 GLU 60 HB2 GLU 60 -12.825 -13.578 1.096 480 HB3 GLU 60 HB1 GLU 60 -12.129 -14.452 -0.260 481 HG2 GLU 60 HG2 GLU 60 -10.650 -14.967 1.402 482 HG3 GLU 60 HG1 GLU 60 -9.869 -13.539 0.731 483 H SER 61 HN SER 61 -13.797 -10.859 0.510 484 HA SER 61 HA SER 61 -16.012 -11.664 -1.000 485 HB2 SER 61 HB2 SER 61 -16.114 -10.385 1.125 486 HB3 SER 61 HB1 SER 61 -15.480 -8.970 0.286 487 HG SER 61 HG SER 61 -17.694 -10.106 -0.903 488 H PHE 62 HN PHE 62 -13.316 -9.727 -1.821 489 HA PHE 62 HA PHE 62 -14.637 -8.431 -4.070 490 HB2 PHE 62 HB2 PHE 62 -11.797 -8.313 -3.021 491 HB3 PHE 62 HB1 PHE 62 -12.365 -7.429 -4.427 492 HD1 PHE 62 HD1 PHE 62 -13.446 -7.943 -0.883 493 HD2 PHE 62 HD2 PHE 62 -12.814 -5.221 -4.082 494 HE1 PHE 62 HE1 PHE 62 -14.145 -6.082 0.567 495 HE2 PHE 62 HE2 PHE 62 -13.517 -3.354 -2.642 496 HZ PHE 62 HZ PHE 62 -14.182 -3.784 -0.314 497 HA PRO 63 HA PRO 63 -13.517 -11.765 -6.813 498 HB2 PRO 63 HB2 PRO 63 -13.788 -9.764 -8.961 499 HB3 PRO 63 HB1 PRO 63 -14.702 -11.251 -8.692 500 HG2 PRO 63 HG2 PRO 63 -15.798 -8.831 -8.301 501 HG3 PRO 63 HG1 PRO 63 -16.214 -10.222 -7.282 502 HD2 PRO 63 HD2 PRO 63 -14.366 -7.936 -6.706 503 HD3 PRO 63 HD1 PRO 63 -15.544 -8.729 -5.638 504 H ARG 64 HN ARG 64 -11.470 -12.407 -7.083 505 HA ARG 64 HA ARG 64 -9.205 -12.373 -7.318 506 HB2 ARG 64 HB2 ARG 64 -9.934 -10.350 -9.444 507 HB3 ARG 64 HB1 ARG 64 -8.328 -11.040 -9.250 508 HG2 ARG 64 HG2 ARG 64 -9.170 -13.245 -9.734 509 HG3 ARG 64 HG1 ARG 64 -10.820 -12.632 -9.814 510 HD2 ARG 64 HD2 ARG 64 -9.979 -12.909 -12.036 511 HD3 ARG 64 HD1 ARG 64 -10.158 -11.190 -11.698 512 HE ARG 64 HE ARG 64 -7.537 -11.836 -11.073 513 HH11 ARG 64 HH11 ARG 64 -9.602 -11.801 -13.898 514 HH12 ARG 64 HH12 ARG 64 -8.286 -11.602 -15.017 515 HH21 ARG 64 HH21 ARG 64 -5.811 -11.564 -12.519 516 HH22 ARG 64 HH22 ARG 64 -6.116 -11.460 -14.234 517 HA PRO 65 HA PRO 65 -9.217 -8.533 -4.745 518 HB2 PRO 65 HB2 PRO 65 -8.169 -9.596 -2.480 519 HB3 PRO 65 HB1 PRO 65 -9.890 -9.667 -2.877 520 HG2 PRO 65 HG2 PRO 65 -7.781 -11.761 -3.181 521 HG3 PRO 65 HG1 PRO 65 -9.462 -11.927 -2.641 522 HD2 PRO 65 HD2 PRO 65 -8.630 -12.547 -5.161 523 HD3 PRO 65 HD1 PRO 65 -10.270 -11.995 -4.780 524 H LYS 66 HN LYS 66 -6.629 -10.747 -5.426 525 HA LYS 66 HA LYS 66 -4.602 -8.986 -4.492 526 HB2 LYS 66 HB2 LYS 66 -4.160 -11.383 -4.393 527 HB3 LYS 66 HB1 LYS 66 -4.416 -11.468 -6.119 528 HG2 LYS 66 HG2 LYS 66 -2.458 -10.167 -6.539 529 HG3 LYS 66 HG1 LYS 66 -2.207 -9.900 -4.838 530 HD2 LYS 66 HD2 LYS 66 -1.432 -11.947 -4.501 531 HD3 LYS 66 HD1 LYS 66 -2.391 -12.692 -5.769 532 HE2 LYS 66 HE2 LYS 66 -0.894 -11.721 -7.438 533 HE3 LYS 66 HE1 LYS 66 0.046 -10.953 -6.157 534 HZ1 LYS 66 HZ1 LYS 66 1.047 -13.027 -6.966 535 HZ2 LYS 66 HZ2 LYS 66 -0.322 -13.886 -6.454 536 HZ3 LYS 66 HZ3 LYS 66 0.661 -13.102 -5.317 537 H ARG 67 HN ARG 67 -4.383 -7.153 -5.449 538 HA ARG 67 HA ARG 67 -4.377 -7.076 -8.388 539 HB2 ARG 67 HB2 ARG 67 -4.466 -4.677 -6.549 540 HB3 ARG 67 HB1 ARG 67 -4.900 -4.761 -8.253 541 HG2 ARG 67 HG2 ARG 67 -6.416 -5.930 -5.938 542 HG3 ARG 67 HG1 ARG 67 -6.899 -4.578 -6.961 543 HD2 ARG 67 HD2 ARG 67 -6.946 -6.122 -8.903 544 HD3 ARG 67 HD1 ARG 67 -6.575 -7.461 -7.805 545 HE ARG 67 HE ARG 67 -8.745 -7.498 -7.159 546 HH11 ARG 67 HH11 ARG 67 -8.189 -4.409 -8.760 547 HH12 ARG 67 HH12 ARG 67 -9.880 -3.992 -8.777 548 HH21 ARG 67 HH21 ARG 67 -10.942 -6.946 -7.222 549 HH22 ARG 67 HH22 ARG 67 -11.441 -5.435 -7.917 550 H VAL 68 HN VAL 68 -2.537 -6.453 -9.449 551 HA VAL 68 HA VAL 68 -0.218 -5.969 -7.706 552 HB VAL 68 HB VAL 68 1.153 -7.269 -9.008 553 HG11 VAL 68 HG11 VAL 68 -0.474 -8.738 -7.962 554 HG12 VAL 68 HG12 VAL 68 0.015 -9.383 -9.532 555 HG13 VAL 68 HG13 VAL 68 -1.542 -8.574 -9.361 556 HG21 VAL 68 HG21 VAL 68 0.836 -6.204 -11.109 557 HG22 VAL 68 HG22 VAL 68 -0.772 -6.907 -11.293 558 HG23 VAL 68 HG23 VAL 68 0.657 -7.943 -11.345 559 H CYS 69 HN CYS 69 1.207 -4.353 -8.226 560 HA CYS 69 HA CYS 69 0.512 -2.688 -10.547 561 HB2 CYS 69 HB2 CYS 69 1.229 -1.701 -7.773 562 HB3 CYS 69 HB1 CYS 69 0.919 -0.685 -9.177 563 HG CYS 69 HG CYS 69 -1.708 -2.460 -9.039 564 H LYS 70 HN LYS 70 2.169 -2.872 -11.882 565 HA LYS 70 HA LYS 70 4.900 -3.092 -10.770 566 HB2 LYS 70 HB2 LYS 70 4.260 -3.630 -13.654 567 HB3 LYS 70 HB1 LYS 70 5.462 -4.436 -12.664 568 HG2 LYS 70 HG2 LYS 70 3.162 -5.240 -11.457 569 HG3 LYS 70 HG1 LYS 70 2.631 -5.086 -13.136 570 HD2 LYS 70 HD2 LYS 70 4.612 -6.436 -13.804 571 HD3 LYS 70 HD1 LYS 70 4.908 -6.698 -12.088 572 HE2 LYS 70 HE2 LYS 70 2.812 -7.829 -11.825 573 HE3 LYS 70 HE1 LYS 70 2.334 -7.411 -13.470 574 HZ1 LYS 70 HZ1 LYS 70 4.079 -8.816 -14.328 575 HZ2 LYS 70 HZ2 LYS 70 3.093 -9.715 -13.280 576 HZ3 LYS 70 HZ3 LYS 70 4.615 -9.180 -12.760 577 H ASP 71 HN ASP 71 3.035 -0.817 -11.531 578 HA ASP 71 HA ASP 71 4.601 0.572 -13.584 579 HB2 ASP 71 HB2 ASP 71 1.743 0.783 -12.650 580 HB3 ASP 71 HB1 ASP 71 2.468 2.045 -13.632 581 HA PRO 72 HA PRO 72 5.517 4.253 -10.895 582 HB2 PRO 72 HB2 PRO 72 3.380 5.566 -12.554 583 HB3 PRO 72 HB1 PRO 72 4.930 6.224 -12.033 584 HG2 PRO 72 HG2 PRO 72 4.658 5.342 -14.501 585 HG3 PRO 72 HG1 PRO 72 6.126 4.977 -13.579 586 HD2 PRO 72 HD2 PRO 72 3.862 3.206 -14.304 587 HD3 PRO 72 HD1 PRO 72 5.577 2.808 -14.097 588 HA PRO 73 HA PRO 73 3.034 5.441 -7.484 589 HB2 PRO 73 HB2 PRO 73 0.791 6.542 -9.132 590 HB3 PRO 73 HB1 PRO 73 1.386 7.086 -7.556 591 HG2 PRO 73 HG2 PRO 73 2.164 8.182 -9.962 592 HG3 PRO 73 HG1 PRO 73 3.133 8.242 -8.484 593 HD2 PRO 73 HD2 PRO 73 3.750 6.891 -10.911 594 HD3 PRO 73 HD1 PRO 73 4.672 6.861 -9.398 595 H TYR 74 HN TYR 74 2.415 3.662 -6.556 596 HA TYR 74 HA TYR 74 0.818 1.703 -7.938 597 HB2 TYR 74 HB2 TYR 74 1.983 1.554 -5.158 598 HB3 TYR 74 HB1 TYR 74 1.515 0.207 -6.184 599 HD1 TYR 74 HD2 TYR 74 4.009 2.940 -5.805 600 HD2 TYR 74 HD1 TYR 74 3.050 -0.728 -7.724 601 HE1 TYR 74 HE2 TYR 74 6.317 2.785 -6.641 602 HE2 TYR 74 HE1 TYR 74 5.349 -0.890 -8.581 603 HH TYR 74 HH TYR 74 7.277 0.240 -8.892 604 H LYS 75 HN LYS 75 -1.265 1.243 -7.562 605 HA LYS 75 HA LYS 75 -2.647 2.065 -5.154 606 HB2 LYS 75 HB2 LYS 75 -4.307 3.451 -6.510 607 HB3 LYS 75 HB1 LYS 75 -2.755 4.196 -6.163 608 HG2 LYS 75 HG2 LYS 75 -2.063 4.102 -8.338 609 HG3 LYS 75 HG1 LYS 75 -3.090 2.730 -8.736 610 HD2 LYS 75 HD2 LYS 75 -3.925 4.712 -9.828 611 HD3 LYS 75 HD1 LYS 75 -5.071 4.233 -8.573 612 HE2 LYS 75 HE2 LYS 75 -4.414 5.969 -7.151 613 HE3 LYS 75 HE1 LYS 75 -2.926 6.252 -8.042 614 HZ1 LYS 75 HZ1 LYS 75 -5.679 6.871 -8.964 615 HZ2 LYS 75 HZ2 LYS 75 -4.288 7.033 -9.918 616 HZ3 LYS 75 HZ3 LYS 75 -4.476 7.986 -8.530 617 H VAL 76 HN VAL 76 -4.671 1.234 -4.960 618 HA VAL 76 HA VAL 76 -5.720 -0.367 -7.203 619 HB VAL 76 HB VAL 76 -5.695 -1.076 -4.290 620 HG11 VAL 76 HG11 VAL 76 -8.041 -1.074 -5.227 621 HG12 VAL 76 HG12 VAL 76 -7.475 -2.604 -4.554 622 HG13 VAL 76 HG13 VAL 76 -7.517 -2.370 -6.303 623 HG21 VAL 76 HG21 VAL 76 -3.954 -2.069 -5.574 624 HG22 VAL 76 HG22 VAL 76 -5.069 -2.519 -6.854 625 HG23 VAL 76 HG23 VAL 76 -5.156 -3.317 -5.283 626 H GLU 77 HN GLU 77 -7.658 0.233 -7.899 627 HA GLU 77 HA GLU 77 -9.321 1.856 -6.095 628 HB2 GLU 77 HB2 GLU 77 -9.098 1.926 -9.090 629 HB3 GLU 77 HB1 GLU 77 -10.424 2.658 -8.224 630 HG2 GLU 77 HG2 GLU 77 -8.914 4.090 -7.025 631 HG3 GLU 77 HG1 GLU 77 -7.566 3.332 -7.847 632 H GLU 78 HN GLU 78 -11.059 1.005 -5.415 633 HA GLU 78 HA GLU 78 -12.376 -1.111 -6.961 634 HB2 GLU 78 HB2 GLU 78 -10.971 -1.456 -4.401 635 HB3 GLU 78 HB1 GLU 78 -12.610 -2.093 -4.404 636 HG2 GLU 78 HG2 GLU 78 -10.316 -2.871 -6.185 637 HG3 GLU 78 HG1 GLU 78 -11.176 -3.852 -5.001 638 H SER 79 HN SER 79 -14.335 -1.882 -5.488 639 HA SER 79 HA SER 79 -15.659 0.370 -4.238 640 HB2 SER 79 HB2 SER 79 -16.027 0.600 -6.722 641 HB3 SER 79 HB1 SER 79 -16.890 -0.943 -6.675 642 HG SER 79 HG SER 79 -17.687 1.565 -5.891 643 H GLY 80 HN GLY 80 -17.205 -0.271 -2.808 644 HA2 GLY 80 HA2 GLY 80 -18.251 -2.934 -2.681 645 HA3 GLY 80 HA1 GLY 80 -16.937 -2.681 -1.537 646 H TYR 81 HN TYR 81 -18.382 -2.878 0.282 647 HA TYR 81 HA TYR 81 -19.747 -0.352 0.796 648 HB2 TYR 81 HB2 TYR 81 -21.807 -1.542 1.624 649 HB3 TYR 81 HB1 TYR 81 -21.566 -1.593 -0.116 650 HD1 TYR 81 HD2 TYR 81 -21.480 -3.593 2.973 651 HD2 TYR 81 HD1 TYR 81 -21.135 -3.650 -1.264 652 HE1 TYR 81 HE2 TYR 81 -21.643 -6.045 2.997 653 HE2 TYR 81 HE1 TYR 81 -21.301 -6.101 -1.247 654 HH TYR 81 HH TYR 81 -20.958 -7.956 0.220 655 H ALA 82 HN ALA 82 -17.411 -2.021 1.864 656 HA ALA 82 HA ALA 82 -17.896 -1.404 4.628 657 HB1 ALA 82 HB1 ALA 82 -18.956 -3.572 4.554 658 HB2 ALA 82 HB2 ALA 82 -17.451 -3.684 5.463 659 HB3 ALA 82 HB3 ALA 82 -17.526 -4.281 3.806 660 H GLY 83 HN GLY 83 -15.970 -1.767 5.985 661 HA2 GLY 83 HA2 GLY 83 -13.517 -1.494 4.376 662 HA3 GLY 83 HA1 GLY 83 -13.748 -0.842 5.991 663 H PHE 84 HN PHE 84 -11.493 -2.091 5.810 664 HA PHE 84 HA PHE 84 -11.502 -4.300 7.514 665 HB2 PHE 84 HB2 PHE 84 -10.919 -6.135 5.919 666 HB3 PHE 84 HB1 PHE 84 -12.571 -5.563 5.731 667 HD1 PHE 84 HD1 PHE 84 -13.109 -4.020 3.822 668 HD2 PHE 84 HD2 PHE 84 -9.406 -6.091 4.110 669 HE1 PHE 84 HE1 PHE 84 -12.728 -3.639 1.429 670 HE2 PHE 84 HE2 PHE 84 -9.000 -5.713 1.719 671 HZ PHE 84 HZ PHE 84 -10.661 -4.483 0.364 672 H ILE 85 HN ILE 85 -9.343 -5.043 7.982 673 HA ILE 85 HA ILE 85 -7.172 -3.382 7.259 674 HB ILE 85 HB ILE 85 -7.305 -6.143 8.460 675 HG12 ILE 85 HG12 ILE 85 -7.849 -4.188 9.882 676 HG13 ILE 85 HG11 ILE 85 -6.424 -5.061 10.435 677 HG21 ILE 85 HG21 ILE 85 -4.768 -4.631 7.852 678 HG22 ILE 85 HG22 ILE 85 -5.309 -6.108 7.054 679 HG23 ILE 85 HG23 ILE 85 -4.890 -6.135 8.768 680 HD11 ILE 85 HD11 ILE 85 -6.314 -2.565 8.778 681 HD12 ILE 85 HD12 ILE 85 -4.973 -3.385 9.572 682 HD13 ILE 85 HD13 ILE 85 -6.219 -2.593 10.537 683 H LEU 86 HN LEU 86 -5.980 -3.327 5.458 684 HA LEU 86 HA LEU 86 -6.258 -5.588 3.586 685 HB2 LEU 86 HB2 LEU 86 -7.078 -3.118 3.058 686 HB3 LEU 86 HB1 LEU 86 -5.376 -2.892 2.683 687 HG LEU 86 HG LEU 86 -6.717 -5.231 1.440 688 HD11 LEU 86 HD11 LEU 86 -7.073 -2.468 0.312 689 HD12 LEU 86 HD12 LEU 86 -8.317 -3.294 1.251 690 HD13 LEU 86 HD13 LEU 86 -7.758 -3.986 -0.271 691 HD21 LEU 86 HD21 LEU 86 -5.180 -3.384 -0.152 692 HD22 LEU 86 HD22 LEU 86 -5.006 -5.127 0.027 693 HD23 LEU 86 HD23 LEU 86 -4.277 -4.037 1.210 694 HA PRO 87 HA PRO 87 -1.890 -5.956 4.583 695 HB2 PRO 87 HB2 PRO 87 -2.076 -8.457 3.080 696 HB3 PRO 87 HB1 PRO 87 -1.700 -8.212 4.786 697 HG2 PRO 87 HG2 PRO 87 -4.022 -9.328 3.944 698 HG3 PRO 87 HG1 PRO 87 -3.897 -8.370 5.431 699 HD2 PRO 87 HD2 PRO 87 -4.940 -7.569 2.740 700 HD3 PRO 87 HD1 PRO 87 -5.570 -7.180 4.355 701 H ILE 88 HN ILE 88 -0.943 -4.474 3.266 702 HA ILE 88 HA ILE 88 -0.982 -4.894 0.380 703 HB ILE 88 HB ILE 88 0.077 -2.477 1.866 704 HG12 ILE 88 HG12 ILE 88 -2.618 -2.644 0.517 705 HG13 ILE 88 HG11 ILE 88 -2.434 -3.115 2.206 706 HG21 ILE 88 HG21 ILE 88 0.857 -2.804 -0.436 707 HG22 ILE 88 HG22 ILE 88 -0.177 -1.384 -0.285 708 HG23 ILE 88 HG23 ILE 88 -0.816 -2.869 -0.990 709 HD11 ILE 88 HD11 ILE 88 -1.651 -0.426 1.127 710 HD12 ILE 88 HD12 ILE 88 -1.747 -0.921 2.812 711 HD13 ILE 88 HD13 ILE 88 -3.216 -0.786 1.844 712 H GLU 89 HN GLU 89 0.883 -5.134 -0.821 713 HA GLU 89 HA GLU 89 3.358 -5.428 0.737 714 HB2 GLU 89 HB2 GLU 89 2.346 -7.114 -1.533 715 HB3 GLU 89 HB1 GLU 89 4.031 -7.114 -1.028 716 HG2 GLU 89 HG2 GLU 89 3.262 -7.780 1.251 717 HG3 GLU 89 HG1 GLU 89 1.640 -7.962 0.588 718 H VAL 90 HN VAL 90 5.027 -4.325 0.119 719 HA VAL 90 HA VAL 90 5.033 -3.133 -2.572 720 HB VAL 90 HB VAL 90 6.585 -2.012 -0.243 721 HG11 VAL 90 HG11 VAL 90 7.404 -0.756 -1.917 722 HG12 VAL 90 HG12 VAL 90 5.831 0.039 -1.910 723 HG13 VAL 90 HG13 VAL 90 6.142 -1.287 -3.029 724 HG21 VAL 90 HG21 VAL 90 3.969 -2.197 -0.011 725 HG22 VAL 90 HG22 VAL 90 4.006 -0.782 -1.064 726 HG23 VAL 90 HG23 VAL 90 4.831 -0.745 0.495 727 H TYR 91 HN TYR 91 6.342 -4.338 -3.800 728 HA TYR 91 HA TYR 91 8.317 -6.083 -2.637 729 HB2 TYR 91 HB2 TYR 91 7.347 -5.537 -5.406 730 HB3 TYR 91 HB1 TYR 91 8.898 -6.337 -5.203 731 HD1 TYR 91 HD1 TYR 91 5.674 -6.702 -3.342 732 HD2 TYR 91 HD2 TYR 91 8.629 -8.540 -5.777 733 HE1 TYR 91 HE1 TYR 91 4.546 -8.865 -3.075 734 HE2 TYR 91 HE2 TYR 91 7.496 -10.709 -5.534 735 HH TYR 91 HH TYR 91 4.363 -10.991 -4.076 736 H PHE 92 HN PHE 92 10.483 -5.938 -2.700 737 HA PHE 92 HA PHE 92 11.548 -3.254 -3.307 738 HB2 PHE 92 HB2 PHE 92 12.411 -5.446 -1.401 739 HB3 PHE 92 HB1 PHE 92 13.396 -4.015 -1.727 740 HD1 PHE 92 HD1 PHE 92 11.042 -2.064 -1.906 741 HD2 PHE 92 HD2 PHE 92 12.053 -5.094 0.907 742 HE1 PHE 92 HE1 PHE 92 9.892 -0.805 -0.143 743 HE2 PHE 92 HE2 PHE 92 10.865 -3.841 2.671 744 HZ PHE 92 HZ PHE 92 9.801 -1.694 2.139 745 H LYS 93 HN LYS 93 13.832 -3.220 -4.136 746 HA LYS 93 HA LYS 93 14.397 -5.548 -5.849 747 HB2 LYS 93 HB2 LYS 93 15.582 -2.764 -6.031 748 HB3 LYS 93 HB1 LYS 93 15.800 -4.074 -7.186 749 HG2 LYS 93 HG2 LYS 93 13.479 -3.949 -7.824 750 HG3 LYS 93 HG1 LYS 93 13.179 -2.723 -6.586 751 HD2 LYS 93 HD2 LYS 93 14.721 -1.196 -7.721 752 HD3 LYS 93 HD1 LYS 93 15.078 -2.431 -8.927 753 HE2 LYS 93 HE2 LYS 93 12.483 -2.370 -9.316 754 HE3 LYS 93 HE1 LYS 93 12.608 -0.776 -8.565 755 HZ1 LYS 93 HZ1 LYS 93 12.768 -0.723 -10.998 756 HZ2 LYS 93 HZ2 LYS 93 14.189 -1.639 -10.919 757 HZ3 LYS 93 HZ3 LYS 93 14.146 -0.087 -10.240 758 H ASN 94 HN ASN 94 15.511 -6.864 -4.420 759 HA ASN 94 HA ASN 94 18.104 -5.967 -3.536 760 HB2 ASN 94 HB2 ASN 94 16.422 -5.228 -1.795 761 HB3 ASN 94 HB1 ASN 94 16.148 -6.931 -1.505 762 HD21 ASN 94 HD21 ASN 94 16.845 -6.736 0.633 763 HD22 ASN 94 HD22 ASN 94 18.522 -6.562 1.016 764 H LYS 95 HN LYS 95 19.469 -7.728 -2.880 765 HA LYS 95 HA LYS 95 18.306 -10.398 -3.396 766 HB2 LYS 95 HB2 LYS 95 20.178 -9.479 -4.934 767 HB3 LYS 95 HB1 LYS 95 21.232 -9.681 -3.548 768 HG2 LYS 95 HG2 LYS 95 20.235 -12.134 -3.622 769 HG3 LYS 95 HG1 LYS 95 20.016 -11.715 -5.325 770 HD2 LYS 95 HD2 LYS 95 22.594 -11.684 -3.762 771 HD3 LYS 95 HD1 LYS 95 22.154 -12.773 -5.078 772 HE2 LYS 95 HE2 LYS 95 22.552 -9.788 -5.302 773 HE3 LYS 95 HE1 LYS 95 23.686 -11.026 -5.838 774 HZ1 LYS 95 HZ1 LYS 95 22.441 -10.238 -7.707 775 HZ2 LYS 95 HZ2 LYS 95 20.966 -10.517 -6.922 776 HZ3 LYS 95 HZ3 LYS 95 21.945 -11.825 -7.377 777 H GLU 96 HN GLU 96 19.147 -8.363 -1.112 778 HA GLU 96 HA GLU 96 20.404 -10.253 0.721 779 HB2 GLU 96 HB2 GLU 96 20.007 -7.249 0.733 780 HB3 GLU 96 HB1 GLU 96 20.529 -8.109 2.171 781 HG2 GLU 96 HG2 GLU 96 22.325 -6.997 0.820 782 HG3 GLU 96 HG1 GLU 96 22.600 -8.694 1.188 783 H GLU 97 HN GLU 97 19.323 -8.809 3.038 784 HA GLU 97 HA GLU 97 17.243 -10.137 3.989 785 HB2 GLU 97 HB2 GLU 97 17.631 -7.153 4.158 786 HB3 GLU 97 HB1 GLU 97 16.497 -8.055 5.159 787 HG2 GLU 97 HG2 GLU 97 19.480 -8.485 5.072 788 HG3 GLU 97 HG1 GLU 97 18.613 -7.578 6.310 789 HA PRO 98 HA PRO 98 13.368 -10.374 2.379 790 HB2 PRO 98 HB2 PRO 98 11.921 -8.221 3.622 791 HB3 PRO 98 HB1 PRO 98 11.865 -9.943 4.008 792 HG2 PRO 98 HG2 PRO 98 13.483 -7.781 5.224 793 HG3 PRO 98 HG1 PRO 98 12.869 -9.277 5.957 794 HD2 PRO 98 HD2 PRO 98 15.454 -9.044 5.399 795 HD3 PRO 98 HD1 PRO 98 14.607 -10.568 5.031 796 H ARG 99 HN ARG 99 12.872 -9.950 0.385 797 HA ARG 99 HA ARG 99 13.398 -7.307 -0.729 798 HB2 ARG 99 HB2 ARG 99 12.584 -9.865 -2.136 799 HB3 ARG 99 HB1 ARG 99 13.092 -8.384 -2.901 800 HG2 ARG 99 HG2 ARG 99 15.071 -9.429 -3.006 801 HG3 ARG 99 HG1 ARG 99 15.222 -8.780 -1.370 802 HD2 ARG 99 HD2 ARG 99 14.475 -10.842 -0.449 803 HD3 ARG 99 HD1 ARG 99 14.171 -11.518 -2.035 804 HE ARG 99 HE ARG 99 16.893 -10.711 -1.562 805 HH11 ARG 99 HH11 ARG 99 14.535 -13.283 -1.349 806 HH12 ARG 99 HH12 ARG 99 15.728 -14.543 -1.187 807 HH21 ARG 99 HH21 ARG 99 18.484 -12.377 -1.345 808 HH22 ARG 99 HH22 ARG 99 17.962 -14.025 -1.194 809 H LYS 100 HN LYS 100 11.112 -8.043 1.035 810 HA LYS 100 HA LYS 100 9.078 -6.646 -0.481 811 HB2 LYS 100 HB2 LYS 100 7.308 -8.291 0.043 812 HB3 LYS 100 HB1 LYS 100 8.526 -8.944 -1.042 813 HG2 LYS 100 HG2 LYS 100 9.372 -10.379 0.547 814 HG3 LYS 100 HG1 LYS 100 8.800 -9.391 1.891 815 HD2 LYS 100 HD2 LYS 100 7.436 -11.312 1.895 816 HD3 LYS 100 HD1 LYS 100 6.451 -10.037 1.181 817 HE2 LYS 100 HE2 LYS 100 8.024 -11.945 -0.521 818 HE3 LYS 100 HE1 LYS 100 6.424 -12.357 0.091 819 HZ1 LYS 100 HZ1 LYS 100 5.635 -10.245 -0.956 820 HZ2 LYS 100 HZ2 LYS 100 6.132 -11.450 -2.041 821 HZ3 LYS 100 HZ3 LYS 100 7.149 -10.134 -1.724 822 H VAL 101 HN VAL 101 7.588 -5.602 0.833 823 HA VAL 101 HA VAL 101 7.827 -6.084 3.718 824 HB VAL 101 HB VAL 101 8.949 -3.975 3.050 825 HG11 VAL 101 HG11 VAL 101 7.788 -3.170 1.200 826 HG12 VAL 101 HG12 VAL 101 7.360 -2.046 2.497 827 HG13 VAL 101 HG13 VAL 101 6.223 -3.304 2.013 828 HG21 VAL 101 HG21 VAL 101 7.957 -2.593 4.770 829 HG22 VAL 101 HG22 VAL 101 7.992 -4.280 5.289 830 HG23 VAL 101 HG23 VAL 101 6.483 -3.563 4.726 831 H ARG 102 HN ARG 102 5.896 -6.033 4.876 832 HA ARG 102 HA ARG 102 3.477 -5.956 3.198 833 HB2 ARG 102 HB2 ARG 102 4.264 -8.195 4.272 834 HB3 ARG 102 HB1 ARG 102 3.662 -7.498 5.771 835 HG2 ARG 102 HG2 ARG 102 1.501 -7.075 4.377 836 HG3 ARG 102 HG1 ARG 102 2.152 -8.330 3.335 837 HD2 ARG 102 HD2 ARG 102 0.679 -9.351 4.900 838 HD3 ARG 102 HD1 ARG 102 2.323 -9.778 5.341 839 HE ARG 102 HE ARG 102 0.778 -7.671 6.719 840 HH11 ARG 102 HH11 ARG 102 3.034 -10.360 6.769 841 HH12 ARG 102 HH12 ARG 102 3.175 -10.363 8.505 842 HH21 ARG 102 HH21 ARG 102 1.008 -7.628 8.974 843 HH22 ARG 102 HH22 ARG 102 2.035 -8.800 9.762 844 H PHE 103 HN PHE 103 2.402 -4.127 3.596 845 HA PHE 103 HA PHE 103 2.408 -3.058 6.332 846 HB2 PHE 103 HB2 PHE 103 1.650 -1.763 3.706 847 HB3 PHE 103 HB1 PHE 103 1.546 -0.978 5.277 848 HD1 PHE 103 HD1 PHE 103 4.068 -1.915 6.519 849 HD2 PHE 103 HD2 PHE 103 3.246 -0.531 2.582 850 HE1 PHE 103 HE1 PHE 103 6.394 -1.142 6.310 851 HE2 PHE 103 HE2 PHE 103 5.568 0.234 2.363 852 HZ PHE 103 HZ PHE 103 7.146 -0.068 4.227 853 H ASP 104 HN ASP 104 0.701 -3.482 7.546 854 HA ASP 104 HA ASP 104 -1.762 -4.413 6.295 855 HB2 ASP 104 HB2 ASP 104 -1.168 -4.147 9.249 856 HB3 ASP 104 HB1 ASP 104 -2.458 -5.082 8.501 857 H TYR 105 HN TYR 105 -2.539 -2.515 5.374 858 HA TYR 105 HA TYR 105 -2.784 -0.149 7.063 859 HB2 TYR 105 HB2 TYR 105 -1.913 0.147 4.798 860 HB3 TYR 105 HB1 TYR 105 -3.363 -0.596 4.121 861 HD1 TYR 105 HD1 TYR 105 -2.429 2.263 6.366 862 HD2 TYR 105 HD2 TYR 105 -4.977 0.783 3.310 863 HE1 TYR 105 HE1 TYR 105 -3.500 4.475 6.189 864 HE2 TYR 105 HE2 TYR 105 -6.050 2.973 3.120 865 HH TYR 105 HH TYR 105 -4.735 5.773 4.449 866 H ASP 106 HN ASP 106 -4.668 0.628 7.858 867 HA ASP 106 HA ASP 106 -6.920 -1.178 7.795 868 HB2 ASP 106 HB2 ASP 106 -6.186 -0.071 9.903 869 HB3 ASP 106 HB1 ASP 106 -6.671 1.479 9.220 870 H LEU 107 HN LEU 107 -8.219 -1.101 6.085 871 HA LEU 107 HA LEU 107 -8.661 1.344 4.632 872 HB2 LEU 107 HB2 LEU 107 -9.030 -1.465 4.190 873 HB3 LEU 107 HB1 LEU 107 -10.521 -0.612 3.835 874 HG LEU 107 HG LEU 107 -9.167 0.896 2.325 875 HD11 LEU 107 HD11 LEU 107 -7.035 -0.049 1.522 876 HD12 LEU 107 HD12 LEU 107 -7.081 -1.202 2.858 877 HD13 LEU 107 HD13 LEU 107 -6.966 0.529 3.188 878 HD21 LEU 107 HD21 LEU 107 -8.967 -0.876 0.561 879 HD22 LEU 107 HD22 LEU 107 -10.541 -0.752 1.352 880 HD23 LEU 107 HD23 LEU 107 -9.426 -2.045 1.800 881 H PHE 108 HN PHE 108 -9.741 2.708 6.108 882 HA PHE 108 HA PHE 108 -12.360 1.762 7.019 883 HB2 PHE 108 HB2 PHE 108 -12.463 3.710 8.480 884 HB3 PHE 108 HB1 PHE 108 -10.976 2.821 8.765 885 HD1 PHE 108 HD2 PHE 108 -12.431 5.877 7.322 886 HD2 PHE 108 HD1 PHE 108 -8.842 3.849 8.387 887 HE1 PHE 108 HE2 PHE 108 -11.171 7.969 7.049 888 HE2 PHE 108 HE1 PHE 108 -7.581 5.944 8.126 889 HZ PHE 108 HZ PHE 108 -8.744 8.005 7.450 890 H LEU 109 HN LEU 109 -14.222 2.515 6.232 891 HA LEU 109 HA LEU 109 -14.081 4.697 4.244 892 HB2 LEU 109 HB2 LEU 109 -16.270 2.624 4.516 893 HB3 LEU 109 HB1 LEU 109 -16.027 3.753 3.196 894 HG LEU 109 HG LEU 109 -14.326 1.348 3.855 895 HD11 LEU 109 HD11 LEU 109 -16.532 1.026 2.670 896 HD12 LEU 109 HD12 LEU 109 -15.107 0.428 1.827 897 HD13 LEU 109 HD13 LEU 109 -15.848 1.951 1.336 898 HD21 LEU 109 HD21 LEU 109 -13.930 3.449 1.728 899 HD22 LEU 109 HD22 LEU 109 -13.037 1.930 1.845 900 HD23 LEU 109 HD23 LEU 109 -12.880 3.145 3.114 901 H HIS 110 HN HIS 110 -15.569 6.430 4.530 902 HA HIS 110 HA HIS 110 -16.629 6.608 7.224 903 HB2 HIS 110 HB2 HIS 110 -16.012 8.566 5.094 904 HB3 HIS 110 HB1 HIS 110 -17.354 8.971 6.158 905 HD1 HIS 110 HD1 HIS 110 -16.578 10.474 7.956 906 HD2 HIS 110 HD2 HIS 110 -13.696 7.637 6.972 907 HE1 HIS 110 HE1 HIS 110 -14.629 10.925 9.478 908 HE2 HIS 110 HE2 HIS 110 -12.841 9.299 8.767 909 H LEU 111 HN LEU 111 -18.855 7.961 7.241 910 HA LEU 111 HA LEU 111 -20.611 5.804 6.732 911 HB2 LEU 111 HB2 LEU 111 -20.647 8.273 8.223 912 HB3 LEU 111 HB1 LEU 111 -22.190 7.969 7.443 913 HG LEU 111 HG LEU 111 -21.936 7.058 9.798 914 HD11 LEU 111 HD11 LEU 111 -22.986 4.877 9.203 915 HD12 LEU 111 HD12 LEU 111 -22.606 5.207 7.515 916 HD13 LEU 111 HD13 LEU 111 -23.711 6.264 8.393 917 HD21 LEU 111 HD21 LEU 111 -20.224 5.014 8.380 918 HD22 LEU 111 HD22 LEU 111 -20.706 5.001 10.082 919 HD23 LEU 111 HD23 LEU 111 -19.611 6.250 9.487 920 H GLU 112 HN GLU 112 -22.234 5.515 5.439 921 HA GLU 112 HA GLU 112 -22.243 6.459 2.845 922 HB2 GLU 112 HB2 GLU 112 -23.246 4.342 3.650 923 HB3 GLU 112 HB1 GLU 112 -24.528 5.261 4.418 924 HG2 GLU 112 HG2 GLU 112 -25.325 6.008 2.262 925 HG3 GLU 112 HG1 GLU 112 -23.995 5.177 1.461 926 H GLY 113 HN GLY 113 -22.787 8.353 2.044 927 HA2 GLY 113 HA2 GLY 113 -24.687 9.916 1.718 928 HA3 GLY 113 HA1 GLY 113 -24.791 9.978 3.473 929 H HIS 114 HN HIS 114 -22.219 10.274 4.269 930 HA HIS 114 HA HIS 114 -21.072 12.479 2.733 931 HB2 HIS 114 HB2 HIS 114 -22.637 13.584 4.277 932 HB3 HIS 114 HB1 HIS 114 -21.879 12.779 5.643 933 HD1 HIS 114 HD1 HIS 114 -20.084 14.032 6.784 934 HD2 HIS 114 HD2 HIS 114 -20.766 15.447 2.931 935 HE1 HIS 114 HE1 HIS 114 -18.649 16.086 6.550 936 HE2 HIS 114 HE2 HIS 114 -18.908 16.781 4.143 937 HA PRO 115 HA PRO 115 -17.720 10.139 4.738 938 HB2 PRO 115 HB2 PRO 115 -16.964 8.542 2.722 939 HB3 PRO 115 HB1 PRO 115 -18.372 8.162 3.719 940 HG2 PRO 115 HG2 PRO 115 -18.259 9.050 0.924 941 HG3 PRO 115 HG1 PRO 115 -19.585 8.270 1.800 942 HD2 PRO 115 HD2 PRO 115 -19.159 11.109 1.259 943 HD3 PRO 115 HD1 PRO 115 -20.604 10.297 1.901 944 HA PRO 116 HA PRO 116 -14.641 12.564 2.459 945 HB2 PRO 116 HB2 PRO 116 -13.710 13.910 4.646 946 HB3 PRO 116 HB1 PRO 116 -15.063 14.473 3.663 947 HG2 PRO 116 HG2 PRO 116 -15.088 13.489 6.388 948 HG3 PRO 116 HG1 PRO 116 -16.409 14.216 5.462 949 HD2 PRO 116 HD2 PRO 116 -15.831 11.382 5.978 950 HD3 PRO 116 HD1 PRO 116 -17.339 12.142 5.428 951 H VAL 117 HN VAL 117 -13.325 10.693 2.098 952 HA VAL 117 HA VAL 117 -11.515 10.109 4.360 953 HB VAL 117 HB VAL 117 -12.524 8.191 2.265 954 HG11 VAL 117 HG11 VAL 117 -10.431 7.847 4.392 955 HG12 VAL 117 HG12 VAL 117 -10.228 7.679 2.653 956 HG13 VAL 117 HG13 VAL 117 -11.196 6.508 3.547 957 HG21 VAL 117 HG21 VAL 117 -13.403 6.975 4.226 958 HG22 VAL 117 HG22 VAL 117 -14.135 8.565 4.012 959 HG23 VAL 117 HG23 VAL 117 -12.902 8.321 5.250 960 H ASN 118 HN ASN 118 -9.639 11.068 3.943 961 HA ASN 118 HA ASN 118 -8.189 10.119 1.588 962 HB2 ASN 118 HB2 ASN 118 -9.171 12.453 1.154 963 HB3 ASN 118 HB1 ASN 118 -8.061 13.033 2.385 964 HD21 ASN 118 HD21 ASN 118 -5.845 11.325 1.662 965 HD22 ASN 118 HD22 ASN 118 -5.248 11.896 0.140 966 H HIS 119 HN HIS 119 -6.815 8.858 2.810 967 HA HIS 119 HA HIS 119 -5.348 10.217 4.986 968 HB2 HIS 119 HB2 HIS 119 -7.071 8.543 5.764 969 HB3 HIS 119 HB1 HIS 119 -6.125 7.307 4.945 970 HD1 HIS 119 HD1 HIS 119 -5.383 5.983 6.966 971 HD2 HIS 119 HD2 HIS 119 -4.520 10.045 7.278 972 HE1 HIS 119 HE1 HIS 119 -3.887 6.211 8.972 973 HE2 HIS 119 HE2 HIS 119 -3.517 8.688 9.237 974 H LEU 120 HN LEU 120 -3.221 9.955 5.074 975 HA LEU 120 HA LEU 120 -1.885 7.858 3.542 976 HB2 LEU 120 HB2 LEU 120 -1.548 10.807 3.175 977 HB3 LEU 120 HB1 LEU 120 -0.152 9.770 2.989 978 HG LEU 120 HG LEU 120 -2.684 9.345 1.429 979 HD11 LEU 120 HD11 LEU 120 -0.871 10.305 -0.327 980 HD12 LEU 120 HD12 LEU 120 -0.514 11.292 1.090 981 HD13 LEU 120 HD13 LEU 120 -2.143 11.276 0.410 982 HD21 LEU 120 HD21 LEU 120 -0.738 7.592 1.821 983 HD22 LEU 120 HD22 LEU 120 0.044 8.548 0.560 984 HD23 LEU 120 HD23 LEU 120 -1.512 7.778 0.246 985 H ARG 121 HN ARG 121 0.047 7.177 4.432 986 HA ARG 121 HA ARG 121 1.061 8.461 6.841 987 HB2 ARG 121 HB2 ARG 121 0.844 6.299 8.125 988 HB3 ARG 121 HB1 ARG 121 -0.666 7.151 7.828 989 HG2 ARG 121 HG2 ARG 121 -1.437 5.180 7.121 990 HG3 ARG 121 HG1 ARG 121 -0.499 5.475 5.665 991 HD2 ARG 121 HD2 ARG 121 -0.081 3.243 6.541 992 HD3 ARG 121 HD1 ARG 121 1.390 4.212 6.618 993 HE ARG 121 HE ARG 121 -0.359 3.523 8.904 994 HH11 ARG 121 HH11 ARG 121 2.729 4.599 7.669 995 HH12 ARG 121 HH12 ARG 121 3.539 4.428 9.191 996 HH21 ARG 121 HH21 ARG 121 0.694 3.283 10.898 997 HH22 ARG 121 HH22 ARG 121 2.389 3.673 11.027 998 H CYS 122 HN CYS 122 3.201 7.904 7.304 999 HA CYS 122 HA CYS 122 4.464 6.365 5.145 1000 HB2 CYS 122 HB2 CYS 122 6.513 7.648 5.683 1001 HB3 CYS 122 HB1 CYS 122 5.172 8.656 5.161 1002 HG CYS 122 HG CYS 122 6.525 10.044 7.130 1003 H GLU 123 HN GLU 123 5.480 4.572 5.523 1004 HA GLU 123 HA GLU 123 6.087 3.744 8.269 1005 HB2 GLU 123 HB2 GLU 123 6.002 2.240 5.643 1006 HB3 GLU 123 HB1 GLU 123 6.480 1.517 7.178 1007 HG2 GLU 123 HG2 GLU 123 3.886 2.920 7.093 1008 HG3 GLU 123 HG1 GLU 123 3.992 1.384 6.230 1009 H LYS 124 HN LYS 124 8.221 2.691 8.622 1010 HA LYS 124 HA LYS 124 10.294 3.903 6.921 1011 HB2 LYS 124 HB2 LYS 124 10.023 5.262 8.919 1012 HB3 LYS 124 HB1 LYS 124 10.212 3.837 9.931 1013 HG2 LYS 124 HG2 LYS 124 12.522 3.593 8.898 1014 HG3 LYS 124 HG1 LYS 124 12.296 5.219 8.259 1015 HD2 LYS 124 HD2 LYS 124 13.486 5.402 10.281 1016 HD3 LYS 124 HD1 LYS 124 11.845 5.976 10.590 1017 HE2 LYS 124 HE2 LYS 124 11.242 3.986 11.685 1018 HE3 LYS 124 HE1 LYS 124 12.664 3.141 11.074 1019 HZ1 LYS 124 HZ1 LYS 124 14.058 4.474 12.497 1020 HZ2 LYS 124 HZ2 LYS 124 12.840 3.764 13.443 1021 HZ3 LYS 124 HZ3 LYS 124 12.732 5.401 13.010 1022 H LEU 125 HN LEU 125 11.826 2.566 6.277 1023 HA LEU 125 HA LEU 125 12.183 0.018 7.732 1024 HB2 LEU 125 HB2 LEU 125 12.699 0.493 4.803 1025 HB3 LEU 125 HB1 LEU 125 12.620 -1.044 5.634 1026 HG LEU 125 HG LEU 125 10.157 0.613 5.687 1027 HD11 LEU 125 HD11 LEU 125 10.711 0.941 3.378 1028 HD12 LEU 125 HD12 LEU 125 9.489 -0.332 3.466 1029 HD13 LEU 125 HD13 LEU 125 11.180 -0.755 3.207 1030 HD21 LEU 125 HD21 LEU 125 9.190 -1.687 5.286 1031 HD22 LEU 125 HD22 LEU 125 10.072 -1.470 6.800 1032 HD23 LEU 125 HD23 LEU 125 10.834 -2.307 5.447 1033 H THR 126 HN THR 126 14.134 -0.031 8.726 1034 HA THR 126 HA THR 126 16.299 1.627 7.618 1035 HB THR 126 HB THR 126 16.552 0.352 10.298 1036 HG1 THR 126 HG1 THR 126 15.452 2.718 10.710 1037 HG21 THR 126 HG21 THR 126 18.242 1.848 9.041 1038 HG22 THR 126 HG22 THR 126 17.945 2.150 10.753 1039 HG23 THR 126 HG23 THR 126 17.187 3.173 9.533 1040 H PHE 127 HN PHE 127 17.898 0.636 6.587 1041 HA PHE 127 HA PHE 127 18.320 -2.227 7.113 1042 HB2 PHE 127 HB2 PHE 127 18.971 -0.649 4.616 1043 HB3 PHE 127 HB1 PHE 127 19.189 -2.385 4.826 1044 HD1 PHE 127 HD1 PHE 127 17.215 -3.872 4.984 1045 HD2 PHE 127 HD2 PHE 127 16.853 0.291 4.174 1046 HE1 PHE 127 HE1 PHE 127 14.901 -4.219 4.252 1047 HE2 PHE 127 HE2 PHE 127 14.542 -0.046 3.436 1048 HZ PHE 127 HZ PHE 127 13.549 -2.304 3.482 1049 H ASN 128 HN ASN 128 19.861 -2.301 8.605 1050 HA ASN 128 HA ASN 128 21.969 -0.396 8.790 1051 HB2 ASN 128 HB2 ASN 128 21.621 -3.087 10.121 1052 HB3 ASN 128 HB1 ASN 128 22.880 -1.924 10.519 1053 HD21 ASN 128 HD21 ASN 128 19.478 -2.633 10.679 1054 HD22 ASN 128 HD22 ASN 128 19.078 -1.409 11.845 1055 H ASN 129 HN ASN 129 23.617 -0.285 7.489 1056 HA ASN 129 HA ASN 129 25.317 -0.791 6.091 1057 HB2 ASN 129 HB2 ASN 129 25.495 -3.285 7.789 1058 HB3 ASN 129 HB1 ASN 129 26.768 -2.648 6.751 1059 HD21 ASN 129 HD21 ASN 129 25.249 -2.490 9.796 1060 HD22 ASN 129 HD22 ASN 129 26.182 -1.185 10.456 1061 HA PRO 130 HA PRO 130 23.092 -3.729 3.361 1062 HB2 PRO 130 HB2 PRO 130 22.179 -1.995 1.536 1063 HB3 PRO 130 HB1 PRO 130 21.322 -2.259 3.060 1064 HG2 PRO 130 HG2 PRO 130 23.034 0.018 2.216 1065 HG3 PRO 130 HG1 PRO 130 21.615 0.008 3.276 1066 HD2 PRO 130 HD2 PRO 130 24.316 0.037 4.076 1067 HD3 PRO 130 HD1 PRO 130 22.909 -0.251 5.116 1068 H THR 131 HN THR 131 23.746 -4.376 1.244 1069 HA THR 131 HA THR 131 26.469 -3.825 0.644 1070 HB THR 131 HB THR 131 25.485 -6.035 0.164 1071 HG1 THR 131 HG1 THR 131 27.045 -6.083 -1.236 1072 HG21 THR 131 HG21 THR 131 23.255 -5.390 -0.517 1073 HG22 THR 131 HG22 THR 131 24.020 -6.300 -1.820 1074 HG23 THR 131 HG23 THR 131 23.894 -4.544 -1.927 1075 H GLU 132 HN GLU 132 27.177 -3.143 -1.607 1076 HA GLU 132 HA GLU 132 26.573 -0.451 -1.961 1077 HB2 GLU 132 HB2 GLU 132 28.568 -1.727 -2.908 1078 HB3 GLU 132 HB1 GLU 132 27.501 -2.232 -4.211 1079 HG2 GLU 132 HG2 GLU 132 28.680 -0.391 -5.035 1080 HG3 GLU 132 HG1 GLU 132 27.070 0.212 -4.642 1081 H ASP 133 HN ASP 133 25.261 -3.257 -3.755 1082 HA ASP 133 HA ASP 133 23.888 -1.817 -5.723 1083 HB2 ASP 133 HB2 ASP 133 23.045 -4.474 -4.552 1084 HB3 ASP 133 HB1 ASP 133 22.560 -3.815 -6.104 1085 H PHE 134 HN PHE 134 22.804 -2.956 -2.542 1086 HA PHE 134 HA PHE 134 20.140 -1.995 -2.873 1087 HB2 PHE 134 HB2 PHE 134 21.010 -3.815 -1.209 1088 HB3 PHE 134 HB1 PHE 134 21.412 -2.436 -0.185 1089 HD1 PHE 134 HD1 PHE 134 18.512 -2.722 -2.461 1090 HD2 PHE 134 HD2 PHE 134 19.856 -2.675 1.577 1091 HE1 PHE 134 HE1 PHE 134 16.207 -2.548 -1.706 1092 HE2 PHE 134 HE2 PHE 134 17.524 -2.519 2.340 1093 HZ PHE 134 HZ PHE 134 15.700 -2.452 0.688 1094 H ARG 135 HN ARG 135 22.915 -0.909 -0.994 1095 HA ARG 135 HA ARG 135 22.148 1.518 -0.011 1096 HB2 ARG 135 HB2 ARG 135 24.237 0.839 0.567 1097 HB3 ARG 135 HB1 ARG 135 24.678 0.434 -1.094 1098 HG2 ARG 135 HG2 ARG 135 25.697 2.433 -1.275 1099 HG3 ARG 135 HG1 ARG 135 24.163 3.221 -0.949 1100 HD2 ARG 135 HD2 ARG 135 26.166 3.708 0.604 1101 HD3 ARG 135 HD1 ARG 135 24.600 3.363 1.337 1102 HE ARG 135 HE ARG 135 26.383 1.100 0.965 1103 HH11 ARG 135 HH11 ARG 135 25.213 3.580 3.150 1104 HH12 ARG 135 HH12 ARG 135 25.732 2.734 4.574 1105 HH21 ARG 135 HH21 ARG 135 27.038 -0.015 2.836 1106 HH22 ARG 135 HH22 ARG 135 26.783 0.694 4.401 1107 H ARG 136 HN ARG 136 23.328 0.845 -3.247 1108 HA ARG 136 HA ARG 136 23.402 3.352 -4.374 1109 HB2 ARG 136 HB2 ARG 136 23.630 0.722 -5.173 1110 HB3 ARG 136 HB1 ARG 136 22.340 1.398 -6.123 1111 HG2 ARG 136 HG2 ARG 136 23.848 3.201 -6.849 1112 HG3 ARG 136 HG1 ARG 136 25.155 2.387 -5.978 1113 HD2 ARG 136 HD2 ARG 136 25.297 1.692 -8.255 1114 HD3 ARG 136 HD1 ARG 136 24.644 0.336 -7.323 1115 HE ARG 136 HE ARG 136 22.400 1.513 -8.159 1116 HH11 ARG 136 HH11 ARG 136 25.302 0.595 -9.900 1117 HH12 ARG 136 HH12 ARG 136 24.478 0.428 -11.426 1118 HH21 ARG 136 HH21 ARG 136 21.330 1.292 -10.143 1119 HH22 ARG 136 HH22 ARG 136 22.217 0.805 -11.556 1120 H LYS 137 HN LYS 137 20.730 1.038 -4.378 1121 HA LYS 137 HA LYS 137 18.990 2.661 -5.892 1122 HB2 LYS 137 HB2 LYS 137 18.186 0.499 -3.949 1123 HB3 LYS 137 HB1 LYS 137 17.273 1.094 -5.325 1124 HG2 LYS 137 HG2 LYS 137 19.057 0.213 -6.817 1125 HG3 LYS 137 HG1 LYS 137 19.830 -0.492 -5.396 1126 HD2 LYS 137 HD2 LYS 137 17.616 -1.669 -4.968 1127 HD3 LYS 137 HD1 LYS 137 17.159 -1.173 -6.599 1128 HE2 LYS 137 HE2 LYS 137 18.021 -3.371 -6.791 1129 HE3 LYS 137 HE1 LYS 137 19.273 -2.295 -7.403 1130 HZ1 LYS 137 HZ1 LYS 137 19.216 -3.487 -4.688 1131 HZ2 LYS 137 HZ2 LYS 137 20.420 -2.467 -5.303 1132 HZ3 LYS 137 HZ3 LYS 137 20.189 -4.006 -5.974 1133 H LEU 138 HN LEU 138 19.199 1.954 -2.460 1134 HA LEU 138 HA LEU 138 17.070 3.477 -1.522 1135 HB2 LEU 138 HB2 LEU 138 19.672 3.066 -0.074 1136 HB3 LEU 138 HB1 LEU 138 18.106 3.389 0.637 1137 HG LEU 138 HG LEU 138 19.061 0.851 -0.658 1138 HD11 LEU 138 HD11 LEU 138 19.599 1.283 1.725 1139 HD12 LEU 138 HD12 LEU 138 18.591 -0.140 1.463 1140 HD13 LEU 138 HD13 LEU 138 17.867 1.355 2.054 1141 HD21 LEU 138 HD21 LEU 138 16.254 1.554 0.132 1142 HD22 LEU 138 HD22 LEU 138 16.813 -0.056 -0.302 1143 HD23 LEU 138 HD23 LEU 138 16.833 1.241 -1.499 1144 H LEU 139 HN LEU 139 20.398 4.435 -2.200 1145 HA LEU 139 HA LEU 139 20.149 7.075 -1.158 1146 HB2 LEU 139 HB2 LEU 139 22.152 5.855 -3.054 1147 HB3 LEU 139 HB1 LEU 139 22.302 7.458 -2.357 1148 HG LEU 139 HG LEU 139 22.214 4.887 -0.779 1149 HD11 LEU 139 HD11 LEU 139 24.309 4.694 -1.586 1150 HD12 LEU 139 HD12 LEU 139 24.656 5.879 -0.316 1151 HD13 LEU 139 HD13 LEU 139 24.429 6.416 -1.981 1152 HD21 LEU 139 HD21 LEU 139 21.305 6.841 0.374 1153 HD22 LEU 139 HD22 LEU 139 22.820 7.703 0.095 1154 HD23 LEU 139 HD23 LEU 139 22.798 6.261 1.114 1155 H LYS 140 HN LYS 140 19.650 5.640 -4.317 1156 HA LYS 140 HA LYS 140 19.487 8.095 -5.740 1157 HB2 LYS 140 HB2 LYS 140 19.278 5.295 -6.356 1158 HB3 LYS 140 HB1 LYS 140 17.983 6.199 -7.112 1159 HG2 LYS 140 HG2 LYS 140 19.474 7.567 -8.304 1160 HG3 LYS 140 HG1 LYS 140 20.852 7.016 -7.347 1161 HD2 LYS 140 HD2 LYS 140 19.236 5.111 -9.002 1162 HD3 LYS 140 HD1 LYS 140 20.555 6.039 -9.699 1163 HE2 LYS 140 HE2 LYS 140 20.800 4.260 -7.288 1164 HE3 LYS 140 HE1 LYS 140 21.159 3.762 -8.934 1165 HZ1 LYS 140 HZ1 LYS 140 23.225 4.402 -8.270 1166 HZ2 LYS 140 HZ2 LYS 140 22.653 5.538 -7.156 1167 HZ3 LYS 140 HZ3 LYS 140 22.676 5.910 -8.812 1168 H ALA 141 HN ALA 141 17.308 6.243 -3.870 1169 HA ALA 141 HA ALA 141 14.814 6.788 -4.805 1170 HB1 ALA 141 HB1 ALA 141 14.004 6.332 -2.666 1171 HB2 ALA 141 HB2 ALA 141 15.453 6.966 -1.886 1172 HB3 ALA 141 HB3 ALA 141 15.523 5.445 -2.776 1173 H1 GLY 212 HT1 GLY 212 -18.592 6.617 14.271 1174 H2 GLY 212 HT2 GLY 212 -20.128 6.259 13.648 1175 H3 GLY 212 HT3 GLY 212 -19.976 6.922 15.202 1176 HA2 GLY 212 HA1 GLY 212 -20.706 8.598 13.640 1177 HA3 GLY 212 HA2 GLY 212 -19.115 8.971 14.288 1178 H GLY 213 HN GLY 213 -17.361 7.603 12.861 1179 HA2 GLY 213 HA2 GLY 213 -17.927 8.454 10.087 1180 HA3 GLY 213 HA1 GLY 213 -16.374 8.703 10.867 1181 H LYS 214 HN LYS 214 -17.251 5.791 11.989 1182 HA LYS 214 HA LYS 214 -15.732 4.442 9.888 1183 HB2 LYS 214 HB2 LYS 214 -14.977 4.206 12.241 1184 HB3 LYS 214 HB1 LYS 214 -16.506 3.431 12.632 1185 HG2 LYS 214 HG2 LYS 214 -15.998 1.548 11.276 1186 HG3 LYS 214 HG1 LYS 214 -14.598 2.356 10.569 1187 HD2 LYS 214 HD2 LYS 214 -13.813 0.780 12.195 1188 HD3 LYS 214 HD1 LYS 214 -13.562 2.403 12.834 1189 HE2 LYS 214 HE2 LYS 214 -14.411 1.116 14.625 1190 HE3 LYS 214 HE1 LYS 214 -15.746 2.124 14.071 1191 HZ1 LYS 214 HZ1 LYS 214 -16.506 -0.108 14.466 1192 HZ2 LYS 214 HZ2 LYS 214 -15.330 -0.752 13.437 1193 HZ3 LYS 214 HZ3 LYS 214 -16.576 0.205 12.803 1194 H ALA 215 HN ALA 215 -17.000 3.798 8.289 1195 HA ALA 215 HA ALA 215 -19.695 2.971 8.523 1196 HB1 ALA 215 HB1 ALA 215 -19.367 2.109 6.208 1197 HB2 ALA 215 HB2 ALA 215 -17.649 2.477 6.356 1198 HB3 ALA 215 HB3 ALA 215 -18.838 3.778 6.419 1199 HA PRO 216 HA PRO 216 -19.536 -1.272 9.785 1200 HB2 PRO 216 HB2 PRO 216 -20.948 -2.515 7.732 1201 HB3 PRO 216 HB1 PRO 216 -21.662 -1.779 9.167 1202 HG2 PRO 216 HG2 PRO 216 -21.394 -0.684 6.413 1203 HG3 PRO 216 HG1 PRO 216 -22.703 -0.471 7.587 1204 HD2 PRO 216 HD2 PRO 216 -20.887 1.455 7.093 1205 HD3 PRO 216 HD1 PRO 216 -21.590 1.222 8.706 1206 H ARG 217 HN ARG 217 -18.445 -3.256 9.336 1207 HA ARG 217 HA ARG 217 -16.855 -3.265 6.886 1208 HB2 ARG 217 HB2 ARG 217 -14.758 -3.325 8.001 1209 HB3 ARG 217 HB1 ARG 217 -15.642 -1.960 8.665 1210 HG2 ARG 217 HG2 ARG 217 -16.259 -3.397 10.605 1211 HG3 ARG 217 HG1 ARG 217 -15.186 -4.638 9.955 1212 HD2 ARG 217 HD2 ARG 217 -14.469 -1.888 10.940 1213 HD3 ARG 217 HD1 ARG 217 -13.936 -3.442 11.576 1214 HE ARG 217 HE ARG 217 -13.144 -3.048 8.857 1215 HH11 ARG 217 HH11 ARG 217 -12.315 -2.374 12.184 1216 HH12 ARG 217 HH12 ARG 217 -10.647 -2.019 11.838 1217 HH21 ARG 217 HH21 ARG 217 -10.954 -2.549 8.387 1218 HH22 ARG 217 HH22 ARG 217 -9.881 -2.070 9.667 1219 H1 KCR 218 HN KCR 218 -15.908 -5.262 6.375 1220 H4 KCR 218 HA KCR 218 -17.430 -7.517 7.424 1221 H5 KCR 218 HB1 KCR 218 -16.670 -8.720 5.489 1222 H6 KCR 218 HB2 KCR 218 -15.425 -7.524 5.162 1223 H7 KCR 218 HG1 KCR 218 -17.173 -5.870 4.670 1224 H8 KCR 218 HG2 KCR 218 -18.397 -7.117 4.926 1225 H9 KCR 218 HD1 KCR 218 -17.574 -8.398 3.076 1226 H10 KCR 218 HD2 KCR 218 -16.181 -7.330 2.894 1227 H11 KCR 218 HE1 KCR 218 -17.722 -5.471 2.364 1228 H12 KCR 218 HE2 KCR 218 -19.072 -6.605 2.441 1229 H13 KCR 218 HZ1 KCR 218 -17.879 -7.815 0.578 1230 H14 KCR 218 HH1 KCR 218 -17.382 -7.536 -1.742 1231 H15 KCR 218 HJ1 KCR 218 -17.026 -4.539 -2.369 1232 H16 KCR 218 HF3 KCR 218 -17.827 -5.947 -4.562 1233 H17 KCR 218 HF1 KCR 218 -16.107 -5.591 -4.415 1234 H18 KCR 218 HF2 KCR 218 -16.726 -7.168 -3.921 1235 H GLN 219 HN GLN 219 -15.595 -6.505 9.236 1236 HA GLN 219 HA GLN 219 -13.917 -8.736 9.789 1237 HB2 GLN 219 HB2 GLN 219 -12.635 -7.570 7.976 1238 HB3 GLN 219 HB1 GLN 219 -12.529 -6.160 9.020 1239 HG2 GLN 219 HG2 GLN 219 -11.312 -7.521 10.675 1240 HG3 GLN 219 HG1 GLN 219 -11.357 -8.879 9.548 1241 HE21 GLN 219 HE21 GLN 219 -10.096 -8.810 7.680 1242 HE22 GLN 219 HE22 GLN 219 -8.806 -7.668 7.493 1243 H LEU 220 HN LEU 220 -15.202 -8.496 11.689 1244 HA LEU 220 HA LEU 220 -14.087 -6.565 13.561 1245 HB2 LEU 220 HB2 LEU 220 -16.224 -5.828 14.382 1246 HB3 LEU 220 HB1 LEU 220 -16.129 -5.507 12.665 1247 HG LEU 220 HG LEU 220 -17.584 -7.896 13.801 1248 HD11 LEU 220 HD11 LEU 220 -18.683 -5.186 13.069 1249 HD12 LEU 220 HD12 LEU 220 -18.582 -5.865 14.694 1250 HD13 LEU 220 HD13 LEU 220 -19.639 -6.606 13.492 1251 HD21 LEU 220 HD21 LEU 220 -16.973 -8.072 11.442 1252 HD22 LEU 220 HD22 LEU 220 -17.733 -6.514 11.122 1253 HD23 LEU 220 HD23 LEU 220 -18.717 -7.886 11.633 1254 H ALA 221 HN ALA 221 -14.089 -7.236 15.682 1255 HA ALA 221 HA ALA 221 -14.761 -10.079 16.061 1256 HB1 ALA 221 HB1 ALA 221 -13.042 -10.099 17.796 1257 HB2 ALA 221 HB2 ALA 221 -12.741 -8.382 17.528 1258 HB3 ALA 221 HB3 ALA 221 -12.379 -9.550 16.258 1259 H THR 222 HN THR 222 -16.576 -7.784 16.350 1260 HA THR 222 HA THR 222 -17.143 -7.944 19.228 1261 HB THR 222 HB THR 222 -18.608 -5.902 18.739 1262 HG1 THR 222 HG1 THR 222 -18.702 -5.416 16.680 1263 HG21 THR 222 HG21 THR 222 -15.612 -5.675 18.427 1264 HG22 THR 222 HG22 THR 222 -16.494 -5.752 19.952 1265 HG23 THR 222 HG23 THR 222 -16.698 -4.362 18.885 1266 H LYS 223 HN LYS 223 -17.901 -9.872 17.045 1267 HA LYS 223 HA LYS 223 -20.808 -9.615 17.004 1268 HB2 LYS 223 HB2 LYS 223 -19.650 -10.436 14.973 1269 HB3 LYS 223 HB1 LYS 223 -19.049 -11.813 15.889 1270 HG2 LYS 223 HG2 LYS 223 -21.503 -12.344 16.364 1271 HG3 LYS 223 HG1 LYS 223 -21.867 -11.197 15.074 1272 HD2 LYS 223 HD2 LYS 223 -20.498 -12.516 13.527 1273 HD3 LYS 223 HD1 LYS 223 -20.151 -13.664 14.821 1274 HE2 LYS 223 HE2 LYS 223 -22.601 -14.066 15.026 1275 HE3 LYS 223 HE1 LYS 223 -22.840 -13.048 13.607 1276 HZ1 LYS 223 HZ1 LYS 223 -22.810 -15.310 12.918 1277 HZ2 LYS 223 HZ2 LYS 223 -21.357 -15.614 13.738 1278 HZ3 LYS 223 HZ3 LYS 223 -21.364 -14.597 12.381 1279 H ALA 224 HN ALA 224 -18.338 -11.877 18.143 1280 HA ALA 224 HA ALA 224 -20.131 -12.646 20.330 1281 HB1 ALA 224 HB1 ALA 224 -20.334 -14.388 18.618 1282 HB2 ALA 224 HB2 ALA 224 -19.534 -15.001 20.066 1283 HB3 ALA 224 HB3 ALA 224 -18.584 -14.606 18.633 Start of MODEL 8 1 H1 GLY 1 HT1 GLY 1 29.753 -0.357 18.623 2 H2 GLY 1 HT2 GLY 1 29.079 0.411 17.269 3 H3 GLY 1 HT3 GLY 1 30.758 0.455 17.523 4 HA2 GLY 1 HA1 GLY 1 30.294 -1.125 15.812 5 HA3 GLY 1 HA2 GLY 1 30.861 -1.962 17.252 6 H SER 2 HN SER 2 28.638 -2.055 14.859 7 HA SER 2 HA SER 2 26.492 -3.191 16.487 8 HB2 SER 2 HB2 SER 2 26.590 -2.704 13.502 9 HB3 SER 2 HB1 SER 2 25.167 -3.137 14.448 10 HG SER 2 HG SER 2 25.837 -1.082 15.671 11 H HIS 3 HN HIS 3 28.862 -4.090 14.027 12 HA HIS 3 HA HIS 3 28.710 -6.847 14.695 13 HB2 HIS 3 HB2 HIS 3 26.603 -6.661 13.412 14 HB3 HIS 3 HB1 HIS 3 27.511 -6.073 12.026 15 HD1 HIS 3 HD1 HIS 3 28.045 -7.809 10.370 16 HD2 HIS 3 HD2 HIS 3 27.584 -9.402 14.183 17 HE1 HIS 3 HE1 HIS 3 28.322 -10.297 10.104 18 HE2 HIS 3 HE2 HIS 3 28.296 -11.199 12.460 19 H MET 4 HN MET 4 29.374 -4.848 11.792 20 HA MET 4 HA MET 4 31.846 -6.352 11.412 21 HB2 MET 4 HB2 MET 4 30.377 -6.035 9.470 22 HB3 MET 4 HB1 MET 4 30.526 -4.291 9.636 23 HG2 MET 4 HG2 MET 4 32.948 -4.491 9.215 24 HG3 MET 4 HG1 MET 4 32.735 -6.223 8.962 25 HE1 MET 4 HE1 MET 4 33.934 -5.994 6.604 26 HE2 MET 4 HE2 MET 4 34.124 -4.260 6.860 27 HE3 MET 4 HE3 MET 4 33.427 -4.857 5.354 28 H ALA 5 HN ALA 5 31.128 -2.895 10.886 29 HA ALA 5 HA ALA 5 33.210 -2.097 12.724 30 HB1 ALA 5 HB1 ALA 5 34.541 -0.899 11.012 31 HB2 ALA 5 HB2 ALA 5 33.587 -1.696 9.760 32 HB3 ALA 5 HB3 ALA 5 34.601 -2.654 10.839 33 H SER 6 HN SER 6 32.293 -0.364 9.819 34 HA SER 6 HA SER 6 30.895 1.597 11.490 35 HB2 SER 6 HB2 SER 6 32.084 1.848 8.715 36 HB3 SER 6 HB1 SER 6 31.231 3.137 9.564 37 HG SER 6 HG SER 6 32.825 3.144 11.131 38 H SER 7 HN SER 7 28.883 0.732 11.645 39 HA SER 7 HA SER 7 27.585 -0.401 9.322 40 HB2 SER 7 HB2 SER 7 27.414 -1.364 11.656 41 HB3 SER 7 HB1 SER 7 26.425 0.031 12.087 42 HG SER 7 HG SER 7 24.826 -1.084 11.335 43 H CYS 8 HN CYS 8 26.764 0.957 7.890 44 HA CYS 8 HA CYS 8 25.359 3.351 8.851 45 HB2 CYS 8 HB2 CYS 8 26.286 2.753 6.037 46 HB3 CYS 8 HB1 CYS 8 25.666 4.286 6.648 47 HG CYS 8 HG CYS 8 28.742 3.281 6.483 48 H ALA 9 HN ALA 9 23.293 2.886 9.187 49 HA ALA 9 HA ALA 9 21.876 0.967 7.550 50 HB1 ALA 9 HB1 ALA 9 19.983 1.402 9.036 51 HB2 ALA 9 HB2 ALA 9 20.859 2.752 9.764 52 HB3 ALA 9 HB3 ALA 9 21.454 1.107 9.970 53 H VAL 10 HN VAL 10 20.746 1.440 5.780 54 HA VAL 10 HA VAL 10 20.170 4.266 5.209 55 HB VAL 10 HB VAL 10 20.012 1.976 3.245 56 HG11 VAL 10 HG11 VAL 10 18.739 3.714 2.386 57 HG12 VAL 10 HG12 VAL 10 20.323 3.988 1.656 58 HG13 VAL 10 HG13 VAL 10 19.813 4.953 3.041 59 HG21 VAL 10 HG21 VAL 10 22.298 2.066 3.885 60 HG22 VAL 10 HG22 VAL 10 22.309 3.828 3.851 61 HG23 VAL 10 HG23 VAL 10 22.170 2.918 2.347 62 H GLN 11 HN GLN 11 18.123 4.962 5.144 63 HA GLN 11 HA GLN 11 16.085 2.942 5.790 64 HB2 GLN 11 HB2 GLN 11 15.746 5.795 6.593 65 HB3 GLN 11 HB1 GLN 11 15.181 4.335 7.393 66 HG2 GLN 11 HG2 GLN 11 16.814 4.898 8.855 67 HG3 GLN 11 HG1 GLN 11 17.798 3.983 7.719 68 HE21 GLN 11 HE21 GLN 11 16.977 7.143 8.889 69 HE22 GLN 11 HE22 GLN 11 18.291 7.987 8.131 70 H VAL 12 HN VAL 12 14.285 2.862 4.612 71 HA VAL 12 HA VAL 12 13.857 5.014 2.657 72 HB VAL 12 HB VAL 12 12.738 3.266 1.258 73 HG11 VAL 12 HG11 VAL 12 15.229 3.940 1.095 74 HG12 VAL 12 HG12 VAL 12 14.734 2.439 0.318 75 HG13 VAL 12 HG13 VAL 12 15.550 2.394 1.879 76 HG21 VAL 12 HG21 VAL 12 12.251 1.753 3.107 77 HG22 VAL 12 HG22 VAL 12 13.960 1.340 3.207 78 HG23 VAL 12 HG23 VAL 12 13.037 0.948 1.753 79 H LYS 13 HN LYS 13 11.765 5.814 2.434 80 HA LYS 13 HA LYS 13 9.858 4.823 4.430 81 HB2 LYS 13 HB2 LYS 13 10.413 7.569 3.393 82 HB3 LYS 13 HB1 LYS 13 8.795 7.175 3.958 83 HG2 LYS 13 HG2 LYS 13 9.746 6.465 6.106 84 HG3 LYS 13 HG1 LYS 13 11.340 6.974 5.544 85 HD2 LYS 13 HD2 LYS 13 10.551 9.265 5.308 86 HD3 LYS 13 HD1 LYS 13 8.929 8.773 5.800 87 HE2 LYS 13 HE2 LYS 13 9.738 8.152 7.988 88 HE3 LYS 13 HE1 LYS 13 11.398 8.497 7.506 89 HZ1 LYS 13 HZ1 LYS 13 10.546 10.310 8.790 90 HZ2 LYS 13 HZ2 LYS 13 9.190 10.468 7.786 91 HZ3 LYS 13 HZ3 LYS 13 10.734 10.836 7.188 92 H LEU 14 HN LEU 14 8.137 3.864 3.761 93 HA LEU 14 HA LEU 14 7.158 4.398 1.037 94 HB2 LEU 14 HB2 LEU 14 6.753 1.981 2.787 95 HB3 LEU 14 HB1 LEU 14 5.946 2.231 1.256 96 HG LEU 14 HG LEU 14 8.939 1.972 1.595 97 HD11 LEU 14 HD11 LEU 14 6.900 0.002 0.593 98 HD12 LEU 14 HD12 LEU 14 7.791 -0.111 2.110 99 HD13 LEU 14 HD13 LEU 14 8.649 -0.224 0.572 100 HD21 LEU 14 HD21 LEU 14 7.259 1.924 -0.904 101 HD22 LEU 14 HD22 LEU 14 9.018 1.855 -0.791 102 HD23 LEU 14 HD23 LEU 14 8.162 3.329 -0.338 103 H GLU 15 HN GLU 15 4.980 4.795 0.775 104 HA GLU 15 HA GLU 15 3.715 5.844 3.214 105 HB2 GLU 15 HB2 GLU 15 4.496 7.532 1.574 106 HB3 GLU 15 HB1 GLU 15 3.453 6.811 0.360 107 HG2 GLU 15 HG2 GLU 15 1.492 7.435 1.611 108 HG3 GLU 15 HG1 GLU 15 2.492 8.049 2.928 109 H LEU 16 HN LEU 16 1.885 4.959 3.811 110 HA LEU 16 HA LEU 16 0.340 3.326 1.932 111 HB2 LEU 16 HB2 LEU 16 0.207 3.658 4.919 112 HB3 LEU 16 HB1 LEU 16 -1.076 2.887 4.025 113 HG LEU 16 HG LEU 16 0.187 1.138 4.909 114 HD11 LEU 16 HD11 LEU 16 1.627 1.066 2.379 115 HD12 LEU 16 HD12 LEU 16 -0.104 1.360 2.236 116 HD13 LEU 16 HD13 LEU 16 0.481 -0.079 3.072 117 HD21 LEU 16 HD21 LEU 16 2.733 2.224 3.819 118 HD22 LEU 16 HD22 LEU 16 2.498 0.993 5.052 119 HD23 LEU 16 HD23 LEU 16 2.154 2.686 5.413 120 H GLY 17 HN GLY 17 -1.741 3.844 1.406 121 HA2 GLY 17 HA2 GLY 17 -3.004 6.170 2.580 122 HA3 GLY 17 HA1 GLY 17 -2.459 6.386 0.919 123 H HIS 18 HN HIS 18 -5.078 6.674 1.557 124 HA HIS 18 HA HIS 18 -6.172 5.110 -0.488 125 HB2 HIS 18 HB2 HIS 18 -7.219 3.357 0.503 126 HB3 HIS 18 HB1 HIS 18 -6.102 3.616 1.836 127 HD1 HIS 18 HD1 HIS 18 -7.116 5.360 3.734 128 HD2 HIS 18 HD2 HIS 18 -9.822 3.389 1.263 129 HE1 HIS 18 HE1 HIS 18 -9.361 5.575 4.866 130 HE2 HIS 18 HE2 HIS 18 -10.957 4.302 3.400 131 H ARG 19 HN ARG 19 -8.128 5.838 -1.126 132 HA ARG 19 HA ARG 19 -9.240 8.148 0.324 133 HB2 ARG 19 HB2 ARG 19 -9.632 7.437 -2.581 134 HB3 ARG 19 HB1 ARG 19 -10.015 8.948 -1.797 135 HG2 ARG 19 HG2 ARG 19 -7.698 9.474 -1.532 136 HG3 ARG 19 HG1 ARG 19 -7.230 7.898 -2.146 137 HD2 ARG 19 HD2 ARG 19 -8.720 9.966 -3.647 138 HD3 ARG 19 HD1 ARG 19 -7.019 9.642 -3.847 139 HE ARG 19 HE ARG 19 -7.705 7.465 -4.741 140 HH11 ARG 19 HH11 ARG 19 -10.157 9.955 -4.525 141 HH12 ARG 19 HH12 ARG 19 -11.075 9.343 -5.873 142 HH21 ARG 19 HH21 ARG 19 -8.916 6.671 -6.525 143 HH22 ARG 19 HH22 ARG 19 -10.385 7.471 -6.986 144 H ALA 20 HN ALA 20 -11.599 8.299 0.320 145 HA ALA 20 HA ALA 20 -13.090 6.042 -0.735 146 HB1 ALA 20 HB1 ALA 20 -12.860 4.986 1.271 147 HB2 ALA 20 HB2 ALA 20 -14.312 5.937 1.582 148 HB3 ALA 20 HB3 ALA 20 -12.748 6.493 2.179 149 H GLN 21 HN GLN 21 -14.989 6.685 -1.521 150 HA GLN 21 HA GLN 21 -16.483 8.753 -0.148 151 HB2 GLN 21 HB2 GLN 21 -16.544 10.275 -1.836 152 HB3 GLN 21 HB1 GLN 21 -15.021 9.553 -2.291 153 HG2 GLN 21 HG2 GLN 21 -17.676 8.879 -3.445 154 HG3 GLN 21 HG1 GLN 21 -16.447 9.895 -4.165 155 HE21 GLN 21 HE21 GLN 21 -17.729 7.538 -5.179 156 HE22 GLN 21 HE22 GLN 21 -16.490 6.370 -5.487 157 H VAL 22 HN VAL 22 -18.802 8.694 -0.956 158 HA VAL 22 HA VAL 22 -19.414 5.919 -1.682 159 HB VAL 22 HB VAL 22 -20.322 6.705 0.487 160 HG11 VAL 22 HG11 VAL 22 -22.178 8.260 0.539 161 HG12 VAL 22 HG12 VAL 22 -21.992 8.560 -1.188 162 HG13 VAL 22 HG13 VAL 22 -20.714 9.032 -0.064 163 HG21 VAL 22 HG21 VAL 22 -21.510 4.908 -0.340 164 HG22 VAL 22 HG22 VAL 22 -22.144 5.822 -1.708 165 HG23 VAL 22 HG23 VAL 22 -22.775 6.111 -0.086 166 H ARG 23 HN ARG 23 -20.453 5.439 -3.494 167 HA ARG 23 HA ARG 23 -21.357 7.629 -5.215 168 HB2 ARG 23 HB2 ARG 23 -21.799 5.493 -6.760 169 HB3 ARG 23 HB1 ARG 23 -20.212 6.229 -6.626 170 HG2 ARG 23 HG2 ARG 23 -19.342 4.501 -5.447 171 HG3 ARG 23 HG1 ARG 23 -20.882 4.080 -4.704 172 HD2 ARG 23 HD2 ARG 23 -19.994 2.410 -6.351 173 HD3 ARG 23 HD1 ARG 23 -21.625 2.988 -6.683 174 HE ARG 23 HE ARG 23 -20.606 4.457 -8.390 175 HH11 ARG 23 HH11 ARG 23 -18.766 1.707 -7.263 176 HH12 ARG 23 HH12 ARG 23 -17.882 1.519 -8.745 177 HH21 ARG 23 HH21 ARG 23 -19.447 4.238 -10.333 178 HH22 ARG 23 HH22 ARG 23 -18.258 2.976 -10.499 179 H LYS 24 HN LYS 24 -23.485 7.932 -5.730 180 HA LYS 24 HA LYS 24 -25.319 7.023 -3.755 181 HB2 LYS 24 HB2 LYS 24 -25.371 9.276 -4.897 182 HB3 LYS 24 HB1 LYS 24 -26.017 8.457 -6.314 183 HG2 LYS 24 HG2 LYS 24 -27.838 9.402 -5.062 184 HG3 LYS 24 HG1 LYS 24 -27.890 7.642 -4.933 185 HD2 LYS 24 HD2 LYS 24 -26.880 7.727 -2.748 186 HD3 LYS 24 HD1 LYS 24 -26.694 9.478 -2.870 187 HE2 LYS 24 HE2 LYS 24 -29.042 9.815 -2.812 188 HE3 LYS 24 HE1 LYS 24 -29.364 8.092 -3.002 189 HZ1 LYS 24 HZ1 LYS 24 -28.109 9.416 -0.659 190 HZ2 LYS 24 HZ2 LYS 24 -28.282 7.738 -0.833 191 HZ3 LYS 24 HZ3 LYS 24 -29.656 8.725 -0.715 192 H LYS 25 HN LYS 25 -24.239 5.675 -6.613 193 HA LYS 25 HA LYS 25 -26.504 3.810 -6.581 194 HB2 LYS 25 HB2 LYS 25 -26.635 5.217 -8.595 195 HB3 LYS 25 HB1 LYS 25 -25.019 4.720 -9.058 196 HG2 LYS 25 HG2 LYS 25 -26.448 3.396 -10.330 197 HG3 LYS 25 HG1 LYS 25 -25.948 2.371 -8.994 198 HD2 LYS 25 HD2 LYS 25 -28.023 2.865 -7.815 199 HD3 LYS 25 HD1 LYS 25 -28.549 3.854 -9.184 200 HE2 LYS 25 HE2 LYS 25 -28.512 1.947 -10.643 201 HE3 LYS 25 HE1 LYS 25 -27.806 0.945 -9.374 202 HZ1 LYS 25 HZ1 LYS 25 -30.504 2.193 -9.262 203 HZ2 LYS 25 HZ2 LYS 25 -29.830 1.150 -8.104 204 HZ3 LYS 25 HZ3 LYS 25 -30.195 0.571 -9.652 205 HA PRO 26 HA PRO 26 -22.993 1.083 -5.782 206 HB2 PRO 26 HB2 PRO 26 -25.109 -0.935 -5.572 207 HB3 PRO 26 HB1 PRO 26 -23.919 -0.435 -4.373 208 HG2 PRO 26 HG2 PRO 26 -26.543 0.161 -4.161 209 HG3 PRO 26 HG1 PRO 26 -25.257 1.210 -3.528 210 HD2 PRO 26 HD2 PRO 26 -26.896 1.493 -6.022 211 HD3 PRO 26 HD1 PRO 26 -26.305 2.741 -4.905 212 H THR 27 HN THR 27 -22.407 -1.061 -6.698 213 HA THR 27 HA THR 27 -22.990 -1.142 -9.532 214 HB THR 27 HB THR 27 -20.695 -1.553 -8.820 215 HG1 THR 27 HG1 THR 27 -20.845 -4.055 -9.588 216 HG21 THR 27 HG21 THR 27 -20.940 -2.434 -6.644 217 HG22 THR 27 HG22 THR 27 -20.190 -3.709 -7.608 218 HG23 THR 27 HG23 THR 27 -21.911 -3.788 -7.229 219 H VAL 28 HN VAL 28 -23.263 -3.566 -10.367 220 HA VAL 28 HA VAL 28 -25.818 -4.409 -9.910 221 HB VAL 28 HB VAL 28 -24.688 -5.226 -11.794 222 HG11 VAL 28 HG11 VAL 28 -22.414 -5.167 -10.776 223 HG12 VAL 28 HG12 VAL 28 -22.723 -6.601 -11.763 224 HG13 VAL 28 HG13 VAL 28 -22.775 -6.716 -10.004 225 HG21 VAL 28 HG21 VAL 28 -25.185 -7.503 -9.889 226 HG22 VAL 28 HG22 VAL 28 -24.992 -7.680 -11.634 227 HG23 VAL 28 HG23 VAL 28 -26.352 -6.763 -10.985 228 H GLU 29 HN GLU 29 -22.923 -5.466 -8.158 229 HA GLU 29 HA GLU 29 -24.449 -7.420 -6.663 230 HB2 GLU 29 HB2 GLU 29 -21.538 -6.647 -6.474 231 HB3 GLU 29 HB1 GLU 29 -22.288 -8.008 -5.647 232 HG2 GLU 29 HG2 GLU 29 -22.906 -8.920 -7.908 233 HG3 GLU 29 HG1 GLU 29 -21.928 -7.633 -8.611 234 H GLY 30 HN GLY 30 -24.112 -4.173 -6.367 235 HA2 GLY 30 HA2 GLY 30 -25.155 -2.918 -4.720 236 HA3 GLY 30 HA1 GLY 30 -25.179 -4.333 -3.679 237 H PHE 31 HN PHE 31 -22.276 -3.071 -5.192 238 HA PHE 31 HA PHE 31 -21.160 -2.525 -2.567 239 HB2 PHE 31 HB2 PHE 31 -19.783 -2.187 -5.242 240 HB3 PHE 31 HB1 PHE 31 -19.035 -2.341 -3.655 241 HD1 PHE 31 HD1 PHE 31 -21.015 -4.721 -2.895 242 HD2 PHE 31 HD2 PHE 31 -18.382 -3.955 -6.142 243 HE1 PHE 31 HE1 PHE 31 -20.763 -7.136 -3.260 244 HE2 PHE 31 HE2 PHE 31 -18.132 -6.366 -6.514 245 HZ PHE 31 HZ PHE 31 -19.323 -7.962 -5.072 246 H THR 32 HN THR 32 -21.151 -0.538 -1.709 247 HA THR 32 HA THR 32 -22.357 1.609 -3.308 248 HB THR 32 HB THR 32 -23.009 2.554 -1.123 249 HG1 THR 32 HG1 THR 32 -22.584 1.394 0.763 250 HG21 THR 32 HG21 THR 32 -23.737 -0.287 -1.554 251 HG22 THR 32 HG22 THR 32 -24.560 1.105 -2.231 252 HG23 THR 32 HG23 THR 32 -24.609 0.800 -0.492 253 H HIS 33 HN HIS 33 -19.534 0.906 -1.372 254 HA HIS 33 HA HIS 33 -18.776 3.758 -1.377 255 HB2 HIS 33 HB2 HIS 33 -18.320 1.498 0.503 256 HB3 HIS 33 HB1 HIS 33 -17.018 2.673 0.354 257 HD1 HIS 33 HD1 HIS 33 -20.602 2.361 1.520 258 HD2 HIS 33 HD2 HIS 33 -17.473 5.104 1.560 259 HE1 HIS 33 HE1 HIS 33 -21.285 4.152 3.154 260 HE2 HIS 33 HE2 HIS 33 -19.280 5.664 3.321 261 H ASP 34 HN ASP 34 -17.116 4.384 -2.630 262 HA ASP 34 HA ASP 34 -15.428 2.320 -3.870 263 HB2 ASP 34 HB2 ASP 34 -15.772 5.248 -4.577 264 HB3 ASP 34 HB1 ASP 34 -14.717 4.121 -5.418 265 H TRP 35 HN TRP 35 -13.224 2.375 -3.663 266 HA TRP 35 HA TRP 35 -12.029 4.606 -2.266 267 HB2 TRP 35 HB2 TRP 35 -10.831 3.107 -0.668 268 HB3 TRP 35 HB1 TRP 35 -12.551 3.267 -0.381 269 HD1 TRP 35 HD1 TRP 35 -13.959 1.046 -0.309 270 HE1 TRP 35 HE1 TRP 35 -13.341 -1.452 -0.538 271 HE3 TRP 35 HE3 TRP 35 -9.162 1.531 -2.027 272 HZ2 TRP 35 HZ2 TRP 35 -11.109 -3.001 -1.315 273 HZ3 TRP 35 HZ3 TRP 35 -7.853 -0.507 -2.475 274 HH2 TRP 35 HH2 TRP 35 -8.793 -2.714 -2.100 275 H MET 36 HN MET 36 -9.751 4.669 -2.353 276 HA MET 36 HA MET 36 -8.487 2.900 -4.323 277 HB2 MET 36 HB2 MET 36 -8.991 4.930 -5.551 278 HB3 MET 36 HB1 MET 36 -8.296 5.942 -4.274 279 HG2 MET 36 HG2 MET 36 -6.119 4.724 -4.694 280 HG3 MET 36 HG1 MET 36 -6.867 4.068 -6.154 281 HE1 MET 36 HE1 MET 36 -5.838 6.876 -4.091 282 HE2 MET 36 HE2 MET 36 -5.400 8.196 -5.192 283 HE3 MET 36 HE3 MET 36 -4.409 6.738 -5.129 284 H VAL 37 HN VAL 37 -6.631 2.077 -3.526 285 HA VAL 37 HA VAL 37 -5.538 3.269 -1.095 286 HB VAL 37 HB VAL 37 -4.045 1.075 -1.352 287 HG11 VAL 37 HG11 VAL 37 -6.858 1.089 -0.369 288 HG12 VAL 37 HG12 VAL 37 -5.472 1.672 0.536 289 HG13 VAL 37 HG13 VAL 37 -5.606 -0.040 0.121 290 HG21 VAL 37 HG21 VAL 37 -4.933 0.334 -3.437 291 HG22 VAL 37 HG22 VAL 37 -6.587 0.490 -2.845 292 HG23 VAL 37 HG23 VAL 37 -5.526 -0.752 -2.180 293 H PHE 38 HN PHE 38 -3.375 3.592 -0.761 294 HA PHE 38 HA PHE 38 -1.766 4.296 -3.139 295 HB2 PHE 38 HB2 PHE 38 -2.475 5.755 -0.669 296 HB3 PHE 38 HB1 PHE 38 -0.775 5.813 -1.083 297 HD1 PHE 38 HD1 PHE 38 -0.141 6.737 -3.357 298 HD2 PHE 38 HD2 PHE 38 -4.011 7.207 -1.645 299 HE1 PHE 38 HE1 PHE 38 -0.533 8.678 -4.802 300 HE2 PHE 38 HE2 PHE 38 -4.417 9.148 -3.093 301 HZ PHE 38 HZ PHE 38 -2.692 9.894 -4.677 302 H VAL 39 HN VAL 39 0.012 2.880 -3.236 303 HA VAL 39 HA VAL 39 1.652 3.068 -0.803 304 HB VAL 39 HB VAL 39 2.785 0.918 -1.557 305 HG11 VAL 39 HG11 VAL 39 0.979 1.337 0.279 306 HG12 VAL 39 HG12 VAL 39 1.450 -0.308 -0.148 307 HG13 VAL 39 HG13 VAL 39 -0.041 0.379 -0.794 308 HG21 VAL 39 HG21 VAL 39 2.092 0.383 -3.669 309 HG22 VAL 39 HG22 VAL 39 0.449 0.957 -3.387 310 HG23 VAL 39 HG23 VAL 39 0.972 -0.585 -2.712 311 H ARG 40 HN ARG 40 3.427 4.215 -1.134 312 HA ARG 40 HA ARG 40 4.963 4.173 -3.555 313 HB2 ARG 40 HB2 ARG 40 4.573 6.434 -4.308 314 HB3 ARG 40 HB1 ARG 40 3.020 5.607 -4.265 315 HG2 ARG 40 HG2 ARG 40 2.224 6.874 -2.554 316 HG3 ARG 40 HG1 ARG 40 3.813 7.083 -1.824 317 HD2 ARG 40 HD2 ARG 40 4.322 8.583 -3.855 318 HD3 ARG 40 HD1 ARG 40 2.570 8.597 -4.100 319 HE ARG 40 HE ARG 40 2.814 9.249 -1.489 320 HH11 ARG 40 HH11 ARG 40 4.226 10.574 -4.422 321 HH12 ARG 40 HH12 ARG 40 4.452 12.158 -3.734 322 HH21 ARG 40 HH21 ARG 40 3.099 11.309 -0.612 323 HH22 ARG 40 HH22 ARG 40 3.802 12.573 -1.576 324 H GLY 41 HN GLY 41 6.405 6.386 -3.445 325 HA2 GLY 41 HA2 GLY 41 7.327 6.560 -0.657 326 HA3 GLY 41 HA1 GLY 41 8.311 6.911 -2.071 327 HA PRO 42 HA PRO 42 5.842 10.632 -0.082 328 HB2 PRO 42 HB2 PRO 42 8.443 11.344 1.109 329 HB3 PRO 42 HB1 PRO 42 6.837 11.349 1.841 330 HG2 PRO 42 HG2 PRO 42 8.698 9.497 2.443 331 HG3 PRO 42 HG1 PRO 42 6.971 9.147 2.444 332 HD2 PRO 42 HD2 PRO 42 9.048 8.390 0.474 333 HD3 PRO 42 HD1 PRO 42 7.582 7.523 0.964 334 H GLU 43 HN GLU 43 6.464 12.966 -0.279 335 HA GLU 43 HA GLU 43 7.131 13.545 -2.908 336 HB2 GLU 43 HB2 GLU 43 7.215 15.339 -0.484 337 HB3 GLU 43 HB1 GLU 43 7.282 15.898 -2.151 338 HG2 GLU 43 HG2 GLU 43 5.009 14.351 -0.934 339 HG3 GLU 43 HG1 GLU 43 5.047 16.095 -1.181 340 H HIS 44 HN HIS 44 8.912 13.505 -3.934 341 HA HIS 44 HA HIS 44 11.031 14.028 -4.579 342 HB2 HIS 44 HB2 HIS 44 11.363 14.924 -1.734 343 HB3 HIS 44 HB1 HIS 44 12.748 14.775 -2.811 344 HD1 HIS 44 HD1 HIS 44 12.428 16.176 -5.159 345 HD2 HIS 44 HD2 HIS 44 10.170 17.361 -1.872 346 HE1 HIS 44 HE1 HIS 44 11.643 18.509 -5.677 347 HE2 HIS 44 HE2 HIS 44 10.111 19.122 -3.771 348 H SER 45 HN SER 45 10.230 11.829 -2.103 349 HA SER 45 HA SER 45 12.625 10.251 -2.693 350 HB2 SER 45 HB2 SER 45 11.482 8.677 -0.959 351 HB3 SER 45 HB1 SER 45 12.201 10.174 -0.375 352 HG SER 45 HG SER 45 9.497 10.068 -1.144 353 H ASN 46 HN ASN 46 12.484 9.063 -4.514 354 HA ASN 46 HA ASN 46 9.846 7.987 -5.237 355 HB2 ASN 46 HB2 ASN 46 12.281 8.661 -6.827 356 HB3 ASN 46 HB1 ASN 46 11.222 7.381 -7.412 357 HD21 ASN 46 HD21 ASN 46 8.831 8.644 -6.288 358 HD22 ASN 46 HD22 ASN 46 8.463 9.972 -7.336 359 H ILE 47 HN ILE 47 9.414 5.896 -5.094 360 HA ILE 47 HA ILE 47 11.440 4.274 -3.838 361 HB ILE 47 HB ILE 47 9.776 2.675 -3.361 362 HG12 ILE 47 HG12 ILE 47 7.856 4.285 -5.041 363 HG13 ILE 47 HG11 ILE 47 8.643 2.792 -5.560 364 HG21 ILE 47 HG21 ILE 47 9.862 4.598 -1.954 365 HG22 ILE 47 HG22 ILE 47 8.198 4.043 -2.102 366 HG23 ILE 47 HG23 ILE 47 8.741 5.463 -2.998 367 HD11 ILE 47 HD11 ILE 47 7.222 2.688 -2.996 368 HD12 ILE 47 HD12 ILE 47 7.319 1.493 -4.290 369 HD13 ILE 47 HD13 ILE 47 6.219 2.866 -4.436 370 H GLN 48 HN GLN 48 10.193 4.648 -6.997 371 HA GLN 48 HA GLN 48 10.372 2.021 -7.971 372 HB2 GLN 48 HB2 GLN 48 9.245 3.794 -9.215 373 HB3 GLN 48 HB1 GLN 48 10.749 4.683 -9.374 374 HG2 GLN 48 HG2 GLN 48 10.215 3.639 -11.459 375 HG3 GLN 48 HG1 GLN 48 11.638 2.880 -10.786 376 HE21 GLN 48 HE21 GLN 48 8.337 2.283 -9.770 377 HE22 GLN 48 HE22 GLN 48 8.285 0.636 -10.282 378 H HIS 49 HN HIS 49 12.754 4.037 -6.835 379 HA HIS 49 HA HIS 49 14.937 3.057 -8.427 380 HB2 HIS 49 HB2 HIS 49 14.694 4.833 -6.028 381 HB3 HIS 49 HB1 HIS 49 16.267 4.155 -6.443 382 HD1 HIS 49 HD1 HIS 49 16.224 4.433 -9.492 383 HD2 HIS 49 HD2 HIS 49 14.931 7.394 -6.879 384 HE1 HIS 49 HE1 HIS 49 16.316 6.579 -10.797 385 HE2 HIS 49 HE2 HIS 49 15.328 8.314 -9.267 386 H PHE 50 HN PHE 50 13.501 2.283 -5.288 387 HA PHE 50 HA PHE 50 15.391 0.045 -5.111 388 HB2 PHE 50 HB2 PHE 50 15.193 0.163 -2.651 389 HB3 PHE 50 HB1 PHE 50 15.883 1.621 -3.364 390 HD1 PHE 50 HD1 PHE 50 12.838 0.225 -1.768 391 HD2 PHE 50 HD2 PHE 50 14.883 3.703 -3.115 392 HE1 PHE 50 HE1 PHE 50 11.243 1.623 -0.556 393 HE2 PHE 50 HE2 PHE 50 13.256 5.111 -1.917 394 HZ PHE 50 HZ PHE 50 11.435 4.073 -0.633 395 H VAL 51 HN VAL 51 12.317 0.721 -5.824 396 HA VAL 51 HA VAL 51 11.259 -1.761 -4.647 397 HB VAL 51 HB VAL 51 9.886 0.881 -5.187 398 HG11 VAL 51 HG11 VAL 51 7.936 -0.641 -4.062 399 HG12 VAL 51 HG12 VAL 51 8.737 -1.841 -5.094 400 HG13 VAL 51 HG13 VAL 51 8.093 -0.360 -5.805 401 HG21 VAL 51 HG21 VAL 51 9.199 0.452 -2.760 402 HG22 VAL 51 HG22 VAL 51 10.882 0.874 -3.065 403 HG23 VAL 51 HG23 VAL 51 10.434 -0.803 -2.758 404 H GLU 52 HN GLU 52 10.270 -3.181 -5.962 405 HA GLU 52 HA GLU 52 10.847 -2.806 -8.816 406 HB2 GLU 52 HB2 GLU 52 11.832 -4.739 -7.605 407 HB3 GLU 52 HB1 GLU 52 10.214 -5.321 -7.251 408 HG2 GLU 52 HG2 GLU 52 11.135 -6.574 -9.068 409 HG3 GLU 52 HG1 GLU 52 9.807 -5.583 -9.669 410 H LYS 53 HN LYS 53 8.355 -4.503 -6.931 411 HA LYS 53 HA LYS 53 6.286 -3.346 -8.631 412 HB2 LYS 53 HB2 LYS 53 5.216 -5.568 -8.882 413 HB3 LYS 53 HB1 LYS 53 6.790 -5.477 -9.659 414 HG2 LYS 53 HG2 LYS 53 7.800 -6.681 -7.819 415 HG3 LYS 53 HG1 LYS 53 6.256 -6.742 -6.975 416 HD2 LYS 53 HD2 LYS 53 6.767 -7.929 -9.704 417 HD3 LYS 53 HD1 LYS 53 6.872 -8.841 -8.199 418 HE2 LYS 53 HE2 LYS 53 4.563 -8.575 -7.764 419 HE3 LYS 53 HE1 LYS 53 4.415 -7.330 -9.008 420 HZ1 LYS 53 HZ1 LYS 53 5.104 -10.165 -9.556 421 HZ2 LYS 53 HZ2 LYS 53 4.765 -8.962 -10.702 422 HZ3 LYS 53 HZ3 LYS 53 3.536 -9.529 -9.679 423 H VAL 54 HN VAL 54 4.072 -4.279 -7.680 424 HA VAL 54 HA VAL 54 4.144 -4.284 -4.763 425 HB VAL 54 HB VAL 54 3.116 -2.047 -6.450 426 HG11 VAL 54 HG11 VAL 54 2.085 -2.046 -3.721 427 HG12 VAL 54 HG12 VAL 54 1.335 -3.251 -4.765 428 HG13 VAL 54 HG13 VAL 54 1.309 -1.545 -5.220 429 HG21 VAL 54 HG21 VAL 54 3.868 -1.043 -4.073 430 HG22 VAL 54 HG22 VAL 54 4.962 -1.284 -5.427 431 HG23 VAL 54 HG23 VAL 54 4.870 -2.486 -4.138 432 H VAL 55 HN VAL 55 2.112 -4.946 -3.815 433 HA VAL 55 HA VAL 55 0.103 -5.985 -5.666 434 HB VAL 55 HB VAL 55 2.102 -7.669 -4.600 435 HG11 VAL 55 HG11 VAL 55 -0.582 -8.169 -3.329 436 HG12 VAL 55 HG12 VAL 55 0.942 -7.826 -2.502 437 HG13 VAL 55 HG13 VAL 55 0.739 -9.341 -3.385 438 HG21 VAL 55 HG21 VAL 55 -0.524 -8.402 -5.893 439 HG22 VAL 55 HG22 VAL 55 0.932 -9.396 -5.822 440 HG23 VAL 55 HG23 VAL 55 0.935 -7.895 -6.748 441 H PHE 56 HN PHE 56 -1.915 -6.282 -4.742 442 HA PHE 56 HA PHE 56 -2.204 -5.464 -1.924 443 HB2 PHE 56 HB2 PHE 56 -3.796 -4.625 -4.351 444 HB3 PHE 56 HB1 PHE 56 -4.510 -4.588 -2.738 445 HD1 PHE 56 HD1 PHE 56 -1.666 -3.297 -4.750 446 HD2 PHE 56 HD2 PHE 56 -4.180 -2.762 -1.354 447 HE1 PHE 56 HE1 PHE 56 -0.707 -1.065 -4.404 448 HE2 PHE 56 HE2 PHE 56 -3.221 -0.521 -1.006 449 HZ PHE 56 HZ PHE 56 -1.479 0.326 -2.529 450 H HIS 57 HN HIS 57 -3.428 -6.835 -0.698 451 HA HIS 57 HA HIS 57 -5.004 -8.871 -2.163 452 HB2 HIS 57 HB2 HIS 57 -3.887 -9.096 0.653 453 HB3 HIS 57 HB1 HIS 57 -4.794 -10.334 -0.216 454 HD1 HIS 57 HD1 HIS 57 -3.462 -11.993 -1.468 455 HD2 HIS 57 HD2 HIS 57 -1.271 -8.562 -0.594 456 HE1 HIS 57 HE1 HIS 57 -1.103 -12.486 -2.184 457 HE2 HIS 57 HE2 HIS 57 0.236 -10.508 -1.370 458 H LEU 58 HN LEU 58 -6.790 -7.523 -2.304 459 HA LEU 58 HA LEU 58 -7.942 -6.244 -0.041 460 HB2 LEU 58 HB2 LEU 58 -9.665 -7.088 -2.332 461 HB3 LEU 58 HB1 LEU 58 -9.677 -5.580 -1.431 462 HG LEU 58 HG LEU 58 -7.763 -6.391 -3.604 463 HD11 LEU 58 HD11 LEU 58 -8.752 -4.841 -4.894 464 HD12 LEU 58 HD12 LEU 58 -9.482 -3.981 -3.546 465 HD13 LEU 58 HD13 LEU 58 -10.124 -5.547 -4.054 466 HD21 LEU 58 HD21 LEU 58 -7.653 -4.084 -1.691 467 HD22 LEU 58 HD22 LEU 58 -6.914 -4.015 -3.288 468 HD23 LEU 58 HD23 LEU 58 -6.378 -5.223 -2.121 469 H HIS 59 HN HIS 59 -10.500 -6.966 0.332 470 HA HIS 59 HA HIS 59 -10.213 -9.450 1.729 471 HB2 HIS 59 HB2 HIS 59 -12.003 -7.280 1.836 472 HB3 HIS 59 HB1 HIS 59 -12.982 -8.674 1.393 473 HD1 HIS 59 HD1 HIS 59 -14.108 -9.359 3.518 474 HD2 HIS 59 HD2 HIS 59 -10.060 -8.543 4.065 475 HE1 HIS 59 HE1 HIS 59 -13.615 -9.925 5.917 476 HE2 HIS 59 HE2 HIS 59 -11.143 -9.528 6.202 477 H GLU 60 HN GLU 60 -11.114 -11.415 1.282 478 HA GLU 60 HA GLU 60 -10.941 -12.205 -1.396 479 HB2 GLU 60 HB2 GLU 60 -12.181 -13.690 0.913 480 HB3 GLU 60 HB1 GLU 60 -11.649 -14.406 -0.605 481 HG2 GLU 60 HG2 GLU 60 -9.349 -13.659 -0.109 482 HG3 GLU 60 HG1 GLU 60 -9.911 -13.058 1.450 483 H SER 61 HN SER 61 -13.659 -11.127 0.433 484 HA SER 61 HA SER 61 -15.749 -12.035 -1.198 485 HB2 SER 61 HB2 SER 61 -16.006 -10.917 1.030 486 HB3 SER 61 HB1 SER 61 -15.595 -9.384 0.263 487 HG SER 61 HG SER 61 -17.709 -10.991 -0.707 488 H PHE 62 HN PHE 62 -13.340 -9.601 -1.712 489 HA PHE 62 HA PHE 62 -14.707 -8.221 -3.837 490 HB2 PHE 62 HB2 PHE 62 -11.827 -8.210 -2.901 491 HB3 PHE 62 HB1 PHE 62 -12.416 -7.221 -4.226 492 HD1 PHE 62 HD1 PHE 62 -13.212 -7.944 -0.653 493 HD2 PHE 62 HD2 PHE 62 -13.012 -5.066 -3.766 494 HE1 PHE 62 HE1 PHE 62 -13.829 -6.173 0.945 495 HE2 PHE 62 HE2 PHE 62 -13.634 -3.290 -2.187 496 HZ PHE 62 HZ PHE 62 -14.042 -3.844 0.178 497 HA PRO 63 HA PRO 63 -13.704 -11.203 -7.009 498 HB2 PRO 63 HB2 PRO 63 -14.061 -8.935 -8.862 499 HB3 PRO 63 HB1 PRO 63 -14.938 -10.466 -8.784 500 HG2 PRO 63 HG2 PRO 63 -16.073 -8.154 -8.032 501 HG3 PRO 63 HG1 PRO 63 -16.433 -9.684 -7.211 502 HD2 PRO 63 HD2 PRO 63 -14.641 -7.446 -6.352 503 HD3 PRO 63 HD1 PRO 63 -15.753 -8.436 -5.383 504 H ARG 64 HN ARG 64 -11.664 -11.770 -7.419 505 HA ARG 64 HA ARG 64 -9.399 -11.673 -7.678 506 HB2 ARG 64 HB2 ARG 64 -10.147 -9.312 -9.415 507 HB3 ARG 64 HB1 ARG 64 -8.554 -10.053 -9.373 508 HG2 ARG 64 HG2 ARG 64 -9.439 -12.114 -10.246 509 HG3 ARG 64 HG1 ARG 64 -11.081 -11.476 -10.177 510 HD2 ARG 64 HD2 ARG 64 -8.831 -10.434 -11.880 511 HD3 ARG 64 HD1 ARG 64 -10.231 -11.356 -12.429 512 HE ARG 64 HE ARG 64 -11.539 -9.363 -11.473 513 HH11 ARG 64 HH11 ARG 64 -8.382 -9.125 -12.970 514 HH12 ARG 64 HH12 ARG 64 -8.633 -7.504 -13.540 515 HH21 ARG 64 HH21 ARG 64 -11.875 -7.243 -12.205 516 HH22 ARG 64 HH22 ARG 64 -10.623 -6.429 -13.109 517 HA PRO 65 HA PRO 65 -9.221 -8.285 -4.539 518 HB2 PRO 65 HB2 PRO 65 -8.055 -9.696 -2.540 519 HB3 PRO 65 HB1 PRO 65 -9.801 -9.660 -2.813 520 HG2 PRO 65 HG2 PRO 65 -7.811 -11.759 -3.533 521 HG3 PRO 65 HG1 PRO 65 -9.481 -11.935 -2.963 522 HD2 PRO 65 HD2 PRO 65 -8.715 -12.188 -5.588 523 HD3 PRO 65 HD1 PRO 65 -10.342 -11.720 -5.064 524 H LYS 66 HN LYS 66 -6.763 -10.423 -5.726 525 HA LYS 66 HA LYS 66 -4.659 -8.770 -4.685 526 HB2 LYS 66 HB2 LYS 66 -4.347 -11.189 -4.680 527 HB3 LYS 66 HB1 LYS 66 -4.504 -11.220 -6.431 528 HG2 LYS 66 HG2 LYS 66 -2.474 -9.958 -6.704 529 HG3 LYS 66 HG1 LYS 66 -2.360 -9.701 -4.963 530 HD2 LYS 66 HD2 LYS 66 -1.609 -11.783 -4.555 531 HD3 LYS 66 HD1 LYS 66 -2.528 -12.507 -5.876 532 HE2 LYS 66 HE2 LYS 66 -0.909 -11.481 -7.462 533 HE3 LYS 66 HE1 LYS 66 0.033 -10.927 -6.075 534 HZ1 LYS 66 HZ1 LYS 66 -0.611 -13.763 -6.683 535 HZ2 LYS 66 HZ2 LYS 66 0.344 -13.211 -5.395 536 HZ3 LYS 66 HZ3 LYS 66 0.880 -13.015 -6.991 537 H ARG 67 HN ARG 67 -4.352 -6.938 -5.656 538 HA ARG 67 HA ARG 67 -4.293 -6.882 -8.599 539 HB2 ARG 67 HB2 ARG 67 -4.417 -4.482 -6.765 540 HB3 ARG 67 HB1 ARG 67 -4.773 -4.553 -8.488 541 HG2 ARG 67 HG2 ARG 67 -6.386 -5.792 -6.275 542 HG3 ARG 67 HG1 ARG 67 -6.814 -4.357 -7.216 543 HD2 ARG 67 HD2 ARG 67 -6.729 -5.823 -9.271 544 HD3 ARG 67 HD1 ARG 67 -6.588 -7.207 -8.175 545 HE ARG 67 HE ARG 67 -8.798 -6.986 -7.616 546 HH11 ARG 67 HH11 ARG 67 -7.826 -4.200 -9.533 547 HH12 ARG 67 HH12 ARG 67 -9.465 -3.675 -9.803 548 HH21 ARG 67 HH21 ARG 67 -10.926 -6.299 -8.006 549 HH22 ARG 67 HH22 ARG 67 -11.217 -4.856 -8.924 550 H VAL 68 HN VAL 68 -2.423 -6.225 -9.617 551 HA VAL 68 HA VAL 68 -0.141 -5.774 -7.812 552 HB VAL 68 HB VAL 68 1.260 -7.078 -9.073 553 HG11 VAL 68 HG11 VAL 68 -0.420 -8.548 -8.116 554 HG12 VAL 68 HG12 VAL 68 0.131 -9.174 -9.675 555 HG13 VAL 68 HG13 VAL 68 -1.427 -8.357 -9.557 556 HG21 VAL 68 HG21 VAL 68 0.999 -5.953 -11.172 557 HG22 VAL 68 HG22 VAL 68 -0.572 -6.715 -11.437 558 HG23 VAL 68 HG23 VAL 68 0.896 -7.696 -11.432 559 H CYS 69 HN CYS 69 1.268 -4.145 -8.254 560 HA CYS 69 HA CYS 69 0.688 -2.471 -10.609 561 HB2 CYS 69 HB2 CYS 69 1.295 -1.564 -7.785 562 HB3 CYS 69 HB1 CYS 69 1.254 -0.493 -9.184 563 HG CYS 69 HG CYS 69 -1.547 -2.093 -9.246 564 H LYS 70 HN LYS 70 2.406 -2.454 -11.908 565 HA LYS 70 HA LYS 70 5.083 -2.913 -10.752 566 HB2 LYS 70 HB2 LYS 70 4.267 -3.216 -13.650 567 HB3 LYS 70 HB1 LYS 70 5.731 -3.810 -12.882 568 HG2 LYS 70 HG2 LYS 70 4.613 -5.570 -11.831 569 HG3 LYS 70 HG1 LYS 70 3.044 -4.792 -12.012 570 HD2 LYS 70 HD2 LYS 70 3.180 -5.121 -14.447 571 HD3 LYS 70 HD1 LYS 70 4.727 -5.940 -14.234 572 HE2 LYS 70 HE2 LYS 70 3.724 -7.749 -13.095 573 HE3 LYS 70 HE1 LYS 70 2.210 -6.872 -12.877 574 HZ1 LYS 70 HZ1 LYS 70 2.071 -8.550 -14.633 575 HZ2 LYS 70 HZ2 LYS 70 3.298 -7.758 -15.498 576 HZ3 LYS 70 HZ3 LYS 70 1.811 -6.986 -15.232 577 H ASP 71 HN ASP 71 3.318 -0.403 -11.342 578 HA ASP 71 HA ASP 71 5.345 1.123 -12.828 579 HB2 ASP 71 HB2 ASP 71 2.354 1.096 -13.098 580 HB3 ASP 71 HB1 ASP 71 3.261 2.536 -13.544 581 HA PRO 72 HA PRO 72 5.263 4.688 -9.942 582 HB2 PRO 72 HB2 PRO 72 3.583 5.796 -12.184 583 HB3 PRO 72 HB1 PRO 72 4.760 6.638 -11.165 584 HG2 PRO 72 HG2 PRO 72 5.510 5.792 -13.541 585 HG3 PRO 72 HG1 PRO 72 6.582 5.538 -12.146 586 HD2 PRO 72 HD2 PRO 72 4.950 3.579 -13.648 587 HD3 PRO 72 HD1 PRO 72 6.453 3.340 -12.742 588 HA PRO 73 HA PRO 73 2.470 5.512 -6.983 589 HB2 PRO 73 HB2 PRO 73 0.254 6.525 -8.716 590 HB3 PRO 73 HB1 PRO 73 0.705 7.017 -7.076 591 HG2 PRO 73 HG2 PRO 73 1.535 8.326 -9.357 592 HG3 PRO 73 HG1 PRO 73 2.400 8.371 -7.815 593 HD2 PRO 73 HD2 PRO 73 3.285 7.232 -10.268 594 HD3 PRO 73 HD1 PRO 73 4.107 7.178 -8.697 595 H TYR 74 HN TYR 74 2.088 3.585 -6.332 596 HA TYR 74 HA TYR 74 0.626 1.640 -7.860 597 HB2 TYR 74 HB2 TYR 74 1.775 1.394 -5.079 598 HB3 TYR 74 HB1 TYR 74 1.407 0.077 -6.177 599 HD1 TYR 74 HD2 TYR 74 3.608 3.064 -5.817 600 HD2 TYR 74 HD1 TYR 74 3.106 -0.772 -7.560 601 HE1 TYR 74 HE2 TYR 74 5.911 3.144 -6.637 602 HE2 TYR 74 HE1 TYR 74 5.424 -0.707 -8.391 603 HH TYR 74 HH TYR 74 7.696 1.394 -7.264 604 H LYS 75 HN LYS 75 -1.449 1.112 -7.561 605 HA LYS 75 HA LYS 75 -2.894 2.043 -5.219 606 HB2 LYS 75 HB2 LYS 75 -4.465 3.360 -6.726 607 HB3 LYS 75 HB1 LYS 75 -2.893 4.081 -6.419 608 HG2 LYS 75 HG2 LYS 75 -2.109 3.572 -8.561 609 HG3 LYS 75 HG1 LYS 75 -3.397 2.414 -8.856 610 HD2 LYS 75 HD2 LYS 75 -4.028 4.277 -10.104 611 HD3 LYS 75 HD1 LYS 75 -4.972 4.453 -8.634 612 HE2 LYS 75 HE2 LYS 75 -4.046 6.575 -9.163 613 HE3 LYS 75 HE1 LYS 75 -3.180 5.933 -7.775 614 HZ1 LYS 75 HZ1 LYS 75 -1.389 5.241 -9.242 615 HZ2 LYS 75 HZ2 LYS 75 -1.668 6.909 -9.396 616 HZ3 LYS 75 HZ3 LYS 75 -2.234 5.842 -10.584 617 H VAL 76 HN VAL 76 -4.905 1.245 -5.021 618 HA VAL 76 HA VAL 76 -5.937 -0.475 -7.181 619 HB VAL 76 HB VAL 76 -5.896 -1.103 -4.242 620 HG11 VAL 76 HG11 VAL 76 -8.207 -1.271 -5.219 621 HG12 VAL 76 HG12 VAL 76 -7.562 -2.762 -4.534 622 HG13 VAL 76 HG13 VAL 76 -7.583 -2.530 -6.284 623 HG21 VAL 76 HG21 VAL 76 -4.050 -1.992 -5.517 624 HG22 VAL 76 HG22 VAL 76 -5.152 -2.635 -6.726 625 HG23 VAL 76 HG23 VAL 76 -5.144 -3.304 -5.096 626 H GLU 77 HN GLU 77 -7.876 0.099 -7.865 627 HA GLU 77 HA GLU 77 -9.554 1.745 -6.090 628 HB2 GLU 77 HB2 GLU 77 -9.493 1.680 -9.103 629 HB3 GLU 77 HB1 GLU 77 -10.624 2.597 -8.143 630 HG2 GLU 77 HG2 GLU 77 -8.899 3.947 -7.243 631 HG3 GLU 77 HG1 GLU 77 -7.693 2.947 -8.024 632 H GLU 78 HN GLU 78 -11.171 0.814 -5.304 633 HA GLU 78 HA GLU 78 -12.613 -1.199 -6.869 634 HB2 GLU 78 HB2 GLU 78 -11.005 -1.766 -4.476 635 HB3 GLU 78 HB1 GLU 78 -12.650 -2.386 -4.389 636 HG2 GLU 78 HG2 GLU 78 -10.522 -3.038 -6.414 637 HG3 GLU 78 HG1 GLU 78 -11.312 -4.107 -5.259 638 H SER 79 HN SER 79 -14.448 -2.080 -5.277 639 HA SER 79 HA SER 79 -15.694 0.170 -3.918 640 HB2 SER 79 HB2 SER 79 -16.318 0.296 -6.337 641 HB3 SER 79 HB1 SER 79 -17.050 -1.303 -6.192 642 HG SER 79 HG SER 79 -17.874 1.169 -5.160 643 H GLY 80 HN GLY 80 -17.176 -0.452 -2.386 644 HA2 GLY 80 HA2 GLY 80 -18.039 -3.177 -2.078 645 HA3 GLY 80 HA1 GLY 80 -16.758 -2.733 -0.955 646 H TYR 81 HN TYR 81 -18.332 -3.022 0.809 647 HA TYR 81 HA TYR 81 -19.866 -0.553 1.145 648 HB2 TYR 81 HB2 TYR 81 -21.857 -1.828 1.973 649 HB3 TYR 81 HB1 TYR 81 -21.527 -2.024 0.256 650 HD1 TYR 81 HD2 TYR 81 -21.374 -3.724 3.535 651 HD2 TYR 81 HD1 TYR 81 -20.947 -4.146 -0.676 652 HE1 TYR 81 HE2 TYR 81 -21.354 -6.166 3.787 653 HE2 TYR 81 HE1 TYR 81 -20.928 -6.592 -0.427 654 HH TYR 81 HH TYR 81 -21.773 -8.155 2.507 655 H ALA 82 HN ALA 82 -17.429 -1.925 2.352 656 HA ALA 82 HA ALA 82 -17.874 -0.996 4.997 657 HB1 ALA 82 HB1 ALA 82 -18.951 -3.048 5.446 658 HB2 ALA 82 HB2 ALA 82 -17.324 -3.218 6.096 659 HB3 ALA 82 HB3 ALA 82 -17.742 -3.969 4.555 660 H GLY 83 HN GLY 83 -15.942 -1.282 6.379 661 HA2 GLY 83 HA2 GLY 83 -13.529 -1.161 4.717 662 HA3 GLY 83 HA1 GLY 83 -13.699 -0.500 6.338 663 H PHE 84 HN PHE 84 -11.494 -1.798 6.045 664 HA PHE 84 HA PHE 84 -11.477 -4.005 7.753 665 HB2 PHE 84 HB2 PHE 84 -10.955 -5.839 6.166 666 HB3 PHE 84 HB1 PHE 84 -12.592 -5.234 5.952 667 HD1 PHE 84 HD1 PHE 84 -12.959 -3.518 4.065 668 HD2 PHE 84 HD2 PHE 84 -9.523 -6.018 4.328 669 HE1 PHE 84 HE1 PHE 84 -12.540 -3.180 1.670 670 HE2 PHE 84 HE2 PHE 84 -9.088 -5.684 1.941 671 HZ PHE 84 HZ PHE 84 -10.590 -4.264 0.595 672 H ILE 85 HN ILE 85 -9.298 -4.819 8.086 673 HA ILE 85 HA ILE 85 -7.159 -3.125 7.297 674 HB ILE 85 HB ILE 85 -7.242 -5.883 8.516 675 HG12 ILE 85 HG12 ILE 85 -7.766 -3.933 9.952 676 HG13 ILE 85 HG11 ILE 85 -6.307 -4.777 10.456 677 HG21 ILE 85 HG21 ILE 85 -4.757 -4.335 7.803 678 HG22 ILE 85 HG22 ILE 85 -5.295 -5.840 7.057 679 HG23 ILE 85 HG23 ILE 85 -4.810 -5.820 8.753 680 HD11 ILE 85 HD11 ILE 85 -6.304 -2.279 8.795 681 HD12 ILE 85 HD12 ILE 85 -4.917 -3.078 9.530 682 HD13 ILE 85 HD13 ILE 85 -6.135 -2.311 10.548 683 H LEU 86 HN LEU 86 -6.043 -3.095 5.432 684 HA LEU 86 HA LEU 86 -6.385 -5.400 3.629 685 HB2 LEU 86 HB2 LEU 86 -7.179 -2.964 3.024 686 HB3 LEU 86 HB1 LEU 86 -5.473 -2.725 2.675 687 HG LEU 86 HG LEU 86 -6.780 -5.098 1.461 688 HD11 LEU 86 HD11 LEU 86 -7.076 -2.376 0.224 689 HD12 LEU 86 HD12 LEU 86 -8.350 -3.133 1.181 690 HD13 LEU 86 HD13 LEU 86 -7.784 -3.906 -0.299 691 HD21 LEU 86 HD21 LEU 86 -5.245 -3.434 -0.247 692 HD22 LEU 86 HD22 LEU 86 -4.940 -5.097 0.245 693 HD23 LEU 86 HD23 LEU 86 -4.347 -3.755 1.231 694 HA PRO 87 HA PRO 87 -2.000 -5.999 4.544 695 HB2 PRO 87 HB2 PRO 87 -1.972 -8.367 3.112 696 HB3 PRO 87 HB1 PRO 87 -2.354 -8.240 4.829 697 HG2 PRO 87 HG2 PRO 87 -4.198 -8.432 2.485 698 HG3 PRO 87 HG1 PRO 87 -4.325 -9.200 4.079 699 HD2 PRO 87 HD2 PRO 87 -5.785 -7.036 3.454 700 HD3 PRO 87 HD1 PRO 87 -5.127 -7.274 5.085 701 H ILE 88 HN ILE 88 -1.085 -4.429 3.241 702 HA ILE 88 HA ILE 88 -1.065 -4.867 0.352 703 HB ILE 88 HB ILE 88 0.054 -2.478 1.829 704 HG12 ILE 88 HG12 ILE 88 -2.617 -2.518 0.444 705 HG13 ILE 88 HG11 ILE 88 -2.492 -3.047 2.122 706 HG21 ILE 88 HG21 ILE 88 0.840 -2.876 -0.469 707 HG22 ILE 88 HG22 ILE 88 -0.117 -1.400 -0.332 708 HG23 ILE 88 HG23 ILE 88 -0.834 -2.854 -1.028 709 HD11 ILE 88 HD11 ILE 88 -1.659 -0.343 1.098 710 HD12 ILE 88 HD12 ILE 88 -1.652 -0.882 2.771 711 HD13 ILE 88 HD13 ILE 88 -3.178 -0.708 1.907 712 H GLU 89 HN GLU 89 0.886 -5.065 -0.804 713 HA GLU 89 HA GLU 89 3.280 -5.487 0.854 714 HB2 GLU 89 HB2 GLU 89 2.364 -7.234 -1.431 715 HB3 GLU 89 HB1 GLU 89 3.922 -7.359 -0.629 716 HG2 GLU 89 HG2 GLU 89 2.743 -7.863 1.486 717 HG3 GLU 89 HG1 GLU 89 1.219 -7.848 0.599 718 H VAL 90 HN VAL 90 5.050 -4.521 0.159 719 HA VAL 90 HA VAL 90 5.118 -3.559 -2.620 720 HB VAL 90 HB VAL 90 6.740 -2.427 -0.355 721 HG11 VAL 90 HG11 VAL 90 7.313 -0.744 -1.950 722 HG12 VAL 90 HG12 VAL 90 6.238 -1.438 -3.144 723 HG13 VAL 90 HG13 VAL 90 7.679 -2.314 -2.633 724 HG21 VAL 90 HG21 VAL 90 4.211 -2.073 -0.251 725 HG22 VAL 90 HG22 VAL 90 4.407 -1.109 -1.714 726 HG23 VAL 90 HG23 VAL 90 5.224 -0.631 -0.226 727 H TYR 91 HN TYR 91 6.614 -4.403 -3.924 728 HA TYR 91 HA TYR 91 8.505 -6.321 -2.773 729 HB2 TYR 91 HB2 TYR 91 7.565 -5.745 -5.548 730 HB3 TYR 91 HB1 TYR 91 9.073 -6.615 -5.310 731 HD1 TYR 91 HD1 TYR 91 5.810 -6.803 -3.502 732 HD2 TYR 91 HD2 TYR 91 8.703 -8.826 -5.869 733 HE1 TYR 91 HE1 TYR 91 4.575 -8.898 -3.213 734 HE2 TYR 91 HE2 TYR 91 7.462 -10.936 -5.601 735 HH TYR 91 HH TYR 91 4.308 -11.033 -4.098 736 H PHE 92 HN PHE 92 10.622 -6.108 -2.683 737 HA PHE 92 HA PHE 92 11.721 -3.456 -3.342 738 HB2 PHE 92 HB2 PHE 92 12.558 -5.588 -1.358 739 HB3 PHE 92 HB1 PHE 92 13.509 -4.137 -1.686 740 HD1 PHE 92 HD1 PHE 92 11.116 -2.263 -1.986 741 HD2 PHE 92 HD2 PHE 92 12.111 -5.184 0.937 742 HE1 PHE 92 HE1 PHE 92 9.869 -0.989 -0.302 743 HE2 PHE 92 HE2 PHE 92 10.829 -3.914 2.623 744 HZ PHE 92 HZ PHE 92 9.731 -1.813 2.000 745 H LYS 93 HN LYS 93 13.986 -3.394 -4.113 746 HA LYS 93 HA LYS 93 14.685 -5.736 -5.773 747 HB2 LYS 93 HB2 LYS 93 15.798 -2.927 -5.933 748 HB3 LYS 93 HB1 LYS 93 16.068 -4.224 -7.080 749 HG2 LYS 93 HG2 LYS 93 13.861 -4.058 -7.912 750 HG3 LYS 93 HG1 LYS 93 13.375 -2.990 -6.587 751 HD2 LYS 93 HD2 LYS 93 14.798 -1.237 -7.379 752 HD3 LYS 93 HD1 LYS 93 15.567 -2.302 -8.559 753 HE2 LYS 93 HE2 LYS 93 13.106 -2.519 -9.476 754 HE3 LYS 93 HE1 LYS 93 12.863 -1.002 -8.607 755 HZ1 LYS 93 HZ1 LYS 93 13.459 -0.539 -10.861 756 HZ2 LYS 93 HZ2 LYS 93 14.849 -1.499 -10.754 757 HZ3 LYS 93 HZ3 LYS 93 14.741 -0.067 -9.859 758 H ASN 94 HN ASN 94 15.821 -6.938 -4.117 759 HA ASN 94 HA ASN 94 18.507 -6.002 -3.748 760 HB2 ASN 94 HB2 ASN 94 18.499 -6.179 -1.275 761 HB3 ASN 94 HB1 ASN 94 17.567 -4.820 -1.899 762 HD21 ASN 94 HD21 ASN 94 17.367 -5.992 0.662 763 HD22 ASN 94 HD22 ASN 94 15.778 -6.650 0.834 764 H LYS 95 HN LYS 95 19.919 -7.465 -2.731 765 HA LYS 95 HA LYS 95 19.070 -10.291 -2.729 766 HB2 LYS 95 HB2 LYS 95 20.937 -9.601 -4.228 767 HB3 LYS 95 HB1 LYS 95 21.801 -9.012 -2.819 768 HG2 LYS 95 HG2 LYS 95 21.008 -11.843 -2.726 769 HG3 LYS 95 HG1 LYS 95 22.200 -11.423 -3.953 770 HD2 LYS 95 HD2 LYS 95 22.430 -10.840 -0.997 771 HD3 LYS 95 HD1 LYS 95 23.257 -12.141 -1.852 772 HE2 LYS 95 HE2 LYS 95 24.342 -10.383 -3.278 773 HE3 LYS 95 HE1 LYS 95 23.650 -9.170 -2.200 774 HZ1 LYS 95 HZ1 LYS 95 25.459 -11.355 -1.323 775 HZ2 LYS 95 HZ2 LYS 95 24.880 -10.072 -0.375 776 HZ3 LYS 95 HZ3 LYS 95 25.958 -9.765 -1.646 777 H GLU 96 HN GLU 96 18.992 -7.901 -0.836 778 HA GLU 96 HA GLU 96 20.509 -8.820 1.482 779 HB2 GLU 96 HB2 GLU 96 19.109 -6.228 0.791 780 HB3 GLU 96 HB1 GLU 96 19.836 -6.537 2.366 781 HG2 GLU 96 HG2 GLU 96 21.361 -6.677 -0.217 782 HG3 GLU 96 HG1 GLU 96 21.225 -5.215 0.758 783 H GLU 97 HN GLU 97 18.847 -7.414 3.355 784 HA GLU 97 HA GLU 97 17.161 -9.123 4.521 785 HB2 GLU 97 HB2 GLU 97 16.703 -6.154 4.188 786 HB3 GLU 97 HB1 GLU 97 15.874 -7.168 5.365 787 HG2 GLU 97 HG2 GLU 97 18.861 -6.743 5.260 788 HG3 GLU 97 HG1 GLU 97 17.754 -5.853 6.300 789 HA PRO 98 HA PRO 98 13.314 -10.267 2.838 790 HB2 PRO 98 HB2 PRO 98 11.541 -8.248 3.846 791 HB3 PRO 98 HB1 PRO 98 11.747 -9.900 4.434 792 HG2 PRO 98 HG2 PRO 98 13.005 -7.383 5.371 793 HG3 PRO 98 HG1 PRO 98 12.584 -8.841 6.293 794 HD2 PRO 98 HD2 PRO 98 15.123 -8.332 5.732 795 HD3 PRO 98 HD1 PRO 98 14.502 -9.992 5.543 796 H ARG 99 HN ARG 99 12.698 -10.069 0.827 797 HA ARG 99 HA ARG 99 13.211 -7.598 -0.593 798 HB2 ARG 99 HB2 ARG 99 12.470 -10.379 -1.450 799 HB3 ARG 99 HB1 ARG 99 12.640 -9.047 -2.587 800 HG2 ARG 99 HG2 ARG 99 14.911 -8.777 -2.129 801 HG3 ARG 99 HG1 ARG 99 14.813 -9.762 -0.672 802 HD2 ARG 99 HD2 ARG 99 15.859 -10.745 -2.803 803 HD3 ARG 99 HD1 ARG 99 14.760 -11.746 -1.877 804 HE ARG 99 HE ARG 99 13.030 -10.983 -3.568 805 HH11 ARG 99 HH11 ARG 99 16.433 -11.186 -4.319 806 HH12 ARG 99 HH12 ARG 99 16.184 -11.511 -6.008 807 HH21 ARG 99 HH21 ARG 99 12.670 -11.420 -5.791 808 HH22 ARG 99 HH22 ARG 99 14.035 -11.676 -6.840 809 H LYS 100 HN LYS 100 10.806 -8.436 1.189 810 HA LYS 100 HA LYS 100 8.862 -6.944 -0.353 811 HB2 LYS 100 HB2 LYS 100 7.088 -8.682 0.078 812 HB3 LYS 100 HB1 LYS 100 8.278 -9.096 -1.144 813 HG2 LYS 100 HG2 LYS 100 9.507 -10.369 0.655 814 HG3 LYS 100 HG1 LYS 100 8.077 -10.142 1.660 815 HD2 LYS 100 HD2 LYS 100 8.026 -11.441 -1.061 816 HD3 LYS 100 HD1 LYS 100 8.196 -12.340 0.446 817 HE2 LYS 100 HE2 LYS 100 5.936 -12.492 0.098 818 HE3 LYS 100 HE1 LYS 100 6.010 -11.048 1.104 819 HZ1 LYS 100 HZ1 LYS 100 5.654 -11.192 -1.836 820 HZ2 LYS 100 HZ2 LYS 100 6.021 -9.757 -1.023 821 HZ3 LYS 100 HZ3 LYS 100 4.577 -10.569 -0.681 822 H VAL 101 HN VAL 101 7.533 -5.795 0.877 823 HA VAL 101 HA VAL 101 7.676 -6.232 3.782 824 HB VAL 101 HB VAL 101 8.897 -4.203 3.075 825 HG11 VAL 101 HG11 VAL 101 7.860 -3.417 1.146 826 HG12 VAL 101 HG12 VAL 101 7.399 -2.233 2.380 827 HG13 VAL 101 HG13 VAL 101 6.250 -3.476 1.882 828 HG21 VAL 101 HG21 VAL 101 7.900 -2.686 4.675 829 HG22 VAL 101 HG22 VAL 101 7.859 -4.341 5.285 830 HG23 VAL 101 HG23 VAL 101 6.393 -3.605 4.635 831 H ARG 102 HN ARG 102 5.774 -6.094 4.936 832 HA ARG 102 HA ARG 102 3.343 -5.988 3.287 833 HB2 ARG 102 HB2 ARG 102 3.965 -8.225 4.191 834 HB3 ARG 102 HB1 ARG 102 3.815 -7.570 5.812 835 HG2 ARG 102 HG2 ARG 102 1.491 -7.254 5.596 836 HG3 ARG 102 HG1 ARG 102 1.535 -7.526 3.852 837 HD2 ARG 102 HD2 ARG 102 0.652 -9.481 5.015 838 HD3 ARG 102 HD1 ARG 102 2.193 -9.861 4.248 839 HE ARG 102 HE ARG 102 1.909 -9.291 7.136 840 HH11 ARG 102 HH11 ARG 102 3.276 -11.140 4.483 841 HH12 ARG 102 HH12 ARG 102 4.286 -12.103 5.521 842 HH21 ARG 102 HH21 ARG 102 3.236 -10.577 8.495 843 HH22 ARG 102 HH22 ARG 102 4.261 -11.799 7.784 844 H PHE 103 HN PHE 103 2.202 -4.229 3.670 845 HA PHE 103 HA PHE 103 2.264 -3.067 6.369 846 HB2 PHE 103 HB2 PHE 103 1.540 -1.796 3.722 847 HB3 PHE 103 HB1 PHE 103 1.482 -0.983 5.279 848 HD1 PHE 103 HD1 PHE 103 3.979 -1.896 6.525 849 HD2 PHE 103 HD2 PHE 103 3.175 -0.704 2.517 850 HE1 PHE 103 HE1 PHE 103 6.315 -1.166 6.275 851 HE2 PHE 103 HE2 PHE 103 5.510 0.012 2.259 852 HZ PHE 103 HZ PHE 103 7.083 -0.214 4.139 853 H ASP 104 HN ASP 104 0.589 -3.736 7.533 854 HA ASP 104 HA ASP 104 -1.945 -4.399 6.331 855 HB2 ASP 104 HB2 ASP 104 -2.677 -4.783 8.690 856 HB3 ASP 104 HB1 ASP 104 -1.242 -5.700 8.250 857 H TYR 105 HN TYR 105 -2.630 -2.496 5.352 858 HA TYR 105 HA TYR 105 -2.783 -0.105 7.015 859 HB2 TYR 105 HB2 TYR 105 -1.874 0.188 4.769 860 HB3 TYR 105 HB1 TYR 105 -3.344 -0.494 4.066 861 HD1 TYR 105 HD1 TYR 105 -2.291 2.276 6.350 862 HD2 TYR 105 HD2 TYR 105 -4.974 0.942 3.344 863 HE1 TYR 105 HE1 TYR 105 -3.343 4.497 6.319 864 HE2 TYR 105 HE2 TYR 105 -6.016 3.150 3.279 865 HH TYR 105 HH TYR 105 -6.073 5.186 5.453 866 H ASP 106 HN ASP 106 -4.569 0.647 7.888 867 HA ASP 106 HA ASP 106 -6.960 -0.906 7.822 868 HB2 ASP 106 HB2 ASP 106 -6.147 0.288 9.838 869 HB3 ASP 106 HB1 ASP 106 -6.497 1.821 9.042 870 H LEU 107 HN LEU 107 -8.336 -0.841 6.172 871 HA LEU 107 HA LEU 107 -8.674 1.569 4.598 872 HB2 LEU 107 HB2 LEU 107 -9.138 -1.255 4.263 873 HB3 LEU 107 HB1 LEU 107 -10.568 -0.340 3.821 874 HG LEU 107 HG LEU 107 -9.088 1.010 2.283 875 HD11 LEU 107 HD11 LEU 107 -6.978 -0.102 1.609 876 HD12 LEU 107 HD12 LEU 107 -7.124 -1.137 3.032 877 HD13 LEU 107 HD13 LEU 107 -6.938 0.608 3.224 878 HD21 LEU 107 HD21 LEU 107 -8.924 -0.850 0.609 879 HD22 LEU 107 HD22 LEU 107 -10.510 -0.634 1.357 880 HD23 LEU 107 HD23 LEU 107 -9.455 -1.942 1.892 881 H PHE 108 HN PHE 108 -9.771 3.035 5.905 882 HA PHE 108 HA PHE 108 -12.356 2.137 6.961 883 HB2 PHE 108 HB2 PHE 108 -12.392 4.169 8.325 884 HB3 PHE 108 HB1 PHE 108 -10.939 3.231 8.627 885 HD1 PHE 108 HD2 PHE 108 -12.281 6.291 7.082 886 HD2 PHE 108 HD1 PHE 108 -8.769 4.138 8.162 887 HE1 PHE 108 HE2 PHE 108 -10.930 8.308 6.697 888 HE2 PHE 108 HE1 PHE 108 -7.416 6.159 7.789 889 HZ PHE 108 HZ PHE 108 -8.496 8.244 7.050 890 H LEU 109 HN LEU 109 -14.242 2.904 6.238 891 HA LEU 109 HA LEU 109 -14.150 4.975 4.131 892 HB2 LEU 109 HB2 LEU 109 -16.323 2.904 4.480 893 HB3 LEU 109 HB1 LEU 109 -16.047 3.951 3.102 894 HG LEU 109 HG LEU 109 -14.334 1.609 3.936 895 HD11 LEU 109 HD11 LEU 109 -16.519 1.081 2.857 896 HD12 LEU 109 HD12 LEU 109 -15.108 0.543 1.949 897 HD13 LEU 109 HD13 LEU 109 -15.980 1.991 1.447 898 HD21 LEU 109 HD21 LEU 109 -14.013 3.568 1.671 899 HD22 LEU 109 HD22 LEU 109 -13.134 2.043 1.810 900 HD23 LEU 109 HD23 LEU 109 -12.906 3.305 3.020 901 H HIS 110 HN HIS 110 -15.459 6.774 4.479 902 HA HIS 110 HA HIS 110 -16.670 6.937 7.105 903 HB2 HIS 110 HB2 HIS 110 -16.069 8.986 4.994 904 HB3 HIS 110 HB1 HIS 110 -17.148 9.365 6.333 905 HD1 HIS 110 HD1 HIS 110 -14.253 10.651 5.825 906 HD2 HIS 110 HD2 HIS 110 -15.199 7.666 8.562 907 HE1 HIS 110 HE1 HIS 110 -12.472 10.762 7.590 908 HE2 HIS 110 HE2 HIS 110 -13.116 9.017 9.292 909 H LEU 111 HN LEU 111 -18.809 8.356 7.104 910 HA LEU 111 HA LEU 111 -20.704 6.389 6.535 911 HB2 LEU 111 HB2 LEU 111 -20.607 8.877 7.899 912 HB3 LEU 111 HB1 LEU 111 -22.031 8.868 6.875 913 HG LEU 111 HG LEU 111 -22.426 8.044 9.201 914 HD11 LEU 111 HD11 LEU 111 -23.615 5.941 8.453 915 HD12 LEU 111 HD12 LEU 111 -22.940 6.244 6.853 916 HD13 LEU 111 HD13 LEU 111 -24.028 7.422 7.589 917 HD21 LEU 111 HD21 LEU 111 -20.779 5.699 8.274 918 HD22 LEU 111 HD22 LEU 111 -21.655 5.827 9.803 919 HD23 LEU 111 HD23 LEU 111 -20.280 6.885 9.485 920 H GLU 112 HN GLU 112 -22.211 6.062 5.061 921 HA GLU 112 HA GLU 112 -22.013 7.023 2.450 922 HB2 GLU 112 HB2 GLU 112 -23.124 4.908 3.138 923 HB3 GLU 112 HB1 GLU 112 -24.437 5.848 3.828 924 HG2 GLU 112 HG2 GLU 112 -24.982 6.723 1.624 925 HG3 GLU 112 HG1 GLU 112 -23.652 5.800 0.925 926 H GLY 113 HN GLY 113 -22.551 8.908 1.620 927 HA2 GLY 113 HA2 GLY 113 -24.375 10.540 1.283 928 HA3 GLY 113 HA1 GLY 113 -24.540 10.562 3.036 929 H HIS 114 HN HIS 114 -21.954 10.694 3.881 930 HA HIS 114 HA HIS 114 -20.743 12.971 2.520 931 HB2 HIS 114 HB2 HIS 114 -20.558 14.226 4.692 932 HB3 HIS 114 HB1 HIS 114 -22.194 14.106 4.060 933 HD1 HIS 114 HD1 HIS 114 -20.166 13.414 7.037 934 HD2 HIS 114 HD2 HIS 114 -23.837 12.179 5.507 935 HE1 HIS 114 HE1 HIS 114 -21.384 12.350 8.962 936 HE2 HIS 114 HE2 HIS 114 -23.532 11.471 7.982 937 HA PRO 115 HA PRO 115 -17.401 10.486 4.356 938 HB2 PRO 115 HB2 PRO 115 -16.733 8.947 2.254 939 HB3 PRO 115 HB1 PRO 115 -18.082 8.537 3.318 940 HG2 PRO 115 HG2 PRO 115 -18.140 9.426 0.536 941 HG3 PRO 115 HG1 PRO 115 -19.442 8.728 1.511 942 HD2 PRO 115 HD2 PRO 115 -18.855 11.551 0.937 943 HD3 PRO 115 HD1 PRO 115 -20.347 10.816 1.568 944 HA PRO 116 HA PRO 116 -14.323 12.849 1.982 945 HB2 PRO 116 HB2 PRO 116 -13.285 14.277 3.998 946 HB3 PRO 116 HB1 PRO 116 -14.776 14.774 3.192 947 HG2 PRO 116 HG2 PRO 116 -14.391 13.596 5.875 948 HG3 PRO 116 HG1 PRO 116 -15.694 14.634 5.278 949 HD2 PRO 116 HD2 PRO 116 -15.701 11.781 5.564 950 HD3 PRO 116 HD1 PRO 116 -16.992 12.822 4.930 951 H VAL 117 HN VAL 117 -13.099 10.905 1.653 952 HA VAL 117 HA VAL 117 -11.194 10.405 3.848 953 HB VAL 117 HB VAL 117 -12.452 8.341 2.049 954 HG11 VAL 117 HG11 VAL 117 -10.150 8.137 3.957 955 HG12 VAL 117 HG12 VAL 117 -10.171 7.737 2.246 956 HG13 VAL 117 HG13 VAL 117 -11.060 6.740 3.397 957 HG21 VAL 117 HG21 VAL 117 -13.149 7.344 4.208 958 HG22 VAL 117 HG22 VAL 117 -13.873 8.922 3.897 959 HG23 VAL 117 HG23 VAL 117 -12.528 8.776 5.029 960 H ASN 118 HN ASN 118 -9.368 11.305 3.187 961 HA ASN 118 HA ASN 118 -8.019 9.847 1.047 962 HB2 ASN 118 HB2 ASN 118 -8.799 12.099 0.131 963 HB3 ASN 118 HB1 ASN 118 -7.702 12.852 1.280 964 HD21 ASN 118 HD21 ASN 118 -5.372 12.315 1.054 965 HD22 ASN 118 HD22 ASN 118 -4.771 11.891 -0.511 966 H HIS 119 HN HIS 119 -6.707 8.764 2.495 967 HA HIS 119 HA HIS 119 -5.300 10.427 4.494 968 HB2 HIS 119 HB2 HIS 119 -7.059 8.877 5.425 969 HB3 HIS 119 HB1 HIS 119 -6.080 7.531 4.844 970 HD1 HIS 119 HD1 HIS 119 -4.518 6.602 6.514 971 HD2 HIS 119 HD2 HIS 119 -5.471 10.564 7.326 972 HE1 HIS 119 HE1 HIS 119 -3.370 7.141 8.684 973 HE2 HIS 119 HE2 HIS 119 -4.143 9.471 9.261 974 H LEU 120 HN LEU 120 -3.159 10.027 4.891 975 HA LEU 120 HA LEU 120 -1.815 7.837 3.526 976 HB2 LEU 120 HB2 LEU 120 -1.353 10.751 3.014 977 HB3 LEU 120 HB1 LEU 120 -0.041 9.608 2.840 978 HG LEU 120 HG LEU 120 -2.628 9.210 1.381 979 HD11 LEU 120 HD11 LEU 120 -0.770 10.198 -0.406 980 HD12 LEU 120 HD12 LEU 120 -0.650 11.281 0.980 981 HD13 LEU 120 HD13 LEU 120 -2.204 11.037 0.181 982 HD21 LEU 120 HD21 LEU 120 -0.741 7.450 1.688 983 HD22 LEU 120 HD22 LEU 120 0.125 8.438 0.508 984 HD23 LEU 120 HD23 LEU 120 -1.428 7.717 0.083 985 H ARG 121 HN ARG 121 0.057 7.163 4.490 986 HA ARG 121 HA ARG 121 1.146 8.668 6.733 987 HB2 ARG 121 HB2 ARG 121 1.014 6.698 8.237 988 HB3 ARG 121 HB1 ARG 121 -0.556 7.367 7.832 989 HG2 ARG 121 HG2 ARG 121 -1.038 5.170 7.583 990 HG3 ARG 121 HG1 ARG 121 -0.444 5.484 5.959 991 HD2 ARG 121 HD2 ARG 121 0.430 3.409 7.193 992 HD3 ARG 121 HD1 ARG 121 1.611 4.433 6.371 993 HE ARG 121 HE ARG 121 2.077 5.421 8.599 994 HH11 ARG 121 HH11 ARG 121 0.523 2.274 8.469 995 HH12 ARG 121 HH12 ARG 121 1.110 1.796 10.038 996 HH21 ARG 121 HH21 ARG 121 2.805 4.807 10.639 997 HH22 ARG 121 HH22 ARG 121 2.423 3.232 11.265 998 H CYS 122 HN CYS 122 3.288 7.979 7.332 999 HA CYS 122 HA CYS 122 4.565 6.582 5.087 1000 HB2 CYS 122 HB2 CYS 122 6.593 7.892 5.707 1001 HB3 CYS 122 HB1 CYS 122 5.236 8.870 5.162 1002 HG CYS 122 HG CYS 122 5.799 10.494 7.104 1003 H GLU 123 HN GLU 123 5.631 4.791 5.412 1004 HA GLU 123 HA GLU 123 6.232 3.908 8.145 1005 HB2 GLU 123 HB2 GLU 123 6.021 2.464 5.502 1006 HB3 GLU 123 HB1 GLU 123 6.635 1.697 6.963 1007 HG2 GLU 123 HG2 GLU 123 3.995 3.059 7.047 1008 HG3 GLU 123 HG1 GLU 123 4.114 1.468 6.287 1009 H LYS 124 HN LYS 124 8.328 2.802 8.479 1010 HA LYS 124 HA LYS 124 10.440 3.980 6.810 1011 HB2 LYS 124 HB2 LYS 124 10.166 5.314 8.837 1012 HB3 LYS 124 HB1 LYS 124 10.334 3.867 9.821 1013 HG2 LYS 124 HG2 LYS 124 12.644 3.608 9.028 1014 HG3 LYS 124 HG1 LYS 124 12.442 5.062 8.046 1015 HD2 LYS 124 HD2 LYS 124 11.955 5.129 10.984 1016 HD3 LYS 124 HD1 LYS 124 13.587 5.274 10.317 1017 HE2 LYS 124 HE2 LYS 124 11.411 6.885 9.143 1018 HE3 LYS 124 HE1 LYS 124 12.075 7.405 10.701 1019 HZ1 LYS 124 HZ1 LYS 124 14.296 7.359 9.625 1020 HZ2 LYS 124 HZ2 LYS 124 13.248 8.502 8.940 1021 HZ3 LYS 124 HZ3 LYS 124 13.542 7.037 8.139 1022 H LEU 125 HN LEU 125 11.760 2.497 6.051 1023 HA LEU 125 HA LEU 125 12.084 -0.024 7.550 1024 HB2 LEU 125 HB2 LEU 125 12.622 0.432 4.620 1025 HB3 LEU 125 HB1 LEU 125 12.505 -1.102 5.453 1026 HG LEU 125 HG LEU 125 10.091 0.633 5.473 1027 HD11 LEU 125 HD11 LEU 125 10.745 0.831 3.149 1028 HD12 LEU 125 HD12 LEU 125 9.388 -0.295 3.291 1029 HD13 LEU 125 HD13 LEU 125 11.023 -0.913 3.059 1030 HD21 LEU 125 HD21 LEU 125 9.069 -1.668 5.122 1031 HD22 LEU 125 HD22 LEU 125 9.900 -1.390 6.654 1032 HD23 LEU 125 HD23 LEU 125 10.696 -2.306 5.375 1033 H THR 126 HN THR 126 14.000 -0.082 8.592 1034 HA THR 126 HA THR 126 16.239 1.471 7.503 1035 HB THR 126 HB THR 126 16.557 0.130 10.121 1036 HG1 THR 126 HG1 THR 126 14.400 0.841 10.304 1037 HG21 THR 126 HG21 THR 126 18.132 1.777 8.959 1038 HG22 THR 126 HG22 THR 126 17.761 2.075 10.659 1039 HG23 THR 126 HG23 THR 126 16.960 3.020 9.404 1040 H PHE 127 HN PHE 127 17.894 0.489 6.564 1041 HA PHE 127 HA PHE 127 18.213 -2.405 7.001 1042 HB2 PHE 127 HB2 PHE 127 18.942 -0.784 4.552 1043 HB3 PHE 127 HB1 PHE 127 19.134 -2.531 4.731 1044 HD1 PHE 127 HD1 PHE 127 17.178 -3.992 4.789 1045 HD2 PHE 127 HD2 PHE 127 16.815 0.193 4.147 1046 HE1 PHE 127 HE1 PHE 127 14.867 -4.316 4.047 1047 HE2 PHE 127 HE2 PHE 127 14.504 -0.112 3.394 1048 HZ PHE 127 HZ PHE 127 13.510 -2.369 3.356 1049 H ASN 128 HN ASN 128 19.736 -2.608 8.464 1050 HA ASN 128 HA ASN 128 21.788 -0.675 8.851 1051 HB2 ASN 128 HB2 ASN 128 21.392 -3.426 10.032 1052 HB3 ASN 128 HB1 ASN 128 22.639 -2.293 10.542 1053 HD21 ASN 128 HD21 ASN 128 19.225 -2.976 10.509 1054 HD22 ASN 128 HD22 ASN 128 18.783 -1.806 11.716 1055 H ASN 129 HN ASN 129 23.480 -0.457 7.639 1056 HA ASN 129 HA ASN 129 25.284 -0.828 6.329 1057 HB2 ASN 129 HB2 ASN 129 25.792 -2.004 8.611 1058 HB3 ASN 129 HB1 ASN 129 25.682 -3.481 7.657 1059 HD21 ASN 129 HD21 ASN 129 27.299 -3.979 6.216 1060 HD22 ASN 129 HD22 ASN 129 28.766 -3.062 6.089 1061 HA PRO 130 HA PRO 130 23.306 -3.894 3.494 1062 HB2 PRO 130 HB2 PRO 130 22.220 -2.226 1.698 1063 HB3 PRO 130 HB1 PRO 130 21.405 -2.600 3.221 1064 HG2 PRO 130 HG2 PRO 130 22.856 -0.145 2.404 1065 HG3 PRO 130 HG1 PRO 130 21.478 -0.327 3.499 1066 HD2 PRO 130 HD2 PRO 130 24.196 -0.043 4.218 1067 HD3 PRO 130 HD1 PRO 130 22.850 -0.454 5.296 1068 H THR 131 HN THR 131 23.980 -4.487 1.395 1069 HA THR 131 HA THR 131 26.637 -3.751 0.741 1070 HB THR 131 HB THR 131 25.803 -5.994 0.210 1071 HG1 THR 131 HG1 THR 131 27.456 -5.582 -1.111 1072 HG21 THR 131 HG21 THR 131 23.496 -5.450 -0.361 1073 HG22 THR 131 HG22 THR 131 24.261 -6.348 -1.673 1074 HG23 THR 131 HG23 THR 131 24.040 -4.604 -1.811 1075 H GLU 132 HN GLU 132 27.320 -2.921 -1.436 1076 HA GLU 132 HA GLU 132 26.499 -0.283 -1.649 1077 HB2 GLU 132 HB2 GLU 132 28.640 -1.298 -2.568 1078 HB3 GLU 132 HB1 GLU 132 27.691 -1.799 -3.964 1079 HG2 GLU 132 HG2 GLU 132 28.816 0.249 -4.475 1080 HG3 GLU 132 HG1 GLU 132 27.081 0.574 -4.345 1081 H ASP 133 HN ASP 133 25.496 -3.033 -3.715 1082 HA ASP 133 HA ASP 133 24.133 -1.601 -5.677 1083 HB2 ASP 133 HB2 ASP 133 23.387 -4.311 -4.533 1084 HB3 ASP 133 HB1 ASP 133 22.781 -3.646 -6.044 1085 H PHE 134 HN PHE 134 22.816 -2.979 -2.665 1086 HA PHE 134 HA PHE 134 20.176 -2.004 -3.058 1087 HB2 PHE 134 HB2 PHE 134 20.960 -3.892 -1.447 1088 HB3 PHE 134 HB1 PHE 134 21.450 -2.587 -0.368 1089 HD1 PHE 134 HD1 PHE 134 18.503 -2.562 -2.545 1090 HD2 PHE 134 HD2 PHE 134 19.954 -2.968 1.425 1091 HE1 PHE 134 HE1 PHE 134 16.211 -2.413 -1.700 1092 HE2 PHE 134 HE2 PHE 134 17.651 -2.816 2.281 1093 HZ PHE 134 HZ PHE 134 15.775 -2.532 0.706 1094 H ARG 135 HN ARG 135 22.769 -0.980 -0.910 1095 HA ARG 135 HA ARG 135 21.905 1.383 0.126 1096 HB2 ARG 135 HB2 ARG 135 23.923 0.627 0.853 1097 HB3 ARG 135 HB1 ARG 135 24.523 0.351 -0.780 1098 HG2 ARG 135 HG2 ARG 135 25.564 2.344 -0.713 1099 HG3 ARG 135 HG1 ARG 135 24.020 3.135 -0.420 1100 HD2 ARG 135 HD2 ARG 135 25.903 3.424 1.325 1101 HD3 ARG 135 HD1 ARG 135 24.289 3.013 1.900 1102 HE ARG 135 HE ARG 135 25.312 0.601 1.717 1103 HH11 ARG 135 HH11 ARG 135 26.851 3.513 2.904 1104 HH12 ARG 135 HH12 ARG 135 27.917 2.654 3.986 1105 HH21 ARG 135 HH21 ARG 135 26.704 -0.528 3.105 1106 HH22 ARG 135 HH22 ARG 135 27.835 0.347 4.099 1107 H ARG 136 HN ARG 136 23.407 0.947 -2.984 1108 HA ARG 136 HA ARG 136 23.633 3.575 -3.831 1109 HB2 ARG 136 HB2 ARG 136 24.805 1.735 -4.803 1110 HB3 ARG 136 HB1 ARG 136 23.318 0.949 -5.285 1111 HG2 ARG 136 HG2 ARG 136 22.978 2.959 -6.816 1112 HG3 ARG 136 HG1 ARG 136 24.685 3.306 -6.479 1113 HD2 ARG 136 HD2 ARG 136 24.796 1.950 -8.376 1114 HD3 ARG 136 HD1 ARG 136 25.090 0.846 -7.022 1115 HE ARG 136 HE ARG 136 22.391 1.065 -8.157 1116 HH11 ARG 136 HH11 ARG 136 25.306 -0.756 -7.519 1117 HH12 ARG 136 HH12 ARG 136 24.583 -2.307 -7.843 1118 HH21 ARG 136 HH21 ARG 136 21.425 -0.980 -8.647 1119 HH22 ARG 136 HH22 ARG 136 22.372 -2.431 -8.497 1120 H LYS 137 HN LYS 137 20.991 1.251 -4.357 1121 HA LYS 137 HA LYS 137 19.426 3.102 -5.875 1122 HB2 LYS 137 HB2 LYS 137 18.811 0.444 -4.585 1123 HB3 LYS 137 HB1 LYS 137 17.576 1.394 -5.410 1124 HG2 LYS 137 HG2 LYS 137 18.861 1.293 -7.486 1125 HG3 LYS 137 HG1 LYS 137 20.127 0.370 -6.670 1126 HD2 LYS 137 HD2 LYS 137 17.359 -0.691 -6.535 1127 HD3 LYS 137 HD1 LYS 137 18.201 -0.796 -8.081 1128 HE2 LYS 137 HE2 LYS 137 19.984 -2.018 -7.123 1129 HE3 LYS 137 HE1 LYS 137 19.400 -1.746 -5.487 1130 HZ1 LYS 137 HZ1 LYS 137 17.523 -3.144 -5.950 1131 HZ2 LYS 137 HZ2 LYS 137 18.941 -3.985 -6.329 1132 HZ3 LYS 137 HZ3 LYS 137 17.991 -3.325 -7.570 1133 H LEU 138 HN LEU 138 19.376 1.981 -2.518 1134 HA LEU 138 HA LEU 138 17.159 3.370 -1.583 1135 HB2 LEU 138 HB2 LEU 138 19.728 2.913 -0.083 1136 HB3 LEU 138 HB1 LEU 138 18.164 3.262 0.623 1137 HG LEU 138 HG LEU 138 19.055 0.734 -0.735 1138 HD11 LEU 138 HD11 LEU 138 19.582 1.108 1.674 1139 HD12 LEU 138 HD12 LEU 138 18.562 -0.296 1.359 1140 HD13 LEU 138 HD13 LEU 138 17.847 1.192 1.980 1141 HD21 LEU 138 HD21 LEU 138 16.270 1.493 0.084 1142 HD22 LEU 138 HD22 LEU 138 16.785 -0.111 -0.430 1143 HD23 LEU 138 HD23 LEU 138 16.837 1.241 -1.563 1144 H LEU 139 HN LEU 139 20.410 4.522 -2.213 1145 HA LEU 139 HA LEU 139 20.061 7.063 -0.934 1146 HB2 LEU 139 HB2 LEU 139 22.130 6.204 -2.952 1147 HB3 LEU 139 HB1 LEU 139 22.224 7.609 -1.908 1148 HG LEU 139 HG LEU 139 22.114 4.776 -0.893 1149 HD11 LEU 139 HD11 LEU 139 24.370 4.627 -0.872 1150 HD12 LEU 139 HD12 LEU 139 24.603 6.376 -0.778 1151 HD13 LEU 139 HD13 LEU 139 24.172 5.625 -2.316 1152 HD21 LEU 139 HD21 LEU 139 21.328 6.556 0.615 1153 HD22 LEU 139 HD22 LEU 139 22.906 7.335 0.478 1154 HD23 LEU 139 HD23 LEU 139 22.772 5.732 1.205 1155 H LYS 140 HN LYS 140 19.773 5.854 -4.220 1156 HA LYS 140 HA LYS 140 19.517 8.373 -5.480 1157 HB2 LYS 140 HB2 LYS 140 19.477 5.636 -6.273 1158 HB3 LYS 140 HB1 LYS 140 18.084 6.455 -6.947 1159 HG2 LYS 140 HG2 LYS 140 19.409 8.016 -8.098 1160 HG3 LYS 140 HG1 LYS 140 20.859 7.544 -7.208 1161 HD2 LYS 140 HD2 LYS 140 19.370 5.589 -8.926 1162 HD3 LYS 140 HD1 LYS 140 20.584 6.669 -9.601 1163 HE2 LYS 140 HE2 LYS 140 21.062 4.809 -7.289 1164 HE3 LYS 140 HE1 LYS 140 21.392 4.402 -8.967 1165 HZ1 LYS 140 HZ1 LYS 140 22.829 6.480 -8.979 1166 HZ2 LYS 140 HZ2 LYS 140 23.419 5.156 -8.109 1167 HZ3 LYS 140 HZ3 LYS 140 22.705 6.455 -7.284 1168 H ALA 141 HN ALA 141 17.368 6.393 -3.727 1169 HA ALA 141 HA ALA 141 14.868 6.972 -4.682 1170 HB1 ALA 141 HB1 ALA 141 14.038 6.242 -2.656 1171 HB2 ALA 141 HB2 ALA 141 15.390 6.913 -1.746 1172 HB3 ALA 141 HB3 ALA 141 15.624 5.475 -2.741 1173 H1 GLY 212 HT1 GLY 212 -17.868 14.680 11.636 1174 H2 GLY 212 HT2 GLY 212 -18.165 13.814 13.062 1175 H3 GLY 212 HT3 GLY 212 -19.213 13.653 11.737 1176 HA2 GLY 212 HA1 GLY 212 -17.428 12.658 10.432 1177 HA3 GLY 212 HA2 GLY 212 -16.376 12.787 11.834 1178 H GLY 213 HN GLY 213 -17.368 10.432 10.295 1179 HA2 GLY 213 HA2 GLY 213 -17.865 8.749 12.555 1180 HA3 GLY 213 HA1 GLY 213 -19.300 8.945 11.557 1181 H LYS 214 HN LYS 214 -17.656 6.558 12.087 1182 HA LYS 214 HA LYS 214 -16.517 6.039 9.439 1183 HB2 LYS 214 HB2 LYS 214 -15.541 4.033 10.428 1184 HB3 LYS 214 HB1 LYS 214 -15.126 5.453 11.374 1185 HG2 LYS 214 HG2 LYS 214 -16.799 4.871 13.032 1186 HG3 LYS 214 HG1 LYS 214 -17.292 3.479 12.064 1187 HD2 LYS 214 HD2 LYS 214 -14.974 2.592 12.279 1188 HD3 LYS 214 HD1 LYS 214 -14.614 3.925 13.379 1189 HE2 LYS 214 HE2 LYS 214 -16.348 3.149 14.903 1190 HE3 LYS 214 HE1 LYS 214 -16.757 1.842 13.793 1191 HZ1 LYS 214 HZ1 LYS 214 -14.209 2.195 15.278 1192 HZ2 LYS 214 HZ2 LYS 214 -14.449 1.022 14.080 1193 HZ3 LYS 214 HZ3 LYS 214 -15.363 0.975 15.503 1194 H ALA 215 HN ALA 215 -17.386 4.640 8.028 1195 HA ALA 215 HA ALA 215 -20.123 3.843 8.450 1196 HB1 ALA 215 HB1 ALA 215 -18.232 3.561 6.122 1197 HB2 ALA 215 HB2 ALA 215 -19.564 4.700 6.296 1198 HB3 ALA 215 HB3 ALA 215 -19.894 2.980 6.096 1199 HA PRO 216 HA PRO 216 -19.981 -0.347 9.639 1200 HB2 PRO 216 HB2 PRO 216 -20.760 -1.780 7.354 1201 HB3 PRO 216 HB1 PRO 216 -21.819 -1.133 8.599 1202 HG2 PRO 216 HG2 PRO 216 -21.109 0.016 5.949 1203 HG3 PRO 216 HG1 PRO 216 -22.651 0.068 6.820 1204 HD2 PRO 216 HD2 PRO 216 -21.052 2.196 6.704 1205 HD3 PRO 216 HD1 PRO 216 -21.949 1.817 8.190 1206 H ARG 217 HN ARG 217 -18.814 -2.302 9.569 1207 HA ARG 217 HA ARG 217 -16.638 -2.467 7.627 1208 HB2 ARG 217 HB2 ARG 217 -15.705 -1.123 9.409 1209 HB3 ARG 217 HB1 ARG 217 -16.306 -2.235 10.628 1210 HG2 ARG 217 HG2 ARG 217 -14.739 -3.910 9.971 1211 HG3 ARG 217 HG1 ARG 217 -14.240 -2.962 8.570 1212 HD2 ARG 217 HD2 ARG 217 -13.913 -2.080 11.433 1213 HD3 ARG 217 HD1 ARG 217 -12.649 -2.855 10.478 1214 HE ARG 217 HE ARG 217 -13.874 -0.349 9.540 1215 HH11 ARG 217 HH11 ARG 217 -11.069 -2.126 10.681 1216 HH12 ARG 217 HH12 ARG 217 -9.944 -0.867 10.249 1217 HH21 ARG 217 HH21 ARG 217 -12.390 1.281 8.959 1218 HH22 ARG 217 HH22 ARG 217 -10.688 1.058 9.255 1219 H1 KCR 218 HN KCR 218 -15.728 -4.545 7.430 1220 H4 KCR 218 HA KCR 218 -17.607 -6.617 8.223 1221 H5 KCR 218 HB1 KCR 218 -16.360 -8.033 6.618 1222 H6 KCR 218 HB2 KCR 218 -15.251 -6.694 6.337 1223 H7 KCR 218 HG1 KCR 218 -17.136 -5.332 5.542 1224 H8 KCR 218 HG2 KCR 218 -18.205 -6.716 5.766 1225 H9 KCR 218 HD1 KCR 218 -16.995 -7.984 4.119 1226 H10 KCR 218 HD2 KCR 218 -15.799 -6.694 3.958 1227 H11 KCR 218 HE1 KCR 218 -17.508 -5.188 3.111 1228 H12 KCR 218 HE2 KCR 218 -18.733 -6.444 3.316 1229 H13 KCR 218 HZ1 KCR 218 -17.381 -7.740 1.653 1230 H14 KCR 218 HH1 KCR 218 -16.825 -7.705 -0.677 1231 H15 KCR 218 HJ1 KCR 218 -17.061 -4.809 -1.716 1232 H16 KCR 218 HF3 KCR 218 -15.932 -5.910 -3.625 1233 H17 KCR 218 HF1 KCR 218 -16.180 -7.497 -2.898 1234 H18 KCR 218 HF2 KCR 218 -17.528 -6.659 -3.664 1235 H GLN 219 HN GLN 219 -15.126 -5.304 9.737 1236 HA GLN 219 HA GLN 219 -13.893 -7.719 10.743 1237 HB2 GLN 219 HB2 GLN 219 -13.705 -4.842 11.661 1238 HB3 GLN 219 HB1 GLN 219 -12.792 -6.169 12.363 1239 HG2 GLN 219 HG2 GLN 219 -12.612 -5.184 9.526 1240 HG3 GLN 219 HG1 GLN 219 -11.426 -4.927 10.806 1241 HE21 GLN 219 HE21 GLN 219 -10.145 -6.647 11.487 1242 HE22 GLN 219 HE22 GLN 219 -9.966 -8.087 10.534 1243 H LEU 220 HN LEU 220 -15.050 -8.998 11.982 1244 HA LEU 220 HA LEU 220 -16.582 -9.786 13.450 1245 HB2 LEU 220 HB2 LEU 220 -16.076 -7.133 14.800 1246 HB3 LEU 220 HB1 LEU 220 -17.006 -8.439 15.509 1247 HG LEU 220 HG LEU 220 -14.070 -8.528 14.811 1248 HD11 LEU 220 HD11 LEU 220 -15.496 -8.489 17.465 1249 HD12 LEU 220 HD12 LEU 220 -14.560 -7.167 16.767 1250 HD13 LEU 220 HD13 LEU 220 -13.757 -8.668 17.230 1251 HD21 LEU 220 HD21 LEU 220 -15.842 -10.613 16.081 1252 HD22 LEU 220 HD22 LEU 220 -14.089 -10.715 15.917 1253 HD23 LEU 220 HD23 LEU 220 -15.109 -10.703 14.479 1254 H ALA 221 HN ALA 221 -17.565 -8.668 11.131 1255 HA ALA 221 HA ALA 221 -19.813 -6.972 11.680 1256 HB1 ALA 221 HB1 ALA 221 -20.449 -7.424 9.358 1257 HB2 ALA 221 HB2 ALA 221 -19.201 -8.665 9.255 1258 HB3 ALA 221 HB3 ALA 221 -18.748 -6.975 9.478 1259 H THR 222 HN THR 222 -19.281 -10.408 11.102 1260 HA THR 222 HA THR 222 -22.037 -11.049 11.749 1261 HB THR 222 HB THR 222 -19.735 -12.967 11.323 1262 HG1 THR 222 HG1 THR 222 -19.845 -12.429 9.283 1263 HG21 THR 222 HG21 THR 222 -21.512 -14.547 10.725 1264 HG22 THR 222 HG22 THR 222 -22.727 -13.309 11.049 1265 HG23 THR 222 HG23 THR 222 -21.735 -13.937 12.365 1266 H LYS 223 HN LYS 223 -21.733 -9.937 13.840 1267 HA LYS 223 HA LYS 223 -20.888 -11.819 15.908 1268 HB2 LYS 223 HB2 LYS 223 -18.949 -10.339 15.507 1269 HB3 LYS 223 HB1 LYS 223 -19.968 -8.934 15.779 1270 HG2 LYS 223 HG2 LYS 223 -20.376 -9.770 18.094 1271 HG3 LYS 223 HG1 LYS 223 -19.177 -11.029 17.788 1272 HD2 LYS 223 HD2 LYS 223 -18.105 -9.219 18.945 1273 HD3 LYS 223 HD1 LYS 223 -17.521 -9.242 17.280 1274 HE2 LYS 223 HE2 LYS 223 -17.960 -6.967 17.924 1275 HE3 LYS 223 HE1 LYS 223 -19.156 -7.466 16.729 1276 HZ1 LYS 223 HZ1 LYS 223 -19.585 -7.344 19.667 1277 HZ2 LYS 223 HZ2 LYS 223 -20.742 -7.831 18.531 1278 HZ3 LYS 223 HZ3 LYS 223 -20.174 -6.232 18.536 1279 H ALA 224 HN ALA 224 -22.014 -11.559 17.847 1280 HA ALA 224 HA ALA 224 -24.312 -9.742 17.718 1281 HB1 ALA 224 HB1 ALA 224 -24.794 -12.091 18.190 1282 HB2 ALA 224 HB2 ALA 224 -25.221 -11.071 19.564 1283 HB3 ALA 224 HB3 ALA 224 -23.742 -12.032 19.603 Start of MODEL 9 1 H1 GLY 1 HT1 GLY 1 32.768 18.127 -1.027 2 H2 GLY 1 HT2 GLY 1 33.385 17.233 -2.329 3 H3 GLY 1 HT3 GLY 1 34.115 17.123 -0.803 4 HA2 GLY 1 HA1 GLY 1 32.093 16.135 0.105 5 HA3 GLY 1 HA2 GLY 1 31.387 16.200 -1.504 6 H SER 2 HN SER 2 32.420 14.050 0.515 7 HA SER 2 HA SER 2 34.467 12.643 -0.819 8 HB2 SER 2 HB2 SER 2 33.658 10.719 0.635 9 HB3 SER 2 HB1 SER 2 34.129 12.188 1.488 10 HG SER 2 HG SER 2 32.074 11.166 2.126 11 H HIS 3 HN HIS 3 34.438 10.967 -2.233 12 HA HIS 3 HA HIS 3 31.894 10.553 -3.656 13 HB2 HIS 3 HB2 HIS 3 33.243 9.901 -5.606 14 HB3 HIS 3 HB1 HIS 3 33.666 11.514 -5.051 15 HD1 HIS 3 HD1 HIS 3 35.101 8.249 -5.845 16 HD2 HIS 3 HD2 HIS 3 36.211 11.594 -3.632 17 HE1 HIS 3 HE1 HIS 3 37.578 8.023 -5.464 18 HE2 HIS 3 HE2 HIS 3 38.176 9.937 -3.935 19 H MET 4 HN MET 4 32.335 9.192 -1.291 20 HA MET 4 HA MET 4 32.485 6.427 -2.246 21 HB2 MET 4 HB2 MET 4 33.751 5.759 -0.247 22 HB3 MET 4 HB1 MET 4 34.661 6.892 -1.236 23 HG2 MET 4 HG2 MET 4 34.108 8.700 0.277 24 HG3 MET 4 HG1 MET 4 33.118 7.611 1.247 25 HE1 MET 4 HE1 MET 4 34.077 5.676 2.760 26 HE2 MET 4 HE2 MET 4 35.776 5.200 2.780 27 HE3 MET 4 HE3 MET 4 34.809 4.961 1.324 28 H ALA 5 HN ALA 5 31.394 4.913 -0.831 29 HA ALA 5 HA ALA 5 29.146 6.172 0.538 30 HB1 ALA 5 HB1 ALA 5 28.172 3.928 0.586 31 HB2 ALA 5 HB2 ALA 5 29.628 3.284 -0.175 32 HB3 ALA 5 HB3 ALA 5 28.603 4.423 -1.051 33 H SER 6 HN SER 6 28.635 5.799 2.661 34 HA SER 6 HA SER 6 30.859 4.799 4.303 35 HB2 SER 6 HB2 SER 6 30.118 7.207 4.517 36 HB3 SER 6 HB1 SER 6 28.591 6.608 5.156 37 HG SER 6 HG SER 6 31.015 6.869 6.388 38 H SER 7 HN SER 7 30.514 3.241 5.811 39 HA SER 7 HA SER 7 28.320 1.490 5.552 40 HB2 SER 7 HB2 SER 7 30.288 1.740 7.850 41 HB3 SER 7 HB1 SER 7 29.290 0.332 7.479 42 HG SER 7 HG SER 7 30.450 -0.012 5.620 43 H CYS 8 HN CYS 8 26.294 1.970 6.135 44 HA CYS 8 HA CYS 8 25.660 2.942 8.749 45 HB2 CYS 8 HB2 CYS 8 24.535 5.023 7.957 46 HB3 CYS 8 HB1 CYS 8 26.288 5.072 7.797 47 HG CYS 8 HG CYS 8 26.290 4.588 5.047 48 H ALA 9 HN ALA 9 23.299 3.274 9.018 49 HA ALA 9 HA ALA 9 21.808 1.312 7.512 50 HB1 ALA 9 HB1 ALA 9 19.942 1.927 9.026 51 HB2 ALA 9 HB2 ALA 9 20.962 3.193 9.718 52 HB3 ALA 9 HB3 ALA 9 21.418 1.499 9.897 53 H VAL 10 HN VAL 10 20.782 1.749 5.674 54 HA VAL 10 HA VAL 10 20.187 4.544 5.016 55 HB VAL 10 HB VAL 10 20.087 2.134 3.189 56 HG11 VAL 10 HG11 VAL 10 18.694 3.753 2.254 57 HG12 VAL 10 HG12 VAL 10 20.245 4.026 1.456 58 HG13 VAL 10 HG13 VAL 10 19.732 5.082 2.772 59 HG21 VAL 10 HG21 VAL 10 22.378 2.367 3.698 60 HG22 VAL 10 HG22 VAL 10 22.274 4.126 3.733 61 HG23 VAL 10 HG23 VAL 10 22.166 3.268 2.197 62 H GLN 11 HN GLN 11 18.165 5.279 5.017 63 HA GLN 11 HA GLN 11 16.057 3.350 5.715 64 HB2 GLN 11 HB2 GLN 11 15.913 6.358 5.990 65 HB3 GLN 11 HB1 GLN 11 14.900 5.156 6.766 66 HG2 GLN 11 HG2 GLN 11 16.334 4.846 8.469 67 HG3 GLN 11 HG1 GLN 11 17.748 4.971 7.421 68 HE21 GLN 11 HE21 GLN 11 15.238 7.395 7.536 69 HE22 GLN 11 HE22 GLN 11 16.195 8.617 8.304 70 H VAL 12 HN VAL 12 14.247 3.129 4.523 71 HA VAL 12 HA VAL 12 13.877 5.002 2.290 72 HB VAL 12 HB VAL 12 12.672 3.129 1.151 73 HG11 VAL 12 HG11 VAL 12 15.200 3.643 0.917 74 HG12 VAL 12 HG12 VAL 12 14.604 2.095 0.320 75 HG13 VAL 12 HG13 VAL 12 15.425 2.183 1.878 76 HG21 VAL 12 HG21 VAL 12 12.111 1.930 3.184 77 HG22 VAL 12 HG22 VAL 12 13.795 1.444 3.355 78 HG23 VAL 12 HG23 VAL 12 12.850 0.896 1.967 79 H LYS 13 HN LYS 13 11.701 5.714 1.916 80 HA LYS 13 HA LYS 13 9.988 5.274 4.295 81 HB2 LYS 13 HB2 LYS 13 11.055 7.609 4.171 82 HB3 LYS 13 HB1 LYS 13 10.111 7.854 2.707 83 HG2 LYS 13 HG2 LYS 13 8.759 7.142 5.302 84 HG3 LYS 13 HG1 LYS 13 9.129 8.825 4.906 85 HD2 LYS 13 HD2 LYS 13 7.910 8.074 2.629 86 HD3 LYS 13 HD1 LYS 13 7.094 7.006 3.774 87 HE2 LYS 13 HE2 LYS 13 6.485 8.905 5.152 88 HE3 LYS 13 HE1 LYS 13 7.369 9.993 4.085 89 HZ1 LYS 13 HZ1 LYS 13 4.982 8.396 3.336 90 HZ2 LYS 13 HZ2 LYS 13 5.831 9.433 2.302 91 HZ3 LYS 13 HZ3 LYS 13 5.006 10.063 3.641 92 H LEU 14 HN LEU 14 8.217 4.180 3.746 93 HA LEU 14 HA LEU 14 7.080 4.694 1.085 94 HB2 LEU 14 HB2 LEU 14 6.789 2.290 2.870 95 HB3 LEU 14 HB1 LEU 14 5.902 2.521 1.379 96 HG LEU 14 HG LEU 14 8.918 2.323 1.557 97 HD11 LEU 14 HD11 LEU 14 6.896 0.290 0.650 98 HD12 LEU 14 HD12 LEU 14 7.822 0.217 2.148 99 HD13 LEU 14 HD13 LEU 14 8.648 0.112 0.592 100 HD21 LEU 14 HD21 LEU 14 7.134 2.166 -0.865 101 HD22 LEU 14 HD22 LEU 14 8.897 2.239 -0.818 102 HD23 LEU 14 HD23 LEU 14 7.944 3.646 -0.345 103 H GLU 15 HN GLU 15 4.868 4.994 0.923 104 HA GLU 15 HA GLU 15 3.592 5.873 3.427 105 HB2 GLU 15 HB2 GLU 15 4.285 7.775 2.100 106 HB3 GLU 15 HB1 GLU 15 3.500 7.115 0.675 107 HG2 GLU 15 HG2 GLU 15 1.357 7.548 1.531 108 HG3 GLU 15 HG1 GLU 15 1.976 7.856 3.150 109 H LEU 16 HN LEU 16 1.732 4.969 3.912 110 HA LEU 16 HA LEU 16 0.285 3.390 1.907 111 HB2 LEU 16 HB2 LEU 16 0.034 3.587 4.896 112 HB3 LEU 16 HB1 LEU 16 -1.176 2.797 3.919 113 HG LEU 16 HG LEU 16 0.155 1.089 4.818 114 HD11 LEU 16 HD11 LEU 16 1.631 1.130 2.316 115 HD12 LEU 16 HD12 LEU 16 -0.104 1.381 2.136 116 HD13 LEU 16 HD13 LEU 16 0.501 -0.064 2.948 117 HD21 LEU 16 HD21 LEU 16 2.646 2.335 3.775 118 HD22 LEU 16 HD22 LEU 16 2.477 1.041 4.953 119 HD23 LEU 16 HD23 LEU 16 2.041 2.696 5.386 120 H GLY 17 HN GLY 17 -1.790 3.892 1.317 121 HA2 GLY 17 HA2 GLY 17 -3.076 6.179 2.576 122 HA3 GLY 17 HA1 GLY 17 -2.579 6.391 0.903 123 H HIS 18 HN HIS 18 -5.167 6.657 1.743 124 HA HIS 18 HA HIS 18 -6.398 5.176 -0.284 125 HB2 HIS 18 HB2 HIS 18 -7.339 3.378 0.714 126 HB3 HIS 18 HB1 HIS 18 -6.202 3.643 2.028 127 HD1 HIS 18 HD1 HIS 18 -7.164 5.100 4.084 128 HD2 HIS 18 HD2 HIS 18 -9.966 3.566 1.418 129 HE1 HIS 18 HE1 HIS 18 -9.398 5.328 5.227 130 HE2 HIS 18 HE2 HIS 18 -11.036 4.226 3.679 131 H ARG 19 HN ARG 19 -8.336 6.018 -0.816 132 HA ARG 19 HA ARG 19 -9.494 8.046 0.984 133 HB2 ARG 19 HB2 ARG 19 -9.593 7.996 -2.038 134 HB3 ARG 19 HB1 ARG 19 -10.344 9.188 -1.011 135 HG2 ARG 19 HG2 ARG 19 -8.173 9.966 -0.271 136 HG3 ARG 19 HG1 ARG 19 -7.386 8.744 -1.277 137 HD2 ARG 19 HD2 ARG 19 -7.401 10.872 -2.439 138 HD3 ARG 19 HD1 ARG 19 -8.462 9.720 -3.260 139 HE ARG 19 HE ARG 19 -9.862 11.346 -1.364 140 HH11 ARG 19 HH11 ARG 19 -8.608 11.278 -4.635 141 HH12 ARG 19 HH12 ARG 19 -9.766 12.427 -5.235 142 HH21 ARG 19 HH21 ARG 19 -11.365 12.858 -2.130 143 HH22 ARG 19 HH22 ARG 19 -11.319 13.354 -3.801 144 H ALA 20 HN ALA 20 -11.842 8.147 0.924 145 HA ALA 20 HA ALA 20 -13.127 5.927 -0.489 146 HB1 ALA 20 HB1 ALA 20 -13.045 4.893 1.547 147 HB2 ALA 20 HB2 ALA 20 -14.611 5.706 1.632 148 HB3 ALA 20 HB3 ALA 20 -13.210 6.402 2.448 149 H GLN 21 HN GLN 21 -15.076 6.338 -1.284 150 HA GLN 21 HA GLN 21 -16.610 8.646 -0.424 151 HB2 GLN 21 HB2 GLN 21 -16.797 9.639 -2.591 152 HB3 GLN 21 HB1 GLN 21 -15.092 9.419 -2.262 153 HG2 GLN 21 HG2 GLN 21 -15.046 8.687 -4.347 154 HG3 GLN 21 HG1 GLN 21 -15.559 7.173 -3.639 155 HE21 GLN 21 HE21 GLN 21 -17.643 6.433 -3.997 156 HE22 GLN 21 HE22 GLN 21 -18.685 7.145 -5.179 157 H VAL 22 HN VAL 22 -18.823 8.418 -0.832 158 HA VAL 22 HA VAL 22 -19.564 5.685 -1.622 159 HB VAL 22 HB VAL 22 -20.214 6.487 0.687 160 HG11 VAL 22 HG11 VAL 22 -22.098 7.959 0.939 161 HG12 VAL 22 HG12 VAL 22 -22.209 8.169 -0.811 162 HG13 VAL 22 HG13 VAL 22 -20.808 8.788 0.064 163 HG21 VAL 22 HG21 VAL 22 -21.398 4.616 0.061 164 HG22 VAL 22 HG22 VAL 22 -22.163 5.428 -1.303 165 HG23 VAL 22 HG23 VAL 22 -22.698 5.773 0.341 166 H ARG 23 HN ARG 23 -20.939 5.331 -3.276 167 HA ARG 23 HA ARG 23 -21.969 7.668 -4.718 168 HB2 ARG 23 HB2 ARG 23 -22.751 5.605 -6.266 169 HB3 ARG 23 HB1 ARG 23 -21.161 6.347 -6.396 170 HG2 ARG 23 HG2 ARG 23 -20.095 4.552 -5.592 171 HG3 ARG 23 HG1 ARG 23 -21.365 4.179 -4.431 172 HD2 ARG 23 HD2 ARG 23 -21.154 2.436 -6.130 173 HD3 ARG 23 HD1 ARG 23 -22.725 3.224 -6.211 174 HE ARG 23 HE ARG 23 -22.135 4.185 -8.246 175 HH11 ARG 23 HH11 ARG 23 -19.414 2.457 -6.877 176 HH12 ARG 23 HH12 ARG 23 -18.590 2.290 -8.397 177 HH21 ARG 23 HH21 ARG 23 -21.037 3.980 -10.251 178 HH22 ARG 23 HH22 ARG 23 -19.501 3.163 -10.309 179 H LYS 24 HN LYS 24 -24.074 8.170 -4.666 180 HA LYS 24 HA LYS 24 -25.573 7.216 -2.487 181 HB2 LYS 24 HB2 LYS 24 -25.705 9.510 -3.592 182 HB3 LYS 24 HB1 LYS 24 -26.701 8.756 -4.825 183 HG2 LYS 24 HG2 LYS 24 -28.370 9.438 -3.503 184 HG3 LYS 24 HG1 LYS 24 -28.010 7.956 -2.619 185 HD2 LYS 24 HD2 LYS 24 -26.502 9.274 -1.138 186 HD3 LYS 24 HD1 LYS 24 -27.010 10.734 -1.987 187 HE2 LYS 24 HE2 LYS 24 -28.317 10.610 -0.019 188 HE3 LYS 24 HE1 LYS 24 -29.374 10.144 -1.351 189 HZ1 LYS 24 HZ1 LYS 24 -29.783 8.585 0.303 190 HZ2 LYS 24 HZ2 LYS 24 -28.149 8.429 0.716 191 HZ3 LYS 24 HZ3 LYS 24 -28.720 7.768 -0.736 192 H LYS 25 HN LYS 25 -25.221 6.038 -5.639 193 HA LYS 25 HA LYS 25 -27.438 4.176 -5.134 194 HB2 LYS 25 HB2 LYS 25 -28.054 5.574 -7.034 195 HB3 LYS 25 HB1 LYS 25 -26.533 5.194 -7.834 196 HG2 LYS 25 HG2 LYS 25 -27.152 2.977 -8.223 197 HG3 LYS 25 HG1 LYS 25 -28.465 3.042 -7.050 198 HD2 LYS 25 HD2 LYS 25 -29.625 4.654 -8.502 199 HD3 LYS 25 HD1 LYS 25 -28.350 4.443 -9.709 200 HE2 LYS 25 HE2 LYS 25 -28.871 2.104 -9.920 201 HE3 LYS 25 HE1 LYS 25 -30.026 2.208 -8.592 202 HZ1 LYS 25 HZ1 LYS 25 -31.150 2.200 -10.724 203 HZ2 LYS 25 HZ2 LYS 25 -30.273 3.563 -11.226 204 HZ3 LYS 25 HZ3 LYS 25 -31.378 3.694 -9.953 205 HA PRO 26 HA PRO 26 -23.903 1.399 -4.931 206 HB2 PRO 26 HB2 PRO 26 -26.120 -0.548 -4.739 207 HB3 PRO 26 HB1 PRO 26 -24.730 -0.319 -3.678 208 HG2 PRO 26 HG2 PRO 26 -27.199 0.442 -2.952 209 HG3 PRO 26 HG1 PRO 26 -25.757 1.356 -2.473 210 HD2 PRO 26 HD2 PRO 26 -27.788 1.975 -4.570 211 HD3 PRO 26 HD1 PRO 26 -26.884 3.072 -3.505 212 H THR 27 HN THR 27 -23.142 -0.283 -6.271 213 HA THR 27 HA THR 27 -24.056 -0.064 -8.978 214 HB THR 27 HB THR 27 -21.671 -0.327 -8.548 215 HG1 THR 27 HG1 THR 27 -21.720 -2.679 -9.751 216 HG21 THR 27 HG21 THR 27 -21.593 -1.616 -6.563 217 HG22 THR 27 HG22 THR 27 -20.822 -2.586 -7.819 218 HG23 THR 27 HG23 THR 27 -22.473 -2.947 -7.316 219 H VAL 28 HN VAL 28 -24.137 -2.360 -10.176 220 HA VAL 28 HA VAL 28 -26.598 -3.447 -9.720 221 HB VAL 28 HB VAL 28 -25.531 -3.830 -11.774 222 HG11 VAL 28 HG11 VAL 28 -23.211 -3.816 -10.880 223 HG12 VAL 28 HG12 VAL 28 -23.502 -5.084 -12.078 224 HG13 VAL 28 HG13 VAL 28 -23.448 -5.490 -10.362 225 HG21 VAL 28 HG21 VAL 28 -25.834 -6.431 -10.288 226 HG22 VAL 28 HG22 VAL 28 -25.697 -6.295 -12.042 227 HG23 VAL 28 HG23 VAL 28 -27.074 -5.576 -11.207 228 H GLU 29 HN GLU 29 -23.544 -4.512 -8.284 229 HA GLU 29 HA GLU 29 -24.887 -6.750 -6.987 230 HB2 GLU 29 HB2 GLU 29 -21.970 -5.971 -6.999 231 HB3 GLU 29 HB1 GLU 29 -22.630 -7.443 -6.293 232 HG2 GLU 29 HG2 GLU 29 -23.495 -8.030 -8.585 233 HG3 GLU 29 HG1 GLU 29 -22.579 -6.654 -9.198 234 H GLY 30 HN GLY 30 -24.705 -3.611 -6.291 235 HA2 GLY 30 HA2 GLY 30 -25.566 -2.626 -4.386 236 HA3 GLY 30 HA1 GLY 30 -25.435 -4.168 -3.554 237 H PHE 31 HN PHE 31 -22.749 -2.631 -5.170 238 HA PHE 31 HA PHE 31 -21.382 -2.362 -2.618 239 HB2 PHE 31 HB2 PHE 31 -20.306 -1.771 -5.388 240 HB3 PHE 31 HB1 PHE 31 -19.374 -1.973 -3.906 241 HD1 PHE 31 HD1 PHE 31 -21.099 -4.457 -3.013 242 HD2 PHE 31 HD2 PHE 31 -19.032 -3.429 -6.577 243 HE1 PHE 31 HE1 PHE 31 -20.811 -6.839 -3.522 244 HE2 PHE 31 HE2 PHE 31 -18.741 -5.806 -7.099 245 HZ PHE 31 HZ PHE 31 -19.634 -7.520 -5.573 246 H THR 32 HN THR 32 -21.334 -0.488 -1.557 247 HA THR 32 HA THR 32 -22.540 1.835 -2.862 248 HB THR 32 HB THR 32 -22.975 2.658 -0.597 249 HG1 THR 32 HG1 THR 32 -22.575 1.151 1.162 250 HG21 THR 32 HG21 THR 32 -23.835 -0.132 -1.111 251 HG22 THR 32 HG22 THR 32 -24.664 1.329 -1.619 252 HG23 THR 32 HG23 THR 32 -24.563 0.912 0.094 253 H HIS 33 HN HIS 33 -19.626 0.844 -1.194 254 HA HIS 33 HA HIS 33 -18.694 3.633 -1.114 255 HB2 HIS 33 HB2 HIS 33 -18.167 1.245 0.612 256 HB3 HIS 33 HB1 HIS 33 -16.973 2.537 0.539 257 HD1 HIS 33 HD1 HIS 33 -20.474 1.805 1.725 258 HD2 HIS 33 HD2 HIS 33 -17.652 4.857 1.881 259 HE1 HIS 33 HE1 HIS 33 -21.315 3.425 3.457 260 HE2 HIS 33 HE2 HIS 33 -19.475 5.127 3.693 261 H ASP 34 HN ASP 34 -17.257 4.192 -2.543 262 HA ASP 34 HA ASP 34 -15.508 2.159 -3.751 263 HB2 ASP 34 HB2 ASP 34 -16.348 4.919 -4.649 264 HB3 ASP 34 HB1 ASP 34 -15.001 4.060 -5.385 265 H TRP 35 HN TRP 35 -13.388 2.191 -3.380 266 HA TRP 35 HA TRP 35 -12.268 4.566 -2.101 267 HB2 TRP 35 HB2 TRP 35 -10.960 3.095 -0.554 268 HB3 TRP 35 HB1 TRP 35 -12.683 3.173 -0.231 269 HD1 TRP 35 HD1 TRP 35 -13.991 0.906 -0.185 270 HE1 TRP 35 HE1 TRP 35 -13.288 -1.566 -0.482 271 HE3 TRP 35 HE3 TRP 35 -9.255 1.603 -1.994 272 HZ2 TRP 35 HZ2 TRP 35 -11.015 -3.017 -1.350 273 HZ3 TRP 35 HZ3 TRP 35 -7.881 -0.373 -2.520 274 HH2 TRP 35 HH2 TRP 35 -8.727 -2.627 -2.176 275 H MET 36 HN MET 36 -9.897 4.504 -2.016 276 HA MET 36 HA MET 36 -8.636 2.981 -4.167 277 HB2 MET 36 HB2 MET 36 -9.243 4.978 -5.319 278 HB3 MET 36 HB1 MET 36 -8.755 5.991 -3.965 279 HG2 MET 36 HG2 MET 36 -6.407 5.133 -4.363 280 HG3 MET 36 HG1 MET 36 -7.006 4.513 -5.900 281 HE1 MET 36 HE1 MET 36 -6.502 7.312 -3.580 282 HE2 MET 36 HE2 MET 36 -8.062 7.975 -4.091 283 HE3 MET 36 HE3 MET 36 -6.565 8.807 -4.523 284 H VAL 37 HN VAL 37 -6.635 2.308 -3.564 285 HA VAL 37 HA VAL 37 -5.567 3.391 -1.048 286 HB VAL 37 HB VAL 37 -4.091 1.202 -1.323 287 HG11 VAL 37 HG11 VAL 37 -6.914 1.190 -0.381 288 HG12 VAL 37 HG12 VAL 37 -5.541 1.755 0.554 289 HG13 VAL 37 HG13 VAL 37 -5.670 0.052 0.103 290 HG21 VAL 37 HG21 VAL 37 -4.948 0.500 -3.434 291 HG22 VAL 37 HG22 VAL 37 -6.610 0.619 -2.854 292 HG23 VAL 37 HG23 VAL 37 -5.534 -0.619 -2.205 293 H PHE 38 HN PHE 38 -3.284 3.465 -0.767 294 HA PHE 38 HA PHE 38 -1.749 4.195 -3.184 295 HB2 PHE 38 HB2 PHE 38 -2.372 5.744 -0.722 296 HB3 PHE 38 HB1 PHE 38 -0.741 5.878 -1.349 297 HD1 PHE 38 HD1 PHE 38 -0.317 6.901 -3.472 298 HD2 PHE 38 HD2 PHE 38 -4.239 6.766 -1.839 299 HE1 PHE 38 HE1 PHE 38 -0.990 8.724 -4.971 300 HE2 PHE 38 HE2 PHE 38 -4.941 8.564 -3.361 301 HZ PHE 38 HZ PHE 38 -3.328 9.554 -4.933 302 H VAL 39 HN VAL 39 0.197 3.098 -3.249 303 HA VAL 39 HA VAL 39 1.727 3.228 -0.748 304 HB VAL 39 HB VAL 39 2.983 1.157 -1.598 305 HG11 VAL 39 HG11 VAL 39 1.118 1.414 0.224 306 HG12 VAL 39 HG12 VAL 39 1.706 -0.175 -0.257 307 HG13 VAL 39 HG13 VAL 39 0.188 0.438 -0.912 308 HG21 VAL 39 HG21 VAL 39 2.370 0.544 -3.673 309 HG22 VAL 39 HG22 VAL 39 0.789 1.313 -3.538 310 HG23 VAL 39 HG23 VAL 39 1.062 -0.276 -2.824 311 H ARG 40 HN ARG 40 3.396 4.576 -0.968 312 HA ARG 40 HA ARG 40 4.875 4.855 -3.476 313 HB2 ARG 40 HB2 ARG 40 4.493 7.289 -3.630 314 HB3 ARG 40 HB1 ARG 40 2.946 6.452 -3.733 315 HG2 ARG 40 HG2 ARG 40 2.384 7.067 -1.535 316 HG3 ARG 40 HG1 ARG 40 4.040 7.541 -1.160 317 HD2 ARG 40 HD2 ARG 40 1.955 8.999 -2.721 318 HD3 ARG 40 HD1 ARG 40 3.030 9.562 -1.452 319 HE ARG 40 HE ARG 40 4.136 8.925 -4.087 320 HH11 ARG 40 HH11 ARG 40 3.404 11.173 -1.527 321 HH12 ARG 40 HH12 ARG 40 4.356 12.472 -2.181 322 HH21 ARG 40 HH21 ARG 40 5.366 10.647 -5.025 323 HH22 ARG 40 HH22 ARG 40 5.441 12.175 -4.204 324 H GLY 41 HN GLY 41 6.422 6.918 -3.116 325 HA2 GLY 41 HA2 GLY 41 7.550 6.716 -0.387 326 HA3 GLY 41 HA1 GLY 41 8.504 7.015 -1.830 327 HA PRO 42 HA PRO 42 7.250 11.124 0.291 328 HB2 PRO 42 HB2 PRO 42 10.200 11.390 0.419 329 HB3 PRO 42 HB1 PRO 42 8.983 11.796 1.636 330 HG2 PRO 42 HG2 PRO 42 10.535 9.636 1.939 331 HG3 PRO 42 HG1 PRO 42 8.822 9.615 2.389 332 HD2 PRO 42 HD2 PRO 42 10.136 8.487 -0.049 333 HD3 PRO 42 HD1 PRO 42 8.848 7.808 0.971 334 H GLU 43 HN GLU 43 8.022 13.275 -0.366 335 HA GLU 43 HA GLU 43 7.833 13.549 -3.141 336 HB2 GLU 43 HB2 GLU 43 8.471 15.425 -0.899 337 HB3 GLU 43 HB1 GLU 43 8.635 15.965 -2.562 338 HG2 GLU 43 HG2 GLU 43 6.483 16.593 -1.632 339 HG3 GLU 43 HG1 GLU 43 6.290 15.463 -2.970 340 H HIS 44 HN HIS 44 9.242 13.292 -4.619 341 HA HIS 44 HA HIS 44 11.066 13.691 -5.907 342 HB2 HIS 44 HB2 HIS 44 12.372 15.463 -5.382 343 HB3 HIS 44 HB1 HIS 44 11.507 15.555 -3.854 344 HD1 HIS 44 HD1 HIS 44 14.773 14.497 -5.353 345 HD2 HIS 44 HD2 HIS 44 12.956 14.732 -1.617 346 HE1 HIS 44 HE1 HIS 44 16.625 14.192 -3.674 347 HE2 HIS 44 HE2 HIS 44 15.471 14.133 -1.436 348 H SER 45 HN SER 45 11.219 11.967 -2.926 349 HA SER 45 HA SER 45 13.430 10.319 -3.822 350 HB2 SER 45 HB2 SER 45 12.767 8.920 -1.808 351 HB3 SER 45 HB1 SER 45 13.222 10.579 -1.431 352 HG SER 45 HG SER 45 10.536 10.024 -1.954 353 H ASN 46 HN ASN 46 13.095 8.916 -5.428 354 HA ASN 46 HA ASN 46 10.370 7.972 -5.925 355 HB2 ASN 46 HB2 ASN 46 12.901 7.941 -7.561 356 HB3 ASN 46 HB1 ASN 46 11.494 6.993 -8.023 357 HD21 ASN 46 HD21 ASN 46 9.595 8.968 -7.034 358 HD22 ASN 46 HD22 ASN 46 9.626 10.281 -8.163 359 H ILE 47 HN ILE 47 9.707 5.975 -5.473 360 HA ILE 47 HA ILE 47 11.544 4.301 -4.020 361 HB ILE 47 HB ILE 47 9.732 2.869 -3.493 362 HG12 ILE 47 HG12 ILE 47 7.986 4.540 -5.300 363 HG13 ILE 47 HG11 ILE 47 8.636 2.949 -5.714 364 HG21 ILE 47 HG21 ILE 47 9.940 4.801 -2.163 365 HG22 ILE 47 HG22 ILE 47 8.225 4.484 -2.393 366 HG23 ILE 47 HG23 ILE 47 9.020 5.773 -3.303 367 HD11 ILE 47 HD11 ILE 47 7.188 3.161 -3.167 368 HD12 ILE 47 HD12 ILE 47 7.200 1.860 -4.359 369 HD13 ILE 47 HD13 ILE 47 6.223 3.304 -4.635 370 H GLN 48 HN GLN 48 10.263 4.483 -7.192 371 HA GLN 48 HA GLN 48 10.348 1.812 -8.002 372 HB2 GLN 48 HB2 GLN 48 9.300 3.641 -9.278 373 HB3 GLN 48 HB1 GLN 48 10.879 4.333 -9.595 374 HG2 GLN 48 HG2 GLN 48 10.038 3.187 -11.548 375 HG3 GLN 48 HG1 GLN 48 11.469 2.406 -10.934 376 HE21 GLN 48 HE21 GLN 48 7.911 2.088 -11.026 377 HE22 GLN 48 HE22 GLN 48 7.922 0.376 -10.824 378 H HIS 49 HN HIS 49 12.854 3.767 -7.009 379 HA HIS 49 HA HIS 49 14.945 2.533 -8.560 380 HB2 HIS 49 HB2 HIS 49 14.836 4.540 -6.353 381 HB3 HIS 49 HB1 HIS 49 16.351 3.675 -6.627 382 HD1 HIS 49 HD1 HIS 49 16.408 3.611 -9.688 383 HD2 HIS 49 HD2 HIS 49 15.364 6.960 -7.460 384 HE1 HIS 49 HE1 HIS 49 16.755 5.579 -11.220 385 HE2 HIS 49 HE2 HIS 49 15.976 7.577 -9.897 386 H PHE 50 HN PHE 50 13.555 2.158 -5.314 387 HA PHE 50 HA PHE 50 15.301 -0.177 -4.976 388 HB2 PHE 50 HB2 PHE 50 15.042 0.102 -2.530 389 HB3 PHE 50 HB1 PHE 50 15.843 1.462 -3.315 390 HD1 PHE 50 HD1 PHE 50 12.688 0.370 -1.705 391 HD2 PHE 50 HD2 PHE 50 14.963 3.619 -3.243 392 HE1 PHE 50 HE1 PHE 50 11.179 1.933 -0.614 393 HE2 PHE 50 HE2 PHE 50 13.413 5.200 -2.164 394 HZ PHE 50 HZ PHE 50 11.517 4.359 -0.844 395 H VAL 51 HN VAL 51 12.301 0.643 -5.785 396 HA VAL 51 HA VAL 51 11.079 -1.773 -4.639 397 HB VAL 51 HB VAL 51 9.848 0.956 -5.133 398 HG11 VAL 51 HG11 VAL 51 7.799 -0.367 -4.079 399 HG12 VAL 51 HG12 VAL 51 8.559 -1.720 -4.939 400 HG13 VAL 51 HG13 VAL 51 8.059 -0.280 -5.830 401 HG21 VAL 51 HG21 VAL 51 9.177 0.631 -2.729 402 HG22 VAL 51 HG22 VAL 51 10.905 0.813 -3.013 403 HG23 VAL 51 HG23 VAL 51 10.226 -0.783 -2.702 404 H GLU 52 HN GLU 52 10.191 -3.151 -6.074 405 HA GLU 52 HA GLU 52 10.689 -2.505 -8.900 406 HB2 GLU 52 HB2 GLU 52 11.838 -4.476 -8.014 407 HB3 GLU 52 HB1 GLU 52 10.302 -5.169 -7.510 408 HG2 GLU 52 HG2 GLU 52 9.616 -5.211 -9.908 409 HG3 GLU 52 HG1 GLU 52 11.251 -4.695 -10.326 410 H LYS 53 HN LYS 53 8.339 -4.377 -7.010 411 HA LYS 53 HA LYS 53 6.201 -3.342 -8.712 412 HB2 LYS 53 HB2 LYS 53 5.162 -5.575 -8.835 413 HB3 LYS 53 HB1 LYS 53 6.739 -5.543 -9.612 414 HG2 LYS 53 HG2 LYS 53 7.726 -6.786 -7.922 415 HG3 LYS 53 HG1 LYS 53 6.431 -6.472 -6.778 416 HD2 LYS 53 HD2 LYS 53 6.078 -8.062 -9.296 417 HD3 LYS 53 HD1 LYS 53 6.518 -8.800 -7.754 418 HE2 LYS 53 HE2 LYS 53 4.013 -7.445 -8.571 419 HE3 LYS 53 HE1 LYS 53 4.241 -8.987 -7.759 420 HZ1 LYS 53 HZ1 LYS 53 3.301 -7.343 -6.288 421 HZ2 LYS 53 HZ2 LYS 53 4.646 -6.343 -6.512 422 HZ3 LYS 53 HZ3 LYS 53 4.822 -7.846 -5.757 423 H VAL 54 HN VAL 54 4.036 -4.085 -7.715 424 HA VAL 54 HA VAL 54 4.140 -4.085 -4.793 425 HB VAL 54 HB VAL 54 3.086 -1.899 -6.532 426 HG11 VAL 54 HG11 VAL 54 2.127 -1.876 -3.749 427 HG12 VAL 54 HG12 VAL 54 1.313 -3.009 -4.827 428 HG13 VAL 54 HG13 VAL 54 1.351 -1.290 -5.220 429 HG21 VAL 54 HG21 VAL 54 3.917 -0.904 -4.109 430 HG22 VAL 54 HG22 VAL 54 4.875 -0.980 -5.582 431 HG23 VAL 54 HG23 VAL 54 4.996 -2.267 -4.381 432 H VAL 55 HN VAL 55 2.119 -4.746 -3.821 433 HA VAL 55 HA VAL 55 0.114 -5.784 -5.665 434 HB VAL 55 HB VAL 55 2.118 -7.467 -4.596 435 HG11 VAL 55 HG11 VAL 55 -0.587 -7.998 -3.387 436 HG12 VAL 55 HG12 VAL 55 0.922 -7.676 -2.527 437 HG13 VAL 55 HG13 VAL 55 0.733 -9.169 -3.446 438 HG21 VAL 55 HG21 VAL 55 -0.473 -8.199 -5.941 439 HG22 VAL 55 HG22 VAL 55 1.003 -9.162 -5.889 440 HG23 VAL 55 HG23 VAL 55 0.978 -7.634 -6.769 441 H PHE 56 HN PHE 56 -1.886 -6.073 -4.757 442 HA PHE 56 HA PHE 56 -2.182 -5.267 -1.944 443 HB2 PHE 56 HB2 PHE 56 -3.744 -4.393 -4.380 444 HB3 PHE 56 HB1 PHE 56 -4.477 -4.369 -2.774 445 HD1 PHE 56 HD1 PHE 56 -1.529 -3.119 -4.680 446 HD2 PHE 56 HD2 PHE 56 -4.201 -2.526 -1.415 447 HE1 PHE 56 HE1 PHE 56 -0.535 -0.913 -4.283 448 HE2 PHE 56 HE2 PHE 56 -3.205 -0.306 -1.016 449 HZ PHE 56 HZ PHE 56 -1.361 0.497 -2.449 450 H HIS 57 HN HIS 57 -2.986 -6.939 -0.803 451 HA HIS 57 HA HIS 57 -4.590 -8.960 -2.212 452 HB2 HIS 57 HB2 HIS 57 -3.516 -8.955 0.630 453 HB3 HIS 57 HB1 HIS 57 -4.407 -10.275 -0.120 454 HD1 HIS 57 HD1 HIS 57 -3.054 -11.989 -1.319 455 HD2 HIS 57 HD2 HIS 57 -0.898 -8.501 -0.609 456 HE1 HIS 57 HE1 HIS 57 -0.678 -12.510 -1.969 457 HE2 HIS 57 HE2 HIS 57 0.643 -10.472 -1.268 458 H LEU 58 HN LEU 58 -6.419 -7.579 -2.478 459 HA LEU 58 HA LEU 58 -7.791 -6.463 -0.250 460 HB2 LEU 58 HB2 LEU 58 -9.246 -7.288 -2.741 461 HB3 LEU 58 HB1 LEU 58 -9.505 -5.879 -1.722 462 HG LEU 58 HG LEU 58 -7.329 -6.294 -3.769 463 HD11 LEU 58 HD11 LEU 58 -8.903 -5.449 -5.050 464 HD12 LEU 58 HD12 LEU 58 -8.496 -3.914 -4.282 465 HD13 LEU 58 HD13 LEU 58 -9.859 -4.866 -3.690 466 HD21 LEU 58 HD21 LEU 58 -7.580 -4.139 -1.689 467 HD22 LEU 58 HD22 LEU 58 -6.640 -3.953 -3.168 468 HD23 LEU 58 HD23 LEU 58 -6.209 -5.203 -2.001 469 H HIS 59 HN HIS 59 -10.357 -7.318 -0.166 470 HA HIS 59 HA HIS 59 -10.041 -9.904 1.092 471 HB2 HIS 59 HB2 HIS 59 -12.054 -7.777 1.136 472 HB3 HIS 59 HB1 HIS 59 -12.745 -9.398 1.161 473 HD1 HIS 59 HD1 HIS 59 -13.487 -9.247 3.628 474 HD2 HIS 59 HD2 HIS 59 -9.404 -8.695 3.055 475 HE1 HIS 59 HE1 HIS 59 -12.460 -9.336 5.918 476 HE2 HIS 59 HE2 HIS 59 -9.975 -9.269 5.511 477 H GLU 60 HN GLU 60 -11.290 -11.719 0.674 478 HA GLU 60 HA GLU 60 -10.997 -12.598 -1.962 479 HB2 GLU 60 HB2 GLU 60 -12.656 -13.799 0.253 480 HB3 GLU 60 HB1 GLU 60 -12.148 -14.636 -1.206 481 HG2 GLU 60 HG2 GLU 60 -9.839 -14.469 -0.557 482 HG3 GLU 60 HG1 GLU 60 -10.271 -13.492 0.847 483 H SER 61 HN SER 61 -13.707 -11.122 -0.398 484 HA SER 61 HA SER 61 -15.739 -11.922 -2.185 485 HB2 SER 61 HB2 SER 61 -16.092 -10.870 0.067 486 HB3 SER 61 HB1 SER 61 -15.577 -9.333 -0.623 487 HG SER 61 HG SER 61 -17.372 -9.979 -2.259 488 H PHE 62 HN PHE 62 -13.115 -9.761 -2.502 489 HA PHE 62 HA PHE 62 -14.270 -8.259 -4.702 490 HB2 PHE 62 HB2 PHE 62 -11.485 -8.262 -3.501 491 HB3 PHE 62 HB1 PHE 62 -12.028 -7.180 -4.772 492 HD1 PHE 62 HD1 PHE 62 -12.964 -8.207 -1.305 493 HD2 PHE 62 HD2 PHE 62 -12.756 -5.086 -4.177 494 HE1 PHE 62 HE1 PHE 62 -13.713 -6.597 0.395 495 HE2 PHE 62 HE2 PHE 62 -13.510 -3.468 -2.489 496 HZ PHE 62 HZ PHE 62 -13.988 -4.222 -0.196 497 HA PRO 63 HA PRO 63 -13.094 -11.389 -7.664 498 HB2 PRO 63 HB2 PRO 63 -13.169 -9.099 -9.551 499 HB3 PRO 63 HB1 PRO 63 -14.031 -10.640 -9.617 500 HG2 PRO 63 HG2 PRO 63 -15.303 -8.384 -8.978 501 HG3 PRO 63 HG1 PRO 63 -15.701 -9.919 -8.184 502 HD2 PRO 63 HD2 PRO 63 -14.086 -7.618 -7.163 503 HD3 PRO 63 HD1 PRO 63 -15.244 -8.653 -6.303 504 H ARG 64 HN ARG 64 -11.063 -12.073 -7.770 505 HA ARG 64 HA ARG 64 -8.785 -12.112 -7.873 506 HB2 ARG 64 HB2 ARG 64 -9.351 -9.936 -9.891 507 HB3 ARG 64 HB1 ARG 64 -7.750 -10.609 -9.623 508 HG2 ARG 64 HG2 ARG 64 -8.489 -12.781 -10.338 509 HG3 ARG 64 HG1 ARG 64 -10.151 -12.212 -10.470 510 HD2 ARG 64 HD2 ARG 64 -9.100 -12.319 -12.646 511 HD3 ARG 64 HD1 ARG 64 -9.496 -10.658 -12.218 512 HE ARG 64 HE ARG 64 -6.936 -10.827 -11.430 513 HH11 ARG 64 HH11 ARG 64 -8.521 -11.763 -14.420 514 HH12 ARG 64 HH12 ARG 64 -7.119 -11.437 -15.402 515 HH21 ARG 64 HH21 ARG 64 -5.094 -10.406 -12.742 516 HH22 ARG 64 HH22 ARG 64 -5.194 -10.677 -14.458 517 HA PRO 65 HA PRO 65 -8.964 -8.549 -4.924 518 HB2 PRO 65 HB2 PRO 65 -7.751 -9.823 -2.831 519 HB3 PRO 65 HB1 PRO 65 -9.486 -9.885 -3.155 520 HG2 PRO 65 HG2 PRO 65 -7.364 -11.886 -3.793 521 HG3 PRO 65 HG1 PRO 65 -9.019 -12.146 -3.213 522 HD2 PRO 65 HD2 PRO 65 -8.311 -12.480 -5.806 523 HD3 PRO 65 HD1 PRO 65 -9.921 -11.929 -5.315 524 H LYS 66 HN LYS 66 -6.275 -10.566 -5.784 525 HA LYS 66 HA LYS 66 -4.265 -8.821 -4.776 526 HB2 LYS 66 HB2 LYS 66 -3.776 -11.172 -4.982 527 HB3 LYS 66 HB1 LYS 66 -4.135 -11.138 -6.701 528 HG2 LYS 66 HG2 LYS 66 -2.209 -9.729 -7.114 529 HG3 LYS 66 HG1 LYS 66 -1.875 -9.647 -5.384 530 HD2 LYS 66 HD2 LYS 66 -1.124 -11.807 -5.282 531 HD3 LYS 66 HD1 LYS 66 -2.060 -12.322 -6.688 532 HE2 LYS 66 HE2 LYS 66 -0.545 -11.037 -8.136 533 HE3 LYS 66 HE1 LYS 66 0.395 -10.567 -6.721 534 HZ1 LYS 66 HZ1 LYS 66 -0.049 -13.402 -7.449 535 HZ2 LYS 66 HZ2 LYS 66 1.118 -12.759 -6.397 536 HZ3 LYS 66 HZ3 LYS 66 1.247 -12.505 -8.069 537 H ARG 67 HN ARG 67 -4.271 -6.828 -5.604 538 HA ARG 67 HA ARG 67 -4.275 -6.547 -8.530 539 HB2 ARG 67 HB2 ARG 67 -4.501 -4.288 -6.530 540 HB3 ARG 67 HB1 ARG 67 -4.922 -4.278 -8.240 541 HG2 ARG 67 HG2 ARG 67 -6.367 -5.676 -6.013 542 HG3 ARG 67 HG1 ARG 67 -6.932 -4.305 -6.968 543 HD2 ARG 67 HD2 ARG 67 -6.857 -5.758 -8.991 544 HD3 ARG 67 HD1 ARG 67 -6.446 -7.123 -7.939 545 HE ARG 67 HE ARG 67 -8.633 -7.312 -7.418 546 HH11 ARG 67 HH11 ARG 67 -8.153 -4.053 -8.627 547 HH12 ARG 67 HH12 ARG 67 -9.840 -3.643 -8.535 548 HH21 ARG 67 HH21 ARG 67 -10.851 -6.778 -7.358 549 HH22 ARG 67 HH22 ARG 67 -11.366 -5.189 -7.837 550 H VAL 68 HN VAL 68 -2.377 -6.269 -9.488 551 HA VAL 68 HA VAL 68 -0.081 -5.620 -7.776 552 HB VAL 68 HB VAL 68 1.285 -6.890 -9.121 553 HG11 VAL 68 HG11 VAL 68 -0.347 -8.388 -8.121 554 HG12 VAL 68 HG12 VAL 68 0.148 -8.984 -9.707 555 HG13 VAL 68 HG13 VAL 68 -1.410 -8.182 -9.516 556 HG21 VAL 68 HG21 VAL 68 0.900 -5.727 -11.192 557 HG22 VAL 68 HG22 VAL 68 -0.656 -6.534 -11.397 558 HG23 VAL 68 HG23 VAL 68 0.839 -7.468 -11.467 559 H CYS 69 HN CYS 69 1.363 -3.992 -8.289 560 HA CYS 69 HA CYS 69 0.824 -2.439 -10.729 561 HB2 CYS 69 HB2 CYS 69 1.489 -1.345 -7.984 562 HB3 CYS 69 HB1 CYS 69 1.494 -0.389 -9.465 563 HG CYS 69 HG CYS 69 -1.383 -1.913 -9.285 564 H LYS 70 HN LYS 70 2.515 -2.637 -12.034 565 HA LYS 70 HA LYS 70 5.193 -3.071 -10.861 566 HB2 LYS 70 HB2 LYS 70 4.350 -3.588 -13.721 567 HB3 LYS 70 HB1 LYS 70 5.790 -4.178 -12.905 568 HG2 LYS 70 HG2 LYS 70 4.557 -5.759 -11.653 569 HG3 LYS 70 HG1 LYS 70 3.026 -4.984 -12.052 570 HD2 LYS 70 HD2 LYS 70 3.330 -5.620 -14.402 571 HD3 LYS 70 HD1 LYS 70 4.848 -6.416 -13.980 572 HE2 LYS 70 HE2 LYS 70 3.706 -8.011 -12.610 573 HE3 LYS 70 HE1 LYS 70 2.184 -7.138 -12.774 574 HZ1 LYS 70 HZ1 LYS 70 3.645 -8.494 -14.978 575 HZ2 LYS 70 HZ2 LYS 70 2.176 -7.658 -15.131 576 HZ3 LYS 70 HZ3 LYS 70 2.252 -9.078 -14.208 577 H ASP 71 HN ASP 71 3.471 -0.610 -11.659 578 HA ASP 71 HA ASP 71 5.497 0.778 -13.267 579 HB2 ASP 71 HB2 ASP 71 2.516 0.668 -13.501 580 HB3 ASP 71 HB1 ASP 71 3.334 2.153 -13.966 581 HA PRO 72 HA PRO 72 5.323 4.461 -10.463 582 HB2 PRO 72 HB2 PRO 72 3.630 5.602 -12.678 583 HB3 PRO 72 HB1 PRO 72 4.846 6.413 -11.681 584 HG2 PRO 72 HG2 PRO 72 5.547 5.609 -14.068 585 HG3 PRO 72 HG1 PRO 72 6.624 5.247 -12.700 586 HD2 PRO 72 HD2 PRO 72 4.777 3.446 -14.186 587 HD3 PRO 72 HD1 PRO 72 6.366 3.097 -13.483 588 HA PRO 73 HA PRO 73 2.214 5.605 -7.712 589 HB2 PRO 73 HB2 PRO 73 -0.009 6.004 -9.680 590 HB3 PRO 73 HB1 PRO 73 0.308 6.853 -8.168 591 HG2 PRO 73 HG2 PRO 73 1.130 7.705 -10.701 592 HG3 PRO 73 HG1 PRO 73 1.743 8.296 -9.156 593 HD2 PRO 73 HD2 PRO 73 3.224 6.936 -11.070 594 HD3 PRO 73 HD1 PRO 73 3.693 7.182 -9.378 595 H TYR 74 HN TYR 74 2.043 3.769 -6.783 596 HA TYR 74 HA TYR 74 0.646 1.505 -7.925 597 HB2 TYR 74 HB2 TYR 74 1.896 1.679 -5.199 598 HB3 TYR 74 HB1 TYR 74 1.635 0.246 -6.172 599 HD1 TYR 74 HD2 TYR 74 3.627 3.360 -5.961 600 HD2 TYR 74 HD1 TYR 74 3.332 -0.533 -7.624 601 HE1 TYR 74 HE2 TYR 74 5.917 3.553 -6.790 602 HE2 TYR 74 HE1 TYR 74 5.640 -0.356 -8.466 603 HH TYR 74 HH TYR 74 7.287 1.290 -8.993 604 H LYS 75 HN LYS 75 -1.431 1.187 -7.549 605 HA LYS 75 HA LYS 75 -2.712 1.982 -5.088 606 HB2 LYS 75 HB2 LYS 75 -4.289 3.521 -6.369 607 HB3 LYS 75 HB1 LYS 75 -2.663 4.137 -6.075 608 HG2 LYS 75 HG2 LYS 75 -1.993 3.714 -8.290 609 HG3 LYS 75 HG1 LYS 75 -3.429 2.770 -8.626 610 HD2 LYS 75 HD2 LYS 75 -3.106 5.711 -8.368 611 HD3 LYS 75 HD1 LYS 75 -3.909 4.797 -9.633 612 HE2 LYS 75 HE2 LYS 75 -5.602 4.177 -7.834 613 HE3 LYS 75 HE1 LYS 75 -4.866 5.499 -6.919 614 HZ1 LYS 75 HZ1 LYS 75 -5.970 5.819 -9.653 615 HZ2 LYS 75 HZ2 LYS 75 -5.444 7.045 -8.603 616 HZ3 LYS 75 HZ3 LYS 75 -6.843 6.163 -8.241 617 H VAL 76 HN VAL 76 -5.028 1.652 -5.215 618 HA VAL 76 HA VAL 76 -5.930 -0.253 -7.258 619 HB VAL 76 HB VAL 76 -6.008 -0.728 -4.296 620 HG11 VAL 76 HG11 VAL 76 -8.280 -0.955 -5.298 621 HG12 VAL 76 HG12 VAL 76 -7.647 -2.435 -4.582 622 HG13 VAL 76 HG13 VAL 76 -7.641 -2.226 -6.336 623 HG21 VAL 76 HG21 VAL 76 -4.124 -1.702 -5.416 624 HG22 VAL 76 HG22 VAL 76 -5.157 -2.374 -6.668 625 HG23 VAL 76 HG23 VAL 76 -5.255 -2.988 -5.019 626 H GLU 77 HN GLU 77 -7.945 0.144 -7.970 627 HA GLU 77 HA GLU 77 -9.578 2.089 -6.462 628 HB2 GLU 77 HB2 GLU 77 -9.879 1.501 -9.397 629 HB3 GLU 77 HB1 GLU 77 -10.466 2.888 -8.502 630 HG2 GLU 77 HG2 GLU 77 -8.703 3.934 -9.361 631 HG3 GLU 77 HG1 GLU 77 -7.809 3.073 -8.114 632 H GLU 78 HN GLU 78 -11.184 1.089 -5.417 633 HA GLU 78 HA GLU 78 -12.563 -1.089 -6.813 634 HB2 GLU 78 HB2 GLU 78 -11.013 -1.311 -4.306 635 HB3 GLU 78 HB1 GLU 78 -12.583 -2.109 -4.303 636 HG2 GLU 78 HG2 GLU 78 -10.206 -2.631 -6.046 637 HG3 GLU 78 HG1 GLU 78 -11.095 -3.736 -4.998 638 H SER 79 HN SER 79 -14.374 -1.928 -5.264 639 HA SER 79 HA SER 79 -15.724 0.235 -3.877 640 HB2 SER 79 HB2 SER 79 -16.352 0.487 -6.282 641 HB3 SER 79 HB1 SER 79 -17.014 -1.149 -6.245 642 HG SER 79 HG SER 79 -18.017 1.215 -5.185 643 H GLY 80 HN GLY 80 -17.352 -0.498 -2.510 644 HA2 GLY 80 HA2 GLY 80 -18.209 -3.195 -2.330 645 HA3 GLY 80 HA1 GLY 80 -16.889 -2.893 -1.203 646 H TYR 81 HN TYR 81 -18.308 -3.140 0.642 647 HA TYR 81 HA TYR 81 -19.793 -0.671 1.124 648 HB2 TYR 81 HB2 TYR 81 -21.742 -1.936 2.062 649 HB3 TYR 81 HB1 TYR 81 -21.549 -2.076 0.314 650 HD1 TYR 81 HD2 TYR 81 -21.119 -3.861 3.516 651 HD2 TYR 81 HD1 TYR 81 -21.157 -4.191 -0.722 652 HE1 TYR 81 HE2 TYR 81 -21.129 -6.308 3.714 653 HE2 TYR 81 HE1 TYR 81 -21.178 -6.644 -0.534 654 HH TYR 81 HH TYR 81 -20.544 -8.375 1.078 655 H ALA 82 HN ALA 82 -17.351 -2.279 2.158 656 HA ALA 82 HA ALA 82 -17.749 -1.521 4.904 657 HB1 ALA 82 HB1 ALA 82 -18.682 -3.672 5.153 658 HB2 ALA 82 HB2 ALA 82 -17.019 -3.825 5.716 659 HB3 ALA 82 HB3 ALA 82 -17.467 -4.409 4.113 660 H GLY 83 HN GLY 83 -15.747 -1.669 6.154 661 HA2 GLY 83 HA2 GLY 83 -13.378 -1.486 4.427 662 HA3 GLY 83 HA1 GLY 83 -13.521 -0.827 6.053 663 H PHE 84 HN PHE 84 -11.321 -2.044 5.942 664 HA PHE 84 HA PHE 84 -11.286 -4.278 7.563 665 HB2 PHE 84 HB2 PHE 84 -10.731 -6.110 5.976 666 HB3 PHE 84 HB1 PHE 84 -12.384 -5.541 5.795 667 HD1 PHE 84 HD1 PHE 84 -12.893 -3.955 3.870 668 HD2 PHE 84 HD2 PHE 84 -9.277 -6.174 4.150 669 HE1 PHE 84 HE1 PHE 84 -12.532 -3.645 1.463 670 HE2 PHE 84 HE2 PHE 84 -8.890 -5.865 1.746 671 HZ PHE 84 HZ PHE 84 -10.517 -4.600 0.385 672 H ILE 85 HN ILE 85 -9.151 -5.015 7.994 673 HA ILE 85 HA ILE 85 -6.975 -3.383 7.225 674 HB ILE 85 HB ILE 85 -7.115 -6.128 8.458 675 HG12 ILE 85 HG12 ILE 85 -7.606 -4.119 9.850 676 HG13 ILE 85 HG11 ILE 85 -6.213 -5.040 10.404 677 HG21 ILE 85 HG21 ILE 85 -4.588 -4.638 7.772 678 HG22 ILE 85 HG22 ILE 85 -5.147 -6.132 7.021 679 HG23 ILE 85 HG23 ILE 85 -4.690 -6.118 8.724 680 HD11 ILE 85 HD11 ILE 85 -6.045 -2.546 8.747 681 HD12 ILE 85 HD12 ILE 85 -4.705 -3.434 9.469 682 HD13 ILE 85 HD13 ILE 85 -5.873 -2.608 10.500 683 H LEU 86 HN LEU 86 -5.899 -3.312 5.368 684 HA LEU 86 HA LEU 86 -6.203 -5.593 3.528 685 HB2 LEU 86 HB2 LEU 86 -7.036 -3.132 3.011 686 HB3 LEU 86 HB1 LEU 86 -5.343 -2.891 2.611 687 HG LEU 86 HG LEU 86 -6.688 -5.232 1.378 688 HD11 LEU 86 HD11 LEU 86 -7.062 -2.478 0.236 689 HD12 LEU 86 HD12 LEU 86 -8.283 -3.268 1.234 690 HD13 LEU 86 HD13 LEU 86 -7.784 -4.000 -0.290 691 HD21 LEU 86 HD21 LEU 86 -5.213 -3.449 -0.294 692 HD22 LEU 86 HD22 LEU 86 -4.930 -5.155 0.038 693 HD23 LEU 86 HD23 LEU 86 -4.266 -3.919 1.112 694 HA PRO 87 HA PRO 87 -1.831 -6.018 4.442 695 HB2 PRO 87 HB2 PRO 87 -2.027 -8.486 2.896 696 HB3 PRO 87 HB1 PRO 87 -1.672 -8.275 4.611 697 HG2 PRO 87 HG2 PRO 87 -3.993 -9.354 3.709 698 HG3 PRO 87 HG1 PRO 87 -3.874 -8.446 5.226 699 HD2 PRO 87 HD2 PRO 87 -4.893 -7.555 2.557 700 HD3 PRO 87 HD1 PRO 87 -5.525 -7.203 4.180 701 H ILE 88 HN ILE 88 -0.992 -4.441 3.130 702 HA ILE 88 HA ILE 88 -0.924 -4.861 0.251 703 HB ILE 88 HB ILE 88 0.106 -2.481 1.811 704 HG12 ILE 88 HG12 ILE 88 -2.509 -2.555 0.327 705 HG13 ILE 88 HG11 ILE 88 -2.427 -3.139 1.989 706 HG21 ILE 88 HG21 ILE 88 1.025 -2.669 -0.429 707 HG22 ILE 88 HG22 ILE 88 -0.130 -1.337 -0.358 708 HG23 ILE 88 HG23 ILE 88 -0.597 -2.867 -1.098 709 HD11 ILE 88 HD11 ILE 88 -1.524 -0.402 1.159 710 HD12 ILE 88 HD12 ILE 88 -1.791 -1.006 2.790 711 HD13 ILE 88 HD13 ILE 88 -3.158 -0.766 1.702 712 H GLU 89 HN GLU 89 0.953 -5.149 -0.900 713 HA GLU 89 HA GLU 89 3.403 -5.510 0.697 714 HB2 GLU 89 HB2 GLU 89 2.405 -7.123 -1.639 715 HB3 GLU 89 HB1 GLU 89 4.087 -7.136 -1.129 716 HG2 GLU 89 HG2 GLU 89 3.317 -7.888 1.114 717 HG3 GLU 89 HG1 GLU 89 1.696 -8.038 0.439 718 H VAL 90 HN VAL 90 5.090 -4.374 0.108 719 HA VAL 90 HA VAL 90 5.168 -3.332 -2.638 720 HB VAL 90 HB VAL 90 6.776 -2.227 -0.348 721 HG11 VAL 90 HG11 VAL 90 7.276 -0.490 -1.897 722 HG12 VAL 90 HG12 VAL 90 6.157 -1.140 -3.075 723 HG13 VAL 90 HG13 VAL 90 7.626 -2.023 -2.667 724 HG21 VAL 90 HG21 VAL 90 4.207 -1.976 -0.229 725 HG22 VAL 90 HG22 VAL 90 4.402 -0.888 -1.602 726 HG23 VAL 90 HG23 VAL 90 5.198 -0.527 -0.069 727 H TYR 91 HN TYR 91 6.533 -4.352 -3.919 728 HA TYR 91 HA TYR 91 8.433 -6.227 -2.774 729 HB2 TYR 91 HB2 TYR 91 7.447 -5.641 -5.519 730 HB3 TYR 91 HB1 TYR 91 8.991 -6.463 -5.343 731 HD1 TYR 91 HD1 TYR 91 5.712 -6.763 -3.591 732 HD2 TYR 91 HD2 TYR 91 8.754 -8.704 -5.819 733 HE1 TYR 91 HE1 TYR 91 4.542 -8.889 -3.306 734 HE2 TYR 91 HE2 TYR 91 7.569 -10.845 -5.574 735 HH TYR 91 HH TYR 91 5.947 -11.898 -4.076 736 H PHE 92 HN PHE 92 10.471 -5.913 -2.532 737 HA PHE 92 HA PHE 92 11.620 -3.325 -3.297 738 HB2 PHE 92 HB2 PHE 92 12.398 -5.461 -1.290 739 HB3 PHE 92 HB1 PHE 92 13.405 -4.048 -1.632 740 HD1 PHE 92 HD1 PHE 92 11.114 -2.047 -1.898 741 HD2 PHE 92 HD2 PHE 92 11.940 -5.075 0.978 742 HE1 PHE 92 HE1 PHE 92 9.926 -0.747 -0.196 743 HE2 PHE 92 HE2 PHE 92 10.724 -3.770 2.683 744 HZ PHE 92 HZ PHE 92 9.735 -1.606 2.091 745 H LYS 93 HN LYS 93 13.845 -3.342 -4.186 746 HA LYS 93 HA LYS 93 14.376 -5.741 -5.806 747 HB2 LYS 93 HB2 LYS 93 15.748 -3.042 -5.901 748 HB3 LYS 93 HB1 LYS 93 15.957 -4.357 -7.049 749 HG2 LYS 93 HG2 LYS 93 13.806 -4.029 -7.952 750 HG3 LYS 93 HG1 LYS 93 13.338 -2.949 -6.630 751 HD2 LYS 93 HD2 LYS 93 14.871 -1.272 -7.356 752 HD3 LYS 93 HD1 LYS 93 15.632 -2.369 -8.513 753 HE2 LYS 93 HE2 LYS 93 13.247 -2.465 -9.565 754 HE3 LYS 93 HE1 LYS 93 12.966 -0.981 -8.652 755 HZ1 LYS 93 HZ1 LYS 93 14.893 0.007 -9.752 756 HZ2 LYS 93 HZ2 LYS 93 13.705 -0.462 -10.862 757 HZ3 LYS 93 HZ3 LYS 93 15.100 -1.405 -10.673 758 H ASN 94 HN ASN 94 15.347 -7.118 -4.247 759 HA ASN 94 HA ASN 94 18.034 -6.384 -3.514 760 HB2 ASN 94 HB2 ASN 94 16.475 -5.420 -1.753 761 HB3 ASN 94 HB1 ASN 94 16.181 -7.086 -1.303 762 HD21 ASN 94 HD21 ASN 94 19.294 -6.052 -2.458 763 HD22 ASN 94 HD22 ASN 94 20.109 -6.185 -0.934 764 H LYS 95 HN LYS 95 19.356 -8.096 -3.247 765 HA LYS 95 HA LYS 95 18.159 -10.772 -3.410 766 HB2 LYS 95 HB2 LYS 95 21.011 -9.888 -3.783 767 HB3 LYS 95 HB1 LYS 95 20.401 -11.509 -4.070 768 HG2 LYS 95 HG2 LYS 95 18.919 -10.578 -5.826 769 HG3 LYS 95 HG1 LYS 95 19.699 -9.014 -5.594 770 HD2 LYS 95 HD2 LYS 95 21.190 -11.530 -6.312 771 HD3 LYS 95 HD1 LYS 95 20.570 -10.396 -7.509 772 HE2 LYS 95 HE2 LYS 95 22.823 -9.824 -7.209 773 HE3 LYS 95 HE1 LYS 95 21.916 -8.613 -6.311 774 HZ1 LYS 95 HZ1 LYS 95 22.426 -9.765 -4.274 775 HZ2 LYS 95 HZ2 LYS 95 23.863 -9.439 -5.106 776 HZ3 LYS 95 HZ3 LYS 95 23.218 -11.005 -5.118 777 H GLU 96 HN GLU 96 18.968 -8.679 -1.194 778 HA GLU 96 HA GLU 96 20.321 -10.484 0.674 779 HB2 GLU 96 HB2 GLU 96 19.829 -7.494 0.794 780 HB3 GLU 96 HB1 GLU 96 20.730 -8.423 1.992 781 HG2 GLU 96 HG2 GLU 96 21.464 -7.915 -0.876 782 HG3 GLU 96 HG1 GLU 96 22.267 -7.295 0.564 783 H GLU 97 HN GLU 97 19.372 -9.072 3.018 784 HA GLU 97 HA GLU 97 17.260 -10.180 4.099 785 HB2 GLU 97 HB2 GLU 97 17.870 -7.231 4.085 786 HB3 GLU 97 HB1 GLU 97 16.661 -7.960 5.137 787 HG2 GLU 97 HG2 GLU 97 19.580 -8.702 5.085 788 HG3 GLU 97 HG1 GLU 97 18.833 -7.605 6.246 789 HA PRO 98 HA PRO 98 13.382 -10.268 2.536 790 HB2 PRO 98 HB2 PRO 98 11.901 -8.264 3.901 791 HB3 PRO 98 HB1 PRO 98 12.002 -9.980 4.302 792 HG2 PRO 98 HG2 PRO 98 13.551 -7.685 5.374 793 HG3 PRO 98 HG1 PRO 98 13.009 -9.159 6.201 794 HD2 PRO 98 HD2 PRO 98 15.559 -8.894 5.531 795 HD3 PRO 98 HD1 PRO 98 14.740 -10.451 5.263 796 H ARG 99 HN ARG 99 13.208 -9.730 0.538 797 HA ARG 99 HA ARG 99 13.428 -6.995 -0.369 798 HB2 ARG 99 HB2 ARG 99 13.281 -8.005 -2.626 799 HB3 ARG 99 HB1 ARG 99 14.583 -8.685 -1.647 800 HG2 ARG 99 HG2 ARG 99 13.032 -10.557 -1.045 801 HG3 ARG 99 HG1 ARG 99 11.922 -9.931 -2.263 802 HD2 ARG 99 HD2 ARG 99 13.753 -10.156 -3.941 803 HD3 ARG 99 HD1 ARG 99 14.736 -10.928 -2.695 804 HE ARG 99 HE ARG 99 13.207 -12.755 -2.660 805 HH11 ARG 99 HH11 ARG 99 12.629 -10.452 -5.233 806 HH12 ARG 99 HH12 ARG 99 11.765 -11.592 -6.227 807 HH21 ARG 99 HH21 ARG 99 12.084 -14.253 -3.954 808 HH22 ARG 99 HH22 ARG 99 11.449 -13.754 -5.497 809 H LYS 100 HN LYS 100 11.099 -8.086 1.213 810 HA LYS 100 HA LYS 100 9.147 -6.624 -0.372 811 HB2 LYS 100 HB2 LYS 100 7.354 -8.246 0.053 812 HB3 LYS 100 HB1 LYS 100 8.630 -8.952 -0.931 813 HG2 LYS 100 HG2 LYS 100 9.397 -10.290 0.814 814 HG3 LYS 100 HG1 LYS 100 8.597 -9.309 2.042 815 HD2 LYS 100 HD2 LYS 100 7.309 -11.272 1.899 816 HD3 LYS 100 HD1 LYS 100 6.403 -10.064 0.986 817 HE2 LYS 100 HE2 LYS 100 8.311 -11.941 -0.376 818 HE3 LYS 100 HE1 LYS 100 6.657 -12.420 -0.007 819 HZ1 LYS 100 HZ1 LYS 100 5.912 -10.437 -1.256 820 HZ2 LYS 100 HZ2 LYS 100 6.727 -11.581 -2.209 821 HZ3 LYS 100 HZ3 LYS 100 7.522 -10.166 -1.726 822 H VAL 101 HN VAL 101 7.640 -5.558 0.882 823 HA VAL 101 HA VAL 101 7.812 -5.992 3.780 824 HB VAL 101 HB VAL 101 8.965 -3.896 3.084 825 HG11 VAL 101 HG11 VAL 101 7.814 -3.125 1.201 826 HG12 VAL 101 HG12 VAL 101 7.400 -1.971 2.479 827 HG13 VAL 101 HG13 VAL 101 6.246 -3.223 2.019 828 HG21 VAL 101 HG21 VAL 101 7.958 -2.484 4.769 829 HG22 VAL 101 HG22 VAL 101 7.988 -4.162 5.315 830 HG23 VAL 101 HG23 VAL 101 6.483 -3.452 4.729 831 H ARG 102 HN ARG 102 5.863 -6.004 4.870 832 HA ARG 102 HA ARG 102 3.484 -5.795 3.150 833 HB2 ARG 102 HB2 ARG 102 3.991 -8.064 4.177 834 HB3 ARG 102 HB1 ARG 102 3.669 -7.321 5.741 835 HG2 ARG 102 HG2 ARG 102 1.413 -6.715 5.012 836 HG3 ARG 102 HG1 ARG 102 1.693 -7.483 3.458 837 HD2 ARG 102 HD2 ARG 102 0.610 -9.176 4.549 838 HD3 ARG 102 HD1 ARG 102 2.271 -9.561 5.004 839 HE ARG 102 HE ARG 102 0.810 -7.803 6.811 840 HH11 ARG 102 HH11 ARG 102 1.916 -11.062 6.107 841 HH12 ARG 102 HH12 ARG 102 1.611 -11.637 7.724 842 HH21 ARG 102 HH21 ARG 102 0.404 -8.548 8.888 843 HH22 ARG 102 HH22 ARG 102 0.758 -10.195 9.315 844 H PHE 103 HN PHE 103 2.195 -4.164 3.559 845 HA PHE 103 HA PHE 103 2.286 -2.996 6.263 846 HB2 PHE 103 HB2 PHE 103 1.553 -1.684 3.646 847 HB3 PHE 103 HB1 PHE 103 1.485 -0.906 5.219 848 HD1 PHE 103 HD1 PHE 103 3.986 -1.821 6.452 849 HD2 PHE 103 HD2 PHE 103 3.179 -0.560 2.472 850 HE1 PHE 103 HE1 PHE 103 6.316 -1.070 6.222 851 HE2 PHE 103 HE2 PHE 103 5.510 0.180 2.230 852 HZ PHE 103 HZ PHE 103 7.081 -0.071 4.108 853 H ASP 104 HN ASP 104 0.690 -3.940 7.340 854 HA ASP 104 HA ASP 104 -1.863 -4.535 6.186 855 HB2 ASP 104 HB2 ASP 104 -0.922 -4.457 9.063 856 HB3 ASP 104 HB1 ASP 104 -2.530 -4.972 8.573 857 H TYR 105 HN TYR 105 -2.554 -2.578 5.309 858 HA TYR 105 HA TYR 105 -2.768 -0.262 7.072 859 HB2 TYR 105 HB2 TYR 105 -1.859 0.127 4.848 860 HB3 TYR 105 HB1 TYR 105 -3.279 -0.610 4.105 861 HD1 TYR 105 HD1 TYR 105 -2.418 2.206 6.429 862 HD2 TYR 105 HD2 TYR 105 -4.913 0.757 3.320 863 HE1 TYR 105 HE1 TYR 105 -3.517 4.404 6.289 864 HE2 TYR 105 HE2 TYR 105 -6.015 2.935 3.166 865 HH TYR 105 HH TYR 105 -4.766 5.722 4.531 866 H ASP 106 HN ASP 106 -4.626 0.453 7.937 867 HA ASP 106 HA ASP 106 -6.914 -1.288 7.757 868 HB2 ASP 106 HB2 ASP 106 -6.084 -0.095 9.871 869 HB3 ASP 106 HB1 ASP 106 -6.844 1.351 9.212 870 H LEU 107 HN LEU 107 -8.150 -1.145 6.004 871 HA LEU 107 HA LEU 107 -8.632 1.350 4.662 872 HB2 LEU 107 HB2 LEU 107 -9.039 -1.462 4.164 873 HB3 LEU 107 HB1 LEU 107 -10.492 -0.553 3.790 874 HG LEU 107 HG LEU 107 -9.050 0.918 2.324 875 HD11 LEU 107 HD11 LEU 107 -6.940 -0.134 1.565 876 HD12 LEU 107 HD12 LEU 107 -7.057 -1.251 2.925 877 HD13 LEU 107 HD13 LEU 107 -6.883 0.482 3.216 878 HD21 LEU 107 HD21 LEU 107 -8.883 -0.840 0.547 879 HD22 LEU 107 HD22 LEU 107 -10.462 -0.691 1.325 880 HD23 LEU 107 HD23 LEU 107 -9.382 -2.011 1.770 881 H PHE 108 HN PHE 108 -9.732 2.690 6.111 882 HA PHE 108 HA PHE 108 -12.291 1.653 7.116 883 HB2 PHE 108 HB2 PHE 108 -12.342 3.482 8.710 884 HB3 PHE 108 HB1 PHE 108 -10.821 2.619 8.855 885 HD1 PHE 108 HD2 PHE 108 -12.433 5.729 7.757 886 HD2 PHE 108 HD1 PHE 108 -8.727 3.724 8.385 887 HE1 PHE 108 HE2 PHE 108 -11.245 7.872 7.560 888 HE2 PHE 108 HE1 PHE 108 -7.536 5.873 8.193 889 HZ PHE 108 HZ PHE 108 -8.794 7.946 7.778 890 H LEU 109 HN LEU 109 -14.210 2.518 6.536 891 HA LEU 109 HA LEU 109 -14.119 4.664 4.507 892 HB2 LEU 109 HB2 LEU 109 -16.272 2.560 4.813 893 HB3 LEU 109 HB1 LEU 109 -16.070 3.692 3.489 894 HG LEU 109 HG LEU 109 -14.300 1.330 4.129 895 HD11 LEU 109 HD11 LEU 109 -16.498 0.894 3.005 896 HD12 LEU 109 HD12 LEU 109 -15.079 0.398 2.089 897 HD13 LEU 109 HD13 LEU 109 -15.929 1.883 1.663 898 HD21 LEU 109 HD21 LEU 109 -14.010 3.385 1.945 899 HD22 LEU 109 HD22 LEU 109 -13.043 1.919 2.122 900 HD23 LEU 109 HD23 LEU 109 -12.944 3.194 3.338 901 H HIS 110 HN HIS 110 -15.671 6.332 4.716 902 HA HIS 110 HA HIS 110 -16.716 6.651 7.416 903 HB2 HIS 110 HB2 HIS 110 -15.435 8.450 6.086 904 HB3 HIS 110 HB1 HIS 110 -16.920 8.659 5.171 905 HD1 HIS 110 HD1 HIS 110 -15.315 9.440 8.426 906 HD2 HIS 110 HD2 HIS 110 -19.039 9.885 6.618 907 HE1 HIS 110 HE1 HIS 110 -16.565 11.105 9.838 908 HE2 HIS 110 HE2 HIS 110 -18.858 11.260 8.806 909 H LEU 111 HN LEU 111 -18.950 7.367 7.746 910 HA LEU 111 HA LEU 111 -20.742 5.499 6.894 911 HB2 LEU 111 HB2 LEU 111 -20.827 7.857 8.477 912 HB3 LEU 111 HB1 LEU 111 -22.248 7.826 7.447 913 HG LEU 111 HG LEU 111 -22.607 6.771 9.673 914 HD11 LEU 111 HD11 LEU 111 -23.547 4.608 8.742 915 HD12 LEU 111 HD12 LEU 111 -22.886 5.109 7.185 916 HD13 LEU 111 HD13 LEU 111 -24.107 6.100 7.985 917 HD21 LEU 111 HD21 LEU 111 -20.735 4.652 8.632 918 HD22 LEU 111 HD22 LEU 111 -21.617 4.627 10.162 919 HD23 LEU 111 HD23 LEU 111 -20.341 5.817 9.900 920 H GLU 112 HN GLU 112 -22.142 5.168 5.408 921 HA GLU 112 HA GLU 112 -21.997 6.148 2.845 922 HB2 GLU 112 HB2 GLU 112 -23.040 4.006 3.663 923 HB3 GLU 112 HB1 GLU 112 -24.439 4.945 4.156 924 HG2 GLU 112 HG2 GLU 112 -24.865 5.570 1.861 925 HG3 GLU 112 HG1 GLU 112 -23.414 4.714 1.335 926 H GLY 113 HN GLY 113 -22.916 7.755 1.752 927 HA2 GLY 113 HA2 GLY 113 -24.742 9.312 1.411 928 HA3 GLY 113 HA1 GLY 113 -24.841 9.480 3.159 929 H HIS 114 HN HIS 114 -22.283 9.907 3.948 930 HA HIS 114 HA HIS 114 -21.164 11.978 2.241 931 HB2 HIS 114 HB2 HIS 114 -21.110 13.644 4.128 932 HB3 HIS 114 HB1 HIS 114 -22.696 13.346 3.436 933 HD1 HIS 114 HD1 HIS 114 -20.901 13.431 6.608 934 HD2 HIS 114 HD2 HIS 114 -24.351 11.626 5.132 935 HE1 HIS 114 HE1 HIS 114 -22.241 12.759 8.630 936 HE2 HIS 114 HE2 HIS 114 -24.379 11.779 7.713 937 HA PRO 115 HA PRO 115 -17.733 10.171 4.601 938 HB2 PRO 115 HB2 PRO 115 -16.840 8.359 2.823 939 HB3 PRO 115 HB1 PRO 115 -18.184 8.012 3.914 940 HG2 PRO 115 HG2 PRO 115 -18.214 8.383 1.022 941 HG3 PRO 115 HG1 PRO 115 -19.485 7.750 2.078 942 HD2 PRO 115 HD2 PRO 115 -19.135 10.466 1.011 943 HD3 PRO 115 HD1 PRO 115 -20.576 9.718 1.736 944 HA PRO 116 HA PRO 116 -14.806 12.343 1.886 945 HB2 PRO 116 HB2 PRO 116 -13.969 14.216 3.615 946 HB3 PRO 116 HB1 PRO 116 -15.466 14.410 2.698 947 HG2 PRO 116 HG2 PRO 116 -15.081 13.818 5.564 948 HG3 PRO 116 HG1 PRO 116 -16.460 14.565 4.744 949 HD2 PRO 116 HD2 PRO 116 -16.164 11.833 5.585 950 HD3 PRO 116 HD1 PRO 116 -17.545 12.590 4.765 951 H VAL 117 HN VAL 117 -13.404 10.543 1.928 952 HA VAL 117 HA VAL 117 -11.724 10.350 4.345 953 HB VAL 117 HB VAL 117 -12.649 8.169 2.481 954 HG11 VAL 117 HG11 VAL 117 -10.513 8.058 4.598 955 HG12 VAL 117 HG12 VAL 117 -10.321 7.754 2.875 956 HG13 VAL 117 HG13 VAL 117 -11.262 6.642 3.868 957 HG21 VAL 117 HG21 VAL 117 -13.483 7.166 4.568 958 HG22 VAL 117 HG22 VAL 117 -14.213 8.736 4.237 959 HG23 VAL 117 HG23 VAL 117 -12.942 8.592 5.452 960 H ASN 118 HN ASN 118 -9.746 11.015 4.052 961 HA ASN 118 HA ASN 118 -8.257 10.116 1.712 962 HB2 ASN 118 HB2 ASN 118 -9.129 12.459 1.273 963 HB3 ASN 118 HB1 ASN 118 -8.129 13.002 2.614 964 HD21 ASN 118 HD21 ASN 118 -5.752 12.459 2.409 965 HD22 ASN 118 HD22 ASN 118 -5.065 12.544 0.825 966 H HIS 119 HN HIS 119 -6.924 8.794 2.923 967 HA HIS 119 HA HIS 119 -5.436 10.107 5.110 968 HB2 HIS 119 HB2 HIS 119 -7.146 8.375 5.852 969 HB3 HIS 119 HB1 HIS 119 -6.136 7.185 5.038 970 HD1 HIS 119 HD1 HIS 119 -5.474 5.905 7.147 971 HD2 HIS 119 HD2 HIS 119 -4.549 9.964 7.311 972 HE1 HIS 119 HE1 HIS 119 -3.986 6.188 9.151 973 HE2 HIS 119 HE2 HIS 119 -3.517 8.657 9.295 974 H LEU 120 HN LEU 120 -3.318 9.953 5.063 975 HA LEU 120 HA LEU 120 -1.967 7.856 3.553 976 HB2 LEU 120 HB2 LEU 120 -1.797 10.787 3.005 977 HB3 LEU 120 HB1 LEU 120 -0.333 9.839 2.867 978 HG LEU 120 HG LEU 120 -2.841 9.137 1.361 979 HD11 LEU 120 HD11 LEU 120 -0.993 10.143 -0.429 980 HD12 LEU 120 HD12 LEU 120 -0.943 11.289 0.913 981 HD13 LEU 120 HD13 LEU 120 -2.473 10.947 0.103 982 HD21 LEU 120 HD21 LEU 120 -0.834 7.532 1.827 983 HD22 LEU 120 HD22 LEU 120 -0.036 8.495 0.580 984 HD23 LEU 120 HD23 LEU 120 -1.531 7.636 0.209 985 H ARG 121 HN ARG 121 -0.367 7.002 4.724 986 HA ARG 121 HA ARG 121 0.726 8.585 6.950 987 HB2 ARG 121 HB2 ARG 121 0.707 6.491 8.333 988 HB3 ARG 121 HB1 ARG 121 -0.870 7.180 7.998 989 HG2 ARG 121 HG2 ARG 121 -1.323 4.987 7.624 990 HG3 ARG 121 HG1 ARG 121 -0.815 5.446 6.006 991 HD2 ARG 121 HD2 ARG 121 0.156 3.301 6.859 992 HD3 ARG 121 HD1 ARG 121 1.352 4.481 6.319 993 HE ARG 121 HE ARG 121 1.546 5.044 8.784 994 HH11 ARG 121 HH11 ARG 121 0.590 1.860 7.672 995 HH12 ARG 121 HH12 ARG 121 1.179 1.054 9.091 996 HH21 ARG 121 HH21 ARG 121 2.299 3.975 10.664 997 HH22 ARG 121 HH22 ARG 121 2.151 2.246 10.779 998 H CYS 122 HN CYS 122 2.765 7.679 7.835 999 HA CYS 122 HA CYS 122 4.399 6.904 5.523 1000 HB2 CYS 122 HB2 CYS 122 6.229 8.088 6.740 1001 HB3 CYS 122 HB1 CYS 122 4.892 9.120 6.251 1002 HG CYS 122 HG CYS 122 5.659 8.041 9.393 1003 H GLU 123 HN GLU 123 5.588 5.121 5.570 1004 HA GLU 123 HA GLU 123 6.160 3.858 8.167 1005 HB2 GLU 123 HB2 GLU 123 5.960 2.689 5.388 1006 HB3 GLU 123 HB1 GLU 123 6.593 1.802 6.773 1007 HG2 GLU 123 HG2 GLU 123 3.913 3.078 6.932 1008 HG3 GLU 123 HG1 GLU 123 4.099 1.540 6.085 1009 H LYS 124 HN LYS 124 8.267 3.004 8.467 1010 HA LYS 124 HA LYS 124 10.320 4.281 6.789 1011 HB2 LYS 124 HB2 LYS 124 9.976 5.602 8.816 1012 HB3 LYS 124 HB1 LYS 124 10.194 4.165 9.803 1013 HG2 LYS 124 HG2 LYS 124 12.528 4.008 8.963 1014 HG3 LYS 124 HG1 LYS 124 12.258 5.523 8.097 1015 HD2 LYS 124 HD2 LYS 124 11.778 5.314 11.033 1016 HD3 LYS 124 HD1 LYS 124 13.388 5.630 10.371 1017 HE2 LYS 124 HE2 LYS 124 12.808 7.673 9.558 1018 HE3 LYS 124 HE1 LYS 124 11.127 7.196 9.311 1019 HZ1 LYS 124 HZ1 LYS 124 11.318 8.816 11.087 1020 HZ2 LYS 124 HZ2 LYS 124 12.414 7.825 11.921 1021 HZ3 LYS 124 HZ3 LYS 124 10.804 7.328 11.723 1022 H LEU 125 HN LEU 125 11.763 2.837 6.063 1023 HA LEU 125 HA LEU 125 12.169 0.386 7.661 1024 HB2 LEU 125 HB2 LEU 125 12.582 0.663 4.692 1025 HB3 LEU 125 HB1 LEU 125 12.562 -0.815 5.627 1026 HG LEU 125 HG LEU 125 10.071 0.789 5.687 1027 HD11 LEU 125 HD11 LEU 125 10.688 0.975 3.320 1028 HD12 LEU 125 HD12 LEU 125 9.303 -0.099 3.549 1029 HD13 LEU 125 HD13 LEU 125 10.901 -0.778 3.249 1030 HD21 LEU 125 HD21 LEU 125 9.175 -1.583 5.360 1031 HD22 LEU 125 HD22 LEU 125 10.003 -1.223 6.878 1032 HD23 LEU 125 HD23 LEU 125 10.842 -2.109 5.603 1033 H THR 126 HN THR 126 13.976 0.958 8.808 1034 HA THR 126 HA THR 126 16.265 2.132 7.436 1035 HB THR 126 HB THR 126 16.396 1.143 10.256 1036 HG1 THR 126 HG1 THR 126 14.442 2.296 10.231 1037 HG21 THR 126 HG21 THR 126 18.278 2.226 8.886 1038 HG22 THR 126 HG22 THR 126 17.988 2.819 10.523 1039 HG23 THR 126 HG23 THR 126 17.396 3.732 9.134 1040 H PHE 127 HN PHE 127 17.636 0.864 6.380 1041 HA PHE 127 HA PHE 127 17.958 -1.922 7.248 1042 HB2 PHE 127 HB2 PHE 127 18.806 -0.578 4.669 1043 HB3 PHE 127 HB1 PHE 127 18.974 -2.293 5.033 1044 HD1 PHE 127 HD1 PHE 127 17.014 -3.740 5.149 1045 HD2 PHE 127 HD2 PHE 127 16.700 0.367 4.093 1046 HE1 PHE 127 HE1 PHE 127 14.737 -4.134 4.321 1047 HE2 PHE 127 HE2 PHE 127 14.427 -0.011 3.261 1048 HZ PHE 127 HZ PHE 127 13.431 -2.263 3.381 1049 H ASN 128 HN ASN 128 19.564 -2.248 8.610 1050 HA ASN 128 HA ASN 128 21.606 -0.219 8.917 1051 HB2 ASN 128 HB2 ASN 128 21.044 -1.036 11.023 1052 HB3 ASN 128 HB1 ASN 128 20.909 -2.705 10.447 1053 HD21 ASN 128 HD21 ASN 128 22.685 -4.016 10.540 1054 HD22 ASN 128 HD22 ASN 128 24.210 -3.512 11.200 1055 H ASN 129 HN ASN 129 23.317 -0.104 7.728 1056 HA ASN 129 HA ASN 129 25.034 -0.615 6.346 1057 HB2 ASN 129 HB2 ASN 129 25.210 -2.744 8.452 1058 HB3 ASN 129 HB1 ASN 129 26.379 -2.675 7.134 1059 HD21 ASN 129 HD21 ASN 129 25.194 -1.108 10.004 1060 HD22 ASN 129 HD22 ASN 129 26.497 0.027 10.158 1061 HA PRO 130 HA PRO 130 22.921 -3.788 3.791 1062 HB2 PRO 130 HB2 PRO 130 22.092 -2.205 1.793 1063 HB3 PRO 130 HB1 PRO 130 21.179 -2.336 3.300 1064 HG2 PRO 130 HG2 PRO 130 22.956 -0.152 2.345 1065 HG3 PRO 130 HG1 PRO 130 21.487 -0.058 3.329 1066 HD2 PRO 130 HD2 PRO 130 24.131 0.038 4.271 1067 HD3 PRO 130 HD1 PRO 130 22.674 -0.203 5.252 1068 H THR 131 HN THR 131 23.567 -4.551 1.675 1069 HA THR 131 HA THR 131 26.328 -4.134 1.121 1070 HB THR 131 HB THR 131 25.238 -6.320 0.693 1071 HG1 THR 131 HG1 THR 131 26.733 -6.609 -0.743 1072 HG21 THR 131 HG21 THR 131 23.734 -6.657 -1.146 1073 HG22 THR 131 HG22 THR 131 23.904 -4.979 -1.660 1074 HG23 THR 131 HG23 THR 131 23.082 -5.358 -0.146 1075 H GLU 132 HN GLU 132 27.185 -3.393 -1.014 1076 HA GLU 132 HA GLU 132 26.489 -0.759 -1.465 1077 HB2 GLU 132 HB2 GLU 132 28.622 -1.851 -2.211 1078 HB3 GLU 132 HB1 GLU 132 27.724 -2.529 -3.563 1079 HG2 GLU 132 HG2 GLU 132 28.895 -0.567 -4.287 1080 HG3 GLU 132 HG1 GLU 132 27.159 -0.270 -4.309 1081 H ASP 133 HN ASP 133 25.451 -3.588 -3.346 1082 HA ASP 133 HA ASP 133 24.129 -2.295 -5.410 1083 HB2 ASP 133 HB2 ASP 133 23.435 -4.908 -4.051 1084 HB3 ASP 133 HB1 ASP 133 22.725 -4.364 -5.567 1085 H PHE 134 HN PHE 134 22.837 -3.321 -2.266 1086 HA PHE 134 HA PHE 134 20.210 -2.390 -2.803 1087 HB2 PHE 134 HB2 PHE 134 20.919 -4.132 -1.024 1088 HB3 PHE 134 HB1 PHE 134 21.339 -2.735 -0.033 1089 HD1 PHE 134 HD1 PHE 134 18.535 -2.935 -2.410 1090 HD2 PHE 134 HD2 PHE 134 19.691 -2.897 1.681 1091 HE1 PHE 134 HE1 PHE 134 16.207 -2.662 -1.762 1092 HE2 PHE 134 HE2 PHE 134 17.338 -2.639 2.337 1093 HZ PHE 134 HZ PHE 134 15.595 -2.516 0.605 1094 H ARG 135 HN ARG 135 22.871 -1.145 -0.835 1095 HA ARG 135 HA ARG 135 21.706 1.199 0.076 1096 HB2 ARG 135 HB2 ARG 135 23.817 0.448 0.941 1097 HB3 ARG 135 HB1 ARG 135 24.576 0.599 -0.642 1098 HG2 ARG 135 HG2 ARG 135 24.033 3.052 -0.528 1099 HG3 ARG 135 HG1 ARG 135 23.618 2.781 1.173 1100 HD2 ARG 135 HD2 ARG 135 26.319 2.459 -0.145 1101 HD3 ARG 135 HD1 ARG 135 25.853 3.514 1.191 1102 HE ARG 135 HE ARG 135 25.623 1.449 2.537 1103 HH11 ARG 135 HH11 ARG 135 27.501 1.327 -0.415 1104 HH12 ARG 135 HH12 ARG 135 28.613 0.140 0.196 1105 HH21 ARG 135 HH21 ARG 135 27.097 -0.143 3.335 1106 HH22 ARG 135 HH22 ARG 135 28.369 -0.711 2.291 1107 H ARG 136 HN ARG 136 23.558 0.629 -2.856 1108 HA ARG 136 HA ARG 136 23.694 3.029 -4.092 1109 HB2 ARG 136 HB2 ARG 136 23.929 0.352 -4.761 1110 HB3 ARG 136 HB1 ARG 136 22.791 1.041 -5.880 1111 HG2 ARG 136 HG2 ARG 136 24.382 2.690 -6.594 1112 HG3 ARG 136 HG1 ARG 136 25.537 2.112 -5.387 1113 HD2 ARG 136 HD2 ARG 136 25.395 -0.140 -6.499 1114 HD3 ARG 136 HD1 ARG 136 24.489 0.640 -7.794 1115 HE ARG 136 HE ARG 136 27.034 1.875 -7.194 1116 HH11 ARG 136 HH11 ARG 136 25.363 -0.549 -9.100 1117 HH12 ARG 136 HH12 ARG 136 26.575 -0.594 -10.340 1118 HH21 ARG 136 HH21 ARG 136 28.621 1.834 -8.832 1119 HH22 ARG 136 HH22 ARG 136 28.423 0.775 -10.193 1120 H LYS 137 HN LYS 137 20.987 0.760 -4.367 1121 HA LYS 137 HA LYS 137 19.440 2.547 -5.956 1122 HB2 LYS 137 HB2 LYS 137 18.764 -0.005 -4.509 1123 HB3 LYS 137 HB1 LYS 137 17.550 0.919 -5.398 1124 HG2 LYS 137 HG2 LYS 137 18.875 0.693 -7.448 1125 HG3 LYS 137 HG1 LYS 137 20.091 -0.233 -6.566 1126 HD2 LYS 137 HD2 LYS 137 17.302 -1.218 -6.421 1127 HD3 LYS 137 HD1 LYS 137 18.128 -1.373 -7.972 1128 HE2 LYS 137 HE2 LYS 137 19.973 -2.514 -6.895 1129 HE3 LYS 137 HE1 LYS 137 19.189 -2.364 -5.328 1130 HZ1 LYS 137 HZ1 LYS 137 18.974 -4.558 -6.522 1131 HZ2 LYS 137 HZ2 LYS 137 17.936 -3.772 -7.612 1132 HZ3 LYS 137 HZ3 LYS 137 17.534 -3.866 -5.965 1133 H LEU 138 HN LEU 138 19.353 1.667 -2.539 1134 HA LEU 138 HA LEU 138 17.169 3.180 -1.714 1135 HB2 LEU 138 HB2 LEU 138 19.720 2.805 -0.163 1136 HB3 LEU 138 HB1 LEU 138 18.147 3.197 0.495 1137 HG LEU 138 HG LEU 138 19.062 0.586 -0.669 1138 HD11 LEU 138 HD11 LEU 138 19.564 1.114 1.708 1139 HD12 LEU 138 HD12 LEU 138 18.520 -0.293 1.489 1140 HD13 LEU 138 HD13 LEU 138 17.828 1.249 1.993 1141 HD21 LEU 138 HD21 LEU 138 16.257 1.417 0.010 1142 HD22 LEU 138 HD22 LEU 138 16.774 -0.237 -0.302 1143 HD23 LEU 138 HD23 LEU 138 16.871 0.975 -1.579 1144 H LEU 139 HN LEU 139 20.474 4.200 -2.338 1145 HA LEU 139 HA LEU 139 20.108 6.849 -1.296 1146 HB2 LEU 139 HB2 LEU 139 22.302 5.632 -2.962 1147 HB3 LEU 139 HB1 LEU 139 22.362 7.243 -2.276 1148 HG LEU 139 HG LEU 139 22.173 4.681 -0.698 1149 HD11 LEU 139 HD11 LEU 139 24.339 4.601 -1.371 1150 HD12 LEU 139 HD12 LEU 139 24.510 5.655 0.038 1151 HD13 LEU 139 HD13 LEU 139 24.457 6.351 -1.583 1152 HD21 LEU 139 HD21 LEU 139 21.080 6.586 0.361 1153 HD22 LEU 139 HD22 LEU 139 22.573 7.519 0.224 1154 HD23 LEU 139 HD23 LEU 139 22.521 6.078 1.244 1155 H LYS 140 HN LYS 140 19.929 5.342 -4.452 1156 HA LYS 140 HA LYS 140 19.898 7.715 -5.987 1157 HB2 LYS 140 HB2 LYS 140 19.692 4.922 -6.478 1158 HB3 LYS 140 HB1 LYS 140 18.361 5.735 -7.269 1159 HG2 LYS 140 HG2 LYS 140 19.788 7.061 -8.572 1160 HG3 LYS 140 HG1 LYS 140 21.198 6.615 -7.606 1161 HD2 LYS 140 HD2 LYS 140 19.609 4.548 -9.090 1162 HD3 LYS 140 HD1 LYS 140 20.883 5.469 -9.885 1163 HE2 LYS 140 HE2 LYS 140 21.276 3.921 -7.341 1164 HE3 LYS 140 HE1 LYS 140 21.540 3.245 -8.943 1165 HZ1 LYS 140 HZ1 LYS 140 23.623 4.023 -8.129 1166 HZ2 LYS 140 HZ2 LYS 140 22.972 5.523 -7.695 1167 HZ3 LYS 140 HZ3 LYS 140 23.127 5.110 -9.333 1168 H ALA 141 HN ALA 141 17.559 6.056 -4.125 1169 HA ALA 141 HA ALA 141 15.137 6.696 -5.224 1170 HB1 ALA 141 HB1 ALA 141 14.207 6.231 -3.159 1171 HB2 ALA 141 HB2 ALA 141 15.559 6.935 -2.275 1172 HB3 ALA 141 HB3 ALA 141 15.749 5.383 -3.089 1173 H1 GLY 212 HT1 GLY 212 -22.638 2.767 15.767 1174 H2 GLY 212 HT2 GLY 212 -21.600 3.771 16.656 1175 H3 GLY 212 HT3 GLY 212 -20.958 2.641 15.565 1176 HA2 GLY 212 HA1 GLY 212 -21.972 3.810 13.712 1177 HA3 GLY 212 HA2 GLY 212 -22.624 4.987 14.843 1178 H GLY 213 HN GLY 213 -19.407 3.461 14.620 1179 HA2 GLY 213 HA2 GLY 213 -18.154 6.063 14.910 1180 HA3 GLY 213 HA1 GLY 213 -17.331 4.511 14.803 1181 H LYS 214 HN LYS 214 -16.962 3.585 12.745 1182 HA LYS 214 HA LYS 214 -17.149 5.492 10.513 1183 HB2 LYS 214 HB2 LYS 214 -15.572 2.911 10.701 1184 HB3 LYS 214 HB1 LYS 214 -15.530 4.048 9.364 1185 HG2 LYS 214 HG2 LYS 214 -14.601 4.601 12.174 1186 HG3 LYS 214 HG1 LYS 214 -13.566 4.249 10.790 1187 HD2 LYS 214 HD2 LYS 214 -14.421 6.270 9.670 1188 HD3 LYS 214 HD1 LYS 214 -15.398 6.627 11.096 1189 HE2 LYS 214 HE2 LYS 214 -12.386 6.449 10.991 1190 HE3 LYS 214 HE1 LYS 214 -13.336 7.930 11.100 1191 HZ1 LYS 214 HZ1 LYS 214 -13.225 5.770 13.143 1192 HZ2 LYS 214 HZ2 LYS 214 -14.181 7.170 13.248 1193 HZ3 LYS 214 HZ3 LYS 214 -12.488 7.293 13.258 1194 H ALA 215 HN ALA 215 -17.263 3.902 8.348 1195 HA ALA 215 HA ALA 215 -19.892 2.832 8.337 1196 HB1 ALA 215 HB1 ALA 215 -19.316 2.021 6.086 1197 HB2 ALA 215 HB2 ALA 215 -17.625 2.429 6.374 1198 HB3 ALA 215 HB3 ALA 215 -18.843 3.704 6.312 1199 HA PRO 216 HA PRO 216 -19.382 -1.390 9.657 1200 HB2 PRO 216 HB2 PRO 216 -20.291 -2.831 7.469 1201 HB3 PRO 216 HB1 PRO 216 -21.324 -2.135 8.714 1202 HG2 PRO 216 HG2 PRO 216 -20.626 -1.052 6.017 1203 HG3 PRO 216 HG1 PRO 216 -22.188 -1.053 6.853 1204 HD2 PRO 216 HD2 PRO 216 -20.687 1.148 6.753 1205 HD3 PRO 216 HD1 PRO 216 -21.593 0.740 8.227 1206 H ARG 217 HN ARG 217 -17.984 -3.221 9.384 1207 HA ARG 217 HA ARG 217 -16.217 -3.145 7.074 1208 HB2 ARG 217 HB2 ARG 217 -14.184 -3.206 8.483 1209 HB3 ARG 217 HB1 ARG 217 -15.061 -1.690 8.598 1210 HG2 ARG 217 HG2 ARG 217 -16.009 -2.411 10.739 1211 HG3 ARG 217 HG1 ARG 217 -15.091 -3.916 10.625 1212 HD2 ARG 217 HD2 ARG 217 -13.912 -1.138 10.694 1213 HD3 ARG 217 HD1 ARG 217 -13.970 -2.258 12.054 1214 HE ARG 217 HE ARG 217 -12.609 -3.762 10.464 1215 HH11 ARG 217 HH11 ARG 217 -12.348 -0.265 10.625 1216 HH12 ARG 217 HH12 ARG 217 -10.680 -0.240 10.124 1217 HH21 ARG 217 HH21 ARG 217 -10.419 -3.724 9.807 1218 HH22 ARG 217 HH22 ARG 217 -9.582 -2.194 9.707 1219 H1 KCR 218 HN KCR 218 -15.268 -5.032 6.555 1220 H4 KCR 218 HA KCR 218 -16.523 -7.386 7.719 1221 H5 KCR 218 HB1 KCR 218 -15.720 -8.553 5.758 1222 H6 KCR 218 HB2 KCR 218 -14.684 -7.199 5.323 1223 H7 KCR 218 HG1 KCR 218 -16.702 -5.815 4.981 1224 H8 KCR 218 HG2 KCR 218 -17.692 -7.240 5.303 1225 H9 KCR 218 HD1 KCR 218 -16.837 -8.365 3.387 1226 H10 KCR 218 HD2 KCR 218 -15.605 -7.126 3.138 1227 H11 KCR 218 HE1 KCR 218 -17.342 -5.482 2.657 1228 H12 KCR 218 HE2 KCR 218 -18.584 -6.709 2.920 1229 H13 KCR 218 HZ1 KCR 218 -17.788 -7.841 0.957 1230 H14 KCR 218 HH1 KCR 218 -17.219 -7.668 -1.380 1231 H15 KCR 218 HJ1 KCR 218 -16.795 -4.687 -2.065 1232 H16 KCR 218 HF3 KCR 218 -16.452 -5.496 -4.301 1233 H17 KCR 218 HF1 KCR 218 -16.112 -7.100 -3.651 1234 H18 KCR 218 HF2 KCR 218 -17.775 -6.622 -3.991 1235 H GLN 219 HN GLN 219 -15.404 -7.552 9.669 1236 HA GLN 219 HA GLN 219 -12.609 -7.462 9.933 1237 HB2 GLN 219 HB2 GLN 219 -14.631 -8.914 11.651 1238 HB3 GLN 219 HB1 GLN 219 -12.971 -8.552 12.112 1239 HG2 GLN 219 HG2 GLN 219 -13.473 -6.147 11.900 1240 HG3 GLN 219 HG1 GLN 219 -15.148 -6.555 11.537 1241 HE21 GLN 219 HE21 GLN 219 -15.242 -8.755 13.433 1242 HE22 GLN 219 HE22 GLN 219 -15.291 -8.037 15.007 1243 H LEU 220 HN LEU 220 -14.845 -10.169 9.507 1244 HA LEU 220 HA LEU 220 -14.538 -12.346 8.919 1245 HB2 LEU 220 HB2 LEU 220 -14.083 -11.125 6.811 1246 HB3 LEU 220 HB1 LEU 220 -12.373 -11.138 7.196 1247 HG LEU 220 HG LEU 220 -12.414 -13.622 7.125 1248 HD11 LEU 220 HD11 LEU 220 -14.340 -14.732 6.096 1249 HD12 LEU 220 HD12 LEU 220 -15.224 -13.205 6.117 1250 HD13 LEU 220 HD13 LEU 220 -14.763 -13.978 7.634 1251 HD21 LEU 220 HD21 LEU 220 -12.557 -13.793 4.696 1252 HD22 LEU 220 HD22 LEU 220 -11.709 -12.327 5.188 1253 HD23 LEU 220 HD23 LEU 220 -13.380 -12.234 4.631 1254 H ALA 221 HN ALA 221 -13.670 -12.584 11.179 1255 HA ALA 221 HA ALA 221 -10.926 -13.651 11.046 1256 HB1 ALA 221 HB1 ALA 221 -10.631 -13.056 13.395 1257 HB2 ALA 221 HB2 ALA 221 -12.249 -12.356 13.430 1258 HB3 ALA 221 HB3 ALA 221 -10.997 -11.629 12.424 1259 H THR 222 HN THR 222 -11.885 -15.656 10.425 1260 HA THR 222 HA THR 222 -13.780 -16.956 12.133 1261 HB THR 222 HB THR 222 -13.655 -17.417 9.698 1262 HG1 THR 222 HG1 THR 222 -13.048 -19.878 10.921 1263 HG21 THR 222 HG21 THR 222 -11.075 -18.829 10.379 1264 HG22 THR 222 HG22 THR 222 -11.235 -17.374 9.396 1265 HG23 THR 222 HG23 THR 222 -11.907 -18.901 8.827 1266 H LYS 223 HN LYS 223 -13.437 -18.528 13.656 1267 HA LYS 223 HA LYS 223 -10.733 -19.441 14.186 1268 HB2 LYS 223 HB2 LYS 223 -10.967 -18.750 16.629 1269 HB3 LYS 223 HB1 LYS 223 -10.600 -17.476 15.475 1270 HG2 LYS 223 HG2 LYS 223 -12.902 -16.742 15.497 1271 HG3 LYS 223 HG1 LYS 223 -13.345 -18.077 16.560 1272 HD2 LYS 223 HD2 LYS 223 -13.112 -16.012 17.824 1273 HD3 LYS 223 HD1 LYS 223 -11.874 -17.174 18.299 1274 HE2 LYS 223 HE2 LYS 223 -10.946 -14.923 18.092 1275 HE3 LYS 223 HE1 LYS 223 -10.239 -16.018 16.905 1276 HZ1 LYS 223 HZ1 LYS 223 -12.535 -14.285 16.223 1277 HZ2 LYS 223 HZ2 LYS 223 -11.419 -15.030 15.181 1278 HZ3 LYS 223 HZ3 LYS 223 -10.943 -13.711 16.134 1279 H ALA 224 HN ALA 224 -11.009 -21.538 14.259 1280 HA ALA 224 HA ALA 224 -13.206 -22.617 15.900 1281 HB1 ALA 224 HB1 ALA 224 -12.024 -23.840 13.405 1282 HB2 ALA 224 HB2 ALA 224 -13.595 -23.046 13.519 1283 HB3 ALA 224 HB3 ALA 224 -13.298 -24.543 14.403 Start of MODEL 10 1 H1 GLY 1 HT1 GLY 1 26.672 -5.309 20.826 2 H2 GLY 1 HT2 GLY 1 27.148 -6.438 22.000 3 H3 GLY 1 HT3 GLY 1 27.790 -6.520 20.434 4 HA2 GLY 1 HA1 GLY 1 28.238 -4.332 22.388 5 HA3 GLY 1 HA2 GLY 1 29.399 -5.583 21.965 6 H SER 2 HN SER 2 29.920 -5.714 19.573 7 HA SER 2 HA SER 2 30.778 -3.120 18.738 8 HB2 SER 2 HB2 SER 2 31.655 -4.433 16.733 9 HB3 SER 2 HB1 SER 2 32.280 -4.911 18.312 10 HG SER 2 HG SER 2 31.418 -6.805 18.056 11 H HIS 3 HN HIS 3 30.128 -1.913 16.996 12 HA HIS 3 HA HIS 3 27.638 -2.773 15.659 13 HB2 HIS 3 HB2 HIS 3 28.424 0.015 16.548 14 HB3 HIS 3 HB1 HIS 3 27.017 -0.355 15.558 15 HD1 HIS 3 HD1 HIS 3 28.259 -0.386 19.054 16 HD2 HIS 3 HD2 HIS 3 24.905 -1.657 16.940 17 HE1 HIS 3 HE1 HIS 3 26.512 -0.904 20.791 18 HE2 HIS 3 HE2 HIS 3 24.525 -1.759 19.499 19 H MET 4 HN MET 4 30.343 -3.204 14.817 20 HA MET 4 HA MET 4 31.728 -3.013 13.024 21 HB2 MET 4 HB2 MET 4 29.388 -1.698 11.624 22 HB3 MET 4 HB1 MET 4 30.748 -2.520 10.873 23 HG2 MET 4 HG2 MET 4 28.630 -3.816 12.574 24 HG3 MET 4 HG1 MET 4 28.716 -3.866 10.816 25 HE1 MET 4 HE1 MET 4 31.878 -6.021 10.161 26 HE2 MET 4 HE2 MET 4 31.738 -4.264 10.185 27 HE3 MET 4 HE3 MET 4 30.468 -5.240 9.446 28 H ALA 5 HN ALA 5 31.758 -0.991 14.975 29 HA ALA 5 HA ALA 5 32.569 1.063 15.465 30 HB1 ALA 5 HB1 ALA 5 34.239 0.627 13.691 31 HB2 ALA 5 HB2 ALA 5 33.830 2.331 13.855 32 HB3 ALA 5 HB3 ALA 5 33.160 1.385 12.526 33 H SER 6 HN SER 6 31.090 1.462 12.269 34 HA SER 6 HA SER 6 29.094 3.236 13.469 35 HB2 SER 6 HB2 SER 6 30.853 4.661 12.528 36 HB3 SER 6 HB1 SER 6 30.725 3.824 10.983 37 HG SER 6 HG SER 6 29.403 5.944 11.728 38 H SER 7 HN SER 7 27.346 1.952 13.199 39 HA SER 7 HA SER 7 26.946 0.316 10.895 40 HB2 SER 7 HB2 SER 7 24.996 1.209 13.041 41 HB3 SER 7 HB1 SER 7 24.671 -0.035 11.832 42 HG SER 7 HG SER 7 27.006 -0.365 13.295 43 H CYS 8 HN CYS 8 26.641 1.188 8.965 44 HA CYS 8 HA CYS 8 25.261 3.728 8.692 45 HB2 CYS 8 HB2 CYS 8 26.427 1.989 6.511 46 HB3 CYS 8 HB1 CYS 8 25.997 3.695 6.405 47 HG CYS 8 HG CYS 8 28.825 2.292 7.399 48 H ALA 9 HN ALA 9 23.129 3.500 8.930 49 HA ALA 9 HA ALA 9 21.775 1.298 7.548 50 HB1 ALA 9 HB1 ALA 9 19.845 1.818 8.971 51 HB2 ALA 9 HB2 ALA 9 20.735 3.178 9.668 52 HB3 ALA 9 HB3 ALA 9 21.297 1.530 9.938 53 H VAL 10 HN VAL 10 20.688 1.672 5.746 54 HA VAL 10 HA VAL 10 20.196 4.459 4.977 55 HB VAL 10 HB VAL 10 19.947 2.008 3.226 56 HG11 VAL 10 HG11 VAL 10 18.675 3.682 2.241 57 HG12 VAL 10 HG12 VAL 10 20.248 3.866 1.457 58 HG13 VAL 10 HG13 VAL 10 19.780 4.959 2.759 59 HG21 VAL 10 HG21 VAL 10 22.248 2.123 3.798 60 HG22 VAL 10 HG22 VAL 10 22.273 3.877 3.632 61 HG23 VAL 10 HG23 VAL 10 22.095 2.860 2.204 62 H GLN 11 HN GLN 11 18.224 5.254 5.070 63 HA GLN 11 HA GLN 11 16.073 3.380 5.772 64 HB2 GLN 11 HB2 GLN 11 16.109 6.345 6.315 65 HB3 GLN 11 HB1 GLN 11 15.062 5.128 7.031 66 HG2 GLN 11 HG2 GLN 11 16.479 4.884 8.712 67 HG3 GLN 11 HG1 GLN 11 17.737 4.398 7.581 68 HE21 GLN 11 HE21 GLN 11 16.292 7.559 7.435 69 HE22 GLN 11 HE22 GLN 11 17.680 8.431 8.001 70 H VAL 12 HN VAL 12 14.469 3.120 4.408 71 HA VAL 12 HA VAL 12 14.050 5.192 2.373 72 HB VAL 12 HB VAL 12 12.906 3.375 1.075 73 HG11 VAL 12 HG11 VAL 12 15.445 4.049 0.975 74 HG12 VAL 12 HG12 VAL 12 14.882 2.615 0.119 75 HG13 VAL 12 HG13 VAL 12 15.689 2.452 1.678 76 HG21 VAL 12 HG21 VAL 12 12.430 1.958 3.003 77 HG22 VAL 12 HG22 VAL 12 14.141 1.559 3.121 78 HG23 VAL 12 HG23 VAL 12 13.217 1.084 1.692 79 H LYS 13 HN LYS 13 12.073 6.141 2.227 80 HA LYS 13 HA LYS 13 10.088 5.232 4.179 81 HB2 LYS 13 HB2 LYS 13 10.793 7.941 3.139 82 HB3 LYS 13 HB1 LYS 13 9.148 7.631 3.675 83 HG2 LYS 13 HG2 LYS 13 10.010 6.903 5.850 84 HG3 LYS 13 HG1 LYS 13 11.644 7.305 5.317 85 HD2 LYS 13 HD2 LYS 13 10.996 9.633 5.021 86 HD3 LYS 13 HD1 LYS 13 9.341 9.247 5.493 87 HE2 LYS 13 HE2 LYS 13 11.738 8.824 7.269 88 HE3 LYS 13 HE1 LYS 13 10.746 10.281 7.293 89 HZ1 LYS 13 HZ1 LYS 13 10.134 8.645 9.012 90 HZ2 LYS 13 HZ2 LYS 13 9.703 7.544 7.798 91 HZ3 LYS 13 HZ3 LYS 13 8.854 8.998 7.960 92 H LEU 14 HN LEU 14 8.365 4.343 3.498 93 HA LEU 14 HA LEU 14 7.433 4.822 0.756 94 HB2 LEU 14 HB2 LEU 14 6.875 2.556 2.674 95 HB3 LEU 14 HB1 LEU 14 6.051 2.756 1.137 96 HG LEU 14 HG LEU 14 9.034 2.357 1.456 97 HD11 LEU 14 HD11 LEU 14 6.968 0.408 0.477 98 HD12 LEU 14 HD12 LEU 14 7.640 0.395 2.107 99 HD13 LEU 14 HD13 LEU 14 8.689 0.114 0.718 100 HD21 LEU 14 HD21 LEU 14 7.429 2.047 -1.059 101 HD22 LEU 14 HD22 LEU 14 9.173 2.246 -0.866 102 HD23 LEU 14 HD23 LEU 14 8.093 3.612 -0.581 103 H GLU 15 HN GLU 15 4.874 4.660 0.735 104 HA GLU 15 HA GLU 15 3.777 6.061 3.051 105 HB2 GLU 15 HB2 GLU 15 4.571 7.783 1.523 106 HB3 GLU 15 HB1 GLU 15 3.696 7.039 0.196 107 HG2 GLU 15 HG2 GLU 15 1.599 7.646 1.137 108 HG3 GLU 15 HG1 GLU 15 2.359 8.157 2.643 109 H LEU 16 HN LEU 16 1.989 5.080 3.654 110 HA LEU 16 HA LEU 16 0.349 3.609 1.714 111 HB2 LEU 16 HB2 LEU 16 0.364 3.739 4.704 112 HB3 LEU 16 HB1 LEU 16 -1.089 3.241 3.878 113 HG LEU 16 HG LEU 16 -0.180 1.224 4.388 114 HD11 LEU 16 HD11 LEU 16 1.543 1.058 2.145 115 HD12 LEU 16 HD12 LEU 16 0.104 1.986 1.716 116 HD13 LEU 16 HD13 LEU 16 -0.058 0.354 2.374 117 HD21 LEU 16 HD21 LEU 16 2.584 2.166 3.744 118 HD22 LEU 16 HD22 LEU 16 2.098 0.693 4.592 119 HD23 LEU 16 HD23 LEU 16 1.867 2.268 5.356 120 H GLY 17 HN GLY 17 -1.723 4.144 1.274 121 HA2 GLY 17 HA2 GLY 17 -2.958 6.410 2.612 122 HA3 GLY 17 HA1 GLY 17 -2.562 6.649 0.913 123 H HIS 18 HN HIS 18 -5.135 6.854 1.770 124 HA HIS 18 HA HIS 18 -6.363 5.243 -0.164 125 HB2 HIS 18 HB2 HIS 18 -7.051 3.397 0.914 126 HB3 HIS 18 HB1 HIS 18 -6.069 3.878 2.288 127 HD1 HIS 18 HD1 HIS 18 -7.366 5.303 4.165 128 HD2 HIS 18 HD2 HIS 18 -9.748 3.343 1.381 129 HE1 HIS 18 HE1 HIS 18 -9.670 5.262 5.160 130 HE2 HIS 18 HE2 HIS 18 -11.073 3.983 3.510 131 H ARG 19 HN ARG 19 -8.328 5.999 -0.699 132 HA ARG 19 HA ARG 19 -9.523 8.062 1.037 133 HB2 ARG 19 HB2 ARG 19 -9.531 7.954 -1.985 134 HB3 ARG 19 HB1 ARG 19 -10.361 9.142 -1.012 135 HG2 ARG 19 HG2 ARG 19 -8.271 10.024 -0.215 136 HG3 ARG 19 HG1 ARG 19 -7.379 8.779 -1.094 137 HD2 ARG 19 HD2 ARG 19 -7.340 10.800 -2.387 138 HD3 ARG 19 HD1 ARG 19 -8.383 9.628 -3.197 139 HE ARG 19 HE ARG 19 -10.029 11.156 -1.574 140 HH11 ARG 19 HH11 ARG 19 -7.914 11.682 -4.313 141 HH12 ARG 19 HH12 ARG 19 -8.805 13.048 -4.901 142 HH21 ARG 19 HH21 ARG 19 -11.201 12.929 -2.330 143 HH22 ARG 19 HH22 ARG 19 -10.692 13.762 -3.773 144 H ALA 20 HN ALA 20 -11.867 8.161 0.920 145 HA ALA 20 HA ALA 20 -13.172 5.958 -0.481 146 HB1 ALA 20 HB1 ALA 20 -13.106 4.816 1.484 147 HB2 ALA 20 HB2 ALA 20 -14.603 5.723 1.713 148 HB3 ALA 20 HB3 ALA 20 -13.109 6.282 2.466 149 H GLN 21 HN GLN 21 -15.084 6.447 -1.277 150 HA GLN 21 HA GLN 21 -16.664 8.646 -0.243 151 HB2 GLN 21 HB2 GLN 21 -16.791 9.866 -2.291 152 HB3 GLN 21 HB1 GLN 21 -15.092 9.612 -1.948 153 HG2 GLN 21 HG2 GLN 21 -14.966 9.061 -4.078 154 HG3 GLN 21 HG1 GLN 21 -15.577 7.506 -3.556 155 HE21 GLN 21 HE21 GLN 21 -17.680 6.919 -4.040 156 HE22 GLN 21 HE22 GLN 21 -18.652 7.802 -5.165 157 H VAL 22 HN VAL 22 -18.882 8.472 -0.856 158 HA VAL 22 HA VAL 22 -19.512 5.764 -1.791 159 HB VAL 22 HB VAL 22 -20.293 6.422 0.500 160 HG11 VAL 22 HG11 VAL 22 -22.240 7.841 0.734 161 HG12 VAL 22 HG12 VAL 22 -22.219 8.184 -0.998 162 HG13 VAL 22 HG13 VAL 22 -20.897 8.743 0.027 163 HG21 VAL 22 HG21 VAL 22 -22.475 5.401 0.266 164 HG22 VAL 22 HG22 VAL 22 -21.303 4.587 -0.765 165 HG23 VAL 22 HG23 VAL 22 -22.462 5.718 -1.466 166 H ARG 23 HN ARG 23 -20.666 5.411 -3.562 167 HA ARG 23 HA ARG 23 -21.503 7.642 -5.212 168 HB2 ARG 23 HB2 ARG 23 -22.587 5.554 -6.504 169 HB3 ARG 23 HB1 ARG 23 -20.886 5.974 -6.646 170 HG2 ARG 23 HG2 ARG 23 -20.193 4.224 -5.330 171 HG3 ARG 23 HG1 ARG 23 -21.751 4.077 -4.525 172 HD2 ARG 23 HD2 ARG 23 -21.188 2.233 -6.137 173 HD3 ARG 23 HD1 ARG 23 -22.729 3.038 -6.423 174 HE ARG 23 HE ARG 23 -21.665 4.224 -8.255 175 HH11 ARG 23 HH11 ARG 23 -19.956 1.442 -6.988 176 HH12 ARG 23 HH12 ARG 23 -19.109 1.117 -8.468 177 HH21 ARG 23 HH21 ARG 23 -20.556 3.809 -10.215 178 HH22 ARG 23 HH22 ARG 23 -19.424 2.490 -10.302 179 H LYS 24 HN LYS 24 -23.758 7.758 -6.035 180 HA LYS 24 HA LYS 24 -25.444 7.882 -3.685 181 HB2 LYS 24 HB2 LYS 24 -26.132 8.786 -6.479 182 HB3 LYS 24 HB1 LYS 24 -26.834 9.341 -4.966 183 HG2 LYS 24 HG2 LYS 24 -23.931 9.705 -5.313 184 HG3 LYS 24 HG1 LYS 24 -24.993 10.719 -6.290 185 HD2 LYS 24 HD2 LYS 24 -26.076 11.551 -4.285 186 HD3 LYS 24 HD1 LYS 24 -25.112 10.465 -3.283 187 HE2 LYS 24 HE2 LYS 24 -23.079 11.596 -3.955 188 HE3 LYS 24 HE1 LYS 24 -23.990 12.631 -5.053 189 HZ1 LYS 24 HZ1 LYS 24 -24.385 12.567 -2.111 190 HZ2 LYS 24 HZ2 LYS 24 -25.078 13.656 -3.214 191 HZ3 LYS 24 HZ3 LYS 24 -23.408 13.692 -2.923 192 H LYS 25 HN LYS 25 -24.840 5.661 -6.004 193 HA LYS 25 HA LYS 25 -27.254 4.167 -5.410 194 HB2 LYS 25 HB2 LYS 25 -27.896 5.357 -7.412 195 HB3 LYS 25 HB1 LYS 25 -26.416 4.865 -8.224 196 HG2 LYS 25 HG2 LYS 25 -27.096 2.582 -8.245 197 HG3 LYS 25 HG1 LYS 25 -28.500 2.935 -7.240 198 HD2 LYS 25 HD2 LYS 25 -29.404 4.340 -8.983 199 HD3 LYS 25 HD1 LYS 25 -28.012 3.978 -10.013 200 HE2 LYS 25 HE2 LYS 25 -28.585 1.610 -9.960 201 HE3 LYS 25 HE1 LYS 25 -29.953 1.963 -8.906 202 HZ1 LYS 25 HZ1 LYS 25 -31.037 3.128 -10.648 203 HZ2 LYS 25 HZ2 LYS 25 -30.492 1.668 -11.320 204 HZ3 LYS 25 HZ3 LYS 25 -29.653 3.108 -11.629 205 HA PRO 26 HA PRO 26 -23.960 1.057 -5.249 206 HB2 PRO 26 HB2 PRO 26 -26.319 -0.714 -5.029 207 HB3 PRO 26 HB1 PRO 26 -24.897 -0.600 -3.990 208 HG2 PRO 26 HG2 PRO 26 -27.279 0.351 -3.212 209 HG3 PRO 26 HG1 PRO 26 -25.764 1.165 -2.777 210 HD2 PRO 26 HD2 PRO 26 -27.787 1.897 -4.853 211 HD3 PRO 26 HD1 PRO 26 -26.818 2.948 -3.798 212 H THR 27 HN THR 27 -23.344 -0.681 -6.584 213 HA THR 27 HA THR 27 -24.415 -0.469 -9.263 214 HB THR 27 HB THR 27 -22.014 -0.537 -9.072 215 HG1 THR 27 HG1 THR 27 -21.886 -2.926 -10.124 216 HG21 THR 27 HG21 THR 27 -21.635 -1.656 -7.012 217 HG22 THR 27 HG22 THR 27 -20.886 -2.645 -8.269 218 HG23 THR 27 HG23 THR 27 -22.443 -3.117 -7.590 219 H VAL 28 HN VAL 28 -24.524 -2.702 -10.470 220 HA VAL 28 HA VAL 28 -26.783 -4.051 -9.785 221 HB VAL 28 HB VAL 28 -25.901 -4.322 -11.941 222 HG11 VAL 28 HG11 VAL 28 -23.521 -4.049 -11.326 223 HG12 VAL 28 HG12 VAL 28 -23.792 -5.372 -12.465 224 HG13 VAL 28 HG13 VAL 28 -23.506 -5.722 -10.761 225 HG21 VAL 28 HG21 VAL 28 -25.738 -6.950 -10.480 226 HG22 VAL 28 HG22 VAL 28 -25.832 -6.781 -12.234 227 HG23 VAL 28 HG23 VAL 28 -27.170 -6.235 -11.223 228 H GLU 29 HN GLU 29 -23.543 -4.736 -8.609 229 HA GLU 29 HA GLU 29 -24.461 -7.178 -7.321 230 HB2 GLU 29 HB2 GLU 29 -21.706 -5.966 -7.478 231 HB3 GLU 29 HB1 GLU 29 -22.092 -7.560 -6.835 232 HG2 GLU 29 HG2 GLU 29 -22.973 -8.195 -9.075 233 HG3 GLU 29 HG1 GLU 29 -22.461 -6.620 -9.676 234 H GLY 30 HN GLY 30 -24.611 -4.036 -6.527 235 HA2 GLY 30 HA2 GLY 30 -25.462 -3.202 -4.553 236 HA3 GLY 30 HA1 GLY 30 -25.135 -4.747 -3.782 237 H PHE 31 HN PHE 31 -22.741 -2.834 -5.471 238 HA PHE 31 HA PHE 31 -21.262 -2.567 -2.972 239 HB2 PHE 31 HB2 PHE 31 -20.334 -1.816 -5.754 240 HB3 PHE 31 HB1 PHE 31 -19.343 -2.023 -4.315 241 HD1 PHE 31 HD1 PHE 31 -20.848 -4.669 -3.485 242 HD2 PHE 31 HD2 PHE 31 -19.009 -3.319 -7.065 243 HE1 PHE 31 HE1 PHE 31 -20.403 -6.999 -4.145 244 HE2 PHE 31 HE2 PHE 31 -18.565 -5.634 -7.724 245 HZ PHE 31 HZ PHE 31 -19.263 -7.481 -6.263 246 H THR 32 HN THR 32 -21.297 -0.709 -1.877 247 HA THR 32 HA THR 32 -22.673 1.564 -3.108 248 HB THR 32 HB THR 32 -23.153 2.296 -0.824 249 HG1 THR 32 HG1 THR 32 -22.677 0.751 0.894 250 HG21 THR 32 HG21 THR 32 -23.870 -0.495 -1.499 251 HG22 THR 32 HG22 THR 32 -24.808 0.951 -1.810 252 HG23 THR 32 HG23 THR 32 -24.594 0.368 -0.157 253 H HIS 33 HN HIS 33 -19.703 0.696 -1.445 254 HA HIS 33 HA HIS 33 -18.927 3.534 -1.333 255 HB2 HIS 33 HB2 HIS 33 -18.325 1.172 0.400 256 HB3 HIS 33 HB1 HIS 33 -17.162 2.493 0.336 257 HD1 HIS 33 HD1 HIS 33 -20.775 1.812 1.293 258 HD2 HIS 33 HD2 HIS 33 -17.804 4.671 1.841 259 HE1 HIS 33 HE1 HIS 33 -21.647 3.377 3.072 260 HE2 HIS 33 HE2 HIS 33 -19.736 4.955 3.529 261 H ASP 34 HN ASP 34 -17.247 4.232 -2.465 262 HA ASP 34 HA ASP 34 -15.571 2.267 -3.876 263 HB2 ASP 34 HB2 ASP 34 -15.939 5.212 -4.496 264 HB3 ASP 34 HB1 ASP 34 -15.102 4.023 -5.485 265 H TRP 35 HN TRP 35 -13.370 2.347 -3.592 266 HA TRP 35 HA TRP 35 -12.260 4.602 -2.143 267 HB2 TRP 35 HB2 TRP 35 -11.058 3.107 -0.546 268 HB3 TRP 35 HB1 TRP 35 -12.790 3.199 -0.297 269 HD1 TRP 35 HD1 TRP 35 -14.130 0.933 -0.348 270 HE1 TRP 35 HE1 TRP 35 -13.421 -1.538 -0.623 271 HE3 TRP 35 HE3 TRP 35 -9.292 1.621 -1.875 272 HZ2 TRP 35 HZ2 TRP 35 -11.110 -2.992 -1.375 273 HZ3 TRP 35 HZ3 TRP 35 -7.902 -0.357 -2.338 274 HH2 TRP 35 HH2 TRP 35 -8.778 -2.605 -2.062 275 H MET 36 HN MET 36 -9.928 4.574 -2.045 276 HA MET 36 HA MET 36 -8.609 2.942 -4.091 277 HB2 MET 36 HB2 MET 36 -9.063 4.939 -5.300 278 HB3 MET 36 HB1 MET 36 -8.634 5.952 -3.928 279 HG2 MET 36 HG2 MET 36 -6.292 5.110 -4.149 280 HG3 MET 36 HG1 MET 36 -6.783 4.349 -5.665 281 HE1 MET 36 HE1 MET 36 -6.599 7.340 -3.560 282 HE2 MET 36 HE2 MET 36 -8.038 7.993 -4.361 283 HE3 MET 36 HE3 MET 36 -6.462 8.744 -4.630 284 H VAL 37 HN VAL 37 -6.590 2.312 -3.513 285 HA VAL 37 HA VAL 37 -5.566 3.336 -0.950 286 HB VAL 37 HB VAL 37 -4.101 1.113 -1.314 287 HG11 VAL 37 HG11 VAL 37 -6.836 1.281 -0.160 288 HG12 VAL 37 HG12 VAL 37 -5.340 1.664 0.673 289 HG13 VAL 37 HG13 VAL 37 -5.690 0.001 0.188 290 HG21 VAL 37 HG21 VAL 37 -5.166 0.463 -3.374 291 HG22 VAL 37 HG22 VAL 37 -6.757 0.576 -2.625 292 HG23 VAL 37 HG23 VAL 37 -5.622 -0.669 -2.102 293 H PHE 38 HN PHE 38 -3.359 3.622 -0.661 294 HA PHE 38 HA PHE 38 -1.847 4.280 -3.112 295 HB2 PHE 38 HB2 PHE 38 -2.382 5.787 -0.606 296 HB3 PHE 38 HB1 PHE 38 -0.758 5.905 -1.258 297 HD1 PHE 38 HD1 PHE 38 -0.347 6.964 -3.353 298 HD2 PHE 38 HD2 PHE 38 -4.259 6.847 -1.697 299 HE1 PHE 38 HE1 PHE 38 -1.025 8.782 -4.862 300 HE2 PHE 38 HE2 PHE 38 -4.959 8.651 -3.211 301 HZ PHE 38 HZ PHE 38 -3.356 9.628 -4.796 302 H VAL 39 HN VAL 39 -0.011 3.086 -3.302 303 HA VAL 39 HA VAL 39 1.691 3.092 -0.915 304 HB VAL 39 HB VAL 39 2.773 0.974 -1.812 305 HG11 VAL 39 HG11 VAL 39 1.017 1.279 0.081 306 HG12 VAL 39 HG12 VAL 39 1.455 -0.337 -0.471 307 HG13 VAL 39 HG13 VAL 39 -0.041 0.413 -1.031 308 HG21 VAL 39 HG21 VAL 39 2.017 0.609 -3.947 309 HG22 VAL 39 HG22 VAL 39 0.376 1.122 -3.563 310 HG23 VAL 39 HG23 VAL 39 0.956 -0.452 -3.023 311 H ARG 40 HN ARG 40 3.364 4.374 -1.275 312 HA ARG 40 HA ARG 40 4.920 4.292 -3.691 313 HB2 ARG 40 HB2 ARG 40 4.551 6.568 -4.452 314 HB3 ARG 40 HB1 ARG 40 3.024 5.687 -4.486 315 HG2 ARG 40 HG2 ARG 40 2.166 6.844 -2.653 316 HG3 ARG 40 HG1 ARG 40 3.759 7.359 -2.108 317 HD2 ARG 40 HD2 ARG 40 3.928 8.891 -4.018 318 HD3 ARG 40 HD1 ARG 40 2.330 8.365 -4.584 319 HE ARG 40 HE ARG 40 2.467 9.444 -1.875 320 HH11 ARG 40 HH11 ARG 40 1.877 10.092 -5.268 321 HH12 ARG 40 HH12 ARG 40 0.770 11.398 -4.962 322 HH21 ARG 40 HH21 ARG 40 1.047 11.166 -1.461 323 HH22 ARG 40 HH22 ARG 40 0.279 12.000 -2.780 324 H GLY 41 HN GLY 41 6.372 6.497 -3.616 325 HA2 GLY 41 HA2 GLY 41 7.262 6.721 -0.823 326 HA3 GLY 41 HA1 GLY 41 8.248 7.069 -2.235 327 HA PRO 42 HA PRO 42 6.006 10.890 -0.278 328 HB2 PRO 42 HB2 PRO 42 8.765 11.614 0.496 329 HB3 PRO 42 HB1 PRO 42 7.269 11.736 1.425 330 HG2 PRO 42 HG2 PRO 42 9.109 9.864 1.961 331 HG3 PRO 42 HG1 PRO 42 7.379 9.560 2.129 332 HD2 PRO 42 HD2 PRO 42 9.248 8.676 -0.007 333 HD3 PRO 42 HD1 PRO 42 7.866 7.828 0.709 334 H GLU 43 HN GLU 43 6.588 13.163 -0.686 335 HA GLU 43 HA GLU 43 6.898 13.736 -3.350 336 HB2 GLU 43 HB2 GLU 43 7.735 15.594 -1.123 337 HB3 GLU 43 HB1 GLU 43 7.167 16.038 -2.724 338 HG2 GLU 43 HG2 GLU 43 5.336 16.450 -1.388 339 HG3 GLU 43 HG1 GLU 43 4.986 14.853 -2.042 340 H HIS 44 HN HIS 44 8.521 13.437 -4.650 341 HA HIS 44 HA HIS 44 10.499 13.987 -5.658 342 HB2 HIS 44 HB2 HIS 44 11.496 14.887 -2.950 343 HB3 HIS 44 HB1 HIS 44 12.354 15.075 -4.471 344 HD1 HIS 44 HD1 HIS 44 10.702 16.478 -6.340 345 HD2 HIS 44 HD2 HIS 44 10.221 17.165 -2.259 346 HE1 HIS 44 HE1 HIS 44 9.577 18.719 -6.151 347 HE2 HIS 44 HE2 HIS 44 9.177 19.057 -3.684 348 H SER 45 HN SER 45 10.082 11.817 -3.105 349 HA SER 45 HA SER 45 12.597 10.433 -3.715 350 HB2 SER 45 HB2 SER 45 11.737 8.851 -1.873 351 HB3 SER 45 HB1 SER 45 12.222 10.467 -1.373 352 HG SER 45 HG SER 45 9.557 10.037 -2.098 353 H ASN 46 HN ASN 46 12.531 9.179 -5.463 354 HA ASN 46 HA ASN 46 10.067 7.851 -6.255 355 HB2 ASN 46 HB2 ASN 46 12.786 8.180 -7.464 356 HB3 ASN 46 HB1 ASN 46 11.787 6.834 -7.990 357 HD21 ASN 46 HD21 ASN 46 10.397 9.850 -6.998 358 HD22 ASN 46 HD22 ASN 46 9.880 10.356 -8.566 359 H ILE 47 HN ILE 47 9.544 5.827 -5.677 360 HA ILE 47 HA ILE 47 11.476 4.359 -4.098 361 HB ILE 47 HB ILE 47 9.758 2.845 -3.505 362 HG12 ILE 47 HG12 ILE 47 7.913 4.299 -5.402 363 HG13 ILE 47 HG11 ILE 47 8.684 2.748 -5.749 364 HG21 ILE 47 HG21 ILE 47 9.835 4.909 -2.314 365 HG22 ILE 47 HG22 ILE 47 8.163 4.384 -2.468 366 HG23 ILE 47 HG23 ILE 47 8.782 5.681 -3.493 367 HD11 ILE 47 HD11 ILE 47 7.225 2.899 -3.214 368 HD12 ILE 47 HD12 ILE 47 7.285 1.608 -4.415 369 HD13 ILE 47 HD13 ILE 47 6.236 3.004 -4.669 370 H GLN 48 HN GLN 48 10.236 4.338 -7.306 371 HA GLN 48 HA GLN 48 10.450 1.669 -8.038 372 HB2 GLN 48 HB2 GLN 48 9.485 3.408 -9.473 373 HB3 GLN 48 HB1 GLN 48 11.074 4.132 -9.686 374 HG2 GLN 48 HG2 GLN 48 10.921 2.939 -11.628 375 HG3 GLN 48 HG1 GLN 48 11.685 1.753 -10.594 376 HE21 GLN 48 HE21 GLN 48 8.272 2.585 -10.329 377 HE22 GLN 48 HE22 GLN 48 7.691 1.069 -10.914 378 H HIS 49 HN HIS 49 12.920 3.703 -7.011 379 HA HIS 49 HA HIS 49 15.060 2.478 -8.486 380 HB2 HIS 49 HB2 HIS 49 14.894 4.493 -6.279 381 HB3 HIS 49 HB1 HIS 49 16.432 3.705 -6.611 382 HD1 HIS 49 HD1 HIS 49 16.228 3.651 -9.728 383 HD2 HIS 49 HD2 HIS 49 15.389 6.962 -7.357 384 HE1 HIS 49 HE1 HIS 49 16.529 5.655 -11.219 385 HE2 HIS 49 HE2 HIS 49 16.141 7.647 -9.726 386 H PHE 50 HN PHE 50 13.614 2.122 -5.276 387 HA PHE 50 HA PHE 50 15.361 -0.199 -4.879 388 HB2 PHE 50 HB2 PHE 50 15.068 0.106 -2.452 389 HB3 PHE 50 HB1 PHE 50 15.831 1.489 -3.230 390 HD1 PHE 50 HD1 PHE 50 12.699 0.293 -1.665 391 HD2 PHE 50 HD2 PHE 50 14.879 3.614 -3.185 392 HE1 PHE 50 HE1 PHE 50 11.121 1.818 -0.598 393 HE2 PHE 50 HE2 PHE 50 13.264 5.147 -2.134 394 HZ PHE 50 HZ PHE 50 11.382 4.248 -0.834 395 H VAL 51 HN VAL 51 12.354 0.610 -5.749 396 HA VAL 51 HA VAL 51 11.145 -1.834 -4.633 397 HB VAL 51 HB VAL 51 9.869 0.861 -5.178 398 HG11 VAL 51 HG11 VAL 51 7.863 -0.549 -4.061 399 HG12 VAL 51 HG12 VAL 51 8.648 -1.833 -4.992 400 HG13 VAL 51 HG13 VAL 51 8.073 -0.380 -5.810 401 HG21 VAL 51 HG21 VAL 51 9.178 0.565 -2.768 402 HG22 VAL 51 HG22 VAL 51 10.897 0.822 -3.050 403 HG23 VAL 51 HG23 VAL 51 10.293 -0.797 -2.701 404 H GLU 52 HN GLU 52 10.166 -3.175 -6.080 405 HA GLU 52 HA GLU 52 10.701 -2.505 -8.894 406 HB2 GLU 52 HB2 GLU 52 11.857 -4.485 -8.069 407 HB3 GLU 52 HB1 GLU 52 10.329 -5.193 -7.562 408 HG2 GLU 52 HG2 GLU 52 9.596 -5.320 -9.870 409 HG3 GLU 52 HG1 GLU 52 11.088 -4.547 -10.402 410 H LYS 53 HN LYS 53 8.287 -4.245 -6.944 411 HA LYS 53 HA LYS 53 6.189 -3.257 -8.713 412 HB2 LYS 53 HB2 LYS 53 5.209 -5.541 -8.842 413 HB3 LYS 53 HB1 LYS 53 6.767 -5.402 -9.645 414 HG2 LYS 53 HG2 LYS 53 7.863 -6.460 -7.772 415 HG3 LYS 53 HG1 LYS 53 6.340 -6.564 -6.899 416 HD2 LYS 53 HD2 LYS 53 6.986 -7.898 -9.532 417 HD3 LYS 53 HD1 LYS 53 6.973 -8.693 -7.961 418 HE2 LYS 53 HE2 LYS 53 4.608 -8.316 -7.730 419 HE3 LYS 53 HE1 LYS 53 4.600 -7.331 -9.193 420 HZ1 LYS 53 HZ1 LYS 53 5.244 -9.299 -10.458 421 HZ2 LYS 53 HZ2 LYS 53 3.782 -9.557 -9.636 422 HZ3 LYS 53 HZ3 LYS 53 5.221 -10.230 -9.040 423 H VAL 54 HN VAL 54 4.003 -4.201 -7.733 424 HA VAL 54 HA VAL 54 4.061 -4.101 -4.825 425 HB VAL 54 HB VAL 54 3.062 -1.915 -6.578 426 HG11 VAL 54 HG11 VAL 54 1.949 -1.814 -3.893 427 HG12 VAL 54 HG12 VAL 54 1.248 -3.091 -4.886 428 HG13 VAL 54 HG13 VAL 54 1.203 -1.414 -5.439 429 HG21 VAL 54 HG21 VAL 54 3.753 -0.833 -4.236 430 HG22 VAL 54 HG22 VAL 54 4.903 -1.165 -5.520 431 HG23 VAL 54 HG23 VAL 54 4.724 -2.295 -4.178 432 H VAL 55 HN VAL 55 2.043 -4.725 -3.868 433 HA VAL 55 HA VAL 55 0.055 -5.876 -5.668 434 HB VAL 55 HB VAL 55 2.089 -7.462 -4.544 435 HG11 VAL 55 HG11 VAL 55 -0.565 -7.949 -3.210 436 HG12 VAL 55 HG12 VAL 55 0.972 -7.563 -2.428 437 HG13 VAL 55 HG13 VAL 55 0.764 -9.112 -3.245 438 HG21 VAL 55 HG21 VAL 55 -0.520 -8.387 -5.717 439 HG22 VAL 55 HG22 VAL 55 1.028 -9.236 -5.717 440 HG23 VAL 55 HG23 VAL 55 0.834 -7.760 -6.662 441 H PHE 56 HN PHE 56 -1.946 -6.181 -4.721 442 HA PHE 56 HA PHE 56 -2.234 -5.266 -1.940 443 HB2 PHE 56 HB2 PHE 56 -3.840 -4.532 -4.383 444 HB3 PHE 56 HB1 PHE 56 -4.551 -4.448 -2.771 445 HD1 PHE 56 HD1 PHE 56 -1.753 -3.180 -4.850 446 HD2 PHE 56 HD2 PHE 56 -4.203 -2.601 -1.413 447 HE1 PHE 56 HE1 PHE 56 -0.799 -0.938 -4.560 448 HE2 PHE 56 HE2 PHE 56 -3.247 -0.348 -1.120 449 HZ PHE 56 HZ PHE 56 -1.540 0.480 -2.694 450 H HIS 57 HN HIS 57 -3.082 -6.836 -0.703 451 HA HIS 57 HA HIS 57 -4.672 -8.933 -2.019 452 HB2 HIS 57 HB2 HIS 57 -3.587 -8.815 0.814 453 HB3 HIS 57 HB1 HIS 57 -4.464 -10.169 0.103 454 HD1 HIS 57 HD1 HIS 57 -3.099 -11.896 -1.055 455 HD2 HIS 57 HD2 HIS 57 -0.974 -8.371 -0.442 456 HE1 HIS 57 HE1 HIS 57 -0.723 -12.411 -1.699 457 HE2 HIS 57 HE2 HIS 57 0.579 -10.323 -1.129 458 H LEU 58 HN LEU 58 -6.493 -7.575 -2.337 459 HA LEU 58 HA LEU 58 -7.767 -6.204 -0.217 460 HB2 LEU 58 HB2 LEU 58 -9.235 -7.265 -2.614 461 HB3 LEU 58 HB1 LEU 58 -9.557 -5.804 -1.692 462 HG LEU 58 HG LEU 58 -7.347 -6.279 -3.684 463 HD11 LEU 58 HD11 LEU 58 -9.014 -5.605 -4.977 464 HD12 LEU 58 HD12 LEU 58 -8.503 -4.008 -4.433 465 HD13 LEU 58 HD13 LEU 58 -9.880 -4.804 -3.669 466 HD21 LEU 58 HD21 LEU 58 -7.659 -3.994 -1.749 467 HD22 LEU 58 HD22 LEU 58 -6.686 -3.909 -3.215 468 HD23 LEU 58 HD23 LEU 58 -6.277 -5.068 -1.952 469 H HIS 59 HN HIS 59 -10.283 -6.901 0.155 470 HA HIS 59 HA HIS 59 -10.054 -9.203 1.801 471 HB2 HIS 59 HB2 HIS 59 -11.690 -7.144 1.962 472 HB3 HIS 59 HB1 HIS 59 -12.726 -8.138 0.943 473 HD1 HIS 59 HD1 HIS 59 -14.322 -9.527 2.229 474 HD2 HIS 59 HD2 HIS 59 -10.851 -8.746 4.386 475 HE1 HIS 59 HE1 HIS 59 -14.677 -10.567 4.495 476 HE2 HIS 59 HE2 HIS 59 -12.481 -10.270 5.697 477 H GLU 60 HN GLU 60 -10.720 -11.254 1.494 478 HA GLU 60 HA GLU 60 -10.469 -12.274 -1.097 479 HB2 GLU 60 HB2 GLU 60 -11.545 -13.593 1.387 480 HB3 GLU 60 HB1 GLU 60 -11.017 -14.443 -0.064 481 HG2 GLU 60 HG2 GLU 60 -8.764 -13.568 0.226 482 HG3 GLU 60 HG1 GLU 60 -9.284 -12.684 1.658 483 H SER 61 HN SER 61 -13.272 -11.228 0.593 484 HA SER 61 HA SER 61 -15.255 -12.477 -0.959 485 HB2 SER 61 HB2 SER 61 -16.663 -10.492 -0.254 486 HB3 SER 61 HB1 SER 61 -15.896 -11.374 1.067 487 HG SER 61 HG SER 61 -15.306 -8.836 0.025 488 H PHE 62 HN PHE 62 -13.012 -9.983 -1.704 489 HA PHE 62 HA PHE 62 -14.449 -8.960 -3.996 490 HB2 PHE 62 HB2 PHE 62 -11.599 -8.588 -3.035 491 HB3 PHE 62 HB1 PHE 62 -12.253 -7.818 -4.469 492 HD1 PHE 62 HD1 PHE 62 -13.335 -8.227 -0.909 493 HD2 PHE 62 HD2 PHE 62 -12.703 -5.605 -4.195 494 HE1 PHE 62 HE1 PHE 62 -14.080 -6.326 0.468 495 HE2 PHE 62 HE2 PHE 62 -13.452 -3.701 -2.830 496 HZ PHE 62 HZ PHE 62 -14.138 -4.060 -0.492 497 HA PRO 63 HA PRO 63 -13.177 -12.286 -6.674 498 HB2 PRO 63 HB2 PRO 63 -13.520 -10.295 -8.834 499 HB3 PRO 63 HB1 PRO 63 -14.318 -11.854 -8.605 500 HG2 PRO 63 HG2 PRO 63 -15.627 -9.561 -8.204 501 HG3 PRO 63 HG1 PRO 63 -15.911 -10.978 -7.176 502 HD2 PRO 63 HD2 PRO 63 -14.289 -8.525 -6.617 503 HD3 PRO 63 HD1 PRO 63 -15.384 -9.421 -5.542 504 H ARG 64 HN ARG 64 -11.103 -12.833 -6.851 505 HA ARG 64 HA ARG 64 -8.837 -12.706 -7.043 506 HB2 ARG 64 HB2 ARG 64 -9.649 -10.925 -9.344 507 HB3 ARG 64 HB1 ARG 64 -8.010 -11.502 -9.080 508 HG2 ARG 64 HG2 ARG 64 -8.794 -13.811 -9.297 509 HG3 ARG 64 HG1 ARG 64 -10.428 -13.221 -9.592 510 HD2 ARG 64 HD2 ARG 64 -9.344 -13.756 -11.675 511 HD3 ARG 64 HD1 ARG 64 -9.636 -12.023 -11.566 512 HE ARG 64 HE ARG 64 -7.029 -12.706 -10.635 513 HH11 ARG 64 HH11 ARG 64 -8.930 -12.239 -13.534 514 HH12 ARG 64 HH12 ARG 64 -7.572 -11.761 -14.511 515 HH21 ARG 64 HH21 ARG 64 -5.223 -12.106 -11.918 516 HH22 ARG 64 HH22 ARG 64 -5.456 -11.716 -13.596 517 HA PRO 65 HA PRO 65 -9.036 -8.678 -4.763 518 HB2 PRO 65 HB2 PRO 65 -7.839 -9.526 -2.482 519 HB3 PRO 65 HB1 PRO 65 -9.565 -9.721 -2.802 520 HG2 PRO 65 HG2 PRO 65 -7.347 -11.703 -3.057 521 HG3 PRO 65 HG1 PRO 65 -8.993 -11.931 -2.436 522 HD2 PRO 65 HD2 PRO 65 -8.230 -12.679 -4.937 523 HD3 PRO 65 HD1 PRO 65 -9.880 -12.174 -4.532 524 H LYS 66 HN LYS 66 -6.358 -10.746 -5.461 525 HA LYS 66 HA LYS 66 -4.359 -8.915 -4.570 526 HB2 LYS 66 HB2 LYS 66 -3.890 -11.304 -4.573 527 HB3 LYS 66 HB1 LYS 66 -4.113 -11.364 -6.314 528 HG2 LYS 66 HG2 LYS 66 -2.153 -10.048 -6.690 529 HG3 LYS 66 HG1 LYS 66 -1.996 -9.703 -4.967 530 HD2 LYS 66 HD2 LYS 66 -1.389 -11.901 -4.466 531 HD3 LYS 66 HD1 LYS 66 -1.924 -12.512 -6.031 532 HE2 LYS 66 HE2 LYS 66 -0.102 -11.304 -7.115 533 HE3 LYS 66 HE1 LYS 66 0.409 -10.662 -5.554 534 HZ1 LYS 66 HZ1 LYS 66 0.430 -13.507 -6.405 535 HZ2 LYS 66 HZ2 LYS 66 0.767 -12.984 -4.829 536 HZ3 LYS 66 HZ3 LYS 66 1.780 -12.521 -6.107 537 H ARG 67 HN ARG 67 -4.378 -7.023 -5.541 538 HA ARG 67 HA ARG 67 -4.375 -6.939 -8.479 539 HB2 ARG 67 HB2 ARG 67 -4.650 -4.558 -6.629 540 HB3 ARG 67 HB1 ARG 67 -5.090 -4.674 -8.331 541 HG2 ARG 67 HG2 ARG 67 -6.465 -5.965 -5.995 542 HG3 ARG 67 HG1 ARG 67 -7.088 -4.678 -7.033 543 HD2 ARG 67 HD2 ARG 67 -7.081 -6.207 -8.945 544 HD3 ARG 67 HD1 ARG 67 -6.429 -7.491 -7.918 545 HE ARG 67 HE ARG 67 -8.518 -7.935 -7.215 546 HH11 ARG 67 HH11 ARG 67 -8.583 -4.614 -8.392 547 HH12 ARG 67 HH12 ARG 67 -10.322 -4.516 -8.329 548 HH21 ARG 67 HH21 ARG 67 -10.773 -7.797 -7.188 549 HH22 ARG 67 HH22 ARG 67 -11.564 -6.327 -7.671 550 H VAL 68 HN VAL 68 -2.456 -6.692 -9.441 551 HA VAL 68 HA VAL 68 -0.226 -5.826 -7.743 552 HB VAL 68 HB VAL 68 1.218 -7.169 -8.896 553 HG11 VAL 68 HG11 VAL 68 -0.427 -8.634 -7.888 554 HG12 VAL 68 HG12 VAL 68 0.171 -9.330 -9.397 555 HG13 VAL 68 HG13 VAL 68 -1.414 -8.561 -9.350 556 HG21 VAL 68 HG21 VAL 68 0.930 -6.163 -11.070 557 HG22 VAL 68 HG22 VAL 68 -0.578 -7.049 -11.312 558 HG23 VAL 68 HG23 VAL 68 0.952 -7.923 -11.212 559 H CYS 69 HN CYS 69 1.070 -4.156 -8.264 560 HA CYS 69 HA CYS 69 0.502 -2.688 -10.751 561 HB2 CYS 69 HB2 CYS 69 0.954 -1.513 -7.995 562 HB3 CYS 69 HB1 CYS 69 0.899 -0.574 -9.483 563 HG CYS 69 HG CYS 69 -1.627 -0.195 -9.435 564 H LYS 70 HN LYS 70 2.266 -2.667 -11.980 565 HA LYS 70 HA LYS 70 4.906 -2.930 -10.673 566 HB2 LYS 70 HB2 LYS 70 4.235 -3.485 -13.572 567 HB3 LYS 70 HB1 LYS 70 5.690 -3.950 -12.705 568 HG2 LYS 70 HG2 LYS 70 4.517 -5.616 -11.462 569 HG3 LYS 70 HG1 LYS 70 2.959 -5.012 -12.031 570 HD2 LYS 70 HD2 LYS 70 3.549 -5.662 -14.311 571 HD3 LYS 70 HD1 LYS 70 5.107 -6.266 -13.738 572 HE2 LYS 70 HE2 LYS 70 3.898 -7.859 -12.280 573 HE3 LYS 70 HE1 LYS 70 2.377 -7.294 -12.970 574 HZ1 LYS 70 HZ1 LYS 70 2.978 -9.253 -14.112 575 HZ2 LYS 70 HZ2 LYS 70 4.571 -8.730 -14.355 576 HZ3 LYS 70 HZ3 LYS 70 3.298 -7.976 -15.183 577 H ASP 71 HN ASP 71 3.060 -0.581 -11.561 578 HA ASP 71 HA ASP 71 5.012 0.879 -13.199 579 HB2 ASP 71 HB2 ASP 71 2.008 0.870 -13.166 580 HB3 ASP 71 HB1 ASP 71 2.881 2.259 -13.803 581 HA PRO 72 HA PRO 72 5.231 4.634 -10.540 582 HB2 PRO 72 HB2 PRO 72 3.289 5.608 -12.619 583 HB3 PRO 72 HB1 PRO 72 4.588 6.498 -11.816 584 HG2 PRO 72 HG2 PRO 72 4.978 5.478 -14.233 585 HG3 PRO 72 HG1 PRO 72 6.256 5.401 -13.005 586 HD2 PRO 72 HD2 PRO 72 4.590 3.240 -14.110 587 HD3 PRO 72 HD1 PRO 72 6.167 3.151 -13.308 588 HA PRO 73 HA PRO 73 2.632 5.624 -7.362 589 HB2 PRO 73 HB2 PRO 73 0.421 6.714 -9.056 590 HB3 PRO 73 HB1 PRO 73 0.962 7.239 -7.455 591 HG2 PRO 73 HG2 PRO 73 1.786 8.398 -9.813 592 HG3 PRO 73 HG1 PRO 73 2.714 8.441 -8.308 593 HD2 PRO 73 HD2 PRO 73 3.420 7.153 -10.746 594 HD3 PRO 73 HD1 PRO 73 4.299 7.104 -9.207 595 H TYR 74 HN TYR 74 2.122 3.757 -6.583 596 HA TYR 74 HA TYR 74 0.502 1.855 -8.020 597 HB2 TYR 74 HB2 TYR 74 1.724 1.568 -5.277 598 HB3 TYR 74 HB1 TYR 74 1.269 0.274 -6.373 599 HD1 TYR 74 HD2 TYR 74 3.625 3.163 -6.087 600 HD2 TYR 74 HD1 TYR 74 2.901 -0.688 -7.731 601 HE1 TYR 74 HE2 TYR 74 5.931 3.093 -6.922 602 HE2 TYR 74 HE1 TYR 74 5.212 -0.766 -8.573 603 HH TYR 74 HH TYR 74 7.039 0.621 -9.072 604 H LYS 75 HN LYS 75 -1.571 1.409 -7.615 605 HA LYS 75 HA LYS 75 -2.850 2.108 -5.111 606 HB2 LYS 75 HB2 LYS 75 -4.532 3.575 -6.364 607 HB3 LYS 75 HB1 LYS 75 -2.963 4.280 -6.012 608 HG2 LYS 75 HG2 LYS 75 -2.257 4.119 -8.230 609 HG3 LYS 75 HG1 LYS 75 -3.524 2.973 -8.649 610 HD2 LYS 75 HD2 LYS 75 -4.168 5.050 -9.580 611 HD3 LYS 75 HD1 LYS 75 -5.178 4.846 -8.156 612 HE2 LYS 75 HE2 LYS 75 -4.325 7.115 -8.304 613 HE3 LYS 75 HE1 LYS 75 -3.672 6.278 -6.904 614 HZ1 LYS 75 HZ1 LYS 75 -2.273 6.756 -9.475 615 HZ2 LYS 75 HZ2 LYS 75 -1.651 5.832 -8.202 616 HZ3 LYS 75 HZ3 LYS 75 -1.927 7.489 -7.984 617 H VAL 76 HN VAL 76 -4.856 1.266 -4.882 618 HA VAL 76 HA VAL 76 -5.949 -0.284 -7.141 619 HB VAL 76 HB VAL 76 -5.872 -1.019 -4.234 620 HG11 VAL 76 HG11 VAL 76 -8.231 -1.013 -5.127 621 HG12 VAL 76 HG12 VAL 76 -7.652 -2.550 -4.481 622 HG13 VAL 76 HG13 VAL 76 -7.727 -2.296 -6.227 623 HG21 VAL 76 HG21 VAL 76 -4.147 -1.990 -5.580 624 HG22 VAL 76 HG22 VAL 76 -5.305 -2.460 -6.815 625 HG23 VAL 76 HG23 VAL 76 -5.332 -3.245 -5.237 626 H GLU 77 HN GLU 77 -7.897 0.318 -7.799 627 HA GLU 77 HA GLU 77 -9.503 2.005 -6.004 628 HB2 GLU 77 HB2 GLU 77 -9.351 2.058 -9.018 629 HB3 GLU 77 HB1 GLU 77 -10.436 3.023 -8.049 630 HG2 GLU 77 HG2 GLU 77 -8.787 4.360 -7.227 631 HG3 GLU 77 HG1 GLU 77 -7.553 3.154 -7.524 632 H GLU 78 HN GLU 78 -11.218 1.058 -5.297 633 HA GLU 78 HA GLU 78 -12.514 -0.995 -6.948 634 HB2 GLU 78 HB2 GLU 78 -11.066 -1.426 -4.437 635 HB3 GLU 78 HB1 GLU 78 -12.699 -2.080 -4.418 636 HG2 GLU 78 HG2 GLU 78 -10.426 -2.778 -6.251 637 HG3 GLU 78 HG1 GLU 78 -11.318 -3.819 -5.142 638 H SER 79 HN SER 79 -14.437 -1.900 -5.571 639 HA SER 79 HA SER 79 -15.849 0.217 -4.163 640 HB2 SER 79 HB2 SER 79 -16.292 0.515 -6.622 641 HB3 SER 79 HB1 SER 79 -17.033 -1.088 -6.630 642 HG SER 79 HG SER 79 -17.970 1.324 -5.639 643 H GLY 80 HN GLY 80 -17.422 -0.564 -2.794 644 HA2 GLY 80 HA2 GLY 80 -18.222 -3.303 -2.674 645 HA3 GLY 80 HA1 GLY 80 -16.908 -2.971 -1.550 646 H TYR 81 HN TYR 81 -18.316 -3.344 0.286 647 HA TYR 81 HA TYR 81 -19.862 -0.950 0.885 648 HB2 TYR 81 HB2 TYR 81 -21.830 -2.307 1.685 649 HB3 TYR 81 HB1 TYR 81 -21.608 -2.245 -0.056 650 HD1 TYR 81 HD2 TYR 81 -21.431 -4.405 2.912 651 HD2 TYR 81 HD1 TYR 81 -21.049 -4.228 -1.318 652 HE1 TYR 81 HE2 TYR 81 -21.503 -6.854 2.813 653 HE2 TYR 81 HE1 TYR 81 -21.131 -6.682 -1.420 654 HH TYR 81 HH TYR 81 -20.642 -8.607 0.061 655 H ALA 82 HN ALA 82 -17.397 -2.355 1.928 656 HA ALA 82 HA ALA 82 -17.902 -1.741 4.664 657 HB1 ALA 82 HB1 ALA 82 -18.863 -3.855 4.914 658 HB2 ALA 82 HB2 ALA 82 -17.206 -4.067 5.478 659 HB3 ALA 82 HB3 ALA 82 -17.668 -4.621 3.869 660 H GLY 83 HN GLY 83 -15.981 -2.066 6.044 661 HA2 GLY 83 HA2 GLY 83 -13.523 -1.730 4.457 662 HA3 GLY 83 HA1 GLY 83 -13.780 -1.114 6.084 663 H PHE 84 HN PHE 84 -11.503 -2.328 5.887 664 HA PHE 84 HA PHE 84 -11.490 -4.604 7.505 665 HB2 PHE 84 HB2 PHE 84 -10.842 -6.347 5.831 666 HB3 PHE 84 HB1 PHE 84 -12.506 -5.811 5.653 667 HD1 PHE 84 HD1 PHE 84 -13.056 -4.169 3.818 668 HD2 PHE 84 HD2 PHE 84 -9.324 -6.198 4.033 669 HE1 PHE 84 HE1 PHE 84 -12.655 -3.658 1.452 670 HE2 PHE 84 HE2 PHE 84 -8.900 -5.684 1.674 671 HZ PHE 84 HZ PHE 84 -10.561 -4.415 0.368 672 H ILE 85 HN ILE 85 -9.301 -5.376 7.902 673 HA ILE 85 HA ILE 85 -7.167 -3.629 7.257 674 HB ILE 85 HB ILE 85 -7.220 -6.454 8.311 675 HG12 ILE 85 HG12 ILE 85 -7.852 -4.621 9.839 676 HG13 ILE 85 HG11 ILE 85 -6.372 -5.431 10.343 677 HG21 ILE 85 HG21 ILE 85 -4.739 -4.808 7.797 678 HG22 ILE 85 HG22 ILE 85 -5.217 -6.265 6.923 679 HG23 ILE 85 HG23 ILE 85 -4.803 -6.361 8.635 680 HD11 ILE 85 HD11 ILE 85 -6.421 -2.851 8.809 681 HD12 ILE 85 HD12 ILE 85 -5.031 -3.626 9.567 682 HD13 ILE 85 HD13 ILE 85 -6.324 -2.960 10.565 683 H LEU 86 HN LEU 86 -5.905 -3.504 5.498 684 HA LEU 86 HA LEU 86 -6.193 -5.649 3.494 685 HB2 LEU 86 HB2 LEU 86 -7.023 -3.151 3.110 686 HB3 LEU 86 HB1 LEU 86 -5.329 -2.906 2.720 687 HG LEU 86 HG LEU 86 -6.680 -5.187 1.401 688 HD11 LEU 86 HD11 LEU 86 -7.046 -2.413 0.312 689 HD12 LEU 86 HD12 LEU 86 -8.259 -3.180 1.340 690 HD13 LEU 86 HD13 LEU 86 -7.817 -3.919 -0.197 691 HD21 LEU 86 HD21 LEU 86 -5.242 -3.390 -0.256 692 HD22 LEU 86 HD22 LEU 86 -4.895 -5.078 0.112 693 HD23 LEU 86 HD23 LEU 86 -4.276 -3.797 1.159 694 HA PRO 87 HA PRO 87 -1.825 -6.015 4.488 695 HB2 PRO 87 HB2 PRO 87 -1.930 -8.523 3.040 696 HB3 PRO 87 HB1 PRO 87 -1.673 -8.253 4.763 697 HG2 PRO 87 HG2 PRO 87 -3.931 -9.397 3.727 698 HG3 PRO 87 HG1 PRO 87 -3.881 -8.524 5.269 699 HD2 PRO 87 HD2 PRO 87 -4.854 -7.606 2.596 700 HD3 PRO 87 HD1 PRO 87 -5.507 -7.269 4.213 701 H ILE 88 HN ILE 88 -0.974 -4.490 3.144 702 HA ILE 88 HA ILE 88 -0.981 -4.937 0.264 703 HB ILE 88 HB ILE 88 0.009 -2.512 1.769 704 HG12 ILE 88 HG12 ILE 88 -2.653 -2.657 0.390 705 HG13 ILE 88 HG11 ILE 88 -2.497 -3.265 2.038 706 HG21 ILE 88 HG21 ILE 88 0.826 -2.740 -0.516 707 HG22 ILE 88 HG22 ILE 88 -0.295 -1.387 -0.375 708 HG23 ILE 88 HG23 ILE 88 -0.829 -2.904 -1.098 709 HD11 ILE 88 HD11 ILE 88 -1.889 -0.462 1.125 710 HD12 ILE 88 HD12 ILE 88 -1.724 -1.070 2.767 711 HD13 ILE 88 HD13 ILE 88 -3.314 -0.987 2.014 712 H GLU 89 HN GLU 89 0.945 -4.968 -0.952 713 HA GLU 89 HA GLU 89 3.397 -5.377 0.622 714 HB2 GLU 89 HB2 GLU 89 2.381 -6.921 -1.746 715 HB3 GLU 89 HB1 GLU 89 4.073 -6.950 -1.263 716 HG2 GLU 89 HG2 GLU 89 3.348 -7.773 0.964 717 HG3 GLU 89 HG1 GLU 89 1.706 -7.879 0.340 718 H VAL 90 HN VAL 90 5.119 -4.258 0.024 719 HA VAL 90 HA VAL 90 5.124 -3.028 -2.650 720 HB VAL 90 HB VAL 90 6.625 -1.905 -0.284 721 HG11 VAL 90 HG11 VAL 90 7.545 -0.723 -1.959 722 HG12 VAL 90 HG12 VAL 90 6.013 0.146 -1.986 723 HG13 VAL 90 HG13 VAL 90 6.286 -1.194 -3.098 724 HG21 VAL 90 HG21 VAL 90 4.021 -2.043 -0.128 725 HG22 VAL 90 HG22 VAL 90 4.081 -0.692 -1.258 726 HG23 VAL 90 HG23 VAL 90 4.860 -0.560 0.320 727 H TYR 91 HN TYR 91 6.447 -4.207 -3.878 728 HA TYR 91 HA TYR 91 8.340 -6.025 -2.686 729 HB2 TYR 91 HB2 TYR 91 7.439 -5.442 -5.460 730 HB3 TYR 91 HB1 TYR 91 8.970 -6.273 -5.245 731 HD1 TYR 91 HD1 TYR 91 5.701 -6.583 -3.459 732 HD2 TYR 91 HD2 TYR 91 8.684 -8.478 -5.817 733 HE1 TYR 91 HE1 TYR 91 4.517 -8.729 -3.243 734 HE2 TYR 91 HE2 TYR 91 7.496 -10.620 -5.619 735 HH TYR 91 HH TYR 91 5.900 -11.710 -4.143 736 H PHE 92 HN PHE 92 10.453 -5.916 -2.566 737 HA PHE 92 HA PHE 92 11.710 -3.349 -3.254 738 HB2 PHE 92 HB2 PHE 92 12.375 -5.493 -1.221 739 HB3 PHE 92 HB1 PHE 92 13.441 -4.128 -1.566 740 HD1 PHE 92 HD1 PHE 92 11.185 -2.094 -1.929 741 HD2 PHE 92 HD2 PHE 92 11.972 -5.003 1.068 742 HE1 PHE 92 HE1 PHE 92 10.018 -0.698 -0.279 743 HE2 PHE 92 HE2 PHE 92 10.776 -3.610 2.723 744 HZ PHE 92 HZ PHE 92 9.819 -1.458 2.041 745 H LYS 93 HN LYS 93 13.921 -3.403 -4.070 746 HA LYS 93 HA LYS 93 14.486 -5.794 -5.690 747 HB2 LYS 93 HB2 LYS 93 15.829 -3.079 -5.789 748 HB3 LYS 93 HB1 LYS 93 16.064 -4.400 -6.926 749 HG2 LYS 93 HG2 LYS 93 13.841 -4.146 -7.769 750 HG3 LYS 93 HG1 LYS 93 13.458 -2.955 -6.520 751 HD2 LYS 93 HD2 LYS 93 15.087 -1.415 -7.440 752 HD3 LYS 93 HD1 LYS 93 15.627 -2.623 -8.605 753 HE2 LYS 93 HE2 LYS 93 13.149 -2.575 -9.406 754 HE3 LYS 93 HE1 LYS 93 13.082 -1.027 -8.559 755 HZ1 LYS 93 HZ1 LYS 93 13.630 -0.682 -10.856 756 HZ2 LYS 93 HZ2 LYS 93 14.945 -1.744 -10.756 757 HZ3 LYS 93 HZ3 LYS 93 14.972 -0.281 -9.902 758 H ASN 94 HN ASN 94 15.447 -7.165 -4.164 759 HA ASN 94 HA ASN 94 17.864 -6.111 -2.860 760 HB2 ASN 94 HB2 ASN 94 15.839 -7.991 -1.623 761 HB3 ASN 94 HB1 ASN 94 17.376 -7.540 -0.903 762 HD21 ASN 94 HD21 ASN 94 16.305 -6.769 0.918 763 HD22 ASN 94 HD22 ASN 94 15.474 -5.253 0.902 764 H LYS 95 HN LYS 95 19.618 -7.432 -2.788 765 HA LYS 95 HA LYS 95 19.320 -10.167 -3.838 766 HB2 LYS 95 HB2 LYS 95 21.800 -8.484 -3.554 767 HB3 LYS 95 HB1 LYS 95 21.749 -10.110 -4.216 768 HG2 LYS 95 HG2 LYS 95 20.248 -9.266 -6.001 769 HG3 LYS 95 HG1 LYS 95 20.494 -7.633 -5.388 770 HD2 LYS 95 HD2 LYS 95 22.515 -9.516 -6.609 771 HD3 LYS 95 HD1 LYS 95 22.019 -7.932 -7.198 772 HE2 LYS 95 HE2 LYS 95 23.345 -6.804 -5.672 773 HE3 LYS 95 HE1 LYS 95 23.304 -8.132 -4.506 774 HZ1 LYS 95 HZ1 LYS 95 24.787 -8.120 -7.081 775 HZ2 LYS 95 HZ2 LYS 95 24.766 -9.390 -5.957 776 HZ3 LYS 95 HZ3 LYS 95 25.475 -7.903 -5.542 777 H GLU 96 HN GLU 96 19.274 -8.518 -1.143 778 HA GLU 96 HA GLU 96 20.492 -10.620 0.495 779 HB2 GLU 96 HB2 GLU 96 20.847 -8.799 2.229 780 HB3 GLU 96 HB1 GLU 96 21.883 -8.682 0.812 781 HG2 GLU 96 HG2 GLU 96 20.610 -6.897 -0.079 782 HG3 GLU 96 HG1 GLU 96 19.339 -7.121 1.129 783 H GLU 97 HN GLU 97 19.406 -9.250 2.884 784 HA GLU 97 HA GLU 97 17.277 -10.701 3.560 785 HB2 GLU 97 HB2 GLU 97 16.580 -8.775 5.059 786 HB3 GLU 97 HB1 GLU 97 18.229 -9.366 5.220 787 HG2 GLU 97 HG2 GLU 97 18.969 -7.467 3.801 788 HG3 GLU 97 HG1 GLU 97 17.309 -6.869 3.826 789 HA PRO 98 HA PRO 98 13.341 -10.586 2.154 790 HB2 PRO 98 HB2 PRO 98 12.020 -8.445 3.543 791 HB3 PRO 98 HB1 PRO 98 11.912 -10.179 3.861 792 HG2 PRO 98 HG2 PRO 98 13.680 -8.131 5.082 793 HG3 PRO 98 HG1 PRO 98 12.985 -9.598 5.807 794 HD2 PRO 98 HD2 PRO 98 15.549 -9.566 5.203 795 HD3 PRO 98 HD1 PRO 98 14.580 -10.992 4.746 796 H ARG 99 HN ARG 99 12.700 -10.025 0.243 797 HA ARG 99 HA ARG 99 13.324 -7.371 -0.792 798 HB2 ARG 99 HB2 ARG 99 12.141 -9.604 -2.398 799 HB3 ARG 99 HB1 ARG 99 13.219 -8.315 -2.922 800 HG2 ARG 99 HG2 ARG 99 14.971 -9.361 -1.471 801 HG3 ARG 99 HG1 ARG 99 13.892 -10.745 -1.304 802 HD2 ARG 99 HD2 ARG 99 15.401 -9.794 -3.681 803 HD3 ARG 99 HD1 ARG 99 15.131 -11.432 -3.089 804 HE ARG 99 HE ARG 99 13.220 -9.822 -4.649 805 HH11 ARG 99 HH11 ARG 99 14.185 -12.917 -3.291 806 HH12 ARG 99 HH12 ARG 99 13.092 -13.823 -4.295 807 HH21 ARG 99 HH21 ARG 99 11.780 -10.999 -5.922 808 HH22 ARG 99 HH22 ARG 99 11.697 -12.729 -5.773 809 H LYS 100 HN LYS 100 11.039 -8.113 1.035 810 HA LYS 100 HA LYS 100 9.045 -6.579 -0.419 811 HB2 LYS 100 HB2 LYS 100 7.208 -8.131 0.108 812 HB3 LYS 100 HB1 LYS 100 8.384 -8.849 -0.986 813 HG2 LYS 100 HG2 LYS 100 9.217 -10.277 0.650 814 HG3 LYS 100 HG1 LYS 100 8.568 -9.300 1.967 815 HD2 LYS 100 HD2 LYS 100 7.186 -11.193 1.901 816 HD3 LYS 100 HD1 LYS 100 6.260 -9.941 1.074 817 HE2 LYS 100 HE2 LYS 100 7.970 -11.920 -0.411 818 HE3 LYS 100 HE1 LYS 100 6.294 -12.255 0.021 819 HZ1 LYS 100 HZ1 LYS 100 5.648 -10.244 -1.194 820 HZ2 LYS 100 HZ2 LYS 100 6.410 -11.389 -2.193 821 HZ3 LYS 100 HZ3 LYS 100 7.264 -10.023 -1.675 822 H VAL 101 HN VAL 101 7.795 -5.349 0.855 823 HA VAL 101 HA VAL 101 7.880 -5.843 3.755 824 HB VAL 101 HB VAL 101 8.996 -3.715 3.076 825 HG11 VAL 101 HG11 VAL 101 7.853 -3.001 1.155 826 HG12 VAL 101 HG12 VAL 101 7.422 -1.829 2.409 827 HG13 VAL 101 HG13 VAL 101 6.280 -3.096 1.960 828 HG21 VAL 101 HG21 VAL 101 7.942 -2.321 4.733 829 HG22 VAL 101 HG22 VAL 101 7.945 -4.000 5.285 830 HG23 VAL 101 HG23 VAL 101 6.464 -3.286 4.647 831 H ARG 102 HN ARG 102 5.891 -5.890 4.811 832 HA ARG 102 HA ARG 102 3.565 -5.768 3.006 833 HB2 ARG 102 HB2 ARG 102 4.315 -8.065 3.940 834 HB3 ARG 102 HB1 ARG 102 3.645 -7.494 5.468 835 HG2 ARG 102 HG2 ARG 102 1.517 -6.989 4.016 836 HG3 ARG 102 HG1 ARG 102 2.251 -8.111 2.883 837 HD2 ARG 102 HD2 ARG 102 0.720 -9.308 4.261 838 HD3 ARG 102 HD1 ARG 102 2.356 -9.778 4.695 839 HE ARG 102 HE ARG 102 0.749 -7.863 6.272 840 HH11 ARG 102 HH11 ARG 102 3.007 -10.535 6.052 841 HH12 ARG 102 HH12 ARG 102 3.135 -10.726 7.779 842 HH21 ARG 102 HH21 ARG 102 0.942 -8.085 8.530 843 HH22 ARG 102 HH22 ARG 102 1.977 -9.325 9.183 844 H PHE 103 HN PHE 103 2.380 -4.091 3.454 845 HA PHE 103 HA PHE 103 2.382 -3.027 6.186 846 HB2 PHE 103 HB2 PHE 103 1.612 -1.768 3.549 847 HB3 PHE 103 HB1 PHE 103 1.447 -0.969 5.105 848 HD1 PHE 103 HD1 PHE 103 3.963 -1.745 6.433 849 HD2 PHE 103 HD2 PHE 103 3.208 -0.556 2.418 850 HE1 PHE 103 HE1 PHE 103 6.256 -0.865 6.265 851 HE2 PHE 103 HE2 PHE 103 5.501 0.310 2.239 852 HZ PHE 103 HZ PHE 103 7.025 0.160 4.164 853 H ASP 104 HN ASP 104 0.765 -3.792 7.373 854 HA ASP 104 HA ASP 104 -1.751 -4.566 6.157 855 HB2 ASP 104 HB2 ASP 104 -1.053 -4.495 9.097 856 HB3 ASP 104 HB1 ASP 104 -2.398 -5.345 8.350 857 H TYR 105 HN TYR 105 -2.490 -2.639 5.346 858 HA TYR 105 HA TYR 105 -2.719 -0.351 7.130 859 HB2 TYR 105 HB2 TYR 105 -1.882 -0.034 4.821 860 HB3 TYR 105 HB1 TYR 105 -3.412 -0.649 4.192 861 HD1 TYR 105 HD1 TYR 105 -2.084 2.050 6.410 862 HD2 TYR 105 HD2 TYR 105 -5.074 0.826 3.658 863 HE1 TYR 105 HE1 TYR 105 -3.033 4.325 6.455 864 HE2 TYR 105 HE2 TYR 105 -6.031 3.074 3.672 865 HH TYR 105 HH TYR 105 -6.017 5.046 5.500 866 H ASP 106 HN ASP 106 -4.617 0.485 7.884 867 HA ASP 106 HA ASP 106 -6.863 -1.343 7.857 868 HB2 ASP 106 HB2 ASP 106 -6.140 -0.350 9.975 869 HB3 ASP 106 HB1 ASP 106 -6.460 1.263 9.341 870 H LEU 107 HN LEU 107 -8.232 -1.228 6.190 871 HA LEU 107 HA LEU 107 -8.729 1.285 4.837 872 HB2 LEU 107 HB2 LEU 107 -9.067 -1.532 4.263 873 HB3 LEU 107 HB1 LEU 107 -10.524 -0.634 3.888 874 HG LEU 107 HG LEU 107 -9.068 0.909 2.500 875 HD11 LEU 107 HD11 LEU 107 -6.953 -0.096 1.700 876 HD12 LEU 107 HD12 LEU 107 -7.076 -1.284 3.000 877 HD13 LEU 107 HD13 LEU 107 -6.907 0.429 3.386 878 HD21 LEU 107 HD21 LEU 107 -8.896 -0.778 0.648 879 HD22 LEU 107 HD22 LEU 107 -10.481 -0.632 1.413 880 HD23 LEU 107 HD23 LEU 107 -9.428 -1.988 1.818 881 H PHE 108 HN PHE 108 -10.011 2.619 6.089 882 HA PHE 108 HA PHE 108 -12.570 1.450 6.951 883 HB2 PHE 108 HB2 PHE 108 -12.798 3.159 8.621 884 HB3 PHE 108 HB1 PHE 108 -11.212 2.430 8.806 885 HD1 PHE 108 HD2 PHE 108 -13.053 5.434 7.802 886 HD2 PHE 108 HD1 PHE 108 -9.208 3.720 8.429 887 HE1 PHE 108 HE2 PHE 108 -12.049 7.677 7.741 888 HE2 PHE 108 HE1 PHE 108 -8.199 5.964 8.377 889 HZ PHE 108 HZ PHE 108 -9.619 7.944 8.029 890 H LEU 109 HN LEU 109 -14.460 2.351 6.326 891 HA LEU 109 HA LEU 109 -14.299 4.559 4.375 892 HB2 LEU 109 HB2 LEU 109 -16.496 2.489 4.595 893 HB3 LEU 109 HB1 LEU 109 -16.239 3.637 3.296 894 HG LEU 109 HG LEU 109 -14.510 1.242 3.933 895 HD11 LEU 109 HD11 LEU 109 -16.713 0.819 2.816 896 HD12 LEU 109 HD12 LEU 109 -15.300 0.320 1.891 897 HD13 LEU 109 HD13 LEU 109 -16.147 1.809 1.475 898 HD21 LEU 109 HD21 LEU 109 -14.213 3.344 1.794 899 HD22 LEU 109 HD22 LEU 109 -13.298 1.836 1.874 900 HD23 LEU 109 HD23 LEU 109 -13.115 3.046 3.144 901 H HIS 110 HN HIS 110 -15.959 6.200 4.570 902 HA HIS 110 HA HIS 110 -17.051 6.353 7.270 903 HB2 HIS 110 HB2 HIS 110 -16.461 8.391 5.178 904 HB3 HIS 110 HB1 HIS 110 -17.735 8.741 6.343 905 HD1 HIS 110 HD1 HIS 110 -14.780 10.107 6.104 906 HD2 HIS 110 HD2 HIS 110 -16.119 7.380 8.943 907 HE1 HIS 110 HE1 HIS 110 -13.304 10.439 8.109 908 HE2 HIS 110 HE2 HIS 110 -14.213 8.866 9.862 909 H LEU 111 HN LEU 111 -19.297 7.636 7.271 910 HA LEU 111 HA LEU 111 -20.986 5.480 6.554 911 HB2 LEU 111 HB2 LEU 111 -21.095 7.740 8.280 912 HB3 LEU 111 HB1 LEU 111 -22.570 7.685 7.330 913 HG LEU 111 HG LEU 111 -22.733 6.484 9.510 914 HD11 LEU 111 HD11 LEU 111 -23.645 4.353 8.527 915 HD12 LEU 111 HD12 LEU 111 -23.064 4.922 6.961 916 HD13 LEU 111 HD13 LEU 111 -24.284 5.844 7.837 917 HD21 LEU 111 HD21 LEU 111 -20.833 4.523 8.228 918 HD22 LEU 111 HD22 LEU 111 -21.600 4.381 9.814 919 HD23 LEU 111 HD23 LEU 111 -20.402 5.643 9.525 920 H GLU 112 HN GLU 112 -22.707 5.334 5.289 921 HA GLU 112 HA GLU 112 -22.550 6.281 2.697 922 HB2 GLU 112 HB2 GLU 112 -23.709 4.220 3.397 923 HB3 GLU 112 HB1 GLU 112 -24.945 5.186 4.185 924 HG2 GLU 112 HG2 GLU 112 -25.621 6.097 2.031 925 HG3 GLU 112 HG1 GLU 112 -24.370 5.147 1.236 926 H GLY 113 HN GLY 113 -23.069 8.122 1.800 927 HA2 GLY 113 HA2 GLY 113 -24.892 9.745 1.415 928 HA3 GLY 113 HA1 GLY 113 -24.993 9.886 3.166 929 H HIS 114 HN HIS 114 -22.421 10.151 3.979 930 HA HIS 114 HA HIS 114 -21.203 12.227 2.328 931 HB2 HIS 114 HB2 HIS 114 -22.859 13.387 3.813 932 HB3 HIS 114 HB1 HIS 114 -21.950 12.802 5.202 933 HD1 HIS 114 HD1 HIS 114 -21.570 15.091 2.210 934 HD2 HIS 114 HD2 HIS 114 -19.775 14.339 5.892 935 HE1 HIS 114 HE1 HIS 114 -19.877 16.926 2.531 936 HE2 HIS 114 HE2 HIS 114 -18.844 16.495 4.790 937 HA PRO 115 HA PRO 115 -17.960 10.003 4.627 938 HB2 PRO 115 HB2 PRO 115 -17.031 8.416 2.669 939 HB3 PRO 115 HB1 PRO 115 -18.458 7.988 3.617 940 HG2 PRO 115 HG2 PRO 115 -18.272 8.805 0.813 941 HG3 PRO 115 HG1 PRO 115 -19.611 8.019 1.662 942 HD2 PRO 115 HD2 PRO 115 -19.235 10.847 1.036 943 HD3 PRO 115 HD1 PRO 115 -20.685 10.019 1.644 944 HA PRO 116 HA PRO 116 -14.818 12.473 2.461 945 HB2 PRO 116 HB2 PRO 116 -13.978 13.942 4.531 946 HB3 PRO 116 HB1 PRO 116 -15.468 14.350 3.673 947 HG2 PRO 116 HG2 PRO 116 -15.103 13.101 6.338 948 HG3 PRO 116 HG1 PRO 116 -16.414 14.136 5.752 949 HD2 PRO 116 HD2 PRO 116 -16.406 11.294 5.939 950 HD3 PRO 116 HD1 PRO 116 -17.653 12.330 5.216 951 H VAL 117 HN VAL 117 -13.478 10.622 2.176 952 HA VAL 117 HA VAL 117 -11.696 10.140 4.485 953 HB VAL 117 HB VAL 117 -12.667 8.128 2.462 954 HG11 VAL 117 HG11 VAL 117 -10.556 7.861 4.585 955 HG12 VAL 117 HG12 VAL 117 -10.335 7.718 2.846 956 HG13 VAL 117 HG13 VAL 117 -11.275 6.509 3.721 957 HG21 VAL 117 HG21 VAL 117 -13.507 6.951 4.455 958 HG22 VAL 117 HG22 VAL 117 -14.251 8.536 4.244 959 HG23 VAL 117 HG23 VAL 117 -12.988 8.309 5.455 960 H ASN 118 HN ASN 118 -9.829 11.090 4.066 961 HA ASN 118 HA ASN 118 -8.381 10.255 1.665 962 HB2 ASN 118 HB2 ASN 118 -9.404 12.523 1.225 963 HB3 ASN 118 HB1 ASN 118 -8.438 13.153 2.551 964 HD21 ASN 118 HD21 ASN 118 -6.027 12.823 2.321 965 HD22 ASN 118 HD22 ASN 118 -5.366 12.938 0.727 966 H HIS 119 HN HIS 119 -6.908 9.026 2.838 967 HA HIS 119 HA HIS 119 -5.407 10.471 4.921 968 HB2 HIS 119 HB2 HIS 119 -6.970 8.777 5.860 969 HB3 HIS 119 HB1 HIS 119 -6.104 7.540 4.953 970 HD1 HIS 119 HD1 HIS 119 -4.369 6.362 6.221 971 HD2 HIS 119 HD2 HIS 119 -5.042 10.183 7.723 972 HE1 HIS 119 HE1 HIS 119 -2.866 6.578 8.227 973 HE2 HIS 119 HE2 HIS 119 -3.194 8.938 9.050 974 H LEU 120 HN LEU 120 -3.262 10.207 5.014 975 HA LEU 120 HA LEU 120 -1.890 8.128 3.532 976 HB2 LEU 120 HB2 LEU 120 -1.754 11.036 2.872 977 HB3 LEU 120 HB1 LEU 120 -0.282 10.097 2.771 978 HG LEU 120 HG LEU 120 -2.758 9.231 1.319 979 HD11 LEU 120 HD11 LEU 120 -1.003 10.405 -0.498 980 HD12 LEU 120 HD12 LEU 120 -1.143 11.569 0.820 981 HD13 LEU 120 HD13 LEU 120 -2.590 11.006 -0.019 982 HD21 LEU 120 HD21 LEU 120 -0.657 7.776 1.737 983 HD22 LEU 120 HD22 LEU 120 0.104 8.828 0.538 984 HD23 LEU 120 HD23 LEU 120 -1.315 7.876 0.100 985 H ARG 121 HN ARG 121 0.198 7.724 4.278 986 HA ARG 121 HA ARG 121 1.321 9.335 6.438 987 HB2 ARG 121 HB2 ARG 121 0.849 7.928 8.185 988 HB3 ARG 121 HB1 ARG 121 -0.350 7.211 7.169 989 HG2 ARG 121 HG2 ARG 121 2.444 6.182 7.047 990 HG3 ARG 121 HG1 ARG 121 1.437 5.759 8.426 991 HD2 ARG 121 HD2 ARG 121 0.411 5.265 5.638 992 HD3 ARG 121 HD1 ARG 121 1.576 4.187 6.368 993 HE ARG 121 HE ARG 121 -1.062 4.766 7.540 994 HH11 ARG 121 HH11 ARG 121 1.661 2.658 6.961 995 HH12 ARG 121 HH12 ARG 121 0.979 1.310 7.819 996 HH21 ARG 121 HH21 ARG 121 -1.985 3.002 8.673 997 HH22 ARG 121 HH22 ARG 121 -1.107 1.503 8.791 998 H CYS 122 HN CYS 122 3.622 9.020 6.541 999 HA CYS 122 HA CYS 122 4.683 7.153 4.546 1000 HB2 CYS 122 HB2 CYS 122 6.158 9.299 6.041 1001 HB3 CYS 122 HB1 CYS 122 6.749 8.384 4.668 1002 HG CYS 122 HG CYS 122 4.285 9.511 3.257 1003 H GLU 123 HN GLU 123 5.679 5.332 5.062 1004 HA GLU 123 HA GLU 123 6.308 4.731 7.860 1005 HB2 GLU 123 HB2 GLU 123 6.583 2.827 5.529 1006 HB3 GLU 123 HB1 GLU 123 6.339 2.432 7.226 1007 HG2 GLU 123 HG2 GLU 123 4.290 1.966 6.172 1008 HG3 GLU 123 HG1 GLU 123 4.059 3.521 6.980 1009 H LYS 124 HN LYS 124 8.407 3.511 8.246 1010 HA LYS 124 HA LYS 124 10.527 4.496 6.479 1011 HB2 LYS 124 HB2 LYS 124 10.355 5.971 8.435 1012 HB3 LYS 124 HB1 LYS 124 10.509 4.577 9.495 1013 HG2 LYS 124 HG2 LYS 124 12.770 4.183 8.397 1014 HG3 LYS 124 HG1 LYS 124 12.597 5.794 7.704 1015 HD2 LYS 124 HD2 LYS 124 13.863 6.032 9.660 1016 HD3 LYS 124 HD1 LYS 124 12.249 6.638 10.038 1017 HE2 LYS 124 HE2 LYS 124 11.699 4.765 11.295 1018 HE3 LYS 124 HE1 LYS 124 12.967 3.790 10.553 1019 HZ1 LYS 124 HZ1 LYS 124 13.588 4.362 12.795 1020 HZ2 LYS 124 HZ2 LYS 124 13.344 6.012 12.499 1021 HZ3 LYS 124 HZ3 LYS 124 14.608 5.191 11.725 1022 H LEU 125 HN LEU 125 11.952 2.979 5.918 1023 HA LEU 125 HA LEU 125 12.109 0.527 7.560 1024 HB2 LEU 125 HB2 LEU 125 12.704 0.760 4.615 1025 HB3 LEU 125 HB1 LEU 125 12.528 -0.708 5.547 1026 HG LEU 125 HG LEU 125 10.157 1.074 5.449 1027 HD11 LEU 125 HD11 LEU 125 10.808 1.216 3.134 1028 HD12 LEU 125 HD12 LEU 125 9.469 0.072 3.280 1029 HD13 LEU 125 HD13 LEU 125 11.117 -0.523 3.084 1030 HD21 LEU 125 HD21 LEU 125 9.077 -1.200 5.154 1031 HD22 LEU 125 HD22 LEU 125 9.929 -0.929 6.677 1032 HD23 LEU 125 HD23 LEU 125 10.686 -1.885 5.403 1033 H THR 126 HN THR 126 14.030 0.422 8.608 1034 HA THR 126 HA THR 126 16.318 1.885 7.462 1035 HB THR 126 HB THR 126 16.332 0.835 10.262 1036 HG1 THR 126 HG1 THR 126 14.313 2.016 9.935 1037 HG21 THR 126 HG21 THR 126 18.243 2.021 8.967 1038 HG22 THR 126 HG22 THR 126 17.906 2.481 10.637 1039 HG23 THR 126 HG23 THR 126 17.321 3.486 9.311 1040 H PHE 127 HN PHE 127 17.884 0.743 6.555 1041 HA PHE 127 HA PHE 127 18.199 -2.083 7.329 1042 HB2 PHE 127 HB2 PHE 127 18.935 -0.739 4.719 1043 HB3 PHE 127 HB1 PHE 127 19.105 -2.455 5.076 1044 HD1 PHE 127 HD1 PHE 127 17.108 -3.921 5.182 1045 HD2 PHE 127 HD2 PHE 127 16.815 0.242 4.276 1046 HE1 PHE 127 HE1 PHE 127 14.801 -4.239 4.398 1047 HE2 PHE 127 HE2 PHE 127 14.520 -0.084 3.490 1048 HZ PHE 127 HZ PHE 127 13.507 -2.323 3.558 1049 H ASN 128 HN ASN 128 19.756 -2.143 8.804 1050 HA ASN 128 HA ASN 128 21.971 -0.307 8.812 1051 HB2 ASN 128 HB2 ASN 128 21.245 -2.642 10.569 1052 HB3 ASN 128 HB1 ASN 128 22.707 -1.689 10.785 1053 HD21 ASN 128 HD21 ASN 128 19.222 -1.666 10.945 1054 HD22 ASN 128 HD22 ASN 128 19.091 -0.230 11.906 1055 H ASN 129 HN ASN 129 23.702 -0.565 7.586 1056 HA ASN 129 HA ASN 129 25.541 -1.454 6.600 1057 HB2 ASN 129 HB2 ASN 129 25.083 -3.747 8.527 1058 HB3 ASN 129 HB1 ASN 129 26.552 -3.472 7.577 1059 HD21 ASN 129 HD21 ASN 129 25.824 -3.444 10.618 1060 HD22 ASN 129 HD22 ASN 129 26.559 -1.971 11.154 1061 HA PRO 130 HA PRO 130 23.254 -4.445 3.919 1062 HB2 PRO 130 HB2 PRO 130 22.294 -2.786 2.023 1063 HB3 PRO 130 HB1 PRO 130 21.437 -3.075 3.539 1064 HG2 PRO 130 HG2 PRO 130 22.864 -0.676 2.634 1065 HG3 PRO 130 HG1 PRO 130 21.639 -0.843 3.899 1066 HD2 PRO 130 HD2 PRO 130 24.515 -0.714 4.171 1067 HD3 PRO 130 HD1 PRO 130 23.282 -0.746 5.446 1068 H THR 131 HN THR 131 23.642 -4.865 1.517 1069 HA THR 131 HA THR 131 26.401 -4.447 0.898 1070 HB THR 131 HB THR 131 25.288 -6.514 0.168 1071 HG1 THR 131 HG1 THR 131 26.606 -6.553 -1.480 1072 HG21 THR 131 HG21 THR 131 23.057 -5.735 -0.333 1073 HG22 THR 131 HG22 THR 131 23.750 -6.436 -1.798 1074 HG23 THR 131 HG23 THR 131 23.671 -4.684 -1.614 1075 H GLU 132 HN GLU 132 27.167 -3.423 -1.155 1076 HA GLU 132 HA GLU 132 26.378 -0.743 -1.219 1077 HB2 GLU 132 HB2 GLU 132 28.585 -1.637 -2.039 1078 HB3 GLU 132 HB1 GLU 132 27.758 -2.172 -3.497 1079 HG2 GLU 132 HG2 GLU 132 28.754 -0.121 -4.035 1080 HG3 GLU 132 HG1 GLU 132 27.035 0.218 -3.829 1081 H ASP 133 HN ASP 133 25.558 -3.399 -3.432 1082 HA ASP 133 HA ASP 133 24.184 -1.981 -5.380 1083 HB2 ASP 133 HB2 ASP 133 23.672 -4.761 -4.294 1084 HB3 ASP 133 HB1 ASP 133 22.866 -4.111 -5.717 1085 H PHE 134 HN PHE 134 23.004 -3.147 -2.238 1086 HA PHE 134 HA PHE 134 20.306 -2.326 -2.718 1087 HB2 PHE 134 HB2 PHE 134 21.098 -4.082 -0.988 1088 HB3 PHE 134 HB1 PHE 134 21.511 -2.695 0.017 1089 HD1 PHE 134 HD1 PHE 134 18.624 -2.953 -2.285 1090 HD2 PHE 134 HD2 PHE 134 19.932 -2.887 1.768 1091 HE1 PHE 134 HE1 PHE 134 16.311 -2.731 -1.544 1092 HE2 PHE 134 HE2 PHE 134 17.601 -2.684 2.512 1093 HZ PHE 134 HZ PHE 134 15.790 -2.602 0.849 1094 H ARG 135 HN ARG 135 22.778 -1.129 -0.480 1095 HA ARG 135 HA ARG 135 21.849 1.292 0.294 1096 HB2 ARG 135 HB2 ARG 135 23.876 0.897 1.203 1097 HB3 ARG 135 HB1 ARG 135 24.522 0.215 -0.275 1098 HG2 ARG 135 HG2 ARG 135 25.240 2.276 -1.057 1099 HG3 ARG 135 HG1 ARG 135 23.995 3.135 -0.171 1100 HD2 ARG 135 HD2 ARG 135 26.336 3.464 0.735 1101 HD3 ARG 135 HD1 ARG 135 25.172 2.831 1.892 1102 HE ARG 135 HE ARG 135 27.082 1.104 0.443 1103 HH11 ARG 135 HH11 ARG 135 25.567 2.153 3.449 1104 HH12 ARG 135 HH12 ARG 135 26.295 0.883 4.386 1105 HH21 ARG 135 HH21 ARG 135 28.050 -0.536 1.715 1106 HH22 ARG 135 HH22 ARG 135 27.696 -0.625 3.420 1107 H ARG 136 HN ARG 136 23.578 0.740 -2.671 1108 HA ARG 136 HA ARG 136 23.670 3.261 -3.746 1109 HB2 ARG 136 HB2 ARG 136 24.892 1.337 -4.538 1110 HB3 ARG 136 HB1 ARG 136 23.414 0.570 -5.090 1111 HG2 ARG 136 HG2 ARG 136 23.204 2.611 -6.639 1112 HG3 ARG 136 HG1 ARG 136 24.914 2.865 -6.249 1113 HD2 ARG 136 HD2 ARG 136 25.051 1.515 -8.126 1114 HD3 ARG 136 HD1 ARG 136 25.165 0.362 -6.787 1115 HE ARG 136 HE ARG 136 22.539 0.841 -7.999 1116 HH11 ARG 136 HH11 ARG 136 25.300 -1.242 -7.470 1117 HH12 ARG 136 HH12 ARG 136 24.495 -2.680 -8.012 1118 HH21 ARG 136 HH21 ARG 136 21.475 -1.048 -8.769 1119 HH22 ARG 136 HH22 ARG 136 22.335 -2.566 -8.778 1120 H LYS 137 HN LYS 137 21.102 0.793 -4.229 1121 HA LYS 137 HA LYS 137 19.546 2.486 -5.913 1122 HB2 LYS 137 HB2 LYS 137 18.839 -0.004 -4.362 1123 HB3 LYS 137 HB1 LYS 137 17.662 0.867 -5.349 1124 HG2 LYS 137 HG2 LYS 137 19.226 0.561 -7.294 1125 HG3 LYS 137 HG1 LYS 137 20.188 -0.502 -6.267 1126 HD2 LYS 137 HD2 LYS 137 17.321 -1.127 -6.326 1127 HD3 LYS 137 HD1 LYS 137 18.140 -1.308 -7.875 1128 HE2 LYS 137 HE2 LYS 137 18.135 -3.398 -6.617 1129 HE3 LYS 137 HE1 LYS 137 19.770 -2.797 -6.859 1130 HZ1 LYS 137 HZ1 LYS 137 19.772 -1.967 -4.600 1131 HZ2 LYS 137 HZ2 LYS 137 19.422 -3.625 -4.612 1132 HZ3 LYS 137 HZ3 LYS 137 18.180 -2.501 -4.370 1133 H LEU 138 HN LEU 138 19.388 1.679 -2.485 1134 HA LEU 138 HA LEU 138 17.134 3.125 -1.742 1135 HB2 LEU 138 HB2 LEU 138 19.642 2.793 -0.112 1136 HB3 LEU 138 HB1 LEU 138 18.040 3.146 0.499 1137 HG LEU 138 HG LEU 138 19.019 0.562 -0.692 1138 HD11 LEU 138 HD11 LEU 138 19.540 1.038 1.686 1139 HD12 LEU 138 HD12 LEU 138 18.493 -0.362 1.455 1140 HD13 LEU 138 HD13 LEU 138 17.807 1.171 1.993 1141 HD21 LEU 138 HD21 LEU 138 16.215 1.366 0.019 1142 HD22 LEU 138 HD22 LEU 138 16.737 -0.289 -0.286 1143 HD23 LEU 138 HD23 LEU 138 16.818 0.913 -1.573 1144 H LEU 139 HN LEU 139 20.430 4.208 -2.269 1145 HA LEU 139 HA LEU 139 19.943 6.838 -1.214 1146 HB2 LEU 139 HB2 LEU 139 22.303 5.697 -2.696 1147 HB3 LEU 139 HB1 LEU 139 22.261 7.283 -1.944 1148 HG LEU 139 HG LEU 139 21.942 4.665 -0.482 1149 HD11 LEU 139 HD11 LEU 139 24.149 4.539 -0.783 1150 HD12 LEU 139 HD12 LEU 139 24.207 5.780 0.477 1151 HD13 LEU 139 HD13 LEU 139 24.296 6.244 -1.224 1152 HD21 LEU 139 HD21 LEU 139 20.746 6.534 0.518 1153 HD22 LEU 139 HD22 LEU 139 22.239 7.474 0.556 1154 HD23 LEU 139 HD23 LEU 139 22.094 6.004 1.524 1155 H LYS 140 HN LYS 140 19.793 5.355 -4.365 1156 HA LYS 140 HA LYS 140 19.891 7.808 -5.808 1157 HB2 LYS 140 HB2 LYS 140 19.754 5.065 -6.498 1158 HB3 LYS 140 HB1 LYS 140 18.390 5.881 -7.238 1159 HG2 LYS 140 HG2 LYS 140 19.886 7.526 -8.240 1160 HG3 LYS 140 HG1 LYS 140 21.264 6.687 -7.524 1161 HD2 LYS 140 HD2 LYS 140 19.491 4.973 -9.104 1162 HD3 LYS 140 HD1 LYS 140 20.299 6.224 -10.025 1163 HE2 LYS 140 HE2 LYS 140 21.467 4.021 -8.447 1164 HE3 LYS 140 HE1 LYS 140 21.706 4.387 -10.141 1165 HZ1 LYS 140 HZ1 LYS 140 23.662 5.045 -9.006 1166 HZ2 LYS 140 HZ2 LYS 140 22.789 5.862 -7.807 1167 HZ3 LYS 140 HZ3 LYS 140 22.832 6.476 -9.386 1168 H ALA 141 HN ALA 141 17.507 6.060 -4.102 1169 HA ALA 141 HA ALA 141 15.133 6.993 -5.186 1170 HB1 ALA 141 HB1 ALA 141 14.107 6.291 -3.229 1171 HB2 ALA 141 HB2 ALA 141 15.521 6.659 -2.244 1172 HB3 ALA 141 HB3 ALA 141 15.545 5.277 -3.341 1173 H1 GLY 212 HT1 GLY 212 -17.209 11.801 12.826 1174 H2 GLY 212 HT2 GLY 212 -15.772 11.480 11.984 1175 H3 GLY 212 HT3 GLY 212 -15.752 11.646 13.670 1176 HA2 GLY 212 HA1 GLY 212 -15.593 9.323 13.044 1177 HA3 GLY 212 HA2 GLY 212 -17.070 9.661 13.939 1178 H GLY 213 HN GLY 213 -18.090 7.840 13.041 1179 HA2 GLY 213 HA2 GLY 213 -19.867 7.304 11.549 1180 HA3 GLY 213 HA1 GLY 213 -19.131 8.353 10.341 1181 H LYS 214 HN LYS 214 -18.320 5.463 12.226 1182 HA LYS 214 HA LYS 214 -16.554 4.528 10.146 1183 HB2 LYS 214 HB2 LYS 214 -16.080 4.254 12.594 1184 HB3 LYS 214 HB1 LYS 214 -17.421 3.122 12.676 1185 HG2 LYS 214 HG2 LYS 214 -15.354 1.911 12.536 1186 HG3 LYS 214 HG1 LYS 214 -16.268 1.679 11.046 1187 HD2 LYS 214 HD2 LYS 214 -13.918 2.051 10.548 1188 HD3 LYS 214 HD1 LYS 214 -14.889 3.397 9.952 1189 HE2 LYS 214 HE2 LYS 214 -12.807 4.141 11.044 1190 HE3 LYS 214 HE1 LYS 214 -14.251 4.751 11.851 1191 HZ1 LYS 214 HZ1 LYS 214 -13.981 3.243 13.610 1192 HZ2 LYS 214 HZ2 LYS 214 -12.422 3.849 13.319 1193 HZ3 LYS 214 HZ3 LYS 214 -12.850 2.305 12.763 1194 H ALA 215 HN ALA 215 -17.431 3.672 8.388 1195 HA ALA 215 HA ALA 215 -20.016 2.522 8.267 1196 HB1 ALA 215 HB1 ALA 215 -19.418 1.894 5.987 1197 HB2 ALA 215 HB2 ALA 215 -17.723 2.256 6.317 1198 HB3 ALA 215 HB3 ALA 215 -18.920 3.552 6.329 1199 HA PRO 216 HA PRO 216 -19.637 -1.686 9.475 1200 HB2 PRO 216 HB2 PRO 216 -20.544 -2.985 7.171 1201 HB3 PRO 216 HB1 PRO 216 -21.542 -2.401 8.496 1202 HG2 PRO 216 HG2 PRO 216 -20.971 -1.138 5.869 1203 HG3 PRO 216 HG1 PRO 216 -22.460 -1.118 6.825 1204 HD2 PRO 216 HD2 PRO 216 -20.831 1.001 6.697 1205 HD3 PRO 216 HD1 PRO 216 -21.696 0.589 8.191 1206 H ARG 217 HN ARG 217 -18.507 -3.661 9.147 1207 HA ARG 217 HA ARG 217 -16.483 -3.628 7.017 1208 HB2 ARG 217 HB2 ARG 217 -15.994 -4.138 9.954 1209 HB3 ARG 217 HB1 ARG 217 -14.833 -4.511 8.690 1210 HG2 ARG 217 HG2 ARG 217 -14.834 -2.106 8.067 1211 HG3 ARG 217 HG1 ARG 217 -15.858 -1.797 9.473 1212 HD2 ARG 217 HD2 ARG 217 -14.154 -2.654 10.950 1213 HD3 ARG 217 HD1 ARG 217 -13.151 -3.112 9.575 1214 HE ARG 217 HE ARG 217 -13.850 -0.301 10.030 1215 HH11 ARG 217 HH11 ARG 217 -11.463 -2.847 9.759 1216 HH12 ARG 217 HH12 ARG 217 -10.109 -1.742 9.742 1217 HH21 ARG 217 HH21 ARG 217 -12.067 1.139 9.995 1218 HH22 ARG 217 HH22 ARG 217 -10.452 0.511 9.852 1219 H1 KCR 218 HN KCR 218 -15.405 -5.768 6.776 1220 H4 KCR 218 HA KCR 218 -17.397 -7.904 7.174 1221 H5 KCR 218 HB1 KCR 218 -16.426 -8.986 5.196 1222 H6 KCR 218 HB2 KCR 218 -15.264 -7.677 5.045 1223 H7 KCR 218 HG1 KCR 218 -17.067 -6.107 4.606 1224 H8 KCR 218 HG2 KCR 218 -18.248 -7.412 4.774 1225 H9 KCR 218 HD1 KCR 218 -17.295 -8.569 2.880 1226 H10 KCR 218 HD2 KCR 218 -16.014 -7.364 2.750 1227 H11 KCR 218 HE1 KCR 218 -17.667 -5.646 2.235 1228 H12 KCR 218 HE2 KCR 218 -18.959 -6.838 2.382 1229 H13 KCR 218 HZ1 KCR 218 -18.123 -7.921 0.420 1230 H14 KCR 218 HH1 KCR 218 -17.388 -7.719 -1.872 1231 H15 KCR 218 HJ1 KCR 218 -16.782 -4.752 -2.441 1232 H16 KCR 218 HF3 KCR 218 -17.601 -6.231 -4.574 1233 H17 KCR 218 HF1 KCR 218 -15.906 -5.750 -4.535 1234 H18 KCR 218 HF2 KCR 218 -16.376 -7.363 -4.000 1235 H GLN 219 HN GLN 219 -15.285 -7.143 9.100 1236 HA GLN 219 HA GLN 219 -13.499 -9.461 8.916 1237 HB2 GLN 219 HB2 GLN 219 -12.497 -7.254 9.449 1238 HB3 GLN 219 HB1 GLN 219 -13.469 -7.189 10.915 1239 HG2 GLN 219 HG2 GLN 219 -12.354 -9.255 11.692 1240 HG3 GLN 219 HG1 GLN 219 -11.320 -9.194 10.266 1241 HE21 GLN 219 HE21 GLN 219 -9.740 -7.594 10.116 1242 HE22 GLN 219 HE22 GLN 219 -9.217 -6.699 11.508 1243 H LEU 220 HN LEU 220 -15.860 -7.954 11.067 1244 HA LEU 220 HA LEU 220 -15.930 -10.363 12.728 1245 HB2 LEU 220 HB2 LEU 220 -17.406 -7.749 13.064 1246 HB3 LEU 220 HB1 LEU 220 -17.305 -9.044 14.242 1247 HG LEU 220 HG LEU 220 -14.969 -7.381 13.291 1248 HD11 LEU 220 HD11 LEU 220 -15.044 -6.389 15.525 1249 HD12 LEU 220 HD12 LEU 220 -16.513 -7.300 15.879 1250 HD13 LEU 220 HD13 LEU 220 -16.523 -6.065 14.619 1251 HD21 LEU 220 HD21 LEU 220 -15.175 -9.446 15.480 1252 HD22 LEU 220 HD22 LEU 220 -13.762 -8.448 15.132 1253 HD23 LEU 220 HD23 LEU 220 -14.317 -9.636 13.952 1254 H ALA 221 HN ALA 221 -17.125 -9.751 9.903 1255 HA ALA 221 HA ALA 221 -19.931 -10.379 10.439 1256 HB1 ALA 221 HB1 ALA 221 -18.584 -9.617 7.849 1257 HB2 ALA 221 HB2 ALA 221 -19.452 -8.517 8.920 1258 HB3 ALA 221 HB3 ALA 221 -20.319 -9.817 8.103 1259 H THR 222 HN THR 222 -18.326 -12.455 11.076 1260 HA THR 222 HA THR 222 -18.094 -14.692 10.801 1261 HB THR 222 HB THR 222 -20.061 -14.488 8.515 1262 HG1 THR 222 HG1 THR 222 -21.671 -14.404 9.997 1263 HG21 THR 222 HG21 THR 222 -19.475 -16.684 10.508 1264 HG22 THR 222 HG22 THR 222 -18.993 -16.675 8.812 1265 HG23 THR 222 HG23 THR 222 -20.702 -16.742 9.243 1266 H LYS 223 HN LYS 223 -15.964 -13.787 10.002 1267 HA LYS 223 HA LYS 223 -15.341 -15.083 7.451 1268 HB2 LYS 223 HB2 LYS 223 -14.732 -12.220 8.164 1269 HB3 LYS 223 HB1 LYS 223 -13.737 -13.103 7.017 1270 HG2 LYS 223 HG2 LYS 223 -16.706 -12.704 6.720 1271 HG3 LYS 223 HG1 LYS 223 -15.479 -11.676 5.975 1272 HD2 LYS 223 HD2 LYS 223 -14.573 -13.650 4.809 1273 HD3 LYS 223 HD1 LYS 223 -15.852 -14.636 5.516 1274 HE2 LYS 223 HE2 LYS 223 -16.277 -12.266 3.700 1275 HE3 LYS 223 HE1 LYS 223 -16.351 -13.953 3.202 1276 HZ1 LYS 223 HZ1 LYS 223 -18.155 -12.578 5.115 1277 HZ2 LYS 223 HZ2 LYS 223 -18.171 -14.250 4.831 1278 HZ3 LYS 223 HZ3 LYS 223 -18.557 -13.174 3.579 1279 H ALA 224 HN ALA 224 -14.957 -16.000 10.067 1280 HA ALA 224 HA ALA 224 -12.062 -16.241 10.105 1281 HB1 ALA 224 HB1 ALA 224 -11.864 -15.717 12.477 1282 HB2 ALA 224 HB2 ALA 224 -13.581 -15.318 12.544 1283 HB3 ALA 224 HB3 ALA 224 -12.484 -14.331 11.579 Start of MODEL 11 1 H1 GLY 1 HT1 GLY 1 40.373 -1.609 1.413 2 H2 GLY 1 HT2 GLY 1 42.000 -1.710 1.879 3 H3 GLY 1 HT3 GLY 1 41.596 -1.307 0.279 4 HA2 GLY 1 HA1 GLY 1 41.060 0.339 2.687 5 HA3 GLY 1 HA2 GLY 1 42.279 0.663 1.460 6 H SER 2 HN SER 2 41.692 2.262 0.170 7 HA SER 2 HA SER 2 40.510 3.543 -1.277 8 HB2 SER 2 HB2 SER 2 39.835 1.434 -2.348 9 HB3 SER 2 HB1 SER 2 38.487 1.285 -1.224 10 HG SER 2 HG SER 2 38.692 3.653 -2.704 11 H HIS 3 HN HIS 3 37.889 2.028 0.620 12 HA HIS 3 HA HIS 3 36.232 2.902 1.898 13 HB2 HIS 3 HB2 HIS 3 38.215 5.131 2.406 14 HB3 HIS 3 HB1 HIS 3 36.767 4.810 3.353 15 HD1 HIS 3 HD1 HIS 3 40.214 4.394 3.617 16 HD2 HIS 3 HD2 HIS 3 36.993 1.845 4.273 17 HE1 HIS 3 HE1 HIS 3 41.074 2.591 5.148 18 HE2 HIS 3 HE2 HIS 3 39.065 1.157 5.662 19 H MET 4 HN MET 4 36.083 3.381 -0.810 20 HA MET 4 HA MET 4 35.320 6.117 -1.291 21 HB2 MET 4 HB2 MET 4 36.231 4.731 -3.103 22 HB3 MET 4 HB1 MET 4 34.886 3.612 -2.936 23 HG2 MET 4 HG2 MET 4 33.337 5.375 -3.613 24 HG3 MET 4 HG1 MET 4 34.688 6.493 -3.788 25 HE1 MET 4 HE1 MET 4 33.574 5.778 -7.493 26 HE2 MET 4 HE2 MET 4 33.860 7.025 -6.278 27 HE3 MET 4 HE3 MET 4 32.530 5.884 -6.074 28 H ALA 5 HN ALA 5 33.799 3.100 -0.443 29 HA ALA 5 HA ALA 5 31.170 4.416 -0.394 30 HB1 ALA 5 HB1 ALA 5 30.243 2.157 -0.175 31 HB2 ALA 5 HB2 ALA 5 31.875 1.489 -0.219 32 HB3 ALA 5 HB3 ALA 5 31.225 2.324 -1.630 33 H SER 6 HN SER 6 29.831 4.119 1.480 34 HA SER 6 HA SER 6 31.278 3.438 3.935 35 HB2 SER 6 HB2 SER 6 31.366 5.917 3.560 36 HB3 SER 6 HB1 SER 6 29.605 5.943 3.627 37 HG SER 6 HG SER 6 29.759 5.978 5.709 38 H SER 7 HN SER 7 30.134 2.046 5.085 39 HA SER 7 HA SER 7 27.363 1.566 4.376 40 HB2 SER 7 HB2 SER 7 29.179 0.095 6.310 41 HB3 SER 7 HB1 SER 7 27.582 -0.440 5.781 42 HG SER 7 HG SER 7 29.919 -0.112 4.191 43 H CYS 8 HN CYS 8 25.644 1.909 5.626 44 HA CYS 8 HA CYS 8 25.752 2.409 8.428 45 HB2 CYS 8 HB2 CYS 8 24.734 4.703 8.259 46 HB3 CYS 8 HB1 CYS 8 26.422 4.628 7.768 47 HG CYS 8 HG CYS 8 25.396 6.361 5.979 48 H ALA 9 HN ALA 9 23.365 3.197 9.079 49 HA ALA 9 HA ALA 9 21.578 1.311 7.846 50 HB1 ALA 9 HB1 ALA 9 19.936 2.049 9.491 51 HB2 ALA 9 HB2 ALA 9 20.981 3.406 9.937 52 HB3 ALA 9 HB3 ALA 9 21.500 1.753 10.267 53 H VAL 10 HN VAL 10 20.569 1.704 6.002 54 HA VAL 10 HA VAL 10 20.071 4.487 5.214 55 HB VAL 10 HB VAL 10 19.793 2.033 3.475 56 HG11 VAL 10 HG11 VAL 10 18.584 3.714 2.448 57 HG12 VAL 10 HG12 VAL 10 20.177 3.883 1.706 58 HG13 VAL 10 HG13 VAL 10 19.686 4.979 2.997 59 HG21 VAL 10 HG21 VAL 10 22.075 2.029 3.983 60 HG22 VAL 10 HG22 VAL 10 22.171 3.789 3.984 61 HG23 VAL 10 HG23 VAL 10 21.976 2.918 2.463 62 H GLN 11 HN GLN 11 18.073 5.285 5.053 63 HA GLN 11 HA GLN 11 15.907 3.480 5.919 64 HB2 GLN 11 HB2 GLN 11 16.008 6.450 6.436 65 HB3 GLN 11 HB1 GLN 11 15.015 5.239 7.234 66 HG2 GLN 11 HG2 GLN 11 16.556 4.915 8.797 67 HG3 GLN 11 HG1 GLN 11 17.788 4.613 7.576 68 HE21 GLN 11 HE21 GLN 11 16.040 7.630 7.808 69 HE22 GLN 11 HE22 GLN 11 17.384 8.587 8.332 70 H VAL 12 HN VAL 12 14.486 3.132 4.347 71 HA VAL 12 HA VAL 12 13.913 5.344 2.504 72 HB VAL 12 HB VAL 12 12.747 3.445 1.170 73 HG11 VAL 12 HG11 VAL 12 15.710 3.876 1.380 74 HG12 VAL 12 HG12 VAL 12 14.585 4.571 0.225 75 HG13 VAL 12 HG13 VAL 12 14.996 2.858 0.138 76 HG21 VAL 12 HG21 VAL 12 12.866 1.696 2.766 77 HG22 VAL 12 HG22 VAL 12 14.608 1.879 2.941 78 HG23 VAL 12 HG23 VAL 12 13.930 1.269 1.429 79 H LYS 13 HN LYS 13 11.815 6.037 2.230 80 HA LYS 13 HA LYS 13 9.929 4.974 4.207 81 HB2 LYS 13 HB2 LYS 13 10.438 7.759 3.241 82 HB3 LYS 13 HB1 LYS 13 8.849 7.330 3.862 83 HG2 LYS 13 HG2 LYS 13 9.915 6.542 5.936 84 HG3 LYS 13 HG1 LYS 13 11.469 7.110 5.322 85 HD2 LYS 13 HD2 LYS 13 10.557 9.394 5.192 86 HD3 LYS 13 HD1 LYS 13 9.029 8.808 5.854 87 HE2 LYS 13 HE2 LYS 13 10.189 8.098 7.890 88 HE3 LYS 13 HE1 LYS 13 11.713 8.686 7.228 89 HZ1 LYS 13 HZ1 LYS 13 10.892 10.340 8.682 90 HZ2 LYS 13 HZ2 LYS 13 9.341 10.291 8.001 91 HZ3 LYS 13 HZ3 LYS 13 10.633 10.925 7.108 92 H LEU 14 HN LEU 14 8.181 4.054 3.538 93 HA LEU 14 HA LEU 14 7.228 4.599 0.804 94 HB2 LEU 14 HB2 LEU 14 6.810 2.156 2.512 95 HB3 LEU 14 HB1 LEU 14 6.068 2.412 0.951 96 HG LEU 14 HG LEU 14 9.048 2.193 1.416 97 HD11 LEU 14 HD11 LEU 14 7.051 0.192 0.386 98 HD12 LEU 14 HD12 LEU 14 7.972 0.083 1.886 99 HD13 LEU 14 HD13 LEU 14 8.801 -0.006 0.331 100 HD21 LEU 14 HD21 LEU 14 7.454 2.141 -1.145 101 HD22 LEU 14 HD22 LEU 14 9.209 2.062 -0.980 102 HD23 LEU 14 HD23 LEU 14 8.348 3.540 -0.546 103 H GLU 15 HN GLU 15 5.052 4.993 0.523 104 HA GLU 15 HA GLU 15 3.773 5.987 2.976 105 HB2 GLU 15 HB2 GLU 15 4.556 7.704 1.377 106 HB3 GLU 15 HB1 GLU 15 3.526 7.007 0.140 107 HG2 GLU 15 HG2 GLU 15 1.559 7.663 1.290 108 HG3 GLU 15 HG1 GLU 15 2.474 8.119 2.727 109 H LEU 16 HN LEU 16 1.974 5.061 3.571 110 HA LEU 16 HA LEU 16 0.413 3.432 1.702 111 HB2 LEU 16 HB2 LEU 16 0.366 3.779 4.683 112 HB3 LEU 16 HB1 LEU 16 -0.969 3.032 3.847 113 HG LEU 16 HG LEU 16 0.291 1.267 4.698 114 HD11 LEU 16 HD11 LEU 16 1.638 1.116 2.137 115 HD12 LEU 16 HD12 LEU 16 -0.079 1.506 2.021 116 HD13 LEU 16 HD13 LEU 16 0.442 0.042 2.860 117 HD21 LEU 16 HD21 LEU 16 2.799 2.364 3.513 118 HD22 LEU 16 HD22 LEU 16 2.625 1.072 4.692 119 HD23 LEU 16 HD23 LEU 16 2.293 2.742 5.153 120 H GLY 17 HN GLY 17 -1.717 3.923 1.241 121 HA2 GLY 17 HA2 GLY 17 -2.922 6.259 2.472 122 HA3 GLY 17 HA1 GLY 17 -2.516 6.427 0.767 123 H HIS 18 HN HIS 18 -5.082 6.651 1.789 124 HA HIS 18 HA HIS 18 -6.342 5.116 -0.191 125 HB2 HIS 18 HB2 HIS 18 -7.247 3.331 0.859 126 HB3 HIS 18 HB1 HIS 18 -6.061 3.613 2.122 127 HD1 HIS 18 HD1 HIS 18 -7.297 5.809 3.757 128 HD2 HIS 18 HD2 HIS 18 -9.529 2.667 2.172 129 HE1 HIS 18 HE1 HIS 18 -9.401 5.714 5.134 130 HE2 HIS 18 HE2 HIS 18 -10.796 3.924 4.057 131 H ARG 19 HN ARG 19 -8.335 5.829 -0.647 132 HA ARG 19 HA ARG 19 -9.418 7.971 1.064 133 HB2 ARG 19 HB2 ARG 19 -9.405 7.858 -1.958 134 HB3 ARG 19 HB1 ARG 19 -10.251 9.052 -1.007 135 HG2 ARG 19 HG2 ARG 19 -8.196 9.952 -0.182 136 HG3 ARG 19 HG1 ARG 19 -7.277 8.670 -0.980 137 HD2 ARG 19 HD2 ARG 19 -7.212 10.711 -2.303 138 HD3 ARG 19 HD1 ARG 19 -8.100 9.433 -3.140 139 HE ARG 19 HE ARG 19 -9.916 11.006 -1.677 140 HH11 ARG 19 HH11 ARG 19 -7.801 11.255 -4.465 141 HH12 ARG 19 HH12 ARG 19 -8.856 12.339 -5.325 142 HH21 ARG 19 HH21 ARG 19 -11.298 12.414 -2.786 143 HH22 ARG 19 HH22 ARG 19 -10.856 13.010 -4.362 144 H ALA 20 HN ALA 20 -11.739 8.148 0.963 145 HA ALA 20 HA ALA 20 -13.142 6.011 -0.412 146 HB1 ALA 20 HB1 ALA 20 -12.867 4.831 1.586 147 HB2 ALA 20 HB2 ALA 20 -14.465 5.563 1.741 148 HB3 ALA 20 HB3 ALA 20 -13.084 6.282 2.568 149 H GLN 21 HN GLN 21 -15.028 6.715 -1.205 150 HA GLN 21 HA GLN 21 -16.497 8.769 0.248 151 HB2 GLN 21 HB2 GLN 21 -16.580 10.275 -1.461 152 HB3 GLN 21 HB1 GLN 21 -15.061 9.542 -1.910 153 HG2 GLN 21 HG2 GLN 21 -17.730 8.903 -3.055 154 HG3 GLN 21 HG1 GLN 21 -16.455 9.846 -3.798 155 HE21 GLN 21 HE21 GLN 21 -17.853 7.433 -4.657 156 HE22 GLN 21 HE22 GLN 21 -16.635 6.245 -4.945 157 H VAL 22 HN VAL 22 -18.822 8.760 -0.466 158 HA VAL 22 HA VAL 22 -19.530 6.042 -1.329 159 HB VAL 22 HB VAL 22 -20.384 6.728 0.898 160 HG11 VAL 22 HG11 VAL 22 -22.188 8.317 1.068 161 HG12 VAL 22 HG12 VAL 22 -22.060 8.690 -0.648 162 HG13 VAL 22 HG13 VAL 22 -20.737 9.100 0.448 163 HG21 VAL 22 HG21 VAL 22 -21.544 5.005 -0.292 164 HG22 VAL 22 HG22 VAL 22 -22.437 6.195 -1.234 165 HG23 VAL 22 HG23 VAL 22 -22.730 6.041 0.497 166 H ARG 23 HN ARG 23 -20.719 5.713 -3.116 167 HA ARG 23 HA ARG 23 -21.520 8.076 -4.657 168 HB2 ARG 23 HB2 ARG 23 -22.179 6.091 -6.321 169 HB3 ARG 23 HB1 ARG 23 -20.546 6.726 -6.216 170 HG2 ARG 23 HG2 ARG 23 -19.724 4.863 -5.231 171 HG3 ARG 23 HG1 ARG 23 -21.239 4.491 -4.410 172 HD2 ARG 23 HD2 ARG 23 -20.488 2.940 -6.302 173 HD3 ARG 23 HD1 ARG 23 -22.159 3.495 -6.308 174 HE ARG 23 HE ARG 23 -21.710 4.816 -8.173 175 HH11 ARG 23 HH11 ARG 23 -18.757 3.325 -7.011 176 HH12 ARG 23 HH12 ARG 23 -17.951 3.448 -8.545 177 HH21 ARG 23 HH21 ARG 23 -20.642 4.976 -10.185 178 HH22 ARG 23 HH22 ARG 23 -19.012 4.392 -10.346 179 H LYS 24 HN LYS 24 -23.616 8.570 -5.078 180 HA LYS 24 HA LYS 24 -25.475 7.756 -3.094 181 HB2 LYS 24 HB2 LYS 24 -25.929 9.382 -5.605 182 HB3 LYS 24 HB1 LYS 24 -27.045 9.264 -4.255 183 HG2 LYS 24 HG2 LYS 24 -24.311 10.174 -3.629 184 HG3 LYS 24 HG1 LYS 24 -25.328 11.269 -4.563 185 HD2 LYS 24 HD2 LYS 24 -27.052 11.152 -2.842 186 HD3 LYS 24 HD1 LYS 24 -26.059 10.033 -1.909 187 HE2 LYS 24 HE2 LYS 24 -25.262 12.842 -2.652 188 HE3 LYS 24 HE1 LYS 24 -25.931 12.364 -1.094 189 HZ1 LYS 24 HZ1 LYS 24 -23.529 12.503 -1.005 190 HZ2 LYS 24 HZ2 LYS 24 -23.382 11.379 -2.264 191 HZ3 LYS 24 HZ3 LYS 24 -24.032 10.899 -0.771 192 H LYS 25 HN LYS 25 -24.583 6.235 -5.871 193 HA LYS 25 HA LYS 25 -27.036 4.654 -5.856 194 HB2 LYS 25 HB2 LYS 25 -27.241 6.215 -7.739 195 HB3 LYS 25 HB1 LYS 25 -25.682 5.699 -8.362 196 HG2 LYS 25 HG2 LYS 25 -27.676 3.571 -7.975 197 HG3 LYS 25 HG1 LYS 25 -28.046 4.762 -9.221 198 HD2 LYS 25 HD2 LYS 25 -25.987 4.302 -10.353 199 HD3 LYS 25 HD1 LYS 25 -25.435 3.273 -9.027 200 HE2 LYS 25 HE2 LYS 25 -27.336 1.770 -9.455 201 HE3 LYS 25 HE1 LYS 25 -27.784 2.764 -10.841 202 HZ1 LYS 25 HZ1 LYS 25 -26.422 0.718 -11.324 203 HZ2 LYS 25 HZ2 LYS 25 -25.111 1.512 -10.596 204 HZ3 LYS 25 HZ3 LYS 25 -25.837 2.171 -11.978 205 HA PRO 26 HA PRO 26 -23.643 1.659 -5.387 206 HB2 PRO 26 HB2 PRO 26 -25.997 -0.077 -4.953 207 HB3 PRO 26 HB1 PRO 26 -24.560 0.139 -3.951 208 HG2 PRO 26 HG2 PRO 26 -26.934 1.136 -3.225 209 HG3 PRO 26 HG1 PRO 26 -25.417 1.993 -2.883 210 HD2 PRO 26 HD2 PRO 26 -27.466 2.513 -5.005 211 HD3 PRO 26 HD1 PRO 26 -26.521 3.670 -4.044 212 H THR 27 HN THR 27 -23.115 -0.231 -6.576 213 HA THR 27 HA THR 27 -24.176 -0.216 -9.251 214 HB THR 27 HB THR 27 -21.801 -0.602 -8.976 215 HG1 THR 27 HG1 THR 27 -21.888 -2.981 -9.895 216 HG21 THR 27 HG21 THR 27 -21.624 -1.589 -6.832 217 HG22 THR 27 HG22 THR 27 -21.028 -2.791 -7.983 218 HG23 THR 27 HG23 THR 27 -22.648 -2.950 -7.304 219 H VAL 28 HN VAL 28 -24.481 -2.615 -10.189 220 HA VAL 28 HA VAL 28 -26.945 -3.553 -9.420 221 HB VAL 28 HB VAL 28 -26.102 -4.178 -11.520 222 HG11 VAL 28 HG11 VAL 28 -23.702 -4.122 -10.886 223 HG12 VAL 28 HG12 VAL 28 -24.130 -5.508 -11.894 224 HG13 VAL 28 HG13 VAL 28 -23.898 -5.720 -10.158 225 HG21 VAL 28 HG21 VAL 28 -26.245 -6.614 -9.759 226 HG22 VAL 28 HG22 VAL 28 -26.318 -6.647 -11.522 227 HG23 VAL 28 HG23 VAL 28 -27.585 -5.834 -10.601 228 H GLU 29 HN GLU 29 -23.788 -4.547 -8.231 229 HA GLU 29 HA GLU 29 -24.923 -6.700 -6.663 230 HB2 GLU 29 HB2 GLU 29 -22.074 -5.723 -6.806 231 HB3 GLU 29 HB1 GLU 29 -22.625 -7.253 -6.127 232 HG2 GLU 29 HG2 GLU 29 -23.476 -7.879 -8.389 233 HG3 GLU 29 HG1 GLU 29 -22.764 -6.391 -9.011 234 H GLY 30 HN GLY 30 -24.728 -3.456 -6.233 235 HA2 GLY 30 HA2 GLY 30 -25.532 -2.320 -4.390 236 HA3 GLY 30 HA1 GLY 30 -25.427 -3.803 -3.454 237 H PHE 31 HN PHE 31 -22.748 -2.415 -5.227 238 HA PHE 31 HA PHE 31 -21.288 -2.055 -2.749 239 HB2 PHE 31 HB2 PHE 31 -20.368 -1.402 -5.561 240 HB3 PHE 31 HB1 PHE 31 -19.362 -1.592 -4.130 241 HD1 PHE 31 HD1 PHE 31 -21.063 -4.176 -3.275 242 HD2 PHE 31 HD2 PHE 31 -18.969 -2.983 -6.773 243 HE1 PHE 31 HE1 PHE 31 -20.699 -6.535 -3.868 244 HE2 PHE 31 HE2 PHE 31 -18.605 -5.330 -7.367 245 HZ PHE 31 HZ PHE 31 -19.473 -7.113 -5.913 246 H THR 32 HN THR 32 -21.378 -0.198 -1.657 247 HA THR 32 HA THR 32 -22.582 2.142 -2.949 248 HB THR 32 HB THR 32 -23.044 2.927 -0.674 249 HG1 THR 32 HG1 THR 32 -22.653 1.305 1.050 250 HG21 THR 32 HG21 THR 32 -23.892 0.151 -1.262 251 HG22 THR 32 HG22 THR 32 -24.749 1.624 -1.664 252 HG23 THR 32 HG23 THR 32 -24.594 1.116 0.019 253 H HIS 33 HN HIS 33 -19.678 1.126 -1.276 254 HA HIS 33 HA HIS 33 -18.736 3.918 -1.159 255 HB2 HIS 33 HB2 HIS 33 -18.317 1.535 0.607 256 HB3 HIS 33 HB1 HIS 33 -17.064 2.774 0.557 257 HD1 HIS 33 HD1 HIS 33 -20.710 2.308 1.467 258 HD2 HIS 33 HD2 HIS 33 -17.621 5.044 1.970 259 HE1 HIS 33 HE1 HIS 33 -21.546 3.981 3.152 260 HE2 HIS 33 HE2 HIS 33 -19.568 5.466 3.611 261 H ASP 34 HN ASP 34 -17.084 4.460 -2.416 262 HA ASP 34 HA ASP 34 -15.435 2.341 -3.624 263 HB2 ASP 34 HB2 ASP 34 -16.056 5.163 -4.495 264 HB3 ASP 34 HB1 ASP 34 -14.711 4.253 -5.171 265 H TRP 35 HN TRP 35 -13.285 2.303 -3.327 266 HA TRP 35 HA TRP 35 -12.049 4.538 -1.923 267 HB2 TRP 35 HB2 TRP 35 -10.858 2.968 -0.394 268 HB3 TRP 35 HB1 TRP 35 -12.579 3.116 -0.094 269 HD1 TRP 35 HD1 TRP 35 -14.001 0.910 -0.161 270 HE1 TRP 35 HE1 TRP 35 -13.400 -1.579 -0.529 271 HE3 TRP 35 HE3 TRP 35 -9.179 1.450 -1.801 272 HZ2 TRP 35 HZ2 TRP 35 -11.171 -3.096 -1.385 273 HZ3 TRP 35 HZ3 TRP 35 -7.881 -0.567 -2.362 274 HH2 TRP 35 HH2 TRP 35 -8.843 -2.789 -2.132 275 H MET 36 HN MET 36 -9.765 4.539 -1.990 276 HA MET 36 HA MET 36 -8.546 2.860 -4.066 277 HB2 MET 36 HB2 MET 36 -9.019 4.835 -5.287 278 HB3 MET 36 HB1 MET 36 -8.568 5.869 -3.940 279 HG2 MET 36 HG2 MET 36 -6.215 5.008 -4.219 280 HG3 MET 36 HG1 MET 36 -6.755 4.297 -5.742 281 HE1 MET 36 HE1 MET 36 -6.538 7.219 -3.546 282 HE2 MET 36 HE2 MET 36 -8.009 7.864 -4.295 283 HE3 MET 36 HE3 MET 36 -6.457 8.659 -4.570 284 H VAL 37 HN VAL 37 -6.586 2.127 -3.488 285 HA VAL 37 HA VAL 37 -5.451 3.146 -0.979 286 HB VAL 37 HB VAL 37 -4.014 0.921 -1.419 287 HG11 VAL 37 HG11 VAL 37 -6.742 0.988 -0.217 288 HG12 VAL 37 HG12 VAL 37 -5.265 1.498 0.591 289 HG13 VAL 37 HG13 VAL 37 -5.488 -0.193 0.134 290 HG21 VAL 37 HG21 VAL 37 -5.129 0.321 -3.466 291 HG22 VAL 37 HG22 VAL 37 -6.701 0.420 -2.673 292 HG23 VAL 37 HG23 VAL 37 -5.555 -0.836 -2.205 293 H PHE 38 HN PHE 38 -3.257 3.428 -0.730 294 HA PHE 38 HA PHE 38 -1.741 4.058 -3.187 295 HB2 PHE 38 HB2 PHE 38 -2.196 5.565 -0.653 296 HB3 PHE 38 HB1 PHE 38 -0.615 5.692 -1.401 297 HD1 PHE 38 HD1 PHE 38 -0.319 6.805 -3.470 298 HD2 PHE 38 HD2 PHE 38 -4.157 6.582 -1.669 299 HE1 PHE 38 HE1 PHE 38 -1.080 8.639 -4.914 300 HE2 PHE 38 HE2 PHE 38 -4.944 8.403 -3.122 301 HZ PHE 38 HZ PHE 38 -3.420 9.441 -4.745 302 H VAL 39 HN VAL 39 0.144 2.922 -3.355 303 HA VAL 39 HA VAL 39 1.829 3.055 -0.963 304 HB VAL 39 HB VAL 39 3.013 0.955 -2.135 305 HG11 VAL 39 HG11 VAL 39 0.908 1.049 -0.032 306 HG12 VAL 39 HG12 VAL 39 2.652 0.861 0.135 307 HG13 VAL 39 HG13 VAL 39 1.676 -0.470 -0.485 308 HG21 VAL 39 HG21 VAL 39 1.698 0.180 -3.773 309 HG22 VAL 39 HG22 VAL 39 0.240 0.893 -3.078 310 HG23 VAL 39 HG23 VAL 39 0.878 -0.618 -2.430 311 H ARG 40 HN ARG 40 3.421 4.395 -1.381 312 HA ARG 40 HA ARG 40 4.942 4.339 -3.823 313 HB2 ARG 40 HB2 ARG 40 4.494 6.617 -4.542 314 HB3 ARG 40 HB1 ARG 40 2.982 5.715 -4.542 315 HG2 ARG 40 HG2 ARG 40 2.149 6.845 -2.706 316 HG3 ARG 40 HG1 ARG 40 3.750 7.313 -2.137 317 HD2 ARG 40 HD2 ARG 40 3.933 8.847 -4.099 318 HD3 ARG 40 HD1 ARG 40 2.251 8.459 -4.502 319 HE ARG 40 HE ARG 40 2.723 9.420 -1.795 320 HH11 ARG 40 HH11 ARG 40 1.687 10.184 -5.060 321 HH12 ARG 40 HH12 ARG 40 0.978 11.703 -4.606 322 HH21 ARG 40 HH21 ARG 40 1.777 11.368 -1.198 323 HH22 ARG 40 HH22 ARG 40 1.008 12.375 -2.392 324 H GLY 41 HN GLY 41 6.340 6.595 -3.727 325 HA2 GLY 41 HA2 GLY 41 7.331 6.709 -0.959 326 HA3 GLY 41 HA1 GLY 41 8.245 7.167 -2.390 327 HA PRO 42 HA PRO 42 5.800 10.761 -0.229 328 HB2 PRO 42 HB2 PRO 42 8.391 11.493 0.951 329 HB3 PRO 42 HB1 PRO 42 6.800 11.412 1.710 330 HG2 PRO 42 HG2 PRO 42 8.751 9.603 2.200 331 HG3 PRO 42 HG1 PRO 42 7.034 9.207 2.251 332 HD2 PRO 42 HD2 PRO 42 9.057 8.569 0.181 333 HD3 PRO 42 HD1 PRO 42 7.636 7.644 0.702 334 H GLU 43 HN GLU 43 6.323 13.045 -0.414 335 HA GLU 43 HA GLU 43 7.009 13.897 -2.909 336 HB2 GLU 43 HB2 GLU 43 7.869 15.671 -0.652 337 HB3 GLU 43 HB1 GLU 43 7.098 16.075 -2.173 338 HG2 GLU 43 HG2 GLU 43 5.466 16.447 -0.566 339 HG3 GLU 43 HG1 GLU 43 5.023 14.930 -1.329 340 H HIS 44 HN HIS 44 8.715 13.808 -4.075 341 HA HIS 44 HA HIS 44 10.803 14.274 -4.834 342 HB2 HIS 44 HB2 HIS 44 11.765 15.967 -3.703 343 HB3 HIS 44 HB1 HIS 44 10.794 15.587 -2.290 344 HD1 HIS 44 HD1 HIS 44 14.219 15.241 -3.712 345 HD2 HIS 44 HD2 HIS 44 12.144 14.183 -0.263 346 HE1 HIS 44 HE1 HIS 44 15.978 14.571 -2.038 347 HE2 HIS 44 HE2 HIS 44 14.701 13.885 0.027 348 H SER 45 HN SER 45 10.168 11.947 -2.421 349 HA SER 45 HA SER 45 12.649 10.500 -2.993 350 HB2 SER 45 HB2 SER 45 11.508 8.824 -1.338 351 HB3 SER 45 HB1 SER 45 12.182 10.321 -0.703 352 HG SER 45 HG SER 45 9.494 10.192 -1.524 353 H ASN 46 HN ASN 46 12.698 9.250 -4.743 354 HA ASN 46 HA ASN 46 10.191 8.141 -5.785 355 HB2 ASN 46 HB2 ASN 46 12.960 8.430 -6.941 356 HB3 ASN 46 HB1 ASN 46 11.755 7.388 -7.690 357 HD21 ASN 46 HD21 ASN 46 13.081 9.835 -8.634 358 HD22 ASN 46 HD22 ASN 46 11.797 10.910 -9.067 359 H ILE 47 HN ILE 47 9.664 6.051 -5.520 360 HA ILE 47 HA ILE 47 11.521 4.442 -3.985 361 HB ILE 47 HB ILE 47 9.755 2.908 -3.579 362 HG12 ILE 47 HG12 ILE 47 7.965 4.602 -5.306 363 HG13 ILE 47 HG11 ILE 47 8.760 3.130 -5.871 364 HG21 ILE 47 HG21 ILE 47 9.867 4.827 -2.187 365 HG22 ILE 47 HG22 ILE 47 8.180 4.396 -2.438 366 HG23 ILE 47 HG23 ILE 47 8.886 5.763 -3.307 367 HD11 ILE 47 HD11 ILE 47 7.232 2.941 -3.362 368 HD12 ILE 47 HD12 ILE 47 7.399 1.777 -4.678 369 HD13 ILE 47 HD13 ILE 47 6.302 3.151 -4.846 370 H GLN 48 HN GLN 48 10.392 4.661 -7.231 371 HA GLN 48 HA GLN 48 10.573 1.994 -8.057 372 HB2 GLN 48 HB2 GLN 48 9.572 3.757 -9.428 373 HB3 GLN 48 HB1 GLN 48 11.136 4.537 -9.600 374 HG2 GLN 48 HG2 GLN 48 10.556 3.358 -11.619 375 HG3 GLN 48 HG1 GLN 48 11.953 2.619 -10.870 376 HE21 GLN 48 HE21 GLN 48 8.646 2.162 -9.798 377 HE22 GLN 48 HE22 GLN 48 8.551 0.492 -10.217 378 H HIS 49 HN HIS 49 12.996 3.993 -6.921 379 HA HIS 49 HA HIS 49 15.180 2.882 -8.421 380 HB2 HIS 49 HB2 HIS 49 14.931 4.792 -6.128 381 HB3 HIS 49 HB1 HIS 49 16.500 4.073 -6.491 382 HD1 HIS 49 HD1 HIS 49 16.345 4.187 -9.606 383 HD2 HIS 49 HD2 HIS 49 15.349 7.320 -7.060 384 HE1 HIS 49 HE1 HIS 49 16.469 6.270 -11.007 385 HE2 HIS 49 HE2 HIS 49 15.751 8.136 -9.478 386 H PHE 50 HN PHE 50 13.613 2.277 -5.322 387 HA PHE 50 HA PHE 50 15.431 0.002 -4.964 388 HB2 PHE 50 HB2 PHE 50 15.098 0.188 -2.528 389 HB3 PHE 50 HB1 PHE 50 15.859 1.616 -3.227 390 HD1 PHE 50 HD1 PHE 50 12.687 0.310 -1.811 391 HD2 PHE 50 HD2 PHE 50 14.904 3.729 -3.021 392 HE1 PHE 50 HE1 PHE 50 11.055 1.760 -0.706 393 HE2 PHE 50 HE2 PHE 50 13.242 5.181 -1.938 394 HZ PHE 50 HZ PHE 50 11.314 4.197 -0.778 395 H VAL 51 HN VAL 51 12.444 0.724 -5.904 396 HA VAL 51 HA VAL 51 11.236 -1.706 -4.756 397 HB VAL 51 HB VAL 51 9.979 0.997 -5.269 398 HG11 VAL 51 HG11 VAL 51 7.940 -0.444 -4.237 399 HG12 VAL 51 HG12 VAL 51 8.728 -1.684 -5.230 400 HG13 VAL 51 HG13 VAL 51 8.174 -0.182 -5.974 401 HG21 VAL 51 HG21 VAL 51 9.229 0.620 -2.887 402 HG22 VAL 51 HG22 VAL 51 10.957 0.866 -3.122 403 HG23 VAL 51 HG23 VAL 51 10.326 -0.758 -2.849 404 H GLU 52 HN GLU 52 10.188 -3.048 -6.152 405 HA GLU 52 HA GLU 52 10.608 -2.432 -9.001 406 HB2 GLU 52 HB2 GLU 52 11.809 -4.404 -8.141 407 HB3 GLU 52 HB1 GLU 52 10.280 -5.116 -7.645 408 HG2 GLU 52 HG2 GLU 52 9.559 -5.166 -9.995 409 HG3 GLU 52 HG1 GLU 52 11.123 -4.502 -10.471 410 H LYS 53 HN LYS 53 8.387 -4.474 -7.099 411 HA LYS 53 HA LYS 53 6.167 -3.452 -8.711 412 HB2 LYS 53 HB2 LYS 53 5.257 -5.766 -8.844 413 HB3 LYS 53 HB1 LYS 53 6.774 -5.563 -9.705 414 HG2 LYS 53 HG2 LYS 53 7.972 -6.620 -7.876 415 HG3 LYS 53 HG1 LYS 53 6.473 -6.807 -6.973 416 HD2 LYS 53 HD2 LYS 53 7.112 -8.043 -9.657 417 HD3 LYS 53 HD1 LYS 53 7.151 -8.888 -8.111 418 HE2 LYS 53 HE2 LYS 53 4.780 -8.587 -7.829 419 HE3 LYS 53 HE1 LYS 53 4.716 -7.560 -9.263 420 HZ1 LYS 53 HZ1 LYS 53 5.395 -9.469 -10.600 421 HZ2 LYS 53 HZ2 LYS 53 3.960 -9.795 -9.758 422 HZ3 LYS 53 HZ3 LYS 53 5.425 -10.445 -9.212 423 H VAL 54 HN VAL 54 4.050 -4.548 -7.685 424 HA VAL 54 HA VAL 54 4.126 -4.408 -4.785 425 HB VAL 54 HB VAL 54 3.110 -2.217 -6.525 426 HG11 VAL 54 HG11 VAL 54 1.992 -2.184 -3.827 427 HG12 VAL 54 HG12 VAL 54 1.268 -3.386 -4.891 428 HG13 VAL 54 HG13 VAL 54 1.270 -1.684 -5.353 429 HG21 VAL 54 HG21 VAL 54 3.765 -1.109 -4.221 430 HG22 VAL 54 HG22 VAL 54 4.961 -1.503 -5.445 431 HG23 VAL 54 HG23 VAL 54 4.710 -2.582 -4.070 432 H VAL 55 HN VAL 55 2.088 -5.047 -3.820 433 HA VAL 55 HA VAL 55 0.100 -6.143 -5.666 434 HB VAL 55 HB VAL 55 2.077 -7.790 -4.512 435 HG11 VAL 55 HG11 VAL 55 -0.624 -8.250 -3.269 436 HG12 VAL 55 HG12 VAL 55 0.884 -7.874 -2.429 437 HG13 VAL 55 HG13 VAL 55 0.700 -9.418 -3.262 438 HG21 VAL 55 HG21 VAL 55 -0.523 -8.627 -5.784 439 HG22 VAL 55 HG22 VAL 55 0.991 -9.534 -5.730 440 HG23 VAL 55 HG23 VAL 55 0.888 -8.047 -6.672 441 H PHE 56 HN PHE 56 -1.922 -6.418 -4.756 442 HA PHE 56 HA PHE 56 -2.246 -5.484 -1.985 443 HB2 PHE 56 HB2 PHE 56 -3.821 -4.742 -4.455 444 HB3 PHE 56 HB1 PHE 56 -4.534 -4.628 -2.847 445 HD1 PHE 56 HD1 PHE 56 -1.686 -3.446 -4.913 446 HD2 PHE 56 HD2 PHE 56 -4.185 -2.754 -1.529 447 HE1 PHE 56 HE1 PHE 56 -0.682 -1.226 -4.641 448 HE2 PHE 56 HE2 PHE 56 -3.171 -0.523 -1.254 449 HZ PHE 56 HZ PHE 56 -1.408 0.240 -2.806 450 H HIS 57 HN HIS 57 -3.094 -7.071 -0.763 451 HA HIS 57 HA HIS 57 -4.737 -9.129 -2.085 452 HB2 HIS 57 HB2 HIS 57 -3.663 -9.039 0.756 453 HB3 HIS 57 HB1 HIS 57 -4.579 -10.365 0.048 454 HD1 HIS 57 HD1 HIS 57 -3.247 -12.175 -1.007 455 HD2 HIS 57 HD2 HIS 57 -1.045 -8.675 -0.531 456 HE1 HIS 57 HE1 HIS 57 -0.875 -12.774 -1.585 457 HE2 HIS 57 HE2 HIS 57 0.461 -10.706 -1.038 458 H LEU 58 HN LEU 58 -6.551 -7.713 -2.383 459 HA LEU 58 HA LEU 58 -7.866 -6.514 -0.165 460 HB2 LEU 58 HB2 LEU 58 -9.440 -7.509 -2.508 461 HB3 LEU 58 HB1 LEU 58 -9.624 -6.016 -1.608 462 HG LEU 58 HG LEU 58 -7.639 -6.641 -3.772 463 HD11 LEU 58 HD11 LEU 58 -8.808 -5.279 -5.061 464 HD12 LEU 58 HD12 LEU 58 -9.285 -4.213 -3.745 465 HD13 LEU 58 HD13 LEU 58 -10.122 -5.747 -3.991 466 HD21 LEU 58 HD21 LEU 58 -7.589 -4.357 -1.808 467 HD22 LEU 58 HD22 LEU 58 -6.842 -4.267 -3.401 468 HD23 LEU 58 HD23 LEU 58 -6.292 -5.470 -2.238 469 H HIS 59 HN HIS 59 -10.299 -7.438 0.302 470 HA HIS 59 HA HIS 59 -9.663 -10.072 1.382 471 HB2 HIS 59 HB2 HIS 59 -11.593 -7.956 2.105 472 HB3 HIS 59 HB1 HIS 59 -12.108 -9.617 2.397 473 HD1 HIS 59 HD1 HIS 59 -11.735 -10.052 4.818 474 HD2 HIS 59 HD2 HIS 59 -8.547 -8.010 3.087 475 HE1 HIS 59 HE1 HIS 59 -10.005 -9.820 6.632 476 HE2 HIS 59 HE2 HIS 59 -8.073 -8.604 5.565 477 H GLU 60 HN GLU 60 -11.235 -11.731 1.413 478 HA GLU 60 HA GLU 60 -11.395 -12.801 -1.096 479 HB2 GLU 60 HB2 GLU 60 -13.153 -13.594 1.214 480 HB3 GLU 60 HB1 GLU 60 -12.606 -14.625 -0.097 481 HG2 GLU 60 HG2 GLU 60 -11.279 -15.263 1.691 482 HG3 GLU 60 HG1 GLU 60 -10.236 -14.144 0.818 483 H SER 61 HN SER 61 -13.856 -10.931 0.542 484 HA SER 61 HA SER 61 -16.056 -11.597 -1.077 485 HB2 SER 61 HB2 SER 61 -16.198 -10.357 1.069 486 HB3 SER 61 HB1 SER 61 -15.456 -8.959 0.293 487 HG SER 61 HG SER 61 -17.697 -10.003 -0.971 488 H PHE 62 HN PHE 62 -13.232 -9.801 -1.734 489 HA PHE 62 HA PHE 62 -14.378 -8.387 -4.014 490 HB2 PHE 62 HB2 PHE 62 -11.592 -8.376 -2.820 491 HB3 PHE 62 HB1 PHE 62 -12.102 -7.395 -4.184 492 HD1 PHE 62 HD1 PHE 62 -13.150 -8.112 -0.678 493 HD2 PHE 62 HD2 PHE 62 -12.696 -5.234 -3.766 494 HE1 PHE 62 HE1 PHE 62 -13.905 -6.345 0.863 495 HE2 PHE 62 HE2 PHE 62 -13.454 -3.460 -2.242 496 HZ PHE 62 HZ PHE 62 -14.060 -4.015 0.079 497 HA PRO 63 HA PRO 63 -13.243 -11.836 -6.641 498 HB2 PRO 63 HB2 PRO 63 -13.711 -9.871 -8.796 499 HB3 PRO 63 HB1 PRO 63 -14.483 -11.433 -8.512 500 HG2 PRO 63 HG2 PRO 63 -15.791 -9.140 -8.080 501 HG3 PRO 63 HG1 PRO 63 -16.030 -10.552 -7.036 502 HD2 PRO 63 HD2 PRO 63 -14.404 -8.086 -6.548 503 HD3 PRO 63 HD1 PRO 63 -15.446 -8.990 -5.428 504 H ARG 64 HN ARG 64 -11.304 -12.454 -7.330 505 HA ARG 64 HA ARG 64 -9.043 -12.383 -7.657 506 HB2 ARG 64 HB2 ARG 64 -9.844 -10.114 -9.495 507 HB3 ARG 64 HB1 ARG 64 -8.277 -10.917 -9.499 508 HG2 ARG 64 HG2 ARG 64 -9.311 -13.000 -10.169 509 HG3 ARG 64 HG1 ARG 64 -10.911 -12.264 -10.070 510 HD2 ARG 64 HD2 ARG 64 -10.488 -10.853 -11.917 511 HD3 ARG 64 HD1 ARG 64 -8.757 -11.205 -11.883 512 HE ARG 64 HE ARG 64 -10.527 -13.460 -12.373 513 HH11 ARG 64 HH11 ARG 64 -8.505 -10.951 -13.773 514 HH12 ARG 64 HH12 ARG 64 -8.285 -11.802 -15.276 515 HH21 ARG 64 HH21 ARG 64 -10.222 -14.577 -14.332 516 HH22 ARG 64 HH22 ARG 64 -9.258 -13.861 -15.592 517 HA PRO 65 HA PRO 65 -9.084 -8.690 -4.815 518 HB2 PRO 65 HB2 PRO 65 -8.014 -9.861 -2.604 519 HB3 PRO 65 HB1 PRO 65 -9.736 -9.887 -2.993 520 HG2 PRO 65 HG2 PRO 65 -7.675 -12.006 -3.359 521 HG3 PRO 65 HG1 PRO 65 -9.379 -12.154 -2.885 522 HD2 PRO 65 HD2 PRO 65 -8.441 -12.670 -5.408 523 HD3 PRO 65 HD1 PRO 65 -10.100 -12.165 -5.051 524 H LYS 66 HN LYS 66 -6.494 -10.836 -5.598 525 HA LYS 66 HA LYS 66 -4.439 -9.113 -4.624 526 HB2 LYS 66 HB2 LYS 66 -4.023 -11.503 -4.707 527 HB3 LYS 66 HB1 LYS 66 -4.295 -11.516 -6.443 528 HG2 LYS 66 HG2 LYS 66 -2.323 -10.161 -6.810 529 HG3 LYS 66 HG1 LYS 66 -2.080 -10.008 -5.069 530 HD2 LYS 66 HD2 LYS 66 -1.366 -12.166 -4.833 531 HD3 LYS 66 HD1 LYS 66 -2.233 -12.735 -6.261 532 HE2 LYS 66 HE2 LYS 66 -0.626 -11.571 -7.688 533 HE3 LYS 66 HE1 LYS 66 0.226 -10.987 -6.259 534 HZ1 LYS 66 HZ1 LYS 66 1.212 -12.987 -7.356 535 HZ2 LYS 66 HZ2 LYS 66 -0.149 -13.870 -6.855 536 HZ3 LYS 66 HZ3 LYS 66 0.882 -13.173 -5.702 537 H ARG 67 HN ARG 67 -4.362 -7.195 -5.541 538 HA ARG 67 HA ARG 67 -4.416 -7.027 -8.476 539 HB2 ARG 67 HB2 ARG 67 -4.582 -4.682 -6.577 540 HB3 ARG 67 HB1 ARG 67 -5.062 -4.756 -8.268 541 HG2 ARG 67 HG2 ARG 67 -6.440 -6.094 -5.956 542 HG3 ARG 67 HG1 ARG 67 -7.016 -4.696 -6.867 543 HD2 ARG 67 HD2 ARG 67 -7.059 -6.116 -8.909 544 HD3 ARG 67 HD1 ARG 67 -6.622 -7.504 -7.902 545 HE ARG 67 HE ARG 67 -8.781 -7.663 -7.243 546 HH11 ARG 67 HH11 ARG 67 -8.337 -4.423 -8.523 547 HH12 ARG 67 HH12 ARG 67 -10.040 -4.050 -8.484 548 HH21 ARG 67 HH21 ARG 67 -11.005 -7.188 -7.259 549 HH22 ARG 67 HH22 ARG 67 -11.550 -5.628 -7.798 550 H VAL 68 HN VAL 68 -2.481 -6.915 -9.402 551 HA VAL 68 HA VAL 68 -0.214 -6.108 -7.742 552 HB VAL 68 HB VAL 68 1.181 -7.397 -9.034 553 HG11 VAL 68 HG11 VAL 68 -0.413 -8.895 -7.982 554 HG12 VAL 68 HG12 VAL 68 0.082 -9.535 -9.553 555 HG13 VAL 68 HG13 VAL 68 -1.489 -8.754 -9.376 556 HG21 VAL 68 HG21 VAL 68 0.781 -6.312 -11.144 557 HG22 VAL 68 HG22 VAL 68 -0.756 -7.162 -11.330 558 HG23 VAL 68 HG23 VAL 68 0.761 -8.064 -11.361 559 H CYS 69 HN CYS 69 1.154 -4.455 -8.280 560 HA CYS 69 HA CYS 69 0.559 -2.941 -10.729 561 HB2 CYS 69 HB2 CYS 69 1.071 -1.790 -7.969 562 HB3 CYS 69 HB1 CYS 69 0.974 -0.843 -9.451 563 HG CYS 69 HG CYS 69 -1.735 -2.531 -9.470 564 H LYS 70 HN LYS 70 2.337 -2.961 -11.962 565 HA LYS 70 HA LYS 70 4.950 -3.355 -10.646 566 HB2 LYS 70 HB2 LYS 70 4.282 -3.849 -13.554 567 HB3 LYS 70 HB1 LYS 70 5.703 -4.394 -12.677 568 HG2 LYS 70 HG2 LYS 70 4.445 -6.021 -11.473 569 HG3 LYS 70 HG1 LYS 70 2.922 -5.321 -12.020 570 HD2 LYS 70 HD2 LYS 70 3.442 -5.970 -14.314 571 HD3 LYS 70 HD1 LYS 70 4.980 -6.650 -13.774 572 HE2 LYS 70 HE2 LYS 70 3.833 -8.292 -12.431 573 HE3 LYS 70 HE1 LYS 70 2.273 -7.561 -12.805 574 HZ1 LYS 70 HZ1 LYS 70 2.576 -8.153 -15.117 575 HZ2 LYS 70 HZ2 LYS 70 2.686 -9.536 -14.141 576 HZ3 LYS 70 HZ3 LYS 70 4.094 -8.831 -14.780 577 H ASP 71 HN ASP 71 3.233 -0.910 -11.519 578 HA ASP 71 HA ASP 71 5.356 0.505 -12.974 579 HB2 ASP 71 HB2 ASP 71 2.351 0.702 -13.213 580 HB3 ASP 71 HB1 ASP 71 3.423 1.934 -13.869 581 HA PRO 72 HA PRO 72 5.480 4.144 -10.193 582 HB2 PRO 72 HB2 PRO 72 3.821 5.254 -12.448 583 HB3 PRO 72 HB1 PRO 72 5.053 6.072 -11.475 584 HG2 PRO 72 HG2 PRO 72 5.688 5.081 -13.848 585 HG3 PRO 72 HG1 PRO 72 6.804 4.911 -12.478 586 HD2 PRO 72 HD2 PRO 72 5.181 2.865 -13.838 587 HD3 PRO 72 HD1 PRO 72 6.639 2.674 -12.850 588 HA PRO 73 HA PRO 73 2.743 5.211 -7.225 589 HB2 PRO 73 HB2 PRO 73 0.622 6.333 -9.013 590 HB3 PRO 73 HB1 PRO 73 1.087 6.837 -7.382 591 HG2 PRO 73 HG2 PRO 73 2.037 8.015 -9.687 592 HG3 PRO 73 HG1 PRO 73 2.886 8.040 -8.135 593 HD2 PRO 73 HD2 PRO 73 3.717 6.772 -10.542 594 HD3 PRO 73 HD1 PRO 73 4.508 6.694 -8.957 595 H TYR 74 HN TYR 74 2.187 3.344 -6.486 596 HA TYR 74 HA TYR 74 0.572 1.472 -7.975 597 HB2 TYR 74 HB2 TYR 74 1.720 1.146 -5.199 598 HB3 TYR 74 HB1 TYR 74 1.273 -0.130 -6.325 599 HD1 TYR 74 HD2 TYR 74 3.680 2.679 -5.870 600 HD2 TYR 74 HD1 TYR 74 2.903 -1.051 -7.738 601 HE1 TYR 74 HE2 TYR 74 5.989 2.606 -6.676 602 HE2 TYR 74 HE1 TYR 74 5.222 -1.124 -8.566 603 HH TYR 74 HH TYR 74 7.055 0.244 -8.975 604 H LYS 75 HN LYS 75 -1.526 1.023 -7.580 605 HA LYS 75 HA LYS 75 -2.835 1.883 -5.150 606 HB2 LYS 75 HB2 LYS 75 -4.429 3.363 -6.493 607 HB3 LYS 75 HB1 LYS 75 -2.836 4.016 -6.148 608 HG2 LYS 75 HG2 LYS 75 -2.117 3.773 -8.338 609 HG3 LYS 75 HG1 LYS 75 -3.370 2.601 -8.728 610 HD2 LYS 75 HD2 LYS 75 -4.028 4.606 -9.773 611 HD3 LYS 75 HD1 LYS 75 -5.036 4.500 -8.336 612 HE2 LYS 75 HE2 LYS 75 -4.231 6.740 -8.549 613 HE3 LYS 75 HE1 LYS 75 -3.424 5.972 -7.191 614 HZ1 LYS 75 HZ1 LYS 75 -1.852 7.224 -8.502 615 HZ2 LYS 75 HZ2 LYS 75 -2.281 6.365 -9.898 616 HZ3 LYS 75 HZ3 LYS 75 -1.502 5.570 -8.622 617 H VAL 76 HN VAL 76 -4.891 1.156 -4.932 618 HA VAL 76 HA VAL 76 -6.022 -0.429 -7.143 619 HB VAL 76 HB VAL 76 -5.962 -1.146 -4.228 620 HG11 VAL 76 HG11 VAL 76 -8.302 -1.163 -5.139 621 HG12 VAL 76 HG12 VAL 76 -7.720 -2.711 -4.525 622 HG13 VAL 76 HG13 VAL 76 -7.779 -2.415 -6.264 623 HG21 VAL 76 HG21 VAL 76 -4.204 -2.111 -5.540 624 HG22 VAL 76 HG22 VAL 76 -5.340 -2.609 -6.786 625 HG23 VAL 76 HG23 VAL 76 -5.383 -3.371 -5.197 626 H GLU 77 HN GLU 77 -7.960 0.205 -7.778 627 HA GLU 77 HA GLU 77 -9.499 1.988 -6.010 628 HB2 GLU 77 HB2 GLU 77 -9.489 1.908 -9.026 629 HB3 GLU 77 HB1 GLU 77 -10.424 2.994 -8.028 630 HG2 GLU 77 HG2 GLU 77 -8.631 4.245 -7.417 631 HG3 GLU 77 HG1 GLU 77 -7.513 2.931 -7.721 632 H GLU 78 HN GLU 78 -11.159 1.023 -5.204 633 HA GLU 78 HA GLU 78 -12.591 -0.947 -6.843 634 HB2 GLU 78 HB2 GLU 78 -11.240 -1.411 -4.241 635 HB3 GLU 78 HB1 GLU 78 -12.835 -2.135 -4.429 636 HG2 GLU 78 HG2 GLU 78 -10.328 -2.659 -5.981 637 HG3 GLU 78 HG1 GLU 78 -11.356 -3.780 -5.091 638 H SER 79 HN SER 79 -14.542 -1.742 -5.440 639 HA SER 79 HA SER 79 -15.787 0.433 -3.982 640 HB2 SER 79 HB2 SER 79 -16.276 0.869 -6.394 641 HB3 SER 79 HB1 SER 79 -17.064 -0.710 -6.486 642 HG SER 79 HG SER 79 -17.903 1.663 -5.266 643 H GLY 80 HN GLY 80 -17.438 -0.266 -2.658 644 HA2 GLY 80 HA2 GLY 80 -18.388 -2.945 -2.553 645 HA3 GLY 80 HA1 GLY 80 -17.046 -2.705 -1.434 646 H TYR 81 HN TYR 81 -18.444 -2.955 0.422 647 HA TYR 81 HA TYR 81 -19.900 -0.478 0.953 648 HB2 TYR 81 HB2 TYR 81 -21.852 -1.797 1.888 649 HB3 TYR 81 HB1 TYR 81 -21.687 -1.803 0.136 650 HD1 TYR 81 HD2 TYR 81 -21.207 -3.847 3.180 651 HD2 TYR 81 HD1 TYR 81 -21.305 -3.816 -1.071 652 HE1 TYR 81 HE2 TYR 81 -21.194 -6.306 3.164 653 HE2 TYR 81 HE1 TYR 81 -21.299 -6.274 -1.089 654 HH TYR 81 HH TYR 81 -21.722 -8.152 1.781 655 H ALA 82 HN ALA 82 -17.451 -2.072 1.990 656 HA ALA 82 HA ALA 82 -17.928 -1.396 4.745 657 HB1 ALA 82 HB1 ALA 82 -18.834 -3.556 4.920 658 HB2 ALA 82 HB2 ALA 82 -17.188 -3.703 5.529 659 HB3 ALA 82 HB3 ALA 82 -17.581 -4.256 3.900 660 H GLY 83 HN GLY 83 -16.010 -1.627 6.098 661 HA2 GLY 83 HA2 GLY 83 -13.558 -1.250 4.520 662 HA3 GLY 83 HA1 GLY 83 -13.839 -0.636 6.143 663 H PHE 84 HN PHE 84 -11.513 -1.908 5.724 664 HA PHE 84 HA PHE 84 -11.491 -4.090 7.493 665 HB2 PHE 84 HB2 PHE 84 -10.999 -5.944 5.932 666 HB3 PHE 84 HB1 PHE 84 -12.627 -5.317 5.706 667 HD1 PHE 84 HD1 PHE 84 -13.006 -3.682 3.779 668 HD2 PHE 84 HD2 PHE 84 -9.525 -6.096 4.134 669 HE1 PHE 84 HE1 PHE 84 -12.556 -3.374 1.386 670 HE2 PHE 84 HE2 PHE 84 -9.052 -5.792 1.749 671 HZ PHE 84 HZ PHE 84 -10.565 -4.434 0.360 672 H ILE 85 HN ILE 85 -9.370 -4.873 7.904 673 HA ILE 85 HA ILE 85 -7.147 -3.337 7.097 674 HB ILE 85 HB ILE 85 -7.343 -6.113 8.266 675 HG12 ILE 85 HG12 ILE 85 -7.884 -4.199 9.737 676 HG13 ILE 85 HG11 ILE 85 -6.445 -5.067 10.262 677 HG21 ILE 85 HG21 ILE 85 -4.808 -4.582 7.683 678 HG22 ILE 85 HG22 ILE 85 -5.343 -6.052 6.868 679 HG23 ILE 85 HG23 ILE 85 -4.919 -6.097 8.579 680 HD11 ILE 85 HD11 ILE 85 -6.373 -2.536 8.651 681 HD12 ILE 85 HD12 ILE 85 -5.018 -3.360 9.421 682 HD13 ILE 85 HD13 ILE 85 -6.266 -2.600 10.410 683 H LEU 86 HN LEU 86 -6.016 -3.333 5.289 684 HA LEU 86 HA LEU 86 -6.323 -5.595 3.426 685 HB2 LEU 86 HB2 LEU 86 -7.244 -3.205 2.852 686 HB3 LEU 86 HB1 LEU 86 -5.550 -2.836 2.564 687 HG LEU 86 HG LEU 86 -6.662 -5.241 1.219 688 HD11 LEU 86 HD11 LEU 86 -7.088 -2.465 0.143 689 HD12 LEU 86 HD12 LEU 86 -8.354 -3.412 0.936 690 HD13 LEU 86 HD13 LEU 86 -7.622 -3.998 -0.557 691 HD21 LEU 86 HD21 LEU 86 -5.224 -3.394 -0.362 692 HD22 LEU 86 HD22 LEU 86 -4.803 -5.058 0.043 693 HD23 LEU 86 HD23 LEU 86 -4.319 -3.733 1.111 694 HA PRO 87 HA PRO 87 -1.952 -5.892 4.368 695 HB2 PRO 87 HB2 PRO 87 -2.064 -8.355 2.811 696 HB3 PRO 87 HB1 PRO 87 -1.736 -8.142 4.532 697 HG2 PRO 87 HG2 PRO 87 -4.014 -9.282 3.594 698 HG3 PRO 87 HG1 PRO 87 -3.939 -8.378 5.117 699 HD2 PRO 87 HD2 PRO 87 -4.945 -7.502 2.438 700 HD3 PRO 87 HD1 PRO 87 -5.611 -7.178 4.054 701 H ILE 88 HN ILE 88 -1.138 -4.285 3.043 702 HA ILE 88 HA ILE 88 -0.989 -4.741 0.171 703 HB ILE 88 HB ILE 88 0.033 -2.347 1.715 704 HG12 ILE 88 HG12 ILE 88 -2.572 -2.386 0.220 705 HG13 ILE 88 HG11 ILE 88 -2.516 -3.007 1.869 706 HG21 ILE 88 HG21 ILE 88 0.923 -2.667 -0.569 707 HG22 ILE 88 HG22 ILE 88 -0.077 -1.218 -0.423 708 HG23 ILE 88 HG23 ILE 88 -0.733 -2.666 -1.185 709 HD11 ILE 88 HD11 ILE 88 -1.781 -0.223 0.995 710 HD12 ILE 88 HD12 ILE 88 -1.681 -0.841 2.638 711 HD13 ILE 88 HD13 ILE 88 -3.246 -0.709 1.839 712 H GLU 89 HN GLU 89 0.981 -4.897 -0.936 713 HA GLU 89 HA GLU 89 3.357 -5.284 0.753 714 HB2 GLU 89 HB2 GLU 89 2.444 -7.103 -1.474 715 HB3 GLU 89 HB1 GLU 89 4.034 -7.169 -0.725 716 HG2 GLU 89 HG2 GLU 89 2.929 -7.621 1.443 717 HG3 GLU 89 HG1 GLU 89 1.386 -7.702 0.594 718 H VAL 90 HN VAL 90 5.124 -4.314 0.053 719 HA VAL 90 HA VAL 90 5.188 -3.409 -2.744 720 HB VAL 90 HB VAL 90 6.823 -2.215 -0.522 721 HG11 VAL 90 HG11 VAL 90 7.322 -0.547 -2.143 722 HG12 VAL 90 HG12 VAL 90 6.192 -1.238 -3.288 723 HG13 VAL 90 HG13 VAL 90 7.659 -2.113 -2.854 724 HG21 VAL 90 HG21 VAL 90 4.255 -1.947 -0.400 725 HG22 VAL 90 HG22 VAL 90 4.452 -0.909 -1.810 726 HG23 VAL 90 HG23 VAL 90 5.259 -0.502 -0.293 727 H TYR 91 HN TYR 91 6.609 -4.361 -4.013 728 HA TYR 91 HA TYR 91 8.550 -6.193 -2.831 729 HB2 TYR 91 HB2 TYR 91 7.581 -5.689 -5.608 730 HB3 TYR 91 HB1 TYR 91 9.103 -6.537 -5.365 731 HD1 TYR 91 HD1 TYR 91 5.839 -6.706 -3.562 732 HD2 TYR 91 HD2 TYR 91 8.777 -8.779 -5.827 733 HE1 TYR 91 HE1 TYR 91 4.627 -8.806 -3.208 734 HE2 TYR 91 HE2 TYR 91 7.553 -10.890 -5.499 735 HH TYR 91 HH TYR 91 5.950 -11.839 -3.851 736 H PHE 92 HN PHE 92 10.659 -5.967 -2.784 737 HA PHE 92 HA PHE 92 11.717 -3.303 -3.439 738 HB2 PHE 92 HB2 PHE 92 12.561 -5.476 -1.502 739 HB3 PHE 92 HB1 PHE 92 13.551 -4.045 -1.820 740 HD1 PHE 92 HD1 PHE 92 11.235 -2.097 -2.078 741 HD2 PHE 92 HD2 PHE 92 12.106 -5.104 0.801 742 HE1 PHE 92 HE1 PHE 92 10.058 -0.789 -0.370 743 HE2 PHE 92 HE2 PHE 92 10.896 -3.797 2.518 744 HZ PHE 92 HZ PHE 92 9.891 -1.636 1.926 745 H LYS 93 HN LYS 93 14.041 -3.254 -4.213 746 HA LYS 93 HA LYS 93 14.640 -5.580 -5.937 747 HB2 LYS 93 HB2 LYS 93 15.826 -2.792 -6.080 748 HB3 LYS 93 HB1 LYS 93 16.069 -4.092 -7.236 749 HG2 LYS 93 HG2 LYS 93 13.823 -3.919 -8.011 750 HG3 LYS 93 HG1 LYS 93 13.406 -2.800 -6.707 751 HD2 LYS 93 HD2 LYS 93 14.903 -1.126 -7.610 752 HD3 LYS 93 HD1 LYS 93 15.497 -2.253 -8.827 753 HE2 LYS 93 HE2 LYS 93 13.032 -2.336 -9.614 754 HE3 LYS 93 HE1 LYS 93 12.833 -0.862 -8.665 755 HZ1 LYS 93 HZ1 LYS 93 14.662 0.131 -9.952 756 HZ2 LYS 93 HZ2 LYS 93 13.328 -0.275 -10.908 757 HZ3 LYS 93 HZ3 LYS 93 14.709 -1.252 -10.933 758 H ASN 94 HN ASN 94 15.691 -6.849 -4.334 759 HA ASN 94 HA ASN 94 18.382 -6.053 -3.747 760 HB2 ASN 94 HB2 ASN 94 18.128 -6.332 -1.264 761 HB3 ASN 94 HB1 ASN 94 17.408 -4.874 -1.935 762 HD21 ASN 94 HD21 ASN 94 16.754 -5.885 0.544 763 HD22 ASN 94 HD22 ASN 94 15.113 -6.422 0.529 764 H LYS 95 HN LYS 95 19.567 -7.657 -2.491 765 HA LYS 95 HA LYS 95 18.672 -10.394 -3.150 766 HB2 LYS 95 HB2 LYS 95 20.558 -9.823 -4.450 767 HB3 LYS 95 HB1 LYS 95 21.357 -9.059 -3.088 768 HG2 LYS 95 HG2 LYS 95 21.729 -11.200 -2.053 769 HG3 LYS 95 HG1 LYS 95 20.817 -11.995 -3.339 770 HD2 LYS 95 HD2 LYS 95 23.340 -12.091 -3.540 771 HD3 LYS 95 HD1 LYS 95 22.473 -11.492 -4.954 772 HE2 LYS 95 HE2 LYS 95 24.480 -10.161 -4.448 773 HE3 LYS 95 HE1 LYS 95 23.004 -9.208 -4.358 774 HZ1 LYS 95 HZ1 LYS 95 24.264 -10.400 -1.953 775 HZ2 LYS 95 HZ2 LYS 95 23.104 -9.160 -2.023 776 HZ3 LYS 95 HZ3 LYS 95 24.691 -8.865 -2.537 777 H GLU 96 HN GLU 96 19.326 -8.239 -0.706 778 HA GLU 96 HA GLU 96 20.231 -10.236 1.223 779 HB2 GLU 96 HB2 GLU 96 20.513 -7.846 2.534 780 HB3 GLU 96 HB1 GLU 96 21.794 -8.582 1.587 781 HG2 GLU 96 HG2 GLU 96 19.840 -6.565 0.520 782 HG3 GLU 96 HG1 GLU 96 21.438 -6.170 1.151 783 H GLU 97 HN GLU 97 19.438 -8.417 3.438 784 HA GLU 97 HA GLU 97 17.285 -9.541 4.541 785 HB2 GLU 97 HB2 GLU 97 17.872 -6.576 4.596 786 HB3 GLU 97 HB1 GLU 97 16.833 -7.422 5.738 787 HG2 GLU 97 HG2 GLU 97 19.800 -7.743 5.361 788 HG3 GLU 97 HG1 GLU 97 18.954 -7.093 6.763 789 HA PRO 98 HA PRO 98 13.245 -9.431 3.388 790 HB2 PRO 98 HB2 PRO 98 12.625 -6.618 4.133 791 HB3 PRO 98 HB1 PRO 98 11.734 -8.104 4.477 792 HG2 PRO 98 HG2 PRO 98 13.518 -6.777 6.172 793 HG3 PRO 98 HG1 PRO 98 12.847 -8.391 6.421 794 HD2 PRO 98 HD2 PRO 98 15.560 -7.768 5.982 795 HD3 PRO 98 HD1 PRO 98 14.819 -9.381 5.872 796 H ARG 99 HN ARG 99 12.796 -9.526 1.369 797 HA ARG 99 HA ARG 99 13.636 -7.386 -0.422 798 HB2 ARG 99 HB2 ARG 99 12.786 -10.218 -0.963 799 HB3 ARG 99 HB1 ARG 99 13.338 -9.082 -2.193 800 HG2 ARG 99 HG2 ARG 99 15.499 -8.927 -1.238 801 HG3 ARG 99 HG1 ARG 99 14.995 -9.798 0.199 802 HD2 ARG 99 HD2 ARG 99 16.365 -11.214 -1.251 803 HD3 ARG 99 HD1 ARG 99 14.739 -11.859 -1.187 804 HE ARG 99 HE ARG 99 15.667 -10.168 -3.421 805 HH11 ARG 99 HH11 ARG 99 14.083 -13.050 -2.200 806 HH12 ARG 99 HH12 ARG 99 13.714 -13.668 -3.785 807 HH21 ARG 99 HH21 ARG 99 15.194 -10.981 -5.502 808 HH22 ARG 99 HH22 ARG 99 14.358 -12.498 -5.665 809 H LYS 100 HN LYS 100 11.085 -8.028 1.326 810 HA LYS 100 HA LYS 100 9.243 -6.647 -0.405 811 HB2 LYS 100 HB2 LYS 100 7.457 -8.420 -0.047 812 HB3 LYS 100 HB1 LYS 100 8.715 -8.809 -1.209 813 HG2 LYS 100 HG2 LYS 100 9.880 -10.102 0.570 814 HG3 LYS 100 HG1 LYS 100 8.483 -9.821 1.613 815 HD2 LYS 100 HD2 LYS 100 8.263 -11.133 -1.088 816 HD3 LYS 100 HD1 LYS 100 8.558 -12.046 0.390 817 HE2 LYS 100 HE2 LYS 100 6.303 -12.199 0.387 818 HE3 LYS 100 HE1 LYS 100 6.411 -10.620 1.161 819 HZ1 LYS 100 HZ1 LYS 100 6.220 -9.655 -1.122 820 HZ2 LYS 100 HZ2 LYS 100 4.836 -10.444 -0.557 821 HZ3 LYS 100 HZ3 LYS 100 5.846 -11.208 -1.689 822 H VAL 101 HN VAL 101 7.726 -5.554 0.753 823 HA VAL 101 HA VAL 101 7.830 -5.939 3.666 824 HB VAL 101 HB VAL 101 9.021 -3.894 2.923 825 HG11 VAL 101 HG11 VAL 101 7.933 -3.138 1.009 826 HG12 VAL 101 HG12 VAL 101 7.480 -1.957 2.248 827 HG13 VAL 101 HG13 VAL 101 6.340 -3.217 1.777 828 HG21 VAL 101 HG21 VAL 101 8.018 -2.400 4.540 829 HG22 VAL 101 HG22 VAL 101 8.015 -4.058 5.147 830 HG23 VAL 101 HG23 VAL 101 6.528 -3.347 4.519 831 H ARG 102 HN ARG 102 5.924 -5.875 4.772 832 HA ARG 102 HA ARG 102 3.500 -5.795 3.115 833 HB2 ARG 102 HB2 ARG 102 4.127 -8.024 4.002 834 HB3 ARG 102 HB1 ARG 102 4.022 -7.378 5.631 835 HG2 ARG 102 HG2 ARG 102 1.681 -7.032 5.453 836 HG3 ARG 102 HG1 ARG 102 1.690 -7.387 3.724 837 HD2 ARG 102 HD2 ARG 102 0.851 -9.278 5.045 838 HD3 ARG 102 HD1 ARG 102 2.337 -9.688 4.189 839 HE ARG 102 HE ARG 102 2.935 -8.776 6.803 840 HH11 ARG 102 HH11 ARG 102 1.607 -11.529 5.099 841 HH12 ARG 102 HH12 ARG 102 2.059 -12.678 6.323 842 HH21 ARG 102 HH21 ARG 102 3.598 -10.287 8.394 843 HH22 ARG 102 HH22 ARG 102 3.211 -11.976 8.187 844 H PHE 103 HN PHE 103 2.267 -4.110 3.515 845 HA PHE 103 HA PHE 103 2.325 -2.922 6.208 846 HB2 PHE 103 HB2 PHE 103 1.540 -1.677 3.568 847 HB3 PHE 103 HB1 PHE 103 1.513 -0.857 5.118 848 HD1 PHE 103 HD1 PHE 103 4.058 -1.698 6.311 849 HD2 PHE 103 HD2 PHE 103 3.130 -0.605 2.302 850 HE1 PHE 103 HE1 PHE 103 6.380 -0.951 5.978 851 HE2 PHE 103 HE2 PHE 103 5.451 0.127 1.964 852 HZ PHE 103 HZ PHE 103 7.076 -0.040 3.802 853 H ASP 104 HN ASP 104 0.666 -3.601 7.381 854 HA ASP 104 HA ASP 104 -1.806 -4.478 6.170 855 HB2 ASP 104 HB2 ASP 104 -1.181 -4.119 9.111 856 HB3 ASP 104 HB1 ASP 104 -2.501 -5.053 8.422 857 H TYR 105 HN TYR 105 -2.675 -2.628 5.212 858 HA TYR 105 HA TYR 105 -2.972 -0.265 6.910 859 HB2 TYR 105 HB2 TYR 105 -2.003 0.033 4.659 860 HB3 TYR 105 HB1 TYR 105 -3.492 -0.598 3.946 861 HD1 TYR 105 HD1 TYR 105 -2.167 2.133 6.081 862 HD2 TYR 105 HD2 TYR 105 -5.311 0.825 3.517 863 HE1 TYR 105 HE1 TYR 105 -3.148 4.389 6.133 864 HE2 TYR 105 HE2 TYR 105 -6.240 3.063 3.522 865 HH TYR 105 HH TYR 105 -6.119 5.074 5.418 866 H ASP 106 HN ASP 106 -4.896 0.526 7.564 867 HA ASP 106 HA ASP 106 -7.166 -1.286 7.315 868 HB2 ASP 106 HB2 ASP 106 -6.391 -0.356 9.525 869 HB3 ASP 106 HB1 ASP 106 -6.909 1.234 8.972 870 H LEU 107 HN LEU 107 -8.569 -0.944 5.651 871 HA LEU 107 HA LEU 107 -8.884 1.727 4.571 872 HB2 LEU 107 HB2 LEU 107 -10.559 -0.676 3.859 873 HB3 LEU 107 HB1 LEU 107 -10.348 0.794 2.934 874 HG LEU 107 HG LEU 107 -8.187 -1.201 3.379 875 HD11 LEU 107 HD11 LEU 107 -8.615 -1.526 0.869 876 HD12 LEU 107 HD12 LEU 107 -10.184 -0.779 1.203 877 HD13 LEU 107 HD13 LEU 107 -9.735 -2.279 2.013 878 HD21 LEU 107 HD21 LEU 107 -7.127 -0.002 1.529 879 HD22 LEU 107 HD22 LEU 107 -7.266 0.951 3.012 880 HD23 LEU 107 HD23 LEU 107 -8.376 1.238 1.669 881 H PHE 108 HN PHE 108 -9.773 2.848 6.382 882 HA PHE 108 HA PHE 108 -12.406 1.961 7.245 883 HB2 PHE 108 HB2 PHE 108 -12.483 3.979 8.657 884 HB3 PHE 108 HB1 PHE 108 -11.039 3.031 8.967 885 HD1 PHE 108 HD2 PHE 108 -12.351 6.111 7.431 886 HD2 PHE 108 HD1 PHE 108 -8.858 3.969 8.603 887 HE1 PHE 108 HE2 PHE 108 -11.000 8.141 7.110 888 HE2 PHE 108 HE1 PHE 108 -7.510 5.999 8.285 889 HZ PHE 108 HZ PHE 108 -8.579 8.088 7.539 890 H LEU 109 HN LEU 109 -14.294 2.609 6.441 891 HA LEU 109 HA LEU 109 -14.276 4.831 4.491 892 HB2 LEU 109 HB2 LEU 109 -16.425 2.721 4.702 893 HB3 LEU 109 HB1 LEU 109 -16.106 3.816 3.373 894 HG LEU 109 HG LEU 109 -14.464 1.406 4.143 895 HD11 LEU 109 HD11 LEU 109 -16.607 0.959 2.990 896 HD12 LEU 109 HD12 LEU 109 -15.191 0.486 2.053 897 HD13 LEU 109 HD13 LEU 109 -16.055 1.970 1.654 898 HD21 LEU 109 HD21 LEU 109 -14.015 3.442 1.976 899 HD22 LEU 109 HD22 LEU 109 -13.168 1.898 2.105 900 HD23 LEU 109 HD23 LEU 109 -12.970 3.119 3.361 901 H HIS 110 HN HIS 110 -15.746 6.535 4.940 902 HA HIS 110 HA HIS 110 -16.999 6.378 7.557 903 HB2 HIS 110 HB2 HIS 110 -16.477 8.664 5.686 904 HB3 HIS 110 HB1 HIS 110 -17.631 8.833 7.006 905 HD1 HIS 110 HD1 HIS 110 -16.460 7.977 9.446 906 HD2 HIS 110 HD2 HIS 110 -14.000 9.443 6.431 907 HE1 HIS 110 HE1 HIS 110 -14.314 8.639 10.580 908 HE2 HIS 110 HE2 HIS 110 -12.904 9.672 8.762 909 H LEU 111 HN LEU 111 -19.261 7.613 7.620 910 HA LEU 111 HA LEU 111 -20.930 5.548 6.716 911 HB2 LEU 111 HB2 LEU 111 -21.104 7.664 8.530 912 HB3 LEU 111 HB1 LEU 111 -22.418 7.921 7.397 913 HG LEU 111 HG LEU 111 -23.146 6.625 9.345 914 HD11 LEU 111 HD11 LEU 111 -23.984 4.585 8.081 915 HD12 LEU 111 HD12 LEU 111 -23.121 5.235 6.686 916 HD13 LEU 111 HD13 LEU 111 -24.418 6.167 7.434 917 HD21 LEU 111 HD21 LEU 111 -21.104 4.618 8.412 918 HD22 LEU 111 HD22 LEU 111 -22.320 4.332 9.658 919 HD23 LEU 111 HD23 LEU 111 -21.064 5.543 9.915 920 H GLU 112 HN GLU 112 -22.468 5.377 5.244 921 HA GLU 112 HA GLU 112 -22.339 6.594 2.752 922 HB2 GLU 112 HB2 GLU 112 -23.521 4.432 3.540 923 HB3 GLU 112 HB1 GLU 112 -24.869 5.471 3.959 924 HG2 GLU 112 HG2 GLU 112 -23.704 5.230 1.190 925 HG3 GLU 112 HG1 GLU 112 -25.094 4.323 1.778 926 H GLY 113 HN GLY 113 -22.815 8.603 2.170 927 HA2 GLY 113 HA2 GLY 113 -24.663 10.257 2.023 928 HA3 GLY 113 HA1 GLY 113 -24.779 10.111 3.771 929 H HIS 114 HN HIS 114 -22.207 10.256 4.630 930 HA HIS 114 HA HIS 114 -20.976 12.559 3.313 931 HB2 HIS 114 HB2 HIS 114 -22.556 13.511 4.981 932 HB3 HIS 114 HB1 HIS 114 -21.718 12.629 6.251 933 HD1 HIS 114 HD1 HIS 114 -19.850 13.831 7.369 934 HD2 HIS 114 HD2 HIS 114 -20.808 15.493 3.674 935 HE1 HIS 114 HE1 HIS 114 -18.428 15.895 7.160 936 HE2 HIS 114 HE2 HIS 114 -19.162 16.982 5.008 937 HA PRO 115 HA PRO 115 -17.654 10.054 5.138 938 HB2 PRO 115 HB2 PRO 115 -16.929 8.565 3.017 939 HB3 PRO 115 HB1 PRO 115 -18.299 8.119 4.041 940 HG2 PRO 115 HG2 PRO 115 -18.296 9.100 1.285 941 HG3 PRO 115 HG1 PRO 115 -19.602 8.327 2.194 942 HD2 PRO 115 HD2 PRO 115 -19.107 11.180 1.726 943 HD3 PRO 115 HD1 PRO 115 -20.573 10.381 2.338 944 HA PRO 116 HA PRO 116 -14.629 12.582 2.903 945 HB2 PRO 116 HB2 PRO 116 -13.625 13.834 5.103 946 HB3 PRO 116 HB1 PRO 116 -15.025 14.428 4.212 947 HG2 PRO 116 HG2 PRO 116 -14.914 13.289 6.883 948 HG3 PRO 116 HG1 PRO 116 -16.268 14.093 6.075 949 HD2 PRO 116 HD2 PRO 116 -15.733 11.228 6.398 950 HD3 PRO 116 HD1 PRO 116 -17.238 12.044 5.926 951 H VAL 117 HN VAL 117 -13.361 10.701 2.425 952 HA VAL 117 HA VAL 117 -11.484 10.004 4.595 953 HB VAL 117 HB VAL 117 -12.608 8.181 2.476 954 HG11 VAL 117 HG11 VAL 117 -10.552 7.638 4.603 955 HG12 VAL 117 HG12 VAL 117 -10.279 7.669 2.866 956 HG13 VAL 117 HG13 VAL 117 -11.302 6.421 3.577 957 HG21 VAL 117 HG21 VAL 117 -13.531 6.949 4.387 958 HG22 VAL 117 HG22 VAL 117 -14.165 8.590 4.290 959 HG23 VAL 117 HG23 VAL 117 -12.920 8.193 5.475 960 H ASN 118 HN ASN 118 -9.647 10.995 4.118 961 HA ASN 118 HA ASN 118 -8.285 10.159 1.669 962 HB2 ASN 118 HB2 ASN 118 -9.278 12.444 1.256 963 HB3 ASN 118 HB1 ASN 118 -8.278 13.055 2.566 964 HD21 ASN 118 HD21 ASN 118 -5.884 12.740 2.286 965 HD22 ASN 118 HD22 ASN 118 -5.251 12.838 0.682 966 H HIS 119 HN HIS 119 -6.807 8.901 2.800 967 HA HIS 119 HA HIS 119 -5.261 10.307 4.877 968 HB2 HIS 119 HB2 HIS 119 -6.880 8.662 5.827 969 HB3 HIS 119 HB1 HIS 119 -6.030 7.395 4.948 970 HD1 HIS 119 HD1 HIS 119 -4.487 6.144 6.398 971 HD2 HIS 119 HD2 HIS 119 -4.778 10.133 7.540 972 HE1 HIS 119 HE1 HIS 119 -2.970 6.391 8.390 973 HE2 HIS 119 HE2 HIS 119 -3.271 8.775 9.147 974 H LEU 120 HN LEU 120 -3.139 10.018 4.925 975 HA LEU 120 HA LEU 120 -1.846 7.915 3.384 976 HB2 LEU 120 HB2 LEU 120 -1.556 10.850 2.910 977 HB3 LEU 120 HB1 LEU 120 -0.141 9.836 2.741 978 HG LEU 120 HG LEU 120 -2.678 9.271 1.239 979 HD11 LEU 120 HD11 LEU 120 -0.877 10.273 -0.550 980 HD12 LEU 120 HD12 LEU 120 -0.678 11.356 0.829 981 HD13 LEU 120 HD13 LEU 120 -2.268 11.147 0.088 982 HD21 LEU 120 HD21 LEU 120 -0.695 7.604 1.628 983 HD22 LEU 120 HD22 LEU 120 0.099 8.587 0.395 984 HD23 LEU 120 HD23 LEU 120 -1.421 7.770 0.028 985 H ARG 121 HN ARG 121 0.041 7.199 4.288 986 HA ARG 121 HA ARG 121 1.212 8.667 6.510 987 HB2 ARG 121 HB2 ARG 121 1.094 6.728 8.023 988 HB3 ARG 121 HB1 ARG 121 -0.492 7.357 7.624 989 HG2 ARG 121 HG2 ARG 121 -0.944 5.155 7.404 990 HG3 ARG 121 HG1 ARG 121 -0.343 5.438 5.778 991 HD2 ARG 121 HD2 ARG 121 0.547 3.402 7.074 992 HD3 ARG 121 HD1 ARG 121 1.719 4.413 6.223 993 HE ARG 121 HE ARG 121 2.076 5.504 8.475 994 HH11 ARG 121 HH11 ARG 121 0.986 2.175 8.215 995 HH12 ARG 121 HH12 ARG 121 1.613 1.726 9.771 996 HH21 ARG 121 HH21 ARG 121 2.868 4.909 10.524 997 HH22 ARG 121 HH22 ARG 121 2.652 3.281 11.097 998 H CYS 122 HN CYS 122 3.382 8.450 6.557 999 HA CYS 122 HA CYS 122 4.550 6.591 4.643 1000 HB2 CYS 122 HB2 CYS 122 6.648 7.894 5.052 1001 HB3 CYS 122 HB1 CYS 122 5.316 8.825 4.386 1002 HG CYS 122 HG CYS 122 6.118 10.678 6.048 1003 H GLU 123 HN GLU 123 5.605 4.843 5.127 1004 HA GLU 123 HA GLU 123 6.195 4.167 7.916 1005 HB2 GLU 123 HB2 GLU 123 6.116 2.551 5.358 1006 HB3 GLU 123 HB1 GLU 123 6.631 1.888 6.906 1007 HG2 GLU 123 HG2 GLU 123 4.026 3.236 6.938 1008 HG3 GLU 123 HG1 GLU 123 4.100 1.771 5.954 1009 H LYS 124 HN LYS 124 8.333 3.068 8.313 1010 HA LYS 124 HA LYS 124 10.428 4.203 6.597 1011 HB2 LYS 124 HB2 LYS 124 10.178 5.605 8.581 1012 HB3 LYS 124 HB1 LYS 124 10.349 4.190 9.612 1013 HG2 LYS 124 HG2 LYS 124 12.643 3.896 8.515 1014 HG3 LYS 124 HG1 LYS 124 12.438 5.545 7.932 1015 HD2 LYS 124 HD2 LYS 124 13.661 5.667 9.929 1016 HD3 LYS 124 HD1 LYS 124 12.027 6.218 10.308 1017 HE2 LYS 124 HE2 LYS 124 11.471 4.203 11.362 1018 HE3 LYS 124 HE1 LYS 124 12.854 3.367 10.656 1019 HZ1 LYS 124 HZ1 LYS 124 14.318 4.703 12.049 1020 HZ2 LYS 124 HZ2 LYS 124 13.205 3.848 13.002 1021 HZ3 LYS 124 HZ3 LYS 124 12.985 5.507 12.724 1022 H LEU 125 HN LEU 125 11.897 2.803 5.970 1023 HA LEU 125 HA LEU 125 12.197 0.286 7.484 1024 HB2 LEU 125 HB2 LEU 125 12.766 0.739 4.561 1025 HB3 LEU 125 HB1 LEU 125 12.700 -0.795 5.398 1026 HG LEU 125 HG LEU 125 10.219 0.851 5.370 1027 HD11 LEU 125 HD11 LEU 125 10.818 1.079 3.074 1028 HD12 LEU 125 HD12 LEU 125 9.615 -0.207 3.177 1029 HD13 LEU 125 HD13 LEU 125 11.319 -0.610 2.981 1030 HD21 LEU 125 HD21 LEU 125 9.252 -1.457 5.056 1031 HD22 LEU 125 HD22 LEU 125 10.125 -1.193 6.569 1032 HD23 LEU 125 HD23 LEU 125 10.894 -2.079 5.253 1033 H THR 126 HN THR 126 14.063 0.434 8.639 1034 HA THR 126 HA THR 126 16.341 1.877 7.452 1035 HB THR 126 HB THR 126 16.330 0.907 10.288 1036 HG1 THR 126 HG1 THR 126 15.520 3.305 10.513 1037 HG21 THR 126 HG21 THR 126 18.268 2.025 8.962 1038 HG22 THR 126 HG22 THR 126 17.936 2.525 10.620 1039 HG23 THR 126 HG23 THR 126 17.371 3.512 9.272 1040 H PHE 127 HN PHE 127 17.892 0.715 6.550 1041 HA PHE 127 HA PHE 127 18.219 -2.090 7.389 1042 HB2 PHE 127 HB2 PHE 127 18.941 -0.785 4.754 1043 HB3 PHE 127 HB1 PHE 127 19.151 -2.490 5.148 1044 HD1 PHE 127 HD2 PHE 127 16.716 0.148 4.432 1045 HD2 PHE 127 HD1 PHE 127 17.287 -3.994 5.197 1046 HE1 PHE 127 HE2 PHE 127 14.419 -0.288 3.708 1047 HE2 PHE 127 HE1 PHE 127 14.978 -4.448 4.471 1048 HZ PHE 127 HZ PHE 127 13.542 -2.591 3.730 1049 H ASN 128 HN ASN 128 19.870 -2.370 8.687 1050 HA ASN 128 HA ASN 128 21.916 -0.388 8.974 1051 HB2 ASN 128 HB2 ASN 128 21.571 -3.090 10.275 1052 HB3 ASN 128 HB1 ASN 128 22.814 -1.921 10.708 1053 HD21 ASN 128 HD21 ASN 128 19.429 -2.684 10.815 1054 HD22 ASN 128 HD22 ASN 128 18.985 -1.463 11.970 1055 H ASN 129 HN ASN 129 23.593 -0.225 7.702 1056 HA ASN 129 HA ASN 129 25.392 -0.695 6.405 1057 HB2 ASN 129 HB2 ASN 129 25.564 -2.974 8.385 1058 HB3 ASN 129 HB1 ASN 129 26.848 -2.546 7.245 1059 HD21 ASN 129 HD21 ASN 129 26.377 -2.388 10.361 1060 HD22 ASN 129 HD22 ASN 129 26.972 -0.796 10.723 1061 HA PRO 130 HA PRO 130 23.594 -4.017 3.786 1062 HB2 PRO 130 HB2 PRO 130 22.439 -2.533 1.878 1063 HB3 PRO 130 HB1 PRO 130 21.623 -2.865 3.409 1064 HG2 PRO 130 HG2 PRO 130 22.912 -0.372 2.454 1065 HG3 PRO 130 HG1 PRO 130 21.553 -0.582 3.568 1066 HD2 PRO 130 HD2 PRO 130 24.267 -0.091 4.240 1067 HD3 PRO 130 HD1 PRO 130 22.941 -0.474 5.352 1068 H THR 131 HN THR 131 24.128 -4.475 1.500 1069 HA THR 131 HA THR 131 26.812 -3.662 0.863 1070 HB THR 131 HB THR 131 26.077 -5.973 0.449 1071 HG1 THR 131 HG1 THR 131 27.378 -6.057 -1.200 1072 HG21 THR 131 HG21 THR 131 23.753 -5.642 -0.104 1073 HG22 THR 131 HG22 THR 131 24.554 -6.432 -1.468 1074 HG23 THR 131 HG23 THR 131 24.192 -4.709 -1.541 1075 H GLU 132 HN GLU 132 27.335 -2.898 -1.457 1076 HA GLU 132 HA GLU 132 26.284 -0.352 -1.774 1077 HB2 GLU 132 HB2 GLU 132 28.393 -1.002 -2.856 1078 HB3 GLU 132 HB1 GLU 132 27.499 -1.999 -4.002 1079 HG2 GLU 132 HG2 GLU 132 27.873 -0.045 -5.194 1080 HG3 GLU 132 HG1 GLU 132 26.220 0.180 -4.596 1081 H ASP 133 HN ASP 133 25.360 -3.298 -3.599 1082 HA ASP 133 HA ASP 133 23.831 -2.058 -5.529 1083 HB2 ASP 133 HB2 ASP 133 23.111 -4.695 -4.250 1084 HB3 ASP 133 HB1 ASP 133 22.613 -4.127 -5.832 1085 H PHE 134 HN PHE 134 22.818 -3.122 -2.315 1086 HA PHE 134 HA PHE 134 20.141 -2.184 -2.650 1087 HB2 PHE 134 HB2 PHE 134 20.982 -4.023 -1.023 1088 HB3 PHE 134 HB1 PHE 134 21.435 -2.674 0.022 1089 HD1 PHE 134 HD1 PHE 134 18.557 -2.619 -2.226 1090 HD2 PHE 134 HD2 PHE 134 19.872 -3.132 1.787 1091 HE1 PHE 134 HE1 PHE 134 16.258 -2.403 -1.456 1092 HE2 PHE 134 HE2 PHE 134 17.545 -2.921 2.568 1093 HZ PHE 134 HZ PHE 134 15.739 -2.546 0.931 1094 H ARG 135 HN ARG 135 22.864 -1.106 -0.673 1095 HA ARG 135 HA ARG 135 21.955 1.253 0.375 1096 HB2 ARG 135 HB2 ARG 135 24.013 0.650 1.123 1097 HB3 ARG 135 HB1 ARG 135 24.591 0.246 -0.482 1098 HG2 ARG 135 HG2 ARG 135 25.425 2.343 -0.814 1099 HG3 ARG 135 HG1 ARG 135 24.008 3.077 -0.094 1100 HD2 ARG 135 HD2 ARG 135 26.304 3.325 1.101 1101 HD3 ARG 135 HD1 ARG 135 24.887 2.903 2.061 1102 HE ARG 135 HE ARG 135 25.875 0.907 2.551 1103 HH11 ARG 135 HH11 ARG 135 27.433 2.187 -0.316 1104 HH12 ARG 135 HH12 ARG 135 28.598 0.901 -0.405 1105 HH21 ARG 135 HH21 ARG 135 27.404 -0.790 2.409 1106 HH22 ARG 135 HH22 ARG 135 28.583 -0.774 1.136 1107 H ARG 136 HN ARG 136 23.324 0.762 -2.771 1108 HA ARG 136 HA ARG 136 23.504 3.460 -3.529 1109 HB2 ARG 136 HB2 ARG 136 24.976 2.262 -4.732 1110 HB3 ARG 136 HB1 ARG 136 23.978 0.819 -4.700 1111 HG2 ARG 136 HG2 ARG 136 22.530 1.914 -6.335 1112 HG3 ARG 136 HG1 ARG 136 23.734 3.174 -6.527 1113 HD2 ARG 136 HD2 ARG 136 25.354 1.591 -7.296 1114 HD3 ARG 136 HD1 ARG 136 24.299 0.235 -6.891 1115 HE ARG 136 HE ARG 136 22.842 1.671 -8.681 1116 HH11 ARG 136 HH11 ARG 136 26.098 0.366 -8.726 1117 HH12 ARG 136 HH12 ARG 136 26.074 0.035 -10.431 1118 HH21 ARG 136 HH21 ARG 136 22.823 1.263 -10.929 1119 HH22 ARG 136 HH22 ARG 136 24.219 0.544 -11.684 1120 H LYS 137 HN LYS 137 21.032 0.964 -4.098 1121 HA LYS 137 HA LYS 137 19.444 2.641 -5.779 1122 HB2 LYS 137 HB2 LYS 137 18.485 0.372 -4.021 1123 HB3 LYS 137 HB1 LYS 137 17.627 1.073 -5.387 1124 HG2 LYS 137 HG2 LYS 137 19.471 0.271 -6.861 1125 HG3 LYS 137 HG1 LYS 137 20.161 -0.553 -5.461 1126 HD2 LYS 137 HD2 LYS 137 17.857 -1.655 -5.220 1127 HD3 LYS 137 HD1 LYS 137 17.560 -1.087 -6.863 1128 HE2 LYS 137 HE2 LYS 137 18.356 -3.260 -7.157 1129 HE3 LYS 137 HE1 LYS 137 19.769 -2.249 -7.455 1130 HZ1 LYS 137 HZ1 LYS 137 19.158 -3.693 -4.938 1131 HZ2 LYS 137 HZ2 LYS 137 20.483 -2.665 -5.176 1132 HZ3 LYS 137 HZ3 LYS 137 20.353 -4.100 -6.068 1133 H LEU 138 HN LEU 138 19.264 1.762 -2.364 1134 HA LEU 138 HA LEU 138 17.053 3.219 -1.561 1135 HB2 LEU 138 HB2 LEU 138 19.569 2.768 0.030 1136 HB3 LEU 138 HB1 LEU 138 18.007 3.207 0.685 1137 HG LEU 138 HG LEU 138 18.814 0.584 -0.547 1138 HD11 LEU 138 HD11 LEU 138 19.363 1.037 1.837 1139 HD12 LEU 138 HD12 LEU 138 18.272 -0.327 1.594 1140 HD13 LEU 138 HD13 LEU 138 17.636 1.223 2.146 1141 HD21 LEU 138 HD21 LEU 138 16.058 1.495 0.225 1142 HD22 LEU 138 HD22 LEU 138 16.508 -0.153 -0.200 1143 HD23 LEU 138 HD23 LEU 138 16.617 1.132 -1.402 1144 H LEU 139 HN LEU 139 20.383 4.316 -1.947 1145 HA LEU 139 HA LEU 139 19.890 6.881 -0.787 1146 HB2 LEU 139 HB2 LEU 139 22.209 5.856 -2.417 1147 HB3 LEU 139 HB1 LEU 139 22.177 7.402 -1.583 1148 HG LEU 139 HG LEU 139 21.929 4.715 -0.234 1149 HD11 LEU 139 HD11 LEU 139 24.134 4.591 -0.594 1150 HD12 LEU 139 HD12 LEU 139 24.234 5.818 0.679 1151 HD13 LEU 139 HD13 LEU 139 24.255 6.305 -1.016 1152 HD21 LEU 139 HD21 LEU 139 20.776 6.561 0.878 1153 HD22 LEU 139 HD22 LEU 139 22.287 7.471 0.920 1154 HD23 LEU 139 HD23 LEU 139 22.141 5.959 1.819 1155 H LYS 140 HN LYS 140 19.851 5.618 -4.076 1156 HA LYS 140 HA LYS 140 19.781 8.164 -5.323 1157 HB2 LYS 140 HB2 LYS 140 19.825 5.494 -6.227 1158 HB3 LYS 140 HB1 LYS 140 18.388 6.254 -6.876 1159 HG2 LYS 140 HG2 LYS 140 19.640 7.998 -7.861 1160 HG3 LYS 140 HG1 LYS 140 21.121 7.429 -7.092 1161 HD2 LYS 140 HD2 LYS 140 19.521 5.754 -8.996 1162 HD3 LYS 140 HD1 LYS 140 20.817 6.815 -9.520 1163 HE2 LYS 140 HE2 LYS 140 21.015 4.522 -7.593 1164 HE3 LYS 140 HE1 LYS 140 21.580 4.571 -9.256 1165 HZ1 LYS 140 HZ1 LYS 140 23.456 4.952 -7.877 1166 HZ2 LYS 140 HZ2 LYS 140 22.638 6.106 -6.948 1167 HZ3 LYS 140 HZ3 LYS 140 23.056 6.454 -8.552 1168 H ALA 141 HN ALA 141 17.454 6.251 -3.741 1169 HA ALA 141 HA ALA 141 15.059 6.896 -4.909 1170 HB1 ALA 141 HB1 ALA 141 14.034 6.304 -2.898 1171 HB2 ALA 141 HB2 ALA 141 15.426 6.807 -1.941 1172 HB3 ALA 141 HB3 ALA 141 15.525 5.367 -2.956 1173 H1 GLY 212 HT1 GLY 212 -17.008 10.848 13.630 1174 H2 GLY 212 HT2 GLY 212 -17.851 11.572 14.911 1175 H3 GLY 212 HT3 GLY 212 -18.138 12.072 13.314 1176 HA2 GLY 212 HA1 GLY 212 -18.720 9.369 14.387 1177 HA3 GLY 212 HA2 GLY 212 -19.914 10.641 14.166 1178 H GLY 213 HN GLY 213 -19.554 7.921 12.945 1179 HA2 GLY 213 HA2 GLY 213 -20.784 7.629 10.820 1180 HA3 GLY 213 HA1 GLY 213 -19.713 8.845 10.141 1181 H LYS 214 HN LYS 214 -19.320 5.828 12.001 1182 HA LYS 214 HA LYS 214 -17.178 5.066 10.159 1183 HB2 LYS 214 HB2 LYS 214 -16.687 4.886 12.557 1184 HB3 LYS 214 HB1 LYS 214 -18.054 3.800 12.763 1185 HG2 LYS 214 HG2 LYS 214 -16.983 2.137 11.364 1186 HG3 LYS 214 HG1 LYS 214 -15.634 3.234 11.062 1187 HD2 LYS 214 HD2 LYS 214 -15.037 3.194 13.412 1188 HD3 LYS 214 HD1 LYS 214 -16.439 2.183 13.774 1189 HE2 LYS 214 HE2 LYS 214 -15.530 0.402 12.388 1190 HE3 LYS 214 HE1 LYS 214 -14.151 1.414 11.964 1191 HZ1 LYS 214 HZ1 LYS 214 -13.400 1.365 14.214 1192 HZ2 LYS 214 HZ2 LYS 214 -13.694 -0.235 13.734 1193 HZ3 LYS 214 HZ3 LYS 214 -14.802 0.567 14.737 1194 H ALA 215 HN ALA 215 -17.775 3.978 8.430 1195 HA ALA 215 HA ALA 215 -20.320 2.767 8.123 1196 HB1 ALA 215 HB1 ALA 215 -19.438 2.011 5.951 1197 HB2 ALA 215 HB2 ALA 215 -17.828 2.542 6.432 1198 HB3 ALA 215 HB3 ALA 215 -19.125 3.721 6.238 1199 HA PRO 216 HA PRO 216 -19.848 -1.380 9.555 1200 HB2 PRO 216 HB2 PRO 216 -20.743 -2.451 6.974 1201 HB3 PRO 216 HB1 PRO 216 -21.482 -2.575 8.554 1202 HG2 PRO 216 HG2 PRO 216 -22.426 -1.008 6.524 1203 HG3 PRO 216 HG1 PRO 216 -22.770 -0.740 8.240 1204 HD2 PRO 216 HD2 PRO 216 -21.020 0.756 6.412 1205 HD3 PRO 216 HD1 PRO 216 -21.761 1.267 7.938 1206 H ARG 217 HN ARG 217 -18.641 -3.343 9.240 1207 HA ARG 217 HA ARG 217 -16.595 -3.191 7.137 1208 HB2 ARG 217 HB2 ARG 217 -16.090 -3.513 10.098 1209 HB3 ARG 217 HB1 ARG 217 -14.880 -3.822 8.861 1210 HG2 ARG 217 HG2 ARG 217 -15.007 -1.505 8.137 1211 HG3 ARG 217 HG1 ARG 217 -16.253 -1.187 9.345 1212 HD2 ARG 217 HD2 ARG 217 -14.024 -0.447 10.073 1213 HD3 ARG 217 HD1 ARG 217 -14.704 -1.687 11.127 1214 HE ARG 217 HE ARG 217 -13.242 -3.285 9.912 1215 HH11 ARG 217 HH11 ARG 217 -12.452 0.118 9.939 1216 HH12 ARG 217 HH12 ARG 217 -10.748 -0.139 9.715 1217 HH21 ARG 217 HH21 ARG 217 -10.997 -3.635 9.642 1218 HH22 ARG 217 HH22 ARG 217 -9.919 -2.263 9.598 1219 H1 KCR 218 HN KCR 218 -15.625 -5.144 6.578 1220 H4 KCR 218 HA KCR 218 -17.200 -7.506 7.283 1221 H5 KCR 218 HB1 KCR 218 -16.115 -8.569 5.357 1222 H6 KCR 218 HB2 KCR 218 -15.103 -7.150 5.129 1223 H7 KCR 218 HG1 KCR 218 -17.095 -5.814 4.641 1224 H8 KCR 218 HG2 KCR 218 -18.099 -7.251 4.848 1225 H9 KCR 218 HD1 KCR 218 -17.112 -8.316 2.966 1226 H10 KCR 218 HD2 KCR 218 -15.856 -7.081 2.849 1227 H11 KCR 218 HE1 KCR 218 -17.571 -5.408 2.313 1228 H12 KCR 218 HE2 KCR 218 -18.806 -6.665 2.392 1229 H13 KCR 218 HZ1 KCR 218 -17.575 -7.745 0.508 1230 H14 KCR 218 HH1 KCR 218 -17.052 -7.437 -1.788 1231 H15 KCR 218 HJ1 KCR 218 -17.050 -4.424 -2.443 1232 H16 KCR 218 HF3 KCR 218 -17.524 -5.885 -4.596 1233 H17 KCR 218 HF1 KCR 218 -15.835 -5.405 -4.449 1234 H18 KCR 218 HF2 KCR 218 -16.336 -7.022 -3.958 1235 H GLN 219 HN GLN 219 -16.302 -7.734 9.378 1236 HA GLN 219 HA GLN 219 -13.449 -8.308 9.560 1237 HB2 GLN 219 HB2 GLN 219 -15.576 -8.161 11.705 1238 HB3 GLN 219 HB1 GLN 219 -13.856 -8.399 11.995 1239 HG2 GLN 219 HG2 GLN 219 -13.394 -6.220 10.972 1240 HG3 GLN 219 HG1 GLN 219 -15.122 -5.982 10.725 1241 HE21 GLN 219 HE21 GLN 219 -16.435 -5.539 12.482 1242 HE22 GLN 219 HE22 GLN 219 -15.789 -5.034 14.010 1243 H LEU 220 HN LEU 220 -16.538 -9.878 9.600 1244 HA LEU 220 HA LEU 220 -15.180 -12.480 9.870 1245 HB2 LEU 220 HB2 LEU 220 -18.049 -11.669 10.328 1246 HB3 LEU 220 HB1 LEU 220 -17.580 -13.343 10.126 1247 HG LEU 220 HG LEU 220 -16.025 -13.015 12.110 1248 HD11 LEU 220 HD11 LEU 220 -15.983 -10.570 12.103 1249 HD12 LEU 220 HD12 LEU 220 -16.553 -11.208 13.646 1250 HD13 LEU 220 HD13 LEU 220 -17.704 -10.541 12.489 1251 HD21 LEU 220 HD21 LEU 220 -18.110 -14.247 12.262 1252 HD22 LEU 220 HD22 LEU 220 -18.997 -12.745 12.522 1253 HD23 LEU 220 HD23 LEU 220 -17.837 -13.305 13.727 1254 H ALA 221 HN ALA 221 -17.516 -10.604 8.008 1255 HA ALA 221 HA ALA 221 -18.279 -10.762 5.874 1256 HB1 ALA 221 HB1 ALA 221 -15.929 -10.278 5.404 1257 HB2 ALA 221 HB2 ALA 221 -16.631 -11.320 4.165 1258 HB3 ALA 221 HB3 ALA 221 -15.572 -12.005 5.398 1259 H THR 222 HN THR 222 -19.209 -12.743 7.508 1260 HA THR 222 HA THR 222 -19.045 -15.244 6.005 1261 HB THR 222 HB THR 222 -20.527 -16.064 7.947 1262 HG1 THR 222 HG1 THR 222 -20.778 -14.753 9.653 1263 HG21 THR 222 HG21 THR 222 -18.594 -16.350 9.423 1264 HG22 THR 222 HG22 THR 222 -17.724 -15.105 8.528 1265 HG23 THR 222 HG23 THR 222 -18.154 -16.622 7.738 1266 H LYS 223 HN LYS 223 -20.276 -14.997 4.215 1267 HA LYS 223 HA LYS 223 -22.915 -13.784 4.400 1268 HB2 LYS 223 HB2 LYS 223 -21.439 -14.915 2.015 1269 HB3 LYS 223 HB1 LYS 223 -22.936 -13.997 1.956 1270 HG2 LYS 223 HG2 LYS 223 -21.780 -12.038 2.840 1271 HG3 LYS 223 HG1 LYS 223 -20.277 -12.960 2.921 1272 HD2 LYS 223 HD2 LYS 223 -21.850 -12.393 0.408 1273 HD3 LYS 223 HD1 LYS 223 -20.391 -11.538 0.913 1274 HE2 LYS 223 HE2 LYS 223 -19.067 -13.510 0.687 1275 HE3 LYS 223 HE1 LYS 223 -20.497 -14.515 0.456 1276 HZ1 LYS 223 HZ1 LYS 223 -19.381 -14.072 -1.637 1277 HZ2 LYS 223 HZ2 LYS 223 -19.549 -12.402 -1.408 1278 HZ3 LYS 223 HZ3 LYS 223 -20.925 -13.372 -1.625 1279 H ALA 224 HN ALA 224 -22.898 -16.021 5.897 1280 HA ALA 224 HA ALA 224 -24.289 -18.028 4.251 1281 HB1 ALA 224 HB1 ALA 224 -22.171 -18.882 5.132 1282 HB2 ALA 224 HB2 ALA 224 -23.549 -19.727 5.840 1283 HB3 ALA 224 HB3 ALA 224 -22.695 -18.496 6.771 Start of MODEL 12 1 H1 GLY 1 HT1 GLY 1 23.046 5.076 17.077 2 H2 GLY 1 HT2 GLY 1 23.771 4.542 15.644 3 H3 GLY 1 HT3 GLY 1 24.648 5.514 16.720 4 HA2 GLY 1 HA1 GLY 1 24.542 3.757 18.399 5 HA3 GLY 1 HA2 GLY 1 23.702 2.746 17.231 6 H SER 2 HN SER 2 26.150 2.085 18.492 7 HA SER 2 HA SER 2 28.105 2.354 16.313 8 HB2 SER 2 HB2 SER 2 28.486 1.647 19.233 9 HB3 SER 2 HB1 SER 2 29.778 1.653 18.034 10 HG SER 2 HG SER 2 29.483 3.854 17.747 11 H HIS 3 HN HIS 3 27.059 0.720 15.058 12 HA HIS 3 HA HIS 3 27.516 -1.987 16.112 13 HB2 HIS 3 HB2 HIS 3 25.749 -2.762 14.514 14 HB3 HIS 3 HB1 HIS 3 25.156 -1.728 15.805 15 HD1 HIS 3 HD1 HIS 3 25.298 -2.052 12.152 16 HD2 HIS 3 HD2 HIS 3 24.440 0.927 14.928 17 HE1 HIS 3 HE1 HIS 3 24.119 -0.236 10.863 18 HE2 HIS 3 HE2 HIS 3 23.569 1.540 12.566 19 H MET 4 HN MET 4 29.118 -2.999 15.240 20 HA MET 4 HA MET 4 30.707 -3.735 13.812 21 HB2 MET 4 HB2 MET 4 28.898 -2.530 11.719 22 HB3 MET 4 HB1 MET 4 30.393 -3.373 11.330 23 HG2 MET 4 HG2 MET 4 29.558 -5.412 12.263 24 HG3 MET 4 HG1 MET 4 28.120 -4.596 12.873 25 HE1 MET 4 HE1 MET 4 29.803 -3.972 9.362 26 HE2 MET 4 HE2 MET 4 28.974 -5.170 8.368 27 HE3 MET 4 HE3 MET 4 30.081 -5.691 9.639 28 H ALA 5 HN ALA 5 32.274 -2.806 11.979 29 HA ALA 5 HA ALA 5 33.530 -0.568 13.201 30 HB1 ALA 5 HB1 ALA 5 35.168 -0.745 11.400 31 HB2 ALA 5 HB2 ALA 5 34.105 -1.855 10.535 32 HB3 ALA 5 HB3 ALA 5 34.803 -2.330 12.082 33 H SER 6 HN SER 6 32.034 -0.983 10.005 34 HA SER 6 HA SER 6 31.790 1.931 9.778 35 HB2 SER 6 HB2 SER 6 32.815 0.631 7.895 36 HB3 SER 6 HB1 SER 6 31.279 -0.206 7.688 37 HG SER 6 HG SER 6 31.582 1.608 6.267 38 H SER 7 HN SER 7 29.986 2.628 10.760 39 HA SER 7 HA SER 7 27.606 0.924 10.712 40 HB2 SER 7 HB2 SER 7 28.421 1.745 12.899 41 HB3 SER 7 HB1 SER 7 28.209 3.407 12.350 42 HG SER 7 HG SER 7 26.102 3.239 12.573 43 H CYS 8 HN CYS 8 26.365 1.264 8.990 44 HA CYS 8 HA CYS 8 25.386 3.969 8.502 45 HB2 CYS 8 HB2 CYS 8 27.166 3.805 6.916 46 HB3 CYS 8 HB1 CYS 8 26.648 2.212 6.394 47 HG CYS 8 HG CYS 8 26.168 4.287 4.458 48 H ALA 9 HN ALA 9 23.277 3.804 8.697 49 HA ALA 9 HA ALA 9 21.956 1.419 7.591 50 HB1 ALA 9 HB1 ALA 9 20.132 1.833 9.155 51 HB2 ALA 9 HB2 ALA 9 20.985 3.243 9.785 52 HB3 ALA 9 HB3 ALA 9 21.664 1.631 10.006 53 H VAL 10 HN VAL 10 20.898 1.772 5.775 54 HA VAL 10 HA VAL 10 20.003 4.498 5.142 55 HB VAL 10 HB VAL 10 20.032 2.109 3.291 56 HG11 VAL 10 HG11 VAL 10 18.594 3.661 2.356 57 HG12 VAL 10 HG12 VAL 10 20.138 4.083 1.608 58 HG13 VAL 10 HG13 VAL 10 19.523 5.036 2.959 59 HG21 VAL 10 HG21 VAL 10 22.303 2.343 3.680 60 HG22 VAL 10 HG22 VAL 10 22.187 4.085 3.927 61 HG23 VAL 10 HG23 VAL 10 22.057 3.414 2.301 62 H GLN 11 HN GLN 11 17.855 4.987 5.134 63 HA GLN 11 HA GLN 11 16.037 2.704 5.290 64 HB2 GLN 11 HB2 GLN 11 14.645 4.498 6.714 65 HB3 GLN 11 HB1 GLN 11 15.524 3.150 7.371 66 HG2 GLN 11 HG2 GLN 11 16.319 4.751 8.711 67 HG3 GLN 11 HG1 GLN 11 17.467 4.923 7.403 68 HE21 GLN 11 HE21 GLN 11 15.519 6.232 5.646 69 HE22 GLN 11 HE22 GLN 11 15.338 7.825 6.275 70 H VAL 12 HN VAL 12 14.312 2.688 4.193 71 HA VAL 12 HA VAL 12 13.843 4.968 2.418 72 HB VAL 12 HB VAL 12 12.668 3.241 1.004 73 HG11 VAL 12 HG11 VAL 12 15.081 3.978 0.684 74 HG12 VAL 12 HG12 VAL 12 14.689 2.385 0.046 75 HG13 VAL 12 HG13 VAL 12 15.547 2.533 1.579 76 HG21 VAL 12 HG21 VAL 12 12.261 1.647 2.815 77 HG22 VAL 12 HG22 VAL 12 13.988 1.302 2.884 78 HG23 VAL 12 HG23 VAL 12 13.066 0.908 1.432 79 H LYS 13 HN LYS 13 11.814 5.896 2.327 80 HA LYS 13 HA LYS 13 9.916 4.878 4.297 81 HB2 LYS 13 HB2 LYS 13 10.415 7.626 3.210 82 HB3 LYS 13 HB1 LYS 13 8.895 7.227 4.008 83 HG2 LYS 13 HG2 LYS 13 10.151 6.471 5.968 84 HG3 LYS 13 HG1 LYS 13 11.650 6.977 5.185 85 HD2 LYS 13 HD2 LYS 13 10.729 9.290 5.060 86 HD3 LYS 13 HD1 LYS 13 9.343 8.739 6.006 87 HE2 LYS 13 HE2 LYS 13 10.853 8.081 7.820 88 HE3 LYS 13 HE1 LYS 13 12.229 8.648 6.878 89 HZ1 LYS 13 HZ1 LYS 13 11.169 10.882 6.896 90 HZ2 LYS 13 HZ2 LYS 13 11.655 10.331 8.425 91 HZ3 LYS 13 HZ3 LYS 13 10.017 10.286 7.989 92 H LEU 14 HN LEU 14 8.199 3.933 3.703 93 HA LEU 14 HA LEU 14 7.108 4.445 1.011 94 HB2 LEU 14 HB2 LEU 14 6.838 1.985 2.721 95 HB3 LEU 14 HB1 LEU 14 6.025 2.228 1.193 96 HG LEU 14 HG LEU 14 9.025 2.070 1.534 97 HD11 LEU 14 HD11 LEU 14 7.021 0.051 0.556 98 HD12 LEU 14 HD12 LEU 14 8.005 -0.063 2.013 99 HD13 LEU 14 HD13 LEU 14 8.770 -0.117 0.424 100 HD21 LEU 14 HD21 LEU 14 7.370 1.980 -0.983 101 HD22 LEU 14 HD22 LEU 14 9.129 2.023 -0.847 102 HD23 LEU 14 HD23 LEU 14 8.175 3.432 -0.384 103 H GLU 15 HN GLU 15 5.006 4.930 0.848 104 HA GLU 15 HA GLU 15 3.751 5.756 3.370 105 HB2 GLU 15 HB2 GLU 15 4.460 7.593 1.918 106 HB3 GLU 15 HB1 GLU 15 3.525 6.927 0.590 107 HG2 GLU 15 HG2 GLU 15 1.472 7.387 1.722 108 HG3 GLU 15 HG1 GLU 15 2.332 7.886 3.180 109 H LEU 16 HN LEU 16 1.884 4.911 3.916 110 HA LEU 16 HA LEU 16 0.346 3.348 1.969 111 HB2 LEU 16 HB2 LEU 16 0.147 3.592 4.962 112 HB3 LEU 16 HB1 LEU 16 -1.089 2.812 4.004 113 HG LEU 16 HG LEU 16 0.207 1.090 4.915 114 HD11 LEU 16 HD11 LEU 16 1.663 1.089 2.391 115 HD12 LEU 16 HD12 LEU 16 -0.076 1.341 2.240 116 HD13 LEU 16 HD13 LEU 16 0.542 -0.096 3.059 117 HD21 LEU 16 HD21 LEU 16 2.708 2.317 3.864 118 HD22 LEU 16 HD22 LEU 16 2.545 0.989 5.005 119 HD23 LEU 16 HD23 LEU 16 2.121 2.632 5.491 120 H GLY 17 HN GLY 17 -1.717 3.917 1.426 121 HA2 GLY 17 HA2 GLY 17 -2.959 6.193 2.716 122 HA3 GLY 17 HA1 GLY 17 -2.430 6.465 1.057 123 H HIS 18 HN HIS 18 -4.994 6.793 1.667 124 HA HIS 18 HA HIS 18 -6.206 5.231 -0.302 125 HB2 HIS 18 HB2 HIS 18 -7.042 3.440 0.767 126 HB3 HIS 18 HB1 HIS 18 -6.114 3.899 2.186 127 HD1 HIS 18 HD1 HIS 18 -7.428 5.419 3.960 128 HD2 HIS 18 HD2 HIS 18 -9.755 3.543 1.071 129 HE1 HIS 18 HE1 HIS 18 -9.790 5.547 4.803 130 HE2 HIS 18 HE2 HIS 18 -11.148 4.254 3.132 131 H ARG 19 HN ARG 19 -8.155 6.058 -0.907 132 HA ARG 19 HA ARG 19 -9.300 8.199 0.764 133 HB2 ARG 19 HB2 ARG 19 -9.278 8.081 -2.261 134 HB3 ARG 19 HB1 ARG 19 -10.002 9.333 -1.286 135 HG2 ARG 19 HG2 ARG 19 -7.877 10.096 -0.537 136 HG3 ARG 19 HG1 ARG 19 -7.062 8.736 -1.315 137 HD2 ARG 19 HD2 ARG 19 -7.971 9.544 -3.493 138 HD3 ARG 19 HD1 ARG 19 -8.566 10.977 -2.655 139 HE ARG 19 HE ARG 19 -5.993 11.054 -1.997 140 HH11 ARG 19 HH11 ARG 19 -7.539 10.527 -5.099 141 HH12 ARG 19 HH12 ARG 19 -6.204 11.172 -6.011 142 HH21 ARG 19 HH21 ARG 19 -4.236 11.904 -3.193 143 HH22 ARG 19 HH22 ARG 19 -4.340 11.967 -4.933 144 H ALA 20 HN ALA 20 -11.680 8.444 0.390 145 HA ALA 20 HA ALA 20 -12.957 6.119 -0.803 146 HB1 ALA 20 HB1 ALA 20 -13.035 5.096 1.197 147 HB2 ALA 20 HB2 ALA 20 -14.413 6.172 1.452 148 HB3 ALA 20 HB3 ALA 20 -12.828 6.603 2.095 149 H GLN 21 HN GLN 21 -14.930 6.480 -1.565 150 HA GLN 21 HA GLN 21 -16.482 8.796 -0.806 151 HB2 GLN 21 HB2 GLN 21 -16.598 9.770 -2.994 152 HB3 GLN 21 HB1 GLN 21 -14.907 9.580 -2.576 153 HG2 GLN 21 HG2 GLN 21 -14.711 8.792 -4.623 154 HG3 GLN 21 HG1 GLN 21 -15.317 7.298 -3.945 155 HE21 GLN 21 HE21 GLN 21 -17.403 6.631 -4.419 156 HE22 GLN 21 HE22 GLN 21 -18.337 7.360 -5.678 157 H VAL 22 HN VAL 22 -18.693 8.620 -1.517 158 HA VAL 22 HA VAL 22 -19.388 5.811 -2.047 159 HB VAL 22 HB VAL 22 -20.223 6.852 0.077 160 HG11 VAL 22 HG11 VAL 22 -22.118 8.357 -0.037 161 HG12 VAL 22 HG12 VAL 22 -21.952 8.456 -1.789 162 HG13 VAL 22 HG13 VAL 22 -20.677 9.085 -0.743 163 HG21 VAL 22 HG21 VAL 22 -21.387 4.934 -0.542 164 HG22 VAL 22 HG22 VAL 22 -22.103 5.709 -1.954 165 HG23 VAL 22 HG23 VAL 22 -22.659 6.136 -0.336 166 H ARG 23 HN ARG 23 -20.647 5.238 -3.731 167 HA ARG 23 HA ARG 23 -21.571 7.350 -5.539 168 HB2 ARG 23 HB2 ARG 23 -22.316 5.163 -6.860 169 HB3 ARG 23 HB1 ARG 23 -20.669 5.770 -6.937 170 HG2 ARG 23 HG2 ARG 23 -19.820 4.049 -5.736 171 HG3 ARG 23 HG1 ARG 23 -21.300 3.812 -4.809 172 HD2 ARG 23 HD2 ARG 23 -20.800 1.958 -6.384 173 HD3 ARG 23 HD1 ARG 23 -22.356 2.730 -6.677 174 HE ARG 23 HE ARG 23 -21.314 3.882 -8.556 175 HH11 ARG 23 HH11 ARG 23 -19.598 1.130 -7.246 176 HH12 ARG 23 HH12 ARG 23 -18.841 0.719 -8.755 177 HH21 ARG 23 HH21 ARG 23 -20.314 3.355 -10.546 178 HH22 ARG 23 HH22 ARG 23 -19.233 1.997 -10.622 179 H LYS 24 HN LYS 24 -23.680 7.840 -5.757 180 HA LYS 24 HA LYS 24 -25.396 7.151 -3.602 181 HB2 LYS 24 HB2 LYS 24 -25.364 9.324 -4.891 182 HB3 LYS 24 HB1 LYS 24 -26.217 8.481 -6.176 183 HG2 LYS 24 HG2 LYS 24 -27.824 9.652 -4.865 184 HG3 LYS 24 HG1 LYS 24 -27.996 7.927 -4.542 185 HD2 LYS 24 HD2 LYS 24 -26.688 8.183 -2.485 186 HD3 LYS 24 HD1 LYS 24 -26.557 9.916 -2.795 187 HE2 LYS 24 HE2 LYS 24 -28.997 10.108 -2.700 188 HE3 LYS 24 HE1 LYS 24 -29.119 8.382 -2.376 189 HZ1 LYS 24 HZ1 LYS 24 -27.698 10.318 -0.626 190 HZ2 LYS 24 HZ2 LYS 24 -27.990 8.679 -0.297 191 HZ3 LYS 24 HZ3 LYS 24 -29.282 9.774 -0.367 192 H LYS 25 HN LYS 25 -24.688 5.524 -6.453 193 HA LYS 25 HA LYS 25 -27.032 3.817 -6.023 194 HB2 LYS 25 HB2 LYS 25 -27.332 5.280 -8.053 195 HB3 LYS 25 HB1 LYS 25 -25.952 4.480 -8.774 196 HG2 LYS 25 HG2 LYS 25 -27.890 3.471 -9.651 197 HG3 LYS 25 HG1 LYS 25 -27.212 2.352 -8.480 198 HD2 LYS 25 HD2 LYS 25 -28.809 3.148 -6.797 199 HD3 LYS 25 HD1 LYS 25 -29.528 4.204 -8.019 200 HE2 LYS 25 HE2 LYS 25 -30.231 2.348 -9.324 201 HE3 LYS 25 HE1 LYS 25 -29.292 1.222 -8.342 202 HZ1 LYS 25 HZ1 LYS 25 -31.687 2.761 -7.481 203 HZ2 LYS 25 HZ2 LYS 25 -30.746 1.801 -6.452 204 HZ3 LYS 25 HZ3 LYS 25 -31.594 1.085 -7.737 205 HA PRO 26 HA PRO 26 -23.598 0.900 -5.643 206 HB2 PRO 26 HB2 PRO 26 -25.848 -1.008 -5.468 207 HB3 PRO 26 HB1 PRO 26 -24.498 -0.754 -4.364 208 HG2 PRO 26 HG2 PRO 26 -26.977 0.055 -3.755 209 HG3 PRO 26 HG1 PRO 26 -25.544 0.979 -3.267 210 HD2 PRO 26 HD2 PRO 26 -27.482 1.504 -5.481 211 HD3 PRO 26 HD1 PRO 26 -26.657 2.647 -4.402 212 H THR 27 HN THR 27 -22.805 -0.820 -6.877 213 HA THR 27 HA THR 27 -23.571 -0.701 -9.641 214 HB THR 27 HB THR 27 -21.207 -0.877 -9.095 215 HG1 THR 27 HG1 THR 27 -20.905 -3.120 -10.227 216 HG21 THR 27 HG21 THR 27 -21.109 -2.053 -7.057 217 HG22 THR 27 HG22 THR 27 -20.354 -3.125 -8.237 218 HG23 THR 27 HG23 THR 27 -22.012 -3.420 -7.715 219 H VAL 28 HN VAL 28 -23.631 -2.944 -10.833 220 HA VAL 28 HA VAL 28 -25.944 -4.304 -10.347 221 HB VAL 28 HB VAL 28 -24.868 -4.630 -12.406 222 HG11 VAL 28 HG11 VAL 28 -22.554 -4.281 -11.576 223 HG12 VAL 28 HG12 VAL 28 -22.695 -5.626 -12.712 224 HG13 VAL 28 HG13 VAL 28 -22.558 -5.944 -10.983 225 HG21 VAL 28 HG21 VAL 28 -24.761 -7.203 -10.850 226 HG22 VAL 28 HG22 VAL 28 -24.713 -7.092 -12.610 227 HG23 VAL 28 HG23 VAL 28 -26.146 -6.555 -11.731 228 H GLU 29 HN GLU 29 -22.801 -4.928 -8.909 229 HA GLU 29 HA GLU 29 -23.736 -7.364 -7.647 230 HB2 GLU 29 HB2 GLU 29 -21.066 -5.977 -7.441 231 HB3 GLU 29 HB1 GLU 29 -21.432 -7.611 -6.901 232 HG2 GLU 29 HG2 GLU 29 -21.973 -8.198 -9.271 233 HG3 GLU 29 HG1 GLU 29 -21.431 -6.587 -9.733 234 H GLY 30 HN GLY 30 -24.046 -4.169 -6.936 235 HA2 GLY 30 HA2 GLY 30 -25.153 -3.313 -5.096 236 HA3 GLY 30 HA1 GLY 30 -24.946 -4.856 -4.281 237 H PHE 31 HN PHE 31 -22.330 -2.992 -5.652 238 HA PHE 31 HA PHE 31 -21.206 -2.676 -2.982 239 HB2 PHE 31 HB2 PHE 31 -19.893 -2.143 -5.661 240 HB3 PHE 31 HB1 PHE 31 -19.096 -2.250 -4.093 241 HD1 PHE 31 HD1 PHE 31 -20.788 -4.733 -3.206 242 HD2 PHE 31 HD2 PHE 31 -18.522 -3.839 -6.676 243 HE1 PHE 31 HE1 PHE 31 -20.407 -7.129 -3.566 244 HE2 PHE 31 HE2 PHE 31 -18.144 -6.222 -7.056 245 HZ PHE 31 HZ PHE 31 -19.085 -7.881 -5.499 246 H THR 32 HN THR 32 -21.179 -0.757 -1.983 247 HA THR 32 HA THR 32 -22.581 1.432 -3.332 248 HB THR 32 HB THR 32 -23.073 2.238 -1.064 249 HG1 THR 32 HG1 THR 32 -22.579 0.421 0.589 250 HG21 THR 32 HG21 THR 32 -23.745 -0.560 -1.726 251 HG22 THR 32 HG22 THR 32 -24.727 0.871 -1.976 252 HG23 THR 32 HG23 THR 32 -24.452 0.252 -0.345 253 H HIS 33 HN HIS 33 -19.577 0.724 -1.697 254 HA HIS 33 HA HIS 33 -18.880 3.595 -1.690 255 HB2 HIS 33 HB2 HIS 33 -18.226 1.332 0.153 256 HB3 HIS 33 HB1 HIS 33 -17.104 2.684 0.032 257 HD1 HIS 33 HD1 HIS 33 -20.683 1.919 1.031 258 HD2 HIS 33 HD2 HIS 33 -17.830 4.924 1.404 259 HE1 HIS 33 HE1 HIS 33 -21.613 3.544 2.721 260 HE2 HIS 33 HE2 HIS 33 -19.777 5.227 3.074 261 H ASP 34 HN ASP 34 -17.120 4.278 -2.748 262 HA ASP 34 HA ASP 34 -15.441 2.267 -4.094 263 HB2 ASP 34 HB2 ASP 34 -15.876 5.178 -4.833 264 HB3 ASP 34 HB1 ASP 34 -14.910 4.014 -5.731 265 H TRP 35 HN TRP 35 -13.253 2.343 -3.765 266 HA TRP 35 HA TRP 35 -12.149 4.674 -2.425 267 HB2 TRP 35 HB2 TRP 35 -10.938 3.239 -0.772 268 HB3 TRP 35 HB1 TRP 35 -12.666 3.368 -0.512 269 HD1 TRP 35 HD1 TRP 35 -14.046 1.133 -0.482 270 HE1 TRP 35 HE1 TRP 35 -13.385 -1.363 -0.634 271 HE3 TRP 35 HE3 TRP 35 -9.191 1.655 -2.014 272 HZ2 TRP 35 HZ2 TRP 35 -11.103 -2.893 -1.302 273 HZ3 TRP 35 HZ3 TRP 35 -7.839 -0.372 -2.383 274 HH2 TRP 35 HH2 TRP 35 -8.766 -2.588 -2.006 275 H MET 36 HN MET 36 -9.805 4.604 -2.276 276 HA MET 36 HA MET 36 -8.469 2.837 -4.190 277 HB2 MET 36 HB2 MET 36 -8.812 4.768 -5.540 278 HB3 MET 36 HB1 MET 36 -8.410 5.855 -4.217 279 HG2 MET 36 HG2 MET 36 -6.088 4.896 -4.276 280 HG3 MET 36 HG1 MET 36 -6.542 4.106 -5.789 281 HE1 MET 36 HE1 MET 36 -6.260 7.152 -3.774 282 HE2 MET 36 HE2 MET 36 -7.668 7.819 -4.615 283 HE3 MET 36 HE3 MET 36 -6.068 8.514 -4.886 284 H VAL 37 HN VAL 37 -6.460 2.231 -3.526 285 HA VAL 37 HA VAL 37 -5.508 3.384 -0.993 286 HB VAL 37 HB VAL 37 -4.023 1.172 -1.173 287 HG11 VAL 37 HG11 VAL 37 -6.846 1.284 -0.233 288 HG12 VAL 37 HG12 VAL 37 -5.443 1.793 0.689 289 HG13 VAL 37 HG13 VAL 37 -5.662 0.091 0.272 290 HG21 VAL 37 HG21 VAL 37 -4.913 0.415 -3.272 291 HG22 VAL 37 HG22 VAL 37 -6.561 0.545 -2.660 292 HG23 VAL 37 HG23 VAL 37 -5.467 -0.666 -1.994 293 H PHE 38 HN PHE 38 -3.242 3.524 -0.648 294 HA PHE 38 HA PHE 38 -1.693 4.232 -3.065 295 HB2 PHE 38 HB2 PHE 38 -2.367 5.770 -0.618 296 HB3 PHE 38 HB1 PHE 38 -0.694 5.865 -1.132 297 HD1 PHE 38 HD1 PHE 38 -0.086 6.956 -3.164 298 HD2 PHE 38 HD2 PHE 38 -4.145 6.826 -1.894 299 HE1 PHE 38 HE1 PHE 38 -0.611 8.788 -4.707 300 HE2 PHE 38 HE2 PHE 38 -4.690 8.642 -3.456 301 HZ PHE 38 HZ PHE 38 -2.937 9.635 -4.865 302 H VAL 39 HN VAL 39 0.163 3.044 -3.177 303 HA VAL 39 HA VAL 39 1.775 3.082 -0.733 304 HB VAL 39 HB VAL 39 2.860 0.925 -1.532 305 HG11 VAL 39 HG11 VAL 39 1.066 1.319 0.303 306 HG12 VAL 39 HG12 VAL 39 1.473 -0.325 -0.192 307 HG13 VAL 39 HG13 VAL 39 0.011 0.446 -0.809 308 HG21 VAL 39 HG21 VAL 39 2.166 0.504 -3.684 309 HG22 VAL 39 HG22 VAL 39 0.519 1.049 -3.367 310 HG23 VAL 39 HG23 VAL 39 1.063 -0.516 -2.761 311 H ARG 40 HN ARG 40 3.469 4.329 -1.059 312 HA ARG 40 HA ARG 40 5.061 4.310 -3.447 313 HB2 ARG 40 HB2 ARG 40 4.636 6.613 -4.142 314 HB3 ARG 40 HB1 ARG 40 3.139 5.687 -4.234 315 HG2 ARG 40 HG2 ARG 40 2.136 6.867 -2.592 316 HG3 ARG 40 HG1 ARG 40 3.627 7.064 -1.675 317 HD2 ARG 40 HD2 ARG 40 4.325 8.739 -3.476 318 HD3 ARG 40 HD1 ARG 40 2.633 8.689 -4.009 319 HE ARG 40 HE ARG 40 2.557 9.137 -1.283 320 HH11 ARG 40 HH11 ARG 40 3.852 10.786 -4.094 321 HH12 ARG 40 HH12 ARG 40 3.717 12.368 -3.372 322 HH21 ARG 40 HH21 ARG 40 2.383 11.166 -0.349 323 HH22 ARG 40 HH22 ARG 40 2.874 12.583 -1.237 324 H GLY 41 HN GLY 41 6.474 6.538 -3.296 325 HA2 GLY 41 HA2 GLY 41 7.301 6.715 -0.470 326 HA3 GLY 41 HA1 GLY 41 8.333 7.059 -1.850 327 HA PRO 42 HA PRO 42 5.890 10.879 0.053 328 HB2 PRO 42 HB2 PRO 42 8.619 11.392 1.132 329 HB3 PRO 42 HB1 PRO 42 7.043 11.729 1.856 330 HG2 PRO 42 HG2 PRO 42 8.542 9.673 2.684 331 HG3 PRO 42 HG1 PRO 42 6.776 9.560 2.613 332 HD2 PRO 42 HD2 PRO 42 8.830 8.367 0.827 333 HD3 PRO 42 HD1 PRO 42 7.221 7.762 1.272 334 H GLU 43 HN GLU 43 6.281 13.036 -0.557 335 HA GLU 43 HA GLU 43 6.746 13.356 -3.202 336 HB2 GLU 43 HB2 GLU 43 7.078 15.411 -1.023 337 HB3 GLU 43 HB1 GLU 43 7.007 15.792 -2.737 338 HG2 GLU 43 HG2 GLU 43 4.829 14.443 -1.163 339 HG3 GLU 43 HG1 GLU 43 4.871 16.143 -1.616 340 H HIS 44 HN HIS 44 8.358 13.326 -4.479 341 HA HIS 44 HA HIS 44 10.343 13.970 -5.444 342 HB2 HIS 44 HB2 HIS 44 11.191 14.736 -2.654 343 HB3 HIS 44 HB1 HIS 44 12.286 14.764 -4.028 344 HD1 HIS 44 HD1 HIS 44 11.323 16.319 -6.111 345 HD2 HIS 44 HD2 HIS 44 9.945 17.110 -2.264 346 HE1 HIS 44 HE1 HIS 44 10.376 18.649 -6.189 347 HE2 HIS 44 HE2 HIS 44 9.343 19.004 -3.920 348 H SER 45 HN SER 45 9.944 11.732 -2.904 349 HA SER 45 HA SER 45 12.409 10.328 -3.584 350 HB2 SER 45 HB2 SER 45 10.308 9.484 -1.609 351 HB3 SER 45 HB1 SER 45 11.982 8.956 -1.659 352 HG SER 45 HG SER 45 12.559 11.161 -1.170 353 H ASN 46 HN ASN 46 12.314 9.041 -5.333 354 HA ASN 46 HA ASN 46 9.762 7.789 -6.015 355 HB2 ASN 46 HB2 ASN 46 12.416 7.956 -7.450 356 HB3 ASN 46 HB1 ASN 46 11.119 6.903 -8.004 357 HD21 ASN 46 HD21 ASN 46 12.340 10.086 -7.851 358 HD22 ASN 46 HD22 ASN 46 11.089 10.845 -8.776 359 H ILE 47 HN ILE 47 9.290 5.780 -5.400 360 HA ILE 47 HA ILE 47 11.310 4.279 -4.002 361 HB ILE 47 HB ILE 47 9.652 2.768 -3.328 362 HG12 ILE 47 HG12 ILE 47 7.900 4.040 -5.429 363 HG13 ILE 47 HG11 ILE 47 8.453 2.366 -5.343 364 HG21 ILE 47 HG21 ILE 47 9.706 4.864 -2.183 365 HG22 ILE 47 HG22 ILE 47 8.054 4.257 -2.252 366 HG23 ILE 47 HG23 ILE 47 8.563 5.558 -3.328 367 HD11 ILE 47 HD11 ILE 47 7.165 2.550 -3.003 368 HD12 ILE 47 HD12 ILE 47 6.402 2.026 -4.504 369 HD13 ILE 47 HD13 ILE 47 6.227 3.695 -3.960 370 H GLN 48 HN GLN 48 9.997 4.408 -7.124 371 HA GLN 48 HA GLN 48 10.246 1.771 -8.006 372 HB2 GLN 48 HB2 GLN 48 9.052 3.421 -9.298 373 HB3 GLN 48 HB1 GLN 48 10.486 4.429 -9.432 374 HG2 GLN 48 HG2 GLN 48 11.355 3.201 -11.130 375 HG3 GLN 48 HG1 GLN 48 10.634 1.699 -10.573 376 HE21 GLN 48 HE21 GLN 48 8.476 1.215 -11.177 377 HE22 GLN 48 HE22 GLN 48 7.747 2.058 -12.497 378 H HIS 49 HN HIS 49 12.626 3.830 -6.954 379 HA HIS 49 HA HIS 49 14.798 2.793 -8.534 380 HB2 HIS 49 HB2 HIS 49 14.545 4.685 -6.247 381 HB3 HIS 49 HB1 HIS 49 16.109 3.893 -6.487 382 HD1 HIS 49 HD1 HIS 49 16.466 3.961 -9.459 383 HD2 HIS 49 HD2 HIS 49 14.859 7.138 -7.314 384 HE1 HIS 49 HE1 HIS 49 16.755 5.984 -10.920 385 HE2 HIS 49 HE2 HIS 49 15.592 7.845 -9.691 386 H PHE 50 HN PHE 50 13.426 2.161 -5.326 387 HA PHE 50 HA PHE 50 15.292 -0.097 -5.106 388 HB2 PHE 50 HB2 PHE 50 15.070 0.078 -2.649 389 HB3 PHE 50 HB1 PHE 50 15.771 1.517 -3.384 390 HD1 PHE 50 HD1 PHE 50 12.756 0.152 -1.757 391 HD2 PHE 50 HD2 PHE 50 14.738 3.606 -3.245 392 HE1 PHE 50 HE1 PHE 50 11.138 1.573 -0.599 393 HE2 PHE 50 HE2 PHE 50 13.086 5.038 -2.108 394 HZ PHE 50 HZ PHE 50 11.283 4.020 -0.780 395 H VAL 51 HN VAL 51 12.248 0.592 -5.864 396 HA VAL 51 HA VAL 51 11.142 -1.877 -4.707 397 HB VAL 51 HB VAL 51 9.817 0.798 -5.172 398 HG11 VAL 51 HG11 VAL 51 7.816 -0.628 -4.120 399 HG12 VAL 51 HG12 VAL 51 8.604 -1.905 -5.065 400 HG13 VAL 51 HG13 VAL 51 8.040 -0.437 -5.867 401 HG21 VAL 51 HG21 VAL 51 9.154 0.406 -2.771 402 HG22 VAL 51 HG22 VAL 51 10.871 0.664 -3.059 403 HG23 VAL 51 HG23 VAL 51 10.259 -0.965 -2.776 404 H GLU 52 HN GLU 52 10.201 -3.273 -6.080 405 HA GLU 52 HA GLU 52 10.696 -2.720 -8.920 406 HB2 GLU 52 HB2 GLU 52 11.790 -4.682 -7.859 407 HB3 GLU 52 HB1 GLU 52 10.206 -5.352 -7.503 408 HG2 GLU 52 HG2 GLU 52 11.114 -6.442 -9.425 409 HG3 GLU 52 HG1 GLU 52 9.740 -5.458 -9.927 410 H LYS 53 HN LYS 53 8.309 -4.545 -7.011 411 HA LYS 53 HA LYS 53 6.184 -3.440 -8.687 412 HB2 LYS 53 HB2 LYS 53 5.116 -5.685 -8.775 413 HB3 LYS 53 HB1 LYS 53 6.646 -5.606 -9.634 414 HG2 LYS 53 HG2 LYS 53 7.761 -6.697 -7.766 415 HG3 LYS 53 HG1 LYS 53 6.237 -6.789 -6.889 416 HD2 LYS 53 HD2 LYS 53 6.772 -8.039 -9.588 417 HD3 LYS 53 HD1 LYS 53 6.888 -8.895 -8.060 418 HE2 LYS 53 HE2 LYS 53 4.548 -8.592 -7.633 419 HE3 LYS 53 HE1 LYS 53 4.409 -7.519 -9.030 420 HZ1 LYS 53 HZ1 LYS 53 5.087 -9.466 -10.420 421 HZ2 LYS 53 HZ2 LYS 53 3.585 -9.648 -9.653 422 HZ3 LYS 53 HZ3 LYS 53 4.950 -10.441 -9.038 423 H VAL 54 HN VAL 54 4.004 -4.207 -7.673 424 HA VAL 54 HA VAL 54 4.147 -4.174 -4.753 425 HB VAL 54 HB VAL 54 3.044 -2.000 -6.483 426 HG11 VAL 54 HG11 VAL 54 2.135 -1.920 -3.707 427 HG12 VAL 54 HG12 VAL 54 1.349 -3.152 -4.689 428 HG13 VAL 54 HG13 VAL 54 1.294 -1.461 -5.185 429 HG21 VAL 54 HG21 VAL 54 3.900 -0.959 -4.113 430 HG22 VAL 54 HG22 VAL 54 4.877 -1.114 -5.567 431 HG23 VAL 54 HG23 VAL 54 4.959 -2.350 -4.311 432 H VAL 55 HN VAL 55 2.133 -4.822 -3.737 433 HA VAL 55 HA VAL 55 0.129 -5.958 -5.528 434 HB VAL 55 HB VAL 55 2.181 -7.560 -4.379 435 HG11 VAL 55 HG11 VAL 55 -0.558 -8.185 -3.291 436 HG12 VAL 55 HG12 VAL 55 0.868 -7.733 -2.354 437 HG13 VAL 55 HG13 VAL 55 0.836 -9.266 -3.226 438 HG21 VAL 55 HG21 VAL 55 -0.340 -8.330 -5.839 439 HG22 VAL 55 HG22 VAL 55 1.106 -9.325 -5.658 440 HG23 VAL 55 HG23 VAL 55 1.177 -7.828 -6.588 441 H PHE 56 HN PHE 56 -1.852 -6.265 -4.602 442 HA PHE 56 HA PHE 56 -2.170 -5.497 -1.776 443 HB2 PHE 56 HB2 PHE 56 -3.757 -4.618 -4.195 444 HB3 PHE 56 HB1 PHE 56 -4.474 -4.617 -2.583 445 HD1 PHE 56 HD1 PHE 56 -1.565 -3.303 -4.507 446 HD2 PHE 56 HD2 PHE 56 -4.230 -2.763 -1.226 447 HE1 PHE 56 HE1 PHE 56 -0.621 -1.074 -4.120 448 HE2 PHE 56 HE2 PHE 56 -3.281 -0.523 -0.836 449 HZ PHE 56 HZ PHE 56 -1.467 0.321 -2.280 450 H HIS 57 HN HIS 57 -3.243 -7.018 -0.609 451 HA HIS 57 HA HIS 57 -4.816 -9.023 -2.117 452 HB2 HIS 57 HB2 HIS 57 -3.794 -9.230 0.736 453 HB3 HIS 57 HB1 HIS 57 -4.628 -10.488 -0.176 454 HD1 HIS 57 HD1 HIS 57 -3.161 -12.168 -1.198 455 HD2 HIS 57 HD2 HIS 57 -1.175 -8.567 -0.562 456 HE1 HIS 57 HE1 HIS 57 -0.756 -12.597 -1.805 457 HE2 HIS 57 HE2 HIS 57 0.460 -10.471 -1.188 458 H LEU 58 HN LEU 58 -6.627 -7.698 -2.312 459 HA LEU 58 HA LEU 58 -7.876 -6.437 -0.090 460 HB2 LEU 58 HB2 LEU 58 -9.447 -7.317 -2.482 461 HB3 LEU 58 HB1 LEU 58 -9.617 -5.853 -1.531 462 HG LEU 58 HG LEU 58 -7.533 -6.447 -3.614 463 HD11 LEU 58 HD11 LEU 58 -8.616 -5.035 -4.937 464 HD12 LEU 58 HD12 LEU 58 -9.253 -4.061 -3.619 465 HD13 LEU 58 HD13 LEU 58 -9.992 -5.617 -4.011 466 HD21 LEU 58 HD21 LEU 58 -7.661 -4.192 -1.626 467 HD22 LEU 58 HD22 LEU 58 -6.787 -4.080 -3.153 468 HD23 LEU 58 HD23 LEU 58 -6.319 -5.287 -1.957 469 H HIS 59 HN HIS 59 -10.451 -7.152 0.131 470 HA HIS 59 HA HIS 59 -10.286 -9.663 1.523 471 HB2 HIS 59 HB2 HIS 59 -11.809 -7.523 1.959 472 HB3 HIS 59 HB1 HIS 59 -12.924 -8.388 0.908 473 HD1 HIS 59 HD1 HIS 59 -14.654 -9.250 2.508 474 HD2 HIS 59 HD2 HIS 59 -10.773 -9.961 3.833 475 HE1 HIS 59 HE1 HIS 59 -14.890 -10.595 4.616 476 HE2 HIS 59 HE2 HIS 59 -12.534 -11.128 5.334 477 H GLU 60 HN GLU 60 -11.228 -11.583 0.988 478 HA GLU 60 HA GLU 60 -10.826 -12.407 -1.616 479 HB2 GLU 60 HB2 GLU 60 -12.383 -13.728 0.595 480 HB3 GLU 60 HB1 GLU 60 -11.950 -14.527 -0.911 481 HG2 GLU 60 HG2 GLU 60 -10.001 -13.381 1.076 482 HG3 GLU 60 HG1 GLU 60 -10.425 -15.086 0.920 483 H SER 61 HN SER 61 -13.783 -11.263 -0.174 484 HA SER 61 HA SER 61 -15.560 -12.231 -2.143 485 HB2 SER 61 HB2 SER 61 -16.233 -11.380 0.107 486 HB3 SER 61 HB1 SER 61 -15.867 -9.747 -0.443 487 HG SER 61 HG SER 61 -18.027 -10.042 -0.765 488 H PHE 62 HN PHE 62 -13.297 -9.627 -2.122 489 HA PHE 62 HA PHE 62 -14.439 -8.152 -4.305 490 HB2 PHE 62 HB2 PHE 62 -11.647 -8.242 -3.133 491 HB3 PHE 62 HB1 PHE 62 -12.102 -7.187 -4.460 492 HD1 PHE 62 HD1 PHE 62 -13.141 -8.014 -0.973 493 HD2 PHE 62 HD2 PHE 62 -12.755 -5.051 -3.987 494 HE1 PHE 62 HE1 PHE 62 -13.832 -6.287 0.639 495 HE2 PHE 62 HE2 PHE 62 -13.450 -3.317 -2.392 496 HZ PHE 62 HZ PHE 62 -13.987 -3.935 -0.070 497 HA PRO 63 HA PRO 63 -13.388 -11.057 -7.513 498 HB2 PRO 63 HB2 PRO 63 -13.128 -8.627 -9.197 499 HB3 PRO 63 HB1 PRO 63 -14.120 -10.069 -9.445 500 HG2 PRO 63 HG2 PRO 63 -15.222 -7.761 -8.676 501 HG3 PRO 63 HG1 PRO 63 -15.802 -9.310 -8.033 502 HD2 PRO 63 HD2 PRO 63 -14.050 -7.256 -6.744 503 HD3 PRO 63 HD1 PRO 63 -15.336 -8.253 -6.030 504 H ARG 64 HN ARG 64 -11.419 -11.919 -7.511 505 HA ARG 64 HA ARG 64 -9.147 -12.171 -7.592 506 HB2 ARG 64 HB2 ARG 64 -9.087 -9.833 -9.486 507 HB3 ARG 64 HB1 ARG 64 -8.104 -11.292 -9.508 508 HG2 ARG 64 HG2 ARG 64 -10.065 -12.596 -10.181 509 HG3 ARG 64 HG1 ARG 64 -11.039 -11.132 -10.151 510 HD2 ARG 64 HD2 ARG 64 -8.629 -11.566 -11.902 511 HD3 ARG 64 HD1 ARG 64 -10.304 -11.759 -12.415 512 HE ARG 64 HE ARG 64 -9.731 -9.177 -11.276 513 HH11 ARG 64 HH11 ARG 64 -9.725 -11.089 -14.208 514 HH12 ARG 64 HH12 ARG 64 -9.793 -9.706 -15.259 515 HH21 ARG 64 HH21 ARG 64 -9.805 -7.362 -12.633 516 HH22 ARG 64 HH22 ARG 64 -9.830 -7.573 -14.361 517 HA PRO 65 HA PRO 65 -9.044 -8.517 -4.723 518 HB2 PRO 65 HB2 PRO 65 -7.939 -9.796 -2.582 519 HB3 PRO 65 HB1 PRO 65 -9.672 -9.777 -2.930 520 HG2 PRO 65 HG2 PRO 65 -7.646 -11.897 -3.499 521 HG3 PRO 65 HG1 PRO 65 -9.312 -12.063 -2.909 522 HD2 PRO 65 HD2 PRO 65 -8.633 -12.506 -5.489 523 HD3 PRO 65 HD1 PRO 65 -10.204 -11.843 -5.018 524 H LYS 66 HN LYS 66 -6.495 -10.623 -5.684 525 HA LYS 66 HA LYS 66 -4.427 -8.947 -4.623 526 HB2 LYS 66 HB2 LYS 66 -4.027 -11.338 -4.782 527 HB3 LYS 66 HB1 LYS 66 -4.270 -11.282 -6.521 528 HG2 LYS 66 HG2 LYS 66 -2.300 -9.917 -6.804 529 HG3 LYS 66 HG1 LYS 66 -2.091 -9.812 -5.056 530 HD2 LYS 66 HD2 LYS 66 -1.119 -11.814 -4.935 531 HD3 LYS 66 HD1 LYS 66 -2.273 -12.551 -6.046 532 HE2 LYS 66 HE2 LYS 66 -0.012 -10.762 -6.918 533 HE3 LYS 66 HE1 LYS 66 0.104 -12.519 -6.848 534 HZ1 LYS 66 HZ1 LYS 66 -0.443 -11.767 -9.077 535 HZ2 LYS 66 HZ2 LYS 66 -1.830 -10.980 -8.505 536 HZ3 LYS 66 HZ3 LYS 66 -1.723 -12.668 -8.426 537 H ARG 67 HN ARG 67 -4.193 -7.026 -5.491 538 HA ARG 67 HA ARG 67 -4.234 -6.807 -8.426 539 HB2 ARG 67 HB2 ARG 67 -4.383 -4.502 -6.476 540 HB3 ARG 67 HB1 ARG 67 -4.804 -4.512 -8.184 541 HG2 ARG 67 HG2 ARG 67 -6.297 -5.862 -5.953 542 HG3 ARG 67 HG1 ARG 67 -6.812 -4.450 -6.878 543 HD2 ARG 67 HD2 ARG 67 -6.854 -5.829 -8.920 544 HD3 ARG 67 HD1 ARG 67 -6.378 -7.239 -7.958 545 HE ARG 67 HE ARG 67 -8.524 -7.479 -7.306 546 HH11 ARG 67 HH11 ARG 67 -8.186 -4.181 -8.502 547 HH12 ARG 67 HH12 ARG 67 -9.898 -3.863 -8.405 548 HH21 ARG 67 HH21 ARG 67 -10.742 -7.047 -7.218 549 HH22 ARG 67 HH22 ARG 67 -11.339 -5.480 -7.673 550 H VAL 68 HN VAL 68 -2.373 -6.280 -9.448 551 HA VAL 68 HA VAL 68 -0.068 -5.746 -7.699 552 HB VAL 68 HB VAL 68 1.325 -7.007 -9.029 553 HG11 VAL 68 HG11 VAL 68 -0.281 -8.520 -8.012 554 HG12 VAL 68 HG12 VAL 68 0.218 -9.125 -9.593 555 HG13 VAL 68 HG13 VAL 68 -1.350 -8.343 -9.407 556 HG21 VAL 68 HG21 VAL 68 0.923 -5.874 -11.113 557 HG22 VAL 68 HG22 VAL 68 -0.619 -6.709 -11.309 558 HG23 VAL 68 HG23 VAL 68 0.892 -7.619 -11.368 559 H CYS 69 HN CYS 69 1.341 -4.103 -8.209 560 HA CYS 69 HA CYS 69 0.673 -2.496 -10.575 561 HB2 CYS 69 HB2 CYS 69 1.331 -1.529 -7.788 562 HB3 CYS 69 HB1 CYS 69 1.348 -0.481 -9.204 563 HG CYS 69 HG CYS 69 -1.504 -1.898 -9.371 564 H LYS 70 HN LYS 70 2.275 -2.792 -11.933 565 HA LYS 70 HA LYS 70 5.050 -3.005 -10.956 566 HB2 LYS 70 HB2 LYS 70 4.059 -3.338 -13.801 567 HB3 LYS 70 HB1 LYS 70 5.562 -3.923 -13.108 568 HG2 LYS 70 HG2 LYS 70 4.488 -5.678 -11.976 569 HG3 LYS 70 HG1 LYS 70 2.898 -4.938 -12.175 570 HD2 LYS 70 HD2 LYS 70 2.966 -5.349 -14.560 571 HD3 LYS 70 HD1 LYS 70 4.608 -5.981 -14.432 572 HE2 LYS 70 HE2 LYS 70 2.289 -7.193 -12.951 573 HE3 LYS 70 HE1 LYS 70 2.724 -7.682 -14.589 574 HZ1 LYS 70 HZ1 LYS 70 3.673 -8.987 -12.611 575 HZ2 LYS 70 HZ2 LYS 70 4.754 -7.686 -12.446 576 HZ3 LYS 70 HZ3 LYS 70 4.713 -8.579 -13.887 577 H ASP 71 HN ASP 71 3.058 -0.625 -11.514 578 HA ASP 71 HA ASP 71 4.613 0.906 -13.473 579 HB2 ASP 71 HB2 ASP 71 1.740 1.047 -12.565 580 HB3 ASP 71 HB1 ASP 71 2.480 2.339 -13.502 581 HA PRO 72 HA PRO 72 5.338 4.500 -10.581 582 HB2 PRO 72 HB2 PRO 72 3.300 5.721 -12.431 583 HB3 PRO 72 HB1 PRO 72 4.732 6.468 -11.711 584 HG2 PRO 72 HG2 PRO 72 4.874 5.634 -14.189 585 HG3 PRO 72 HG1 PRO 72 6.201 5.238 -13.074 586 HD2 PRO 72 HD2 PRO 72 4.027 3.495 -14.118 587 HD3 PRO 72 HD1 PRO 72 5.708 3.097 -13.755 588 HA PRO 73 HA PRO 73 2.650 5.628 -7.311 589 HB2 PRO 73 HB2 PRO 73 0.386 6.533 -9.045 590 HB3 PRO 73 HB1 PRO 73 0.896 7.145 -7.463 591 HG2 PRO 73 HG2 PRO 73 1.658 8.267 -9.861 592 HG3 PRO 73 HG1 PRO 73 2.581 8.411 -8.360 593 HD2 PRO 73 HD2 PRO 73 3.351 7.080 -10.755 594 HD3 PRO 73 HD1 PRO 73 4.240 7.143 -9.223 595 H TYR 74 HN TYR 74 2.226 3.763 -6.470 596 HA TYR 74 HA TYR 74 0.697 1.748 -7.853 597 HB2 TYR 74 HB2 TYR 74 1.985 1.609 -5.123 598 HB3 TYR 74 HB1 TYR 74 1.536 0.252 -6.143 599 HD1 TYR 74 HD2 TYR 74 3.821 3.203 -6.022 600 HD2 TYR 74 HD1 TYR 74 3.129 -0.681 -7.594 601 HE1 TYR 74 HE2 TYR 74 6.078 3.192 -6.983 602 HE2 TYR 74 HE1 TYR 74 5.396 -0.699 -8.561 603 HH TYR 74 HH TYR 74 7.088 0.950 -9.283 604 H LYS 75 HN LYS 75 -1.349 1.191 -7.410 605 HA LYS 75 HA LYS 75 -2.717 2.087 -5.018 606 HB2 LYS 75 HB2 LYS 75 -4.355 3.434 -6.423 607 HB3 LYS 75 HB1 LYS 75 -2.776 4.162 -6.176 608 HG2 LYS 75 HG2 LYS 75 -2.099 3.739 -8.363 609 HG3 LYS 75 HG1 LYS 75 -3.350 2.531 -8.618 610 HD2 LYS 75 HD2 LYS 75 -4.167 4.352 -9.793 611 HD3 LYS 75 HD1 LYS 75 -4.977 4.535 -8.246 612 HE2 LYS 75 HE2 LYS 75 -4.137 6.663 -8.926 613 HE3 LYS 75 HE1 LYS 75 -3.176 6.081 -7.574 614 HZ1 LYS 75 HZ1 LYS 75 -1.469 5.367 -9.129 615 HZ2 LYS 75 HZ2 LYS 75 -1.780 7.027 -9.299 616 HZ3 LYS 75 HZ3 LYS 75 -2.398 5.930 -10.432 617 H VAL 76 HN VAL 76 -4.801 1.312 -4.853 618 HA VAL 76 HA VAL 76 -5.767 -0.422 -7.029 619 HB VAL 76 HB VAL 76 -5.821 -1.015 -4.086 620 HG11 VAL 76 HG11 VAL 76 -8.116 -1.118 -5.161 621 HG12 VAL 76 HG12 VAL 76 -7.551 -2.585 -4.356 622 HG13 VAL 76 HG13 VAL 76 -7.493 -2.464 -6.118 623 HG21 VAL 76 HG21 VAL 76 -3.982 -1.972 -5.322 624 HG22 VAL 76 HG22 VAL 76 -5.082 -2.591 -6.545 625 HG23 VAL 76 HG23 VAL 76 -5.119 -3.248 -4.911 626 H GLU 77 HN GLU 77 -7.581 0.257 -7.842 627 HA GLU 77 HA GLU 77 -9.363 1.954 -6.238 628 HB2 GLU 77 HB2 GLU 77 -9.438 1.548 -9.218 629 HB3 GLU 77 HB1 GLU 77 -10.197 2.826 -8.295 630 HG2 GLU 77 HG2 GLU 77 -7.966 3.645 -7.703 631 HG3 GLU 77 HG1 GLU 77 -7.261 2.421 -8.741 632 H GLU 78 HN GLU 78 -11.089 0.978 -5.423 633 HA GLU 78 HA GLU 78 -12.325 -1.193 -6.950 634 HB2 GLU 78 HB2 GLU 78 -10.885 -1.488 -4.403 635 HB3 GLU 78 HB1 GLU 78 -12.495 -2.196 -4.397 636 HG2 GLU 78 HG2 GLU 78 -10.185 -2.861 -6.204 637 HG3 GLU 78 HG1 GLU 78 -10.984 -3.883 -5.013 638 H SER 79 HN SER 79 -14.221 -2.065 -5.459 639 HA SER 79 HA SER 79 -15.664 0.136 -4.227 640 HB2 SER 79 HB2 SER 79 -16.136 0.217 -6.694 641 HB3 SER 79 HB1 SER 79 -16.828 -1.403 -6.566 642 HG SER 79 HG SER 79 -17.799 1.058 -5.665 643 H GLY 80 HN GLY 80 -17.179 -0.555 -2.764 644 HA2 GLY 80 HA2 GLY 80 -17.977 -3.295 -2.486 645 HA3 GLY 80 HA1 GLY 80 -16.711 -2.854 -1.344 646 H TYR 81 HN TYR 81 -18.183 -3.096 0.464 647 HA TYR 81 HA TYR 81 -19.806 -0.691 0.773 648 HB2 TYR 81 HB2 TYR 81 -21.736 -1.994 1.684 649 HB3 TYR 81 HB1 TYR 81 -21.463 -2.197 -0.044 650 HD1 TYR 81 HD2 TYR 81 -21.365 -3.854 3.224 651 HD2 TYR 81 HD1 TYR 81 -20.720 -4.336 -0.951 652 HE1 TYR 81 HE2 TYR 81 -21.361 -6.285 3.519 653 HE2 TYR 81 HE1 TYR 81 -20.715 -6.779 -0.665 654 HH TYR 81 HH TYR 81 -21.784 -8.291 2.198 655 H ALA 82 HN ALA 82 -17.333 -2.090 2.002 656 HA ALA 82 HA ALA 82 -17.849 -1.120 4.633 657 HB1 ALA 82 HB1 ALA 82 -18.898 -3.227 4.985 658 HB2 ALA 82 HB2 ALA 82 -17.324 -3.293 5.775 659 HB3 ALA 82 HB3 ALA 82 -17.565 -4.088 4.219 660 H GLY 83 HN GLY 83 -15.959 -1.319 6.047 661 HA2 GLY 83 HA2 GLY 83 -13.476 -1.201 4.490 662 HA3 GLY 83 HA1 GLY 83 -13.728 -0.497 6.083 663 H PHE 84 HN PHE 84 -11.492 -1.831 5.942 664 HA PHE 84 HA PHE 84 -11.574 -4.034 7.637 665 HB2 PHE 84 HB2 PHE 84 -11.115 -5.902 6.081 666 HB3 PHE 84 HB1 PHE 84 -12.713 -5.219 5.816 667 HD1 PHE 84 HD1 PHE 84 -12.980 -3.561 3.883 668 HD2 PHE 84 HD2 PHE 84 -9.609 -6.126 4.303 669 HE1 PHE 84 HE1 PHE 84 -12.480 -3.280 1.497 670 HE2 PHE 84 HE2 PHE 84 -9.090 -5.849 1.922 671 HZ PHE 84 HZ PHE 84 -10.522 -4.426 0.503 672 H ILE 85 HN ILE 85 -9.455 -4.889 8.070 673 HA ILE 85 HA ILE 85 -7.207 -3.345 7.329 674 HB ILE 85 HB ILE 85 -7.460 -6.129 8.457 675 HG12 ILE 85 HG12 ILE 85 -7.939 -4.221 9.948 676 HG13 ILE 85 HG11 ILE 85 -6.517 -5.126 10.456 677 HG21 ILE 85 HG21 ILE 85 -4.887 -4.679 7.848 678 HG22 ILE 85 HG22 ILE 85 -5.469 -6.149 7.067 679 HG23 ILE 85 HG23 ILE 85 -5.029 -6.174 8.775 680 HD11 ILE 85 HD11 ILE 85 -6.380 -2.596 8.856 681 HD12 ILE 85 HD12 ILE 85 -5.054 -3.446 9.646 682 HD13 ILE 85 HD13 ILE 85 -6.297 -2.654 10.615 683 H LEU 86 HN LEU 86 -6.109 -3.281 5.488 684 HA LEU 86 HA LEU 86 -6.448 -5.516 3.599 685 HB2 LEU 86 HB2 LEU 86 -7.250 -3.043 3.113 686 HB3 LEU 86 HB1 LEU 86 -5.549 -2.802 2.746 687 HG LEU 86 HG LEU 86 -6.947 -5.091 1.446 688 HD11 LEU 86 HD11 LEU 86 -7.108 -2.291 0.362 689 HD12 LEU 86 HD12 LEU 86 -8.427 -3.068 1.238 690 HD13 LEU 86 HD13 LEU 86 -7.854 -3.755 -0.281 691 HD21 LEU 86 HD21 LEU 86 -5.291 -3.389 -0.143 692 HD22 LEU 86 HD22 LEU 86 -5.140 -5.116 0.172 693 HD23 LEU 86 HD23 LEU 86 -4.438 -3.944 1.293 694 HA PRO 87 HA PRO 87 -2.051 -6.080 4.534 695 HB2 PRO 87 HB2 PRO 87 -1.968 -8.429 3.092 696 HB3 PRO 87 HB1 PRO 87 -2.395 -8.320 4.802 697 HG2 PRO 87 HG2 PRO 87 -4.181 -8.500 2.408 698 HG3 PRO 87 HG1 PRO 87 -4.331 -9.305 3.982 699 HD2 PRO 87 HD2 PRO 87 -5.808 -7.146 3.369 700 HD3 PRO 87 HD1 PRO 87 -5.183 -7.410 5.009 701 H ILE 88 HN ILE 88 -1.087 -4.514 3.278 702 HA ILE 88 HA ILE 88 -1.049 -4.859 0.386 703 HB ILE 88 HB ILE 88 0.048 -2.512 1.959 704 HG12 ILE 88 HG12 ILE 88 -2.611 -2.536 0.538 705 HG13 ILE 88 HG11 ILE 88 -2.498 -3.091 2.208 706 HG21 ILE 88 HG21 ILE 88 0.872 -2.821 -0.335 707 HG22 ILE 88 HG22 ILE 88 -0.112 -1.365 -0.170 708 HG23 ILE 88 HG23 ILE 88 -0.792 -2.807 -0.923 709 HD11 ILE 88 HD11 ILE 88 -1.757 -0.359 1.193 710 HD12 ILE 88 HD12 ILE 88 -1.603 -0.909 2.856 711 HD13 ILE 88 HD13 ILE 88 -3.196 -0.784 2.111 712 H GLU 89 HN GLU 89 0.901 -5.028 -0.750 713 HA GLU 89 HA GLU 89 3.298 -5.485 0.895 714 HB2 GLU 89 HB2 GLU 89 2.342 -7.203 -1.394 715 HB3 GLU 89 HB1 GLU 89 3.932 -7.325 -0.656 716 HG2 GLU 89 HG2 GLU 89 2.823 -7.858 1.496 717 HG3 GLU 89 HG1 GLU 89 1.280 -7.878 0.647 718 H VAL 90 HN VAL 90 5.074 -4.511 0.187 719 HA VAL 90 HA VAL 90 5.099 -3.541 -2.590 720 HB VAL 90 HB VAL 90 6.782 -2.404 -0.375 721 HG11 VAL 90 HG11 VAL 90 7.312 -0.736 -1.968 722 HG12 VAL 90 HG12 VAL 90 6.108 -1.329 -3.092 723 HG13 VAL 90 HG13 VAL 90 7.548 -2.286 -2.750 724 HG21 VAL 90 HG21 VAL 90 4.243 -2.091 -0.158 725 HG22 VAL 90 HG22 VAL 90 4.377 -1.085 -1.600 726 HG23 VAL 90 HG23 VAL 90 5.249 -0.644 -0.130 727 H TYR 91 HN TYR 91 6.625 -4.338 -3.913 728 HA TYR 91 HA TYR 91 8.494 -6.285 -2.761 729 HB2 TYR 91 HB2 TYR 91 7.498 -5.742 -5.519 730 HB3 TYR 91 HB1 TYR 91 9.020 -6.601 -5.314 731 HD1 TYR 91 HD1 TYR 91 5.832 -6.743 -3.406 732 HD2 TYR 91 HD2 TYR 91 8.639 -8.848 -5.803 733 HE1 TYR 91 HE1 TYR 91 4.623 -8.821 -2.985 734 HE2 TYR 91 HE2 TYR 91 7.414 -10.951 -5.403 735 HH TYR 91 HH TYR 91 4.316 -10.997 -3.841 736 H PHE 92 HN PHE 92 10.604 -6.125 -2.733 737 HA PHE 92 HA PHE 92 11.730 -3.479 -3.365 738 HB2 PHE 92 HB2 PHE 92 12.506 -5.642 -1.385 739 HB3 PHE 92 HB1 PHE 92 13.506 -4.220 -1.699 740 HD1 PHE 92 HD1 PHE 92 11.144 -2.295 -2.018 741 HD2 PHE 92 HD2 PHE 92 12.087 -5.219 0.921 742 HE1 PHE 92 HE1 PHE 92 9.935 -0.982 -0.338 743 HE2 PHE 92 HE2 PHE 92 10.850 -3.902 2.611 744 HZ PHE 92 HZ PHE 92 9.792 -1.784 1.974 745 H LYS 93 HN LYS 93 13.944 -3.420 -4.244 746 HA LYS 93 HA LYS 93 14.533 -5.753 -5.946 747 HB2 LYS 93 HB2 LYS 93 15.726 -2.974 -6.047 748 HB3 LYS 93 HB1 LYS 93 15.993 -4.260 -7.214 749 HG2 LYS 93 HG2 LYS 93 13.776 -4.095 -8.021 750 HG3 LYS 93 HG1 LYS 93 13.308 -3.017 -6.697 751 HD2 LYS 93 HD2 LYS 93 14.734 -1.277 -7.523 752 HD3 LYS 93 HD1 LYS 93 15.467 -2.354 -8.716 753 HE2 LYS 93 HE2 LYS 93 12.918 -2.572 -9.478 754 HE3 LYS 93 HE1 LYS 93 12.816 -0.983 -8.722 755 HZ1 LYS 93 HZ1 LYS 93 14.584 -1.791 -10.958 756 HZ2 LYS 93 HZ2 LYS 93 14.711 -0.305 -10.152 757 HZ3 LYS 93 HZ3 LYS 93 13.297 -0.690 -11.008 758 H ASN 94 HN ASN 94 15.606 -7.056 -4.339 759 HA ASN 94 HA ASN 94 18.395 -6.393 -4.228 760 HB2 ASN 94 HB2 ASN 94 18.658 -6.547 -1.812 761 HB3 ASN 94 HB1 ASN 94 17.597 -5.212 -2.241 762 HD21 ASN 94 HD21 ASN 94 17.857 -6.572 0.255 763 HD22 ASN 94 HD22 ASN 94 16.314 -7.263 0.631 764 H LYS 95 HN LYS 95 19.672 -8.135 -3.124 765 HA LYS 95 HA LYS 95 18.436 -10.767 -3.610 766 HB2 LYS 95 HB2 LYS 95 21.299 -9.874 -3.813 767 HB3 LYS 95 HB1 LYS 95 20.796 -11.554 -3.920 768 HG2 LYS 95 HG2 LYS 95 19.500 -9.597 -5.724 769 HG3 LYS 95 HG1 LYS 95 21.167 -10.060 -6.071 770 HD2 LYS 95 HD2 LYS 95 19.709 -11.505 -7.311 771 HD3 LYS 95 HD1 LYS 95 20.433 -12.446 -6.008 772 HE2 LYS 95 HE2 LYS 95 18.376 -12.116 -4.677 773 HE3 LYS 95 HE1 LYS 95 17.658 -11.262 -6.044 774 HZ1 LYS 95 HZ1 LYS 95 16.979 -13.594 -5.946 775 HZ2 LYS 95 HZ2 LYS 95 18.595 -14.083 -6.092 776 HZ3 LYS 95 HZ3 LYS 95 17.840 -13.258 -7.369 777 H GLU 96 HN GLU 96 19.220 -8.692 -1.309 778 HA GLU 96 HA GLU 96 20.205 -10.627 0.646 779 HB2 GLU 96 HB2 GLU 96 20.315 -8.258 1.986 780 HB3 GLU 96 HB1 GLU 96 21.648 -8.853 1.010 781 HG2 GLU 96 HG2 GLU 96 19.521 -7.019 -0.042 782 HG3 GLU 96 HG1 GLU 96 21.023 -6.451 0.685 783 H GLU 97 HN GLU 97 19.203 -8.820 2.809 784 HA GLU 97 HA GLU 97 17.198 -10.141 3.923 785 HB2 GLU 97 HB2 GLU 97 17.452 -7.137 3.863 786 HB3 GLU 97 HB1 GLU 97 16.432 -8.027 4.991 787 HG2 GLU 97 HG2 GLU 97 19.435 -8.177 4.762 788 HG3 GLU 97 HG1 GLU 97 18.511 -7.405 6.048 789 HA PRO 98 HA PRO 98 13.230 -10.522 2.461 790 HB2 PRO 98 HB2 PRO 98 11.799 -8.383 3.731 791 HB3 PRO 98 HB1 PRO 98 11.819 -10.092 4.172 792 HG2 PRO 98 HG2 PRO 98 13.440 -7.844 5.218 793 HG3 PRO 98 HG1 PRO 98 12.898 -9.321 6.042 794 HD2 PRO 98 HD2 PRO 98 15.444 -9.058 5.344 795 HD3 PRO 98 HD1 PRO 98 14.617 -10.614 5.081 796 H ARG 99 HN ARG 99 12.676 -10.147 0.487 797 HA ARG 99 HA ARG 99 13.189 -7.577 -0.770 798 HB2 ARG 99 HB2 ARG 99 12.068 -10.076 -2.028 799 HB3 ARG 99 HB1 ARG 99 12.900 -8.742 -2.825 800 HG2 ARG 99 HG2 ARG 99 14.930 -9.311 -1.582 801 HG3 ARG 99 HG1 ARG 99 14.097 -10.696 -0.884 802 HD2 ARG 99 HD2 ARG 99 14.624 -10.262 -3.829 803 HD3 ARG 99 HD1 ARG 99 15.460 -11.399 -2.776 804 HE ARG 99 HE ARG 99 13.294 -12.550 -2.510 805 HH11 ARG 99 HH11 ARG 99 13.743 -10.428 -5.264 806 HH12 ARG 99 HH12 ARG 99 12.650 -11.309 -6.288 807 HH21 ARG 99 HH21 ARG 99 11.854 -13.717 -3.846 808 HH22 ARG 99 HH22 ARG 99 11.576 -13.187 -5.485 809 H LYS 100 HN LYS 100 10.930 -8.299 1.106 810 HA LYS 100 HA LYS 100 8.870 -6.877 -0.352 811 HB2 LYS 100 HB2 LYS 100 7.134 -8.602 0.262 812 HB3 LYS 100 HB1 LYS 100 8.247 -9.052 -1.020 813 HG2 LYS 100 HG2 LYS 100 9.597 -10.268 0.726 814 HG3 LYS 100 HG1 LYS 100 8.253 -9.991 1.834 815 HD2 LYS 100 HD2 LYS 100 7.983 -11.410 -0.816 816 HD3 LYS 100 HD1 LYS 100 8.267 -12.239 0.712 817 HE2 LYS 100 HE2 LYS 100 5.998 -12.399 0.609 818 HE3 LYS 100 HE1 LYS 100 6.134 -10.858 1.449 819 HZ1 LYS 100 HZ1 LYS 100 5.924 -9.769 -0.755 820 HZ2 LYS 100 HZ2 LYS 100 4.547 -10.627 -0.276 821 HZ3 LYS 100 HZ3 LYS 100 5.593 -11.284 -1.438 822 H VAL 101 HN VAL 101 7.555 -5.728 0.902 823 HA VAL 101 HA VAL 101 7.756 -6.120 3.809 824 HB VAL 101 HB VAL 101 8.952 -4.084 3.069 825 HG11 VAL 101 HG11 VAL 101 7.874 -3.342 1.135 826 HG12 VAL 101 HG12 VAL 101 7.445 -2.136 2.358 827 HG13 VAL 101 HG13 VAL 101 6.281 -3.381 1.908 828 HG21 VAL 101 HG21 VAL 101 7.950 -2.561 4.663 829 HG22 VAL 101 HG22 VAL 101 7.937 -4.210 5.291 830 HG23 VAL 101 HG23 VAL 101 6.457 -3.499 4.647 831 H ARG 102 HN ARG 102 5.833 -5.986 4.963 832 HA ARG 102 HA ARG 102 3.422 -5.797 3.295 833 HB2 ARG 102 HB2 ARG 102 3.911 -8.055 4.282 834 HB3 ARG 102 HB1 ARG 102 3.709 -7.334 5.872 835 HG2 ARG 102 HG2 ARG 102 1.415 -6.702 5.330 836 HG3 ARG 102 HG1 ARG 102 1.575 -7.426 3.732 837 HD2 ARG 102 HD2 ARG 102 0.468 -9.035 5.036 838 HD3 ARG 102 HD1 ARG 102 2.140 -9.589 4.958 839 HE ARG 102 HE ARG 102 1.934 -8.039 7.247 840 HH11 ARG 102 HH11 ARG 102 0.516 -10.983 5.987 841 HH12 ARG 102 HH12 ARG 102 0.249 -11.681 7.562 842 HH21 ARG 102 HH21 ARG 102 1.578 -8.950 9.329 843 HH22 ARG 102 HH22 ARG 102 0.833 -10.522 9.451 844 H PHE 103 HN PHE 103 2.161 -4.159 3.707 845 HA PHE 103 HA PHE 103 2.233 -2.986 6.402 846 HB2 PHE 103 HB2 PHE 103 1.508 -1.673 3.776 847 HB3 PHE 103 HB1 PHE 103 1.484 -0.888 5.347 848 HD1 PHE 103 HD1 PHE 103 3.998 -1.787 6.547 849 HD2 PHE 103 HD2 PHE 103 3.141 -0.618 2.542 850 HE1 PHE 103 HE1 PHE 103 6.334 -1.071 6.258 851 HE2 PHE 103 HE2 PHE 103 5.476 0.085 2.246 852 HZ PHE 103 HZ PHE 103 7.075 -0.136 4.105 853 H ASP 104 HN ASP 104 0.599 -3.984 7.436 854 HA ASP 104 HA ASP 104 -1.918 -4.548 6.182 855 HB2 ASP 104 HB2 ASP 104 -2.646 -5.136 8.522 856 HB3 ASP 104 HB1 ASP 104 -1.276 -6.050 7.911 857 H TYR 105 HN TYR 105 -2.637 -2.626 5.366 858 HA TYR 105 HA TYR 105 -2.811 -0.334 7.151 859 HB2 TYR 105 HB2 TYR 105 -1.926 0.026 4.889 860 HB3 TYR 105 HB1 TYR 105 -3.424 -0.597 4.194 861 HD1 TYR 105 HD1 TYR 105 -2.278 2.043 6.574 862 HD2 TYR 105 HD2 TYR 105 -5.012 0.909 3.541 863 HE1 TYR 105 HE1 TYR 105 -3.254 4.297 6.644 864 HE2 TYR 105 HE2 TYR 105 -6.006 3.143 3.572 865 HH TYR 105 HH TYR 105 -6.172 5.030 5.517 866 H ASP 106 HN ASP 106 -4.618 0.425 8.011 867 HA ASP 106 HA ASP 106 -6.993 -1.179 7.897 868 HB2 ASP 106 HB2 ASP 106 -6.151 -0.102 9.980 869 HB3 ASP 106 HB1 ASP 106 -6.530 1.470 9.284 870 H LEU 107 HN LEU 107 -8.365 -1.001 6.233 871 HA LEU 107 HA LEU 107 -8.713 1.538 4.847 872 HB2 LEU 107 HB2 LEU 107 -9.122 -1.271 4.264 873 HB3 LEU 107 HB1 LEU 107 -10.549 -0.337 3.866 874 HG LEU 107 HG LEU 107 -9.016 1.142 2.475 875 HD11 LEU 107 HD11 LEU 107 -6.949 -0.018 1.701 876 HD12 LEU 107 HD12 LEU 107 -7.133 -1.123 3.068 877 HD13 LEU 107 HD13 LEU 107 -6.881 0.600 3.354 878 HD21 LEU 107 HD21 LEU 107 -8.877 -0.628 0.656 879 HD22 LEU 107 HD22 LEU 107 -10.468 -0.320 1.359 880 HD23 LEU 107 HD23 LEU 107 -9.550 -1.741 1.852 881 H PHE 108 HN PHE 108 -10.127 2.954 5.799 882 HA PHE 108 HA PHE 108 -12.676 1.804 6.725 883 HB2 PHE 108 HB2 PHE 108 -12.922 3.493 8.380 884 HB3 PHE 108 HB1 PHE 108 -11.286 2.877 8.555 885 HD1 PHE 108 HD2 PHE 108 -13.339 5.728 7.521 886 HD2 PHE 108 HD1 PHE 108 -9.379 4.282 8.087 887 HE1 PHE 108 HE2 PHE 108 -12.483 8.025 7.363 888 HE2 PHE 108 HE1 PHE 108 -8.515 6.583 7.943 889 HZ PHE 108 HZ PHE 108 -10.067 8.454 7.563 890 H LEU 109 HN LEU 109 -14.581 2.918 6.216 891 HA LEU 109 HA LEU 109 -14.313 4.958 4.095 892 HB2 LEU 109 HB2 LEU 109 -16.517 2.893 4.302 893 HB3 LEU 109 HB1 LEU 109 -16.233 4.013 2.983 894 HG LEU 109 HG LEU 109 -14.484 1.661 3.724 895 HD11 LEU 109 HD11 LEU 109 -16.669 1.163 2.590 896 HD12 LEU 109 HD12 LEU 109 -15.233 0.646 1.715 897 HD13 LEU 109 HD13 LEU 109 -16.089 2.104 1.220 898 HD21 LEU 109 HD21 LEU 109 -14.207 3.669 1.492 899 HD22 LEU 109 HD22 LEU 109 -13.243 2.202 1.681 900 HD23 LEU 109 HD23 LEU 109 -13.133 3.490 2.881 901 H HIS 110 HN HIS 110 -16.135 6.521 4.070 902 HA HIS 110 HA HIS 110 -17.278 6.830 6.754 903 HB2 HIS 110 HB2 HIS 110 -16.480 8.751 4.646 904 HB3 HIS 110 HB1 HIS 110 -17.897 9.177 5.600 905 HD1 HIS 110 HD1 HIS 110 -17.051 10.907 7.164 906 HD2 HIS 110 HD2 HIS 110 -14.536 7.600 6.966 907 HE1 HIS 110 HE1 HIS 110 -15.288 11.286 8.918 908 HE2 HIS 110 HE2 HIS 110 -13.941 9.153 8.947 909 H LEU 111 HN LEU 111 -19.470 8.053 6.706 910 HA LEU 111 HA LEU 111 -21.289 6.078 5.909 911 HB2 LEU 111 HB2 LEU 111 -21.344 8.559 7.379 912 HB3 LEU 111 HB1 LEU 111 -22.786 8.377 6.393 913 HG LEU 111 HG LEU 111 -23.006 7.490 8.723 914 HD11 LEU 111 HD11 LEU 111 -23.995 5.311 8.008 915 HD12 LEU 111 HD12 LEU 111 -23.316 5.593 6.405 916 HD13 LEU 111 HD13 LEU 111 -24.524 6.700 7.061 917 HD21 LEU 111 HD21 LEU 111 -21.105 5.379 7.715 918 HD22 LEU 111 HD22 LEU 111 -21.940 5.383 9.273 919 HD23 LEU 111 HD23 LEU 111 -20.719 6.607 8.924 920 H GLU 112 HN GLU 112 -22.676 5.822 4.345 921 HA GLU 112 HA GLU 112 -22.353 6.849 1.806 922 HB2 GLU 112 HB2 GLU 112 -23.603 4.793 2.343 923 HB3 GLU 112 HB1 GLU 112 -24.883 5.761 3.057 924 HG2 GLU 112 HG2 GLU 112 -25.273 6.801 0.851 925 HG3 GLU 112 HG1 GLU 112 -24.057 5.724 0.164 926 H GLY 113 HN GLY 113 -22.804 8.708 0.902 927 HA2 GLY 113 HA2 GLY 113 -24.608 10.343 0.437 928 HA3 GLY 113 HA1 GLY 113 -24.791 10.467 2.182 929 H HIS 114 HN HIS 114 -22.246 10.694 3.113 930 HA HIS 114 HA HIS 114 -20.924 12.730 1.510 931 HB2 HIS 114 HB2 HIS 114 -20.855 14.398 3.315 932 HB3 HIS 114 HB1 HIS 114 -22.502 14.068 2.799 933 HD1 HIS 114 HD1 HIS 114 -20.566 14.538 5.752 934 HD2 HIS 114 HD2 HIS 114 -23.759 12.078 4.711 935 HE1 HIS 114 HE1 HIS 114 -21.599 13.803 7.926 936 HE2 HIS 114 HE2 HIS 114 -23.379 12.143 7.268 937 HA PRO 115 HA PRO 115 -17.683 10.641 3.877 938 HB2 PRO 115 HB2 PRO 115 -16.861 8.816 2.073 939 HB3 PRO 115 HB1 PRO 115 -18.231 8.522 3.147 940 HG2 PRO 115 HG2 PRO 115 -18.219 8.931 0.261 941 HG3 PRO 115 HG1 PRO 115 -19.534 8.362 1.300 942 HD2 PRO 115 HD2 PRO 115 -19.013 11.066 0.268 943 HD3 PRO 115 HD1 PRO 115 -20.505 10.394 0.965 944 HA PRO 116 HA PRO 116 -14.527 12.666 1.326 945 HB2 PRO 116 HB2 PRO 116 -13.741 14.533 3.092 946 HB3 PRO 116 HB1 PRO 116 -15.142 14.781 2.047 947 HG2 PRO 116 HG2 PRO 116 -15.037 14.273 4.944 948 HG3 PRO 116 HG1 PRO 116 -16.324 15.010 3.977 949 HD2 PRO 116 HD2 PRO 116 -16.120 12.288 4.924 950 HD3 PRO 116 HD1 PRO 116 -17.450 13.057 4.034 951 H VAL 117 HN VAL 117 -13.182 10.789 1.527 952 HA VAL 117 HA VAL 117 -11.699 10.690 4.082 953 HB VAL 117 HB VAL 117 -12.180 8.287 2.339 954 HG11 VAL 117 HG11 VAL 117 -10.440 7.703 3.667 955 HG12 VAL 117 HG12 VAL 117 -11.756 7.286 4.747 956 HG13 VAL 117 HG13 VAL 117 -10.886 8.806 4.954 957 HG21 VAL 117 HG21 VAL 117 -13.742 7.618 4.195 958 HG22 VAL 117 HG22 VAL 117 -14.345 8.811 3.046 959 HG23 VAL 117 HG23 VAL 117 -13.791 9.320 4.645 960 H ASN 118 HN ASN 118 -9.676 11.252 3.870 961 HA ASN 118 HA ASN 118 -8.097 10.108 1.689 962 HB2 ASN 118 HB2 ASN 118 -8.769 12.450 1.037 963 HB3 ASN 118 HB1 ASN 118 -7.899 13.037 2.450 964 HD21 ASN 118 HD21 ASN 118 -5.547 12.459 2.537 965 HD22 ASN 118 HD22 ASN 118 -4.681 12.388 1.045 966 H HIS 119 HN HIS 119 -6.359 9.131 2.610 967 HA HIS 119 HA HIS 119 -5.203 10.278 5.039 968 HB2 HIS 119 HB2 HIS 119 -7.085 8.513 5.446 969 HB3 HIS 119 HB1 HIS 119 -5.849 7.355 4.962 970 HD1 HIS 119 HD1 HIS 119 -4.791 6.344 6.937 971 HD2 HIS 119 HD2 HIS 119 -5.823 10.312 7.610 972 HE1 HIS 119 HE1 HIS 119 -4.137 6.818 9.318 973 HE2 HIS 119 HE2 HIS 119 -4.634 9.269 9.657 974 H LEU 120 HN LEU 120 -3.041 9.913 5.241 975 HA LEU 120 HA LEU 120 -1.696 7.855 3.692 976 HB2 LEU 120 HB2 LEU 120 -1.397 10.797 3.216 977 HB3 LEU 120 HB1 LEU 120 -0.022 9.741 2.995 978 HG LEU 120 HG LEU 120 -2.624 9.305 1.552 979 HD11 LEU 120 HD11 LEU 120 -0.728 10.223 -0.246 980 HD12 LEU 120 HD12 LEU 120 -0.584 11.318 1.131 981 HD13 LEU 120 HD13 LEU 120 -2.143 11.109 0.327 982 HD21 LEU 120 HD21 LEU 120 -0.722 7.530 1.897 983 HD22 LEU 120 HD22 LEU 120 0.079 8.464 0.630 984 HD23 LEU 120 HD23 LEU 120 -1.495 7.730 0.322 985 H ARG 121 HN ARG 121 0.360 7.333 4.462 986 HA ARG 121 HA ARG 121 1.537 8.861 6.617 987 HB2 ARG 121 HB2 ARG 121 0.791 7.662 8.381 988 HB3 ARG 121 HB1 ARG 121 -0.232 6.768 7.308 989 HG2 ARG 121 HG2 ARG 121 2.587 5.885 7.523 990 HG3 ARG 121 HG1 ARG 121 1.529 5.594 8.900 991 HD2 ARG 121 HD2 ARG 121 1.006 4.676 6.056 992 HD3 ARG 121 HD1 ARG 121 1.580 3.679 7.384 993 HE ARG 121 HE ARG 121 -1.006 5.048 7.552 994 HH11 ARG 121 HH11 ARG 121 0.926 2.132 7.679 995 HH12 ARG 121 HH12 ARG 121 -0.286 1.211 8.508 996 HH21 ARG 121 HH21 ARG 121 -2.586 3.862 8.668 997 HH22 ARG 121 HH22 ARG 121 -2.300 2.192 9.059 998 H CYS 122 HN CYS 122 3.697 8.705 6.566 999 HA CYS 122 HA CYS 122 4.897 6.814 4.730 1000 HB2 CYS 122 HB2 CYS 122 6.992 8.058 5.263 1001 HB3 CYS 122 HB1 CYS 122 5.704 9.054 4.598 1002 HG CYS 122 HG CYS 122 4.933 9.887 7.287 1003 H GLU 123 HN GLU 123 5.700 4.942 5.269 1004 HA GLU 123 HA GLU 123 6.403 4.332 8.053 1005 HB2 GLU 123 HB2 GLU 123 6.114 2.576 5.598 1006 HB3 GLU 123 HB1 GLU 123 6.539 1.988 7.204 1007 HG2 GLU 123 HG2 GLU 123 4.066 3.578 6.871 1008 HG3 GLU 123 HG1 GLU 123 4.065 1.900 6.327 1009 H LYS 124 HN LYS 124 8.492 3.083 8.325 1010 HA LYS 124 HA LYS 124 10.493 3.986 6.386 1011 HB2 LYS 124 HB2 LYS 124 10.640 5.584 8.135 1012 HB3 LYS 124 HB1 LYS 124 10.581 4.327 9.364 1013 HG2 LYS 124 HG2 LYS 124 12.787 3.490 8.466 1014 HG3 LYS 124 HG1 LYS 124 12.835 4.931 7.456 1015 HD2 LYS 124 HD2 LYS 124 14.168 5.267 9.401 1016 HD3 LYS 124 HD1 LYS 124 12.752 6.308 9.456 1017 HE2 LYS 124 HE2 LYS 124 12.751 3.618 10.729 1018 HE3 LYS 124 HE1 LYS 124 13.451 4.997 11.586 1019 HZ1 LYS 124 HZ1 LYS 124 10.635 4.547 10.782 1020 HZ2 LYS 124 HZ2 LYS 124 11.203 6.101 11.140 1021 HZ3 LYS 124 HZ3 LYS 124 11.252 4.888 12.323 1022 H LEU 125 HN LEU 125 12.008 2.580 5.865 1023 HA LEU 125 HA LEU 125 12.206 0.095 7.446 1024 HB2 LEU 125 HB2 LEU 125 12.711 0.410 4.488 1025 HB3 LEU 125 HB1 LEU 125 12.582 -1.087 5.388 1026 HG LEU 125 HG LEU 125 10.202 0.683 5.421 1027 HD11 LEU 125 HD11 LEU 125 10.822 0.861 3.081 1028 HD12 LEU 125 HD12 LEU 125 9.433 -0.214 3.260 1029 HD13 LEU 125 HD13 LEU 125 11.039 -0.890 2.991 1030 HD21 LEU 125 HD21 LEU 125 9.119 -1.574 5.135 1031 HD22 LEU 125 HD22 LEU 125 10.060 -1.357 6.613 1032 HD23 LEU 125 HD23 LEU 125 10.733 -2.273 5.265 1033 H THR 126 HN THR 126 14.040 0.566 8.655 1034 HA THR 126 HA THR 126 16.349 1.800 7.377 1035 HB THR 126 HB THR 126 16.539 0.688 10.140 1036 HG1 THR 126 HG1 THR 126 14.439 1.725 10.051 1037 HG21 THR 126 HG21 THR 126 18.299 2.016 8.812 1038 HG22 THR 126 HG22 THR 126 17.990 2.469 10.488 1039 HG23 THR 126 HG23 THR 126 17.295 3.419 9.174 1040 H PHE 127 HN PHE 127 17.871 0.654 6.414 1041 HA PHE 127 HA PHE 127 18.167 -2.185 7.108 1042 HB2 PHE 127 HB2 PHE 127 18.957 -0.743 4.563 1043 HB3 PHE 127 HB1 PHE 127 19.151 -2.467 4.864 1044 HD1 PHE 127 HD1 PHE 127 17.178 -3.939 5.000 1045 HD2 PHE 127 HD2 PHE 127 16.850 0.189 4.003 1046 HE1 PHE 127 HE1 PHE 127 14.895 -4.319 4.190 1047 HE2 PHE 127 HE2 PHE 127 14.563 -0.186 3.189 1048 HZ PHE 127 HZ PHE 127 13.579 -2.438 3.291 1049 H ASN 128 HN ASN 128 19.699 -2.403 8.551 1050 HA ASN 128 HA ASN 128 21.852 -0.529 8.807 1051 HB2 ASN 128 HB2 ASN 128 21.315 -3.157 10.200 1052 HB3 ASN 128 HB1 ASN 128 22.621 -2.052 10.616 1053 HD21 ASN 128 HD21 ASN 128 19.174 -2.552 10.633 1054 HD22 ASN 128 HD22 ASN 128 18.805 -1.285 11.762 1055 H ASN 129 HN ASN 129 23.569 -0.527 7.591 1056 HA ASN 129 HA ASN 129 25.298 -1.145 6.279 1057 HB2 ASN 129 HB2 ASN 129 25.296 -3.480 8.198 1058 HB3 ASN 129 HB1 ASN 129 26.597 -3.120 7.048 1059 HD21 ASN 129 HD21 ASN 129 26.395 -3.065 10.142 1060 HD22 ASN 129 HD22 ASN 129 27.058 -1.513 10.523 1061 HA PRO 130 HA PRO 130 23.195 -4.152 3.545 1062 HB2 PRO 130 HB2 PRO 130 22.267 -2.465 1.678 1063 HB3 PRO 130 HB1 PRO 130 21.382 -2.758 3.178 1064 HG2 PRO 130 HG2 PRO 130 22.957 -0.392 2.348 1065 HG3 PRO 130 HG1 PRO 130 21.578 -0.496 3.453 1066 HD2 PRO 130 HD2 PRO 130 24.341 -0.360 4.133 1067 HD3 PRO 130 HD1 PRO 130 22.967 -0.589 5.231 1068 H THR 131 HN THR 131 23.798 -4.662 1.286 1069 HA THR 131 HA THR 131 26.494 -4.092 0.647 1070 HB THR 131 HB THR 131 25.454 -6.161 -0.137 1071 HG1 THR 131 HG1 THR 131 26.367 -6.152 -2.138 1072 HG21 THR 131 HG21 THR 131 23.193 -5.479 -0.530 1073 HG22 THR 131 HG22 THR 131 23.854 -6.044 -2.068 1074 HG23 THR 131 HG23 THR 131 23.703 -4.315 -1.757 1075 H GLU 132 HN GLU 132 27.186 -3.072 -1.481 1076 HA GLU 132 HA GLU 132 26.407 -0.375 -1.420 1077 HB2 GLU 132 HB2 GLU 132 28.613 -1.306 -2.293 1078 HB3 GLU 132 HB1 GLU 132 27.747 -1.657 -3.785 1079 HG2 GLU 132 HG2 GLU 132 28.931 0.437 -3.972 1080 HG3 GLU 132 HG1 GLU 132 27.190 0.708 -4.021 1081 H ASP 133 HN ASP 133 25.573 -2.968 -3.692 1082 HA ASP 133 HA ASP 133 24.214 -1.505 -5.604 1083 HB2 ASP 133 HB2 ASP 133 23.592 -4.291 -4.607 1084 HB3 ASP 133 HB1 ASP 133 22.918 -3.584 -6.066 1085 H PHE 134 HN PHE 134 22.978 -2.880 -2.586 1086 HA PHE 134 HA PHE 134 20.292 -2.090 -3.036 1087 HB2 PHE 134 HB2 PHE 134 21.116 -3.911 -1.413 1088 HB3 PHE 134 HB1 PHE 134 21.505 -2.584 -0.321 1089 HD1 PHE 134 HD1 PHE 134 18.607 -2.776 -2.612 1090 HD2 PHE 134 HD2 PHE 134 19.951 -2.921 1.423 1091 HE1 PHE 134 HE1 PHE 134 16.293 -2.686 -1.843 1092 HE2 PHE 134 HE2 PHE 134 17.623 -2.841 2.197 1093 HZ PHE 134 HZ PHE 134 15.791 -2.723 0.556 1094 H ARG 135 HN ARG 135 22.863 -0.804 -0.951 1095 HA ARG 135 HA ARG 135 21.537 1.396 0.099 1096 HB2 ARG 135 HB2 ARG 135 23.671 0.750 0.959 1097 HB3 ARG 135 HB1 ARG 135 24.441 0.988 -0.607 1098 HG2 ARG 135 HG2 ARG 135 23.864 3.410 -0.426 1099 HG3 ARG 135 HG1 ARG 135 23.353 3.088 1.240 1100 HD2 ARG 135 HD2 ARG 135 26.134 2.692 0.102 1101 HD3 ARG 135 HD1 ARG 135 25.618 3.908 1.272 1102 HE ARG 135 HE ARG 135 25.372 2.164 2.896 1103 HH11 ARG 135 HH11 ARG 135 26.929 1.222 -0.093 1104 HH12 ARG 135 HH12 ARG 135 27.749 -0.144 0.616 1105 HH21 ARG 135 HH21 ARG 135 26.495 0.381 3.848 1106 HH22 ARG 135 HH22 ARG 135 27.495 -0.620 2.838 1107 H ARG 136 HN ARG 136 23.426 1.129 -2.846 1108 HA ARG 136 HA ARG 136 23.409 3.603 -3.939 1109 HB2 ARG 136 HB2 ARG 136 23.822 0.997 -4.756 1110 HB3 ARG 136 HB1 ARG 136 22.614 1.656 -5.821 1111 HG2 ARG 136 HG2 ARG 136 24.048 3.376 -6.568 1112 HG3 ARG 136 HG1 ARG 136 25.238 2.985 -5.318 1113 HD2 ARG 136 HD2 ARG 136 25.942 2.062 -7.451 1114 HD3 ARG 136 HD1 ARG 136 25.542 0.774 -6.311 1115 HE ARG 136 HE ARG 136 23.321 1.469 -7.969 1116 HH11 ARG 136 HH11 ARG 136 26.306 -0.357 -7.862 1117 HH12 ARG 136 HH12 ARG 136 25.779 -1.539 -9.022 1118 HH21 ARG 136 HH21 ARG 136 22.621 -0.079 -9.521 1119 HH22 ARG 136 HH22 ARG 136 23.701 -1.362 -9.993 1120 H LYS 137 HN LYS 137 20.895 1.166 -4.418 1121 HA LYS 137 HA LYS 137 19.176 2.834 -5.901 1122 HB2 LYS 137 HB2 LYS 137 18.541 0.369 -4.276 1123 HB3 LYS 137 HB1 LYS 137 17.418 1.151 -5.379 1124 HG2 LYS 137 HG2 LYS 137 18.874 0.657 -7.254 1125 HG3 LYS 137 HG1 LYS 137 20.063 -0.061 -6.163 1126 HD2 LYS 137 HD2 LYS 137 18.387 -1.747 -5.494 1127 HD3 LYS 137 HD1 LYS 137 17.251 -1.047 -6.653 1128 HE2 LYS 137 HE2 LYS 137 18.570 -1.693 -8.490 1129 HE3 LYS 137 HE1 LYS 137 19.957 -2.037 -7.473 1130 HZ1 LYS 137 HZ1 LYS 137 19.005 -4.086 -8.112 1131 HZ2 LYS 137 HZ2 LYS 137 17.452 -3.596 -7.659 1132 HZ3 LYS 137 HZ3 LYS 137 18.636 -3.865 -6.472 1133 H LEU 138 HN LEU 138 19.233 1.926 -2.505 1134 HA LEU 138 HA LEU 138 16.941 3.208 -1.597 1135 HB2 LEU 138 HB2 LEU 138 19.528 2.949 -0.083 1136 HB3 LEU 138 HB1 LEU 138 17.934 3.180 0.605 1137 HG LEU 138 HG LEU 138 19.009 0.718 -0.747 1138 HD11 LEU 138 HD11 LEU 138 19.601 1.094 1.625 1139 HD12 LEU 138 HD12 LEU 138 18.601 -0.338 1.372 1140 HD13 LEU 138 HD13 LEU 138 17.879 1.139 2.009 1141 HD21 LEU 138 HD21 LEU 138 16.193 1.311 0.098 1142 HD22 LEU 138 HD22 LEU 138 16.799 -0.288 -0.319 1143 HD23 LEU 138 HD23 LEU 138 16.761 0.989 -1.537 1144 H LEU 139 HN LEU 139 20.154 4.513 -2.158 1145 HA LEU 139 HA LEU 139 19.558 7.075 -1.001 1146 HB2 LEU 139 HB2 LEU 139 21.885 6.129 -2.671 1147 HB3 LEU 139 HB1 LEU 139 21.805 7.675 -1.846 1148 HG LEU 139 HG LEU 139 21.718 4.989 -0.476 1149 HD11 LEU 139 HD11 LEU 139 23.902 5.032 -1.109 1150 HD12 LEU 139 HD12 LEU 139 24.004 5.987 0.377 1151 HD13 LEU 139 HD13 LEU 139 23.960 6.796 -1.190 1152 HD21 LEU 139 HD21 LEU 139 20.536 6.779 0.683 1153 HD22 LEU 139 HD22 LEU 139 21.998 7.767 0.649 1154 HD23 LEU 139 HD23 LEU 139 21.973 6.257 1.564 1155 H LYS 140 HN LYS 140 19.453 5.673 -4.189 1156 HA LYS 140 HA LYS 140 19.384 8.123 -5.625 1157 HB2 LYS 140 HB2 LYS 140 19.219 5.305 -6.244 1158 HB3 LYS 140 HB1 LYS 140 18.081 6.253 -7.187 1159 HG2 LYS 140 HG2 LYS 140 19.872 7.680 -7.971 1160 HG3 LYS 140 HG1 LYS 140 21.031 6.778 -6.983 1161 HD2 LYS 140 HD2 LYS 140 19.795 4.793 -8.424 1162 HD3 LYS 140 HD1 LYS 140 19.890 6.106 -9.579 1163 HE2 LYS 140 HE2 LYS 140 22.067 4.674 -8.187 1164 HE3 LYS 140 HE1 LYS 140 21.846 4.933 -9.905 1165 HZ1 LYS 140 HZ1 LYS 140 22.609 7.005 -7.913 1166 HZ2 LYS 140 HZ2 LYS 140 22.309 7.298 -9.556 1167 HZ3 LYS 140 HZ3 LYS 140 23.618 6.319 -9.094 1168 H ALA 141 HN ALA 141 17.069 6.218 -3.996 1169 HA ALA 141 HA ALA 141 14.649 6.731 -5.088 1170 HB1 ALA 141 HB1 ALA 141 13.728 6.195 -3.049 1171 HB2 ALA 141 HB2 ALA 141 14.956 7.078 -2.145 1172 HB3 ALA 141 HB3 ALA 141 15.354 5.531 -2.892 1173 H1 GLY 212 HT1 GLY 212 -25.226 8.977 10.954 1174 H2 GLY 212 HT2 GLY 212 -25.198 8.333 12.525 1175 H3 GLY 212 HT3 GLY 212 -26.156 7.610 11.331 1176 HA2 GLY 212 HA1 GLY 212 -24.159 6.319 11.731 1177 HA3 GLY 212 HA2 GLY 212 -24.218 6.950 10.091 1178 H GLY 213 HN GLY 213 -22.234 6.469 12.645 1179 HA2 GLY 213 HA2 GLY 213 -20.634 8.890 12.214 1180 HA3 GLY 213 HA1 GLY 213 -20.367 7.677 13.460 1181 H LYS 214 HN LYS 214 -19.646 5.531 12.700 1182 HA LYS 214 HA LYS 214 -17.777 5.822 10.453 1183 HB2 LYS 214 HB2 LYS 214 -16.821 5.189 12.648 1184 HB3 LYS 214 HB1 LYS 214 -17.852 3.766 12.676 1185 HG2 LYS 214 HG2 LYS 214 -15.641 3.125 12.022 1186 HG3 LYS 214 HG1 LYS 214 -16.723 2.945 10.643 1187 HD2 LYS 214 HD2 LYS 214 -14.795 3.932 9.752 1188 HD3 LYS 214 HD1 LYS 214 -15.926 5.271 9.940 1189 HE2 LYS 214 HE2 LYS 214 -13.837 4.581 11.995 1190 HE3 LYS 214 HE1 LYS 214 -13.543 5.705 10.671 1191 HZ1 LYS 214 HZ1 LYS 214 -15.390 7.061 11.495 1192 HZ2 LYS 214 HZ2 LYS 214 -14.160 6.895 12.650 1193 HZ3 LYS 214 HZ3 LYS 214 -15.590 6.002 12.803 1194 H ALA 215 HN ALA 215 -18.036 4.646 8.645 1195 HA ALA 215 HA ALA 215 -20.462 3.319 8.118 1196 HB1 ALA 215 HB1 ALA 215 -19.431 2.682 5.992 1197 HB2 ALA 215 HB2 ALA 215 -17.853 3.178 6.602 1198 HB3 ALA 215 HB3 ALA 215 -19.123 4.378 6.365 1199 HA PRO 216 HA PRO 216 -19.875 -0.756 9.656 1200 HB2 PRO 216 HB2 PRO 216 -20.985 -2.220 7.593 1201 HB3 PRO 216 HB1 PRO 216 -21.904 -1.418 8.867 1202 HG2 PRO 216 HG2 PRO 216 -21.335 -0.499 6.086 1203 HG3 PRO 216 HG1 PRO 216 -22.828 -0.360 7.029 1204 HD2 PRO 216 HD2 PRO 216 -21.157 1.705 6.675 1205 HD3 PRO 216 HD1 PRO 216 -22.055 1.486 8.191 1206 H ARG 217 HN ARG 217 -18.618 -2.654 9.383 1207 HA ARG 217 HA ARG 217 -16.687 -2.550 7.177 1208 HB2 ARG 217 HB2 ARG 217 -16.041 -2.591 10.129 1209 HB3 ARG 217 HB1 ARG 217 -14.870 -3.009 8.886 1210 HG2 ARG 217 HG2 ARG 217 -15.093 -0.768 7.926 1211 HG3 ARG 217 HG1 ARG 217 -16.261 -0.353 9.182 1212 HD2 ARG 217 HD2 ARG 217 -13.974 0.476 9.653 1213 HD3 ARG 217 HD1 ARG 217 -14.585 -0.614 10.898 1214 HE ARG 217 HE ARG 217 -13.231 -2.371 9.617 1215 HH11 ARG 217 HH11 ARG 217 -12.302 1.005 9.853 1216 HH12 ARG 217 HH12 ARG 217 -10.597 0.664 9.734 1217 HH21 ARG 217 HH21 ARG 217 -11.022 -2.807 9.495 1218 HH22 ARG 217 HH22 ARG 217 -9.868 -1.500 9.581 1219 H1 KCR 218 HN KCR 218 -15.151 -4.511 7.377 1220 H4 KCR 218 HA KCR 218 -16.742 -6.902 8.059 1221 H5 KCR 218 HB1 KCR 218 -15.679 -8.042 6.186 1222 H6 KCR 218 HB2 KCR 218 -14.695 -6.626 5.846 1223 H7 KCR 218 HG1 KCR 218 -16.723 -5.361 5.293 1224 H8 KCR 218 HG2 KCR 218 -17.689 -6.807 5.593 1225 H9 KCR 218 HD1 KCR 218 -16.619 -7.973 3.791 1226 H10 KCR 218 HD2 KCR 218 -15.476 -6.650 3.557 1227 H11 KCR 218 HE1 KCR 218 -17.285 -5.176 2.881 1228 H12 KCR 218 HE2 KCR 218 -18.463 -6.456 3.175 1229 H13 KCR 218 HZ1 KCR 218 -17.318 -7.701 1.361 1230 H14 KCR 218 HH1 KCR 218 -16.879 -7.633 -0.995 1231 H15 KCR 218 HJ1 KCR 218 -17.037 -4.716 -1.963 1232 H16 KCR 218 HF3 KCR 218 -16.440 -5.662 -4.100 1233 H17 KCR 218 HF1 KCR 218 -15.754 -7.074 -3.298 1234 H18 KCR 218 HF2 KCR 218 -17.487 -6.999 -3.622 1235 H GLN 219 HN GLN 219 -15.010 -8.869 7.994 1236 HA GLN 219 HA GLN 219 -13.430 -9.959 9.184 1237 HB2 GLN 219 HB2 GLN 219 -11.859 -7.406 8.804 1238 HB3 GLN 219 HB1 GLN 219 -11.190 -8.942 9.337 1239 HG2 GLN 219 HG2 GLN 219 -12.043 -9.906 7.157 1240 HG3 GLN 219 HG1 GLN 219 -12.327 -8.242 6.650 1241 HE21 GLN 219 HE21 GLN 219 -10.552 -6.871 6.350 1242 HE22 GLN 219 HE22 GLN 219 -8.953 -7.483 6.118 1243 H LEU 220 HN LEU 220 -15.045 -9.701 10.935 1244 HA LEU 220 HA LEU 220 -15.418 -9.623 13.167 1245 HB2 LEU 220 HB2 LEU 220 -12.490 -8.924 13.208 1246 HB3 LEU 220 HB1 LEU 220 -13.442 -9.014 14.674 1247 HG LEU 220 HG LEU 220 -13.979 -11.411 14.052 1248 HD11 LEU 220 HD11 LEU 220 -12.454 -12.530 12.506 1249 HD12 LEU 220 HD12 LEU 220 -11.745 -10.972 12.078 1250 HD13 LEU 220 HD13 LEU 220 -13.430 -11.311 11.685 1251 HD21 LEU 220 HD21 LEU 220 -11.819 -12.250 14.846 1252 HD22 LEU 220 HD22 LEU 220 -12.361 -10.849 15.770 1253 HD23 LEU 220 HD23 LEU 220 -11.101 -10.666 14.548 1254 H ALA 221 HN ALA 221 -15.808 -7.311 11.427 1255 HA ALA 221 HA ALA 221 -16.213 -5.355 13.560 1256 HB1 ALA 221 HB1 ALA 221 -14.966 -4.640 10.906 1257 HB2 ALA 221 HB2 ALA 221 -14.131 -4.680 12.459 1258 HB3 ALA 221 HB3 ALA 221 -15.420 -3.508 12.180 1259 H THR 222 HN THR 222 -17.818 -7.265 11.949 1260 HA THR 222 HA THR 222 -19.469 -5.489 10.310 1261 HB THR 222 HB THR 222 -19.559 -8.504 10.601 1262 HG1 THR 222 HG1 THR 222 -18.198 -6.744 8.842 1263 HG21 THR 222 HG21 THR 222 -21.684 -7.552 9.811 1264 HG22 THR 222 HG22 THR 222 -20.869 -8.449 8.530 1265 HG23 THR 222 HG23 THR 222 -20.821 -6.687 8.539 1266 H LYS 223 HN LYS 223 -21.619 -5.109 10.728 1267 HA LYS 223 HA LYS 223 -22.613 -6.004 13.356 1268 HB2 LYS 223 HB2 LYS 223 -23.379 -3.588 11.702 1269 HB3 LYS 223 HB1 LYS 223 -24.132 -4.041 13.224 1270 HG2 LYS 223 HG2 LYS 223 -22.064 -3.686 14.408 1271 HG3 LYS 223 HG1 LYS 223 -21.218 -3.365 12.892 1272 HD2 LYS 223 HD2 LYS 223 -22.582 -1.392 12.520 1273 HD3 LYS 223 HD1 LYS 223 -23.509 -1.731 13.982 1274 HE2 LYS 223 HE2 LYS 223 -21.510 -1.427 15.338 1275 HE3 LYS 223 HE1 LYS 223 -20.552 -1.142 13.885 1276 HZ1 LYS 223 HZ1 LYS 223 -22.882 0.537 14.610 1277 HZ2 LYS 223 HZ2 LYS 223 -21.664 0.877 13.482 1278 HZ3 LYS 223 HZ3 LYS 223 -21.311 0.886 15.139 1279 H ALA 224 HN ALA 224 -22.867 -6.633 10.146 1280 HA ALA 224 HA ALA 224 -25.701 -7.380 10.297 1281 HB1 ALA 224 HB1 ALA 224 -25.074 -5.986 8.381 1282 HB2 ALA 224 HB2 ALA 224 -25.620 -7.583 7.867 1283 HB3 ALA 224 HB3 ALA 224 -23.898 -7.204 7.883 Start of MODEL 13 1 H1 GLY 1 HT1 GLY 1 34.787 -11.248 9.070 2 H2 GLY 1 HT2 GLY 1 36.299 -10.532 9.362 3 H3 GLY 1 HT3 GLY 1 35.416 -10.117 7.974 4 HA2 GLY 1 HA1 GLY 1 33.693 -9.117 9.321 5 HA3 GLY 1 HA2 GLY 1 34.589 -9.561 10.768 6 H SER 2 HN SER 2 34.874 -7.478 11.484 7 HA SER 2 HA SER 2 35.946 -5.504 11.759 8 HB2 SER 2 HB2 SER 2 37.853 -6.541 9.649 9 HB3 SER 2 HB1 SER 2 38.169 -5.241 10.797 10 HG SER 2 HG SER 2 37.362 -7.705 11.840 11 H HIS 3 HN HIS 3 33.765 -5.611 9.958 12 HA HIS 3 HA HIS 3 34.451 -3.297 8.272 13 HB2 HIS 3 HB2 HIS 3 32.687 -5.637 7.518 14 HB3 HIS 3 HB1 HIS 3 32.738 -4.124 6.620 15 HD1 HIS 3 HD1 HIS 3 34.080 -7.390 6.487 16 HD2 HIS 3 HD2 HIS 3 35.659 -3.591 5.858 17 HE1 HIS 3 HE1 HIS 3 36.157 -7.732 5.109 18 HE2 HIS 3 HE2 HIS 3 37.004 -5.411 4.605 19 H MET 4 HN MET 4 33.536 -3.135 10.860 20 HA MET 4 HA MET 4 30.834 -2.037 10.446 21 HB2 MET 4 HB2 MET 4 31.894 -3.418 12.919 22 HB3 MET 4 HB1 MET 4 30.372 -2.541 12.846 23 HG2 MET 4 HG2 MET 4 29.591 -4.110 11.113 24 HG3 MET 4 HG1 MET 4 31.092 -5.015 11.292 25 HE1 MET 4 HE1 MET 4 27.913 -4.584 14.613 26 HE2 MET 4 HE2 MET 4 27.743 -3.906 12.993 27 HE3 MET 4 HE3 MET 4 28.951 -3.253 14.100 28 H ALA 5 HN ALA 5 33.301 -0.684 10.082 29 HA ALA 5 HA ALA 5 34.034 0.849 12.353 30 HB1 ALA 5 HB1 ALA 5 35.028 2.396 10.639 31 HB2 ALA 5 HB2 ALA 5 34.405 1.301 9.404 32 HB3 ALA 5 HB3 ALA 5 35.592 0.726 10.578 33 H SER 6 HN SER 6 32.069 1.657 9.505 34 HA SER 6 HA SER 6 30.982 3.937 11.008 35 HB2 SER 6 HB2 SER 6 31.115 3.535 8.010 36 HB3 SER 6 HB1 SER 6 30.566 4.984 8.849 37 HG SER 6 HG SER 6 33.184 3.888 8.845 38 H SER 7 HN SER 7 29.162 3.194 11.949 39 HA SER 7 HA SER 7 27.434 1.262 10.803 40 HB2 SER 7 HB2 SER 7 26.827 3.322 12.950 41 HB3 SER 7 HB1 SER 7 25.902 1.855 12.620 42 HG SER 7 HG SER 7 28.084 0.797 12.993 43 H CYS 8 HN CYS 8 26.408 1.614 8.957 44 HA CYS 8 HA CYS 8 25.104 4.217 8.574 45 HB2 CYS 8 HB2 CYS 8 25.537 3.675 6.061 46 HB3 CYS 8 HB1 CYS 8 26.814 4.370 7.047 47 HG CYS 8 HG CYS 8 28.272 2.074 7.342 48 H ALA 9 HN ALA 9 23.041 3.866 8.824 49 HA ALA 9 HA ALA 9 21.843 1.505 7.537 50 HB1 ALA 9 HB1 ALA 9 19.936 1.859 9.057 51 HB2 ALA 9 HB2 ALA 9 20.781 3.233 9.774 52 HB3 ALA 9 HB3 ALA 9 21.445 1.608 9.936 53 H VAL 10 HN VAL 10 20.702 1.853 5.756 54 HA VAL 10 HA VAL 10 19.993 4.613 5.065 55 HB VAL 10 HB VAL 10 19.933 2.177 3.276 56 HG11 VAL 10 HG11 VAL 10 18.532 3.747 2.305 57 HG12 VAL 10 HG12 VAL 10 20.081 4.068 1.524 58 HG13 VAL 10 HG13 VAL 10 19.520 5.109 2.834 59 HG21 VAL 10 HG21 VAL 10 22.204 2.391 3.713 60 HG22 VAL 10 HG22 VAL 10 22.119 4.148 3.835 61 HG23 VAL 10 HG23 VAL 10 21.994 3.366 2.260 62 H GLN 11 HN GLN 11 17.984 5.248 5.368 63 HA GLN 11 HA GLN 11 15.961 3.177 5.828 64 HB2 GLN 11 HB2 GLN 11 15.509 6.034 6.574 65 HB3 GLN 11 HB1 GLN 11 14.909 4.573 7.346 66 HG2 GLN 11 HG2 GLN 11 16.447 5.026 8.905 67 HG3 GLN 11 HG1 GLN 11 17.575 4.326 7.749 68 HE21 GLN 11 HE21 GLN 11 16.366 7.267 9.141 69 HE22 GLN 11 HE22 GLN 11 17.628 8.298 8.553 70 H VAL 12 HN VAL 12 14.342 2.929 4.505 71 HA VAL 12 HA VAL 12 13.841 5.031 2.523 72 HB VAL 12 HB VAL 12 12.760 3.204 1.203 73 HG11 VAL 12 HG11 VAL 12 15.236 3.927 1.015 74 HG12 VAL 12 HG12 VAL 12 14.776 2.387 0.297 75 HG13 VAL 12 HG13 VAL 12 15.589 2.422 1.859 76 HG21 VAL 12 HG21 VAL 12 12.286 1.744 3.081 77 HG22 VAL 12 HG22 VAL 12 14.004 1.399 3.250 78 HG23 VAL 12 HG23 VAL 12 13.141 0.908 1.790 79 H LYS 13 HN LYS 13 11.776 5.842 2.326 80 HA LYS 13 HA LYS 13 9.880 4.898 4.344 81 HB2 LYS 13 HB2 LYS 13 10.377 7.611 3.176 82 HB3 LYS 13 HB1 LYS 13 8.812 7.217 3.876 83 HG2 LYS 13 HG2 LYS 13 9.907 6.621 5.969 84 HG3 LYS 13 HG1 LYS 13 11.462 7.104 5.281 85 HD2 LYS 13 HD2 LYS 13 10.702 9.370 5.008 86 HD3 LYS 13 HD1 LYS 13 9.070 8.925 5.507 87 HE2 LYS 13 HE2 LYS 13 9.883 8.379 7.733 88 HE3 LYS 13 HE1 LYS 13 11.532 8.766 7.239 89 HZ1 LYS 13 HZ1 LYS 13 9.297 10.719 7.168 90 HZ2 LYS 13 HZ2 LYS 13 10.953 11.035 6.959 91 HZ3 LYS 13 HZ3 LYS 13 10.367 10.560 8.475 92 H LEU 14 HN LEU 14 8.144 3.942 3.729 93 HA LEU 14 HA LEU 14 7.139 4.408 0.995 94 HB2 LEU 14 HB2 LEU 14 6.769 1.975 2.722 95 HB3 LEU 14 HB1 LEU 14 6.065 2.205 1.141 96 HG LEU 14 HG LEU 14 9.036 2.046 1.671 97 HD11 LEU 14 HD11 LEU 14 7.103 -0.000 0.623 98 HD12 LEU 14 HD12 LEU 14 7.960 -0.065 2.163 99 HD13 LEU 14 HD13 LEU 14 8.856 -0.175 0.647 100 HD21 LEU 14 HD21 LEU 14 7.521 1.870 -0.930 101 HD22 LEU 14 HD22 LEU 14 9.271 1.914 -0.699 102 HD23 LEU 14 HD23 LEU 14 8.298 3.340 -0.339 103 H GLU 15 HN GLU 15 5.025 4.896 0.778 104 HA GLU 15 HA GLU 15 3.767 5.770 3.288 105 HB2 GLU 15 HB2 GLU 15 4.557 7.572 1.821 106 HB3 GLU 15 HB1 GLU 15 3.567 6.950 0.512 107 HG2 GLU 15 HG2 GLU 15 1.583 7.607 1.549 108 HG3 GLU 15 HG1 GLU 15 2.363 7.818 3.116 109 H LEU 16 HN LEU 16 1.913 4.915 3.840 110 HA LEU 16 HA LEU 16 0.338 3.398 1.888 111 HB2 LEU 16 HB2 LEU 16 0.147 3.630 4.881 112 HB3 LEU 16 HB1 LEU 16 -1.093 2.855 3.920 113 HG LEU 16 HG LEU 16 0.185 1.125 4.829 114 HD11 LEU 16 HD11 LEU 16 1.700 1.109 2.358 115 HD12 LEU 16 HD12 LEU 16 -0.023 1.409 2.141 116 HD13 LEU 16 HD13 LEU 16 0.523 -0.048 2.974 117 HD21 LEU 16 HD21 LEU 16 2.688 2.400 3.836 118 HD22 LEU 16 HD22 LEU 16 2.537 1.010 4.904 119 HD23 LEU 16 HD23 LEU 16 2.085 2.620 5.472 120 H GLY 17 HN GLY 17 -1.702 4.001 1.339 121 HA2 GLY 17 HA2 GLY 17 -2.919 6.300 2.644 122 HA3 GLY 17 HA1 GLY 17 -2.442 6.527 0.961 123 H HIS 18 HN HIS 18 -5.028 6.840 1.676 124 HA HIS 18 HA HIS 18 -6.249 5.220 -0.246 125 HB2 HIS 18 HB2 HIS 18 -7.038 3.429 0.853 126 HB3 HIS 18 HB1 HIS 18 -6.068 3.902 2.236 127 HD1 HIS 18 HD1 HIS 18 -7.347 5.358 4.087 128 HD2 HIS 18 HD2 HIS 18 -9.745 3.521 1.232 129 HE1 HIS 18 HE1 HIS 18 -9.675 5.418 5.021 130 HE2 HIS 18 HE2 HIS 18 -11.072 4.134 3.369 131 H ARG 19 HN ARG 19 -8.206 5.965 -0.831 132 HA ARG 19 HA ARG 19 -9.407 8.087 0.818 133 HB2 ARG 19 HB2 ARG 19 -9.493 7.861 -2.197 134 HB3 ARG 19 HB1 ARG 19 -10.236 9.114 -1.231 135 HG2 ARG 19 HG2 ARG 19 -8.012 9.856 -0.508 136 HG3 ARG 19 HG1 ARG 19 -7.289 8.646 -1.571 137 HD2 ARG 19 HD2 ARG 19 -7.309 10.730 -2.744 138 HD3 ARG 19 HD1 ARG 19 -8.533 9.688 -3.470 139 HE ARG 19 HE ARG 19 -9.051 11.982 -1.698 140 HH11 ARG 19 HH11 ARG 19 -10.185 9.623 -4.037 141 HH12 ARG 19 HH12 ARG 19 -11.731 10.388 -4.241 142 HH21 ARG 19 HH21 ARG 19 -11.080 12.983 -1.958 143 HH22 ARG 19 HH22 ARG 19 -12.246 12.296 -3.059 144 H ALA 20 HN ALA 20 -11.749 8.171 0.678 145 HA ALA 20 HA ALA 20 -13.050 5.881 -0.590 146 HB1 ALA 20 HB1 ALA 20 -12.976 4.863 1.437 147 HB2 ALA 20 HB2 ALA 20 -14.460 5.796 1.638 148 HB3 ALA 20 HB3 ALA 20 -12.949 6.385 2.328 149 H GLN 21 HN GLN 21 -14.942 6.421 -1.507 150 HA GLN 21 HA GLN 21 -16.452 8.667 -0.439 151 HB2 GLN 21 HB2 GLN 21 -16.632 9.859 -2.476 152 HB3 GLN 21 HB1 GLN 21 -14.928 9.520 -2.267 153 HG2 GLN 21 HG2 GLN 21 -15.050 8.996 -4.415 154 HG3 GLN 21 HG1 GLN 21 -15.583 7.443 -3.808 155 HE21 GLN 21 HE21 GLN 21 -17.697 6.812 -4.098 156 HE22 GLN 21 HE22 GLN 21 -18.802 7.674 -5.114 157 H VAL 22 HN VAL 22 -18.658 8.496 -0.778 158 HA VAL 22 HA VAL 22 -19.450 5.819 -1.695 159 HB VAL 22 HB VAL 22 -21.276 7.606 -0.155 160 HG11 VAL 22 HG11 VAL 22 -21.953 5.308 0.717 161 HG12 VAL 22 HG12 VAL 22 -20.992 4.665 -0.609 162 HG13 VAL 22 HG13 VAL 22 -22.370 5.716 -0.942 163 HG21 VAL 22 HG21 VAL 22 -20.483 6.652 1.937 164 HG22 VAL 22 HG22 VAL 22 -19.223 7.600 1.144 165 HG23 VAL 22 HG23 VAL 22 -19.176 5.838 1.075 166 H ARG 23 HN ARG 23 -20.980 5.522 -3.202 167 HA ARG 23 HA ARG 23 -21.953 7.894 -4.639 168 HB2 ARG 23 HB2 ARG 23 -22.809 5.849 -6.180 169 HB3 ARG 23 HB1 ARG 23 -21.203 6.556 -6.325 170 HG2 ARG 23 HG2 ARG 23 -20.160 4.766 -5.417 171 HG3 ARG 23 HG1 ARG 23 -21.528 4.344 -4.393 172 HD2 ARG 23 HD2 ARG 23 -21.155 2.673 -6.140 173 HD3 ARG 23 HD1 ARG 23 -22.718 3.465 -6.324 174 HE ARG 23 HE ARG 23 -21.823 4.688 -8.181 175 HH11 ARG 23 HH11 ARG 23 -19.696 2.207 -6.942 176 HH12 ARG 23 HH12 ARG 23 -18.918 1.922 -8.467 177 HH21 ARG 23 HH21 ARG 23 -20.815 4.316 -10.202 178 HH22 ARG 23 HH22 ARG 23 -19.556 3.124 -10.323 179 H LYS 24 HN LYS 24 -24.089 8.381 -4.746 180 HA LYS 24 HA LYS 24 -25.735 7.442 -2.650 181 HB2 LYS 24 HB2 LYS 24 -25.815 9.741 -3.623 182 HB3 LYS 24 HB1 LYS 24 -26.535 9.070 -5.075 183 HG2 LYS 24 HG2 LYS 24 -28.415 9.769 -4.033 184 HG3 LYS 24 HG1 LYS 24 -28.304 8.161 -3.318 185 HD2 LYS 24 HD2 LYS 24 -27.142 9.150 -1.367 186 HD3 LYS 24 HD1 LYS 24 -27.340 10.745 -2.090 187 HE2 LYS 24 HE2 LYS 24 -29.765 10.470 -2.020 188 HE3 LYS 24 HE1 LYS 24 -29.569 8.875 -1.299 189 HZ1 LYS 24 HZ1 LYS 24 -30.042 10.511 0.392 190 HZ2 LYS 24 HZ2 LYS 24 -28.717 11.450 -0.089 191 HZ3 LYS 24 HZ3 LYS 24 -28.468 9.919 0.595 192 H LYS 25 HN LYS 25 -25.094 6.149 -5.676 193 HA LYS 25 HA LYS 25 -27.351 4.310 -5.333 194 HB2 LYS 25 HB2 LYS 25 -27.919 5.798 -7.182 195 HB3 LYS 25 HB1 LYS 25 -26.397 5.412 -7.977 196 HG2 LYS 25 HG2 LYS 25 -27.063 3.200 -8.408 197 HG3 LYS 25 HG1 LYS 25 -28.436 3.315 -7.309 198 HD2 LYS 25 HD2 LYS 25 -29.420 5.016 -8.770 199 HD3 LYS 25 HD1 LYS 25 -28.092 4.774 -9.913 200 HE2 LYS 25 HE2 LYS 25 -28.722 2.453 -10.190 201 HE3 LYS 25 HE1 LYS 25 -29.990 2.636 -8.977 202 HZ1 LYS 25 HZ1 LYS 25 -31.083 4.241 -10.424 203 HZ2 LYS 25 HZ2 LYS 25 -30.895 2.749 -11.214 204 HZ3 LYS 25 HZ3 LYS 25 -29.866 4.041 -11.589 205 HA PRO 26 HA PRO 26 -23.849 1.466 -5.249 206 HB2 PRO 26 HB2 PRO 26 -26.092 -0.457 -5.243 207 HB3 PRO 26 HB1 PRO 26 -24.729 -0.320 -4.135 208 HG2 PRO 26 HG2 PRO 26 -27.211 0.421 -3.427 209 HG3 PRO 26 HG1 PRO 26 -25.770 1.273 -2.840 210 HD2 PRO 26 HD2 PRO 26 -27.733 2.081 -4.939 211 HD3 PRO 26 HD1 PRO 26 -26.840 3.082 -3.775 212 H THR 27 HN THR 27 -23.124 -0.226 -6.652 213 HA THR 27 HA THR 27 -24.002 0.154 -9.367 214 HB THR 27 HB THR 27 -21.612 -0.123 -8.904 215 HG1 THR 27 HG1 THR 27 -21.564 -2.310 -10.307 216 HG21 THR 27 HG21 THR 27 -21.488 -1.559 -7.045 217 HG22 THR 27 HG22 THR 27 -20.812 -2.490 -8.383 218 HG23 THR 27 HG23 THR 27 -22.461 -2.797 -7.839 219 H VAL 28 HN VAL 28 -24.164 -2.002 -10.709 220 HA VAL 28 HA VAL 28 -26.539 -3.253 -10.251 221 HB VAL 28 HB VAL 28 -25.584 -3.494 -12.362 222 HG11 VAL 28 HG11 VAL 28 -23.220 -3.277 -11.594 223 HG12 VAL 28 HG12 VAL 28 -23.461 -4.495 -12.852 224 HG13 VAL 28 HG13 VAL 28 -23.255 -4.992 -11.172 225 HG21 VAL 28 HG21 VAL 28 -25.492 -6.171 -10.990 226 HG22 VAL 28 HG22 VAL 28 -25.516 -5.943 -12.741 227 HG23 VAL 28 HG23 VAL 28 -26.891 -5.422 -11.765 228 H GLU 29 HN GLU 29 -23.388 -4.275 -9.036 229 HA GLU 29 HA GLU 29 -24.494 -6.696 -7.904 230 HB2 GLU 29 HB2 GLU 29 -21.711 -5.551 -7.707 231 HB3 GLU 29 HB1 GLU 29 -22.195 -7.183 -7.251 232 HG2 GLU 29 HG2 GLU 29 -22.798 -7.650 -9.595 233 HG3 GLU 29 HG1 GLU 29 -22.334 -6.005 -10.024 234 H GLY 30 HN GLY 30 -24.540 -3.563 -6.948 235 HA2 GLY 30 HA2 GLY 30 -25.502 -2.777 -5.000 236 HA3 GLY 30 HA1 GLY 30 -25.345 -4.381 -4.299 237 H PHE 31 HN PHE 31 -22.696 -2.569 -5.691 238 HA PHE 31 HA PHE 31 -21.443 -2.466 -3.060 239 HB2 PHE 31 HB2 PHE 31 -20.194 -1.787 -5.733 240 HB3 PHE 31 HB1 PHE 31 -19.365 -2.071 -4.206 241 HD1 PHE 31 HD1 PHE 31 -21.124 -4.564 -3.497 242 HD2 PHE 31 HD2 PHE 31 -18.923 -3.416 -6.942 243 HE1 PHE 31 HE1 PHE 31 -20.839 -6.930 -4.106 244 HE2 PHE 31 HE2 PHE 31 -18.639 -5.766 -7.558 245 HZ PHE 31 HZ PHE 31 -19.597 -7.535 -6.138 246 H THR 32 HN THR 32 -21.328 -0.623 -1.962 247 HA THR 32 HA THR 32 -22.593 1.722 -3.173 248 HB THR 32 HB THR 32 -23.039 2.416 -0.864 249 HG1 THR 32 HG1 THR 32 -22.624 0.644 0.751 250 HG21 THR 32 HG21 THR 32 -23.857 -0.350 -1.555 251 HG22 THR 32 HG22 THR 32 -24.724 1.126 -1.933 252 HG23 THR 32 HG23 THR 32 -24.583 0.581 -0.260 253 H HIS 33 HN HIS 33 -19.653 0.720 -1.562 254 HA HIS 33 HA HIS 33 -18.776 3.521 -1.311 255 HB2 HIS 33 HB2 HIS 33 -18.097 1.016 0.209 256 HB3 HIS 33 HB1 HIS 33 -17.054 2.430 0.286 257 HD1 HIS 33 HD1 HIS 33 -20.657 1.441 1.074 258 HD2 HIS 33 HD2 HIS 33 -17.790 4.270 2.123 259 HE1 HIS 33 HE1 HIS 33 -21.598 2.670 3.063 260 HE2 HIS 33 HE2 HIS 33 -19.895 4.439 3.611 261 H ASP 34 HN ASP 34 -17.195 4.206 -2.621 262 HA ASP 34 HA ASP 34 -15.473 2.187 -3.913 263 HB2 ASP 34 HB2 ASP 34 -16.304 4.958 -4.791 264 HB3 ASP 34 HB1 ASP 34 -14.975 4.083 -5.542 265 H TRP 35 HN TRP 35 -13.329 2.259 -3.575 266 HA TRP 35 HA TRP 35 -12.237 4.629 -2.263 267 HB2 TRP 35 HB2 TRP 35 -10.973 3.180 -0.666 268 HB3 TRP 35 HB1 TRP 35 -12.702 3.256 -0.388 269 HD1 TRP 35 HD1 TRP 35 -14.016 0.982 -0.387 270 HE1 TRP 35 HE1 TRP 35 -13.287 -1.486 -0.618 271 HE3 TRP 35 HE3 TRP 35 -9.208 1.688 -1.983 272 HZ2 TRP 35 HZ2 TRP 35 -10.968 -2.933 -1.362 273 HZ3 TRP 35 HZ3 TRP 35 -7.803 -0.287 -2.423 274 HH2 TRP 35 HH2 TRP 35 -8.654 -2.541 -2.090 275 H MET 36 HN MET 36 -9.875 4.574 -2.142 276 HA MET 36 HA MET 36 -8.542 2.950 -4.174 277 HB2 MET 36 HB2 MET 36 -9.015 4.947 -5.405 278 HB3 MET 36 HB1 MET 36 -8.551 5.968 -4.050 279 HG2 MET 36 HG2 MET 36 -6.222 5.048 -4.296 280 HG3 MET 36 HG1 MET 36 -6.760 4.335 -5.820 281 HE1 MET 36 HE1 MET 36 -6.368 7.266 -3.659 282 HE2 MET 36 HE2 MET 36 -7.818 7.991 -4.370 283 HE3 MET 36 HE3 MET 36 -6.230 8.688 -4.704 284 H VAL 37 HN VAL 37 -6.535 2.314 -3.523 285 HA VAL 37 HA VAL 37 -5.548 3.438 -0.989 286 HB VAL 37 HB VAL 37 -4.056 1.237 -1.217 287 HG11 VAL 37 HG11 VAL 37 -6.866 1.322 -0.236 288 HG12 VAL 37 HG12 VAL 37 -5.452 1.825 0.672 289 HG13 VAL 37 HG13 VAL 37 -5.671 0.127 0.234 290 HG21 VAL 37 HG21 VAL 37 -4.958 0.493 -3.308 291 HG22 VAL 37 HG22 VAL 37 -6.605 0.625 -2.692 292 HG23 VAL 37 HG23 VAL 37 -5.514 -0.597 -2.039 293 H PHE 38 HN PHE 38 -3.288 3.589 -0.663 294 HA PHE 38 HA PHE 38 -1.745 4.269 -3.089 295 HB2 PHE 38 HB2 PHE 38 -2.379 5.841 -0.653 296 HB3 PHE 38 HB1 PHE 38 -0.711 5.913 -1.190 297 HD1 PHE 38 HD1 PHE 38 -0.126 6.952 -3.272 298 HD2 PHE 38 HD2 PHE 38 -4.153 6.910 -1.892 299 HE1 PHE 38 HE1 PHE 38 -0.672 8.759 -4.844 300 HE2 PHE 38 HE2 PHE 38 -4.713 8.703 -3.470 301 HZ PHE 38 HZ PHE 38 -2.989 9.638 -4.950 302 H VAL 39 HN VAL 39 0.081 3.061 -3.201 303 HA VAL 39 HA VAL 39 1.730 3.129 -0.780 304 HB VAL 39 HB VAL 39 2.837 0.987 -1.631 305 HG11 VAL 39 HG11 VAL 39 1.082 1.372 0.269 306 HG12 VAL 39 HG12 VAL 39 1.545 -0.261 -0.208 307 HG13 VAL 39 HG13 VAL 39 0.036 0.436 -0.796 308 HG21 VAL 39 HG21 VAL 39 2.047 0.580 -3.756 309 HG22 VAL 39 HG22 VAL 39 0.401 1.060 -3.342 310 HG23 VAL 39 HG23 VAL 39 1.035 -0.487 -2.781 311 H ARG 40 HN ARG 40 3.449 4.341 -1.120 312 HA ARG 40 HA ARG 40 4.984 4.273 -3.559 313 HB2 ARG 40 HB2 ARG 40 4.653 6.603 -4.205 314 HB3 ARG 40 HB1 ARG 40 3.098 5.774 -4.236 315 HG2 ARG 40 HG2 ARG 40 2.288 6.922 -2.431 316 HG3 ARG 40 HG1 ARG 40 3.883 7.166 -1.729 317 HD2 ARG 40 HD2 ARG 40 4.311 8.756 -3.691 318 HD3 ARG 40 HD1 ARG 40 2.563 8.688 -3.961 319 HE ARG 40 HE ARG 40 2.681 9.296 -1.354 320 HH11 ARG 40 HH11 ARG 40 4.306 10.701 -4.135 321 HH12 ARG 40 HH12 ARG 40 4.499 12.259 -3.380 322 HH21 ARG 40 HH21 ARG 40 2.940 11.293 -0.369 323 HH22 ARG 40 HH22 ARG 40 3.736 12.598 -1.217 324 H GLY 41 HN GLY 41 6.537 6.362 -3.437 325 HA2 GLY 41 HA2 GLY 41 7.472 6.540 -0.655 326 HA3 GLY 41 HA1 GLY 41 8.418 6.934 -2.084 327 HA PRO 42 HA PRO 42 6.051 10.675 -0.358 328 HB2 PRO 42 HB2 PRO 42 8.050 11.617 1.397 329 HB3 PRO 42 HB1 PRO 42 6.517 10.875 1.852 330 HG2 PRO 42 HG2 PRO 42 9.125 9.803 2.161 331 HG3 PRO 42 HG1 PRO 42 7.601 8.991 2.520 332 HD2 PRO 42 HD2 PRO 42 9.416 8.688 0.233 333 HD3 PRO 42 HD1 PRO 42 8.153 7.602 0.821 334 H GLU 43 HN GLU 43 6.838 12.992 -0.233 335 HA GLU 43 HA GLU 43 7.532 13.931 -2.623 336 HB2 GLU 43 HB2 GLU 43 8.239 15.080 0.067 337 HB3 GLU 43 HB1 GLU 43 8.487 15.960 -1.432 338 HG2 GLU 43 HG2 GLU 43 6.436 16.685 -0.463 339 HG3 GLU 43 HG1 GLU 43 6.056 15.736 -1.898 340 H HIS 44 HN HIS 44 9.137 13.770 -3.947 341 HA HIS 44 HA HIS 44 11.189 14.098 -4.844 342 HB2 HIS 44 HB2 HIS 44 12.564 15.514 -3.741 343 HB3 HIS 44 HB1 HIS 44 11.464 15.397 -2.374 344 HD1 HIS 44 HD1 HIS 44 14.806 14.230 -3.592 345 HD2 HIS 44 HD2 HIS 44 12.405 13.904 -0.211 346 HE1 HIS 44 HE1 HIS 44 16.285 13.265 -1.799 347 HE2 HIS 44 HE2 HIS 44 14.739 12.842 0.146 348 H SER 45 HN SER 45 10.660 11.714 -2.413 349 HA SER 45 HA SER 45 12.971 10.176 -3.352 350 HB2 SER 45 HB2 SER 45 12.205 8.580 -1.493 351 HB3 SER 45 HB1 SER 45 12.863 10.137 -0.995 352 HG SER 45 HG SER 45 10.096 9.882 -1.417 353 H ASN 46 HN ASN 46 12.671 8.940 -5.058 354 HA ASN 46 HA ASN 46 10.000 7.861 -5.620 355 HB2 ASN 46 HB2 ASN 46 12.416 8.428 -7.243 356 HB3 ASN 46 HB1 ASN 46 11.495 7.002 -7.699 357 HD21 ASN 46 HD21 ASN 46 10.030 9.808 -6.274 358 HD22 ASN 46 HD22 ASN 46 9.176 10.319 -7.686 359 H ILE 47 HN ILE 47 9.507 5.778 -5.275 360 HA ILE 47 HA ILE 47 11.543 4.188 -3.982 361 HB ILE 47 HB ILE 47 9.858 2.658 -3.356 362 HG12 ILE 47 HG12 ILE 47 7.937 4.239 -5.062 363 HG13 ILE 47 HG11 ILE 47 8.650 2.680 -5.497 364 HG21 ILE 47 HG21 ILE 47 10.063 4.633 -2.046 365 HG22 ILE 47 HG22 ILE 47 8.373 4.138 -2.100 366 HG23 ILE 47 HG23 ILE 47 8.930 5.495 -3.082 367 HD11 ILE 47 HD11 ILE 47 7.285 2.833 -2.901 368 HD12 ILE 47 HD12 ILE 47 7.321 1.530 -4.087 369 HD13 ILE 47 HD13 ILE 47 6.261 2.921 -4.333 370 H GLN 48 HN GLN 48 10.101 4.406 -7.086 371 HA GLN 48 HA GLN 48 10.178 1.765 -7.971 372 HB2 GLN 48 HB2 GLN 48 9.157 3.612 -9.237 373 HB3 GLN 48 HB1 GLN 48 10.740 4.321 -9.515 374 HG2 GLN 48 HG2 GLN 48 10.289 3.283 -11.515 375 HG3 GLN 48 HG1 GLN 48 11.272 2.093 -10.696 376 HE21 GLN 48 HE21 GLN 48 7.879 2.776 -10.063 377 HE22 GLN 48 HE22 GLN 48 7.288 1.242 -10.590 378 H HIS 49 HN HIS 49 12.712 3.679 -6.969 379 HA HIS 49 HA HIS 49 14.806 2.560 -8.589 380 HB2 HIS 49 HB2 HIS 49 14.678 4.372 -6.209 381 HB3 HIS 49 HB1 HIS 49 16.222 3.612 -6.621 382 HD1 HIS 49 HD1 HIS 49 16.364 3.881 -9.595 383 HD2 HIS 49 HD2 HIS 49 14.842 6.878 -7.152 384 HE1 HIS 49 HE1 HIS 49 16.526 5.999 -10.938 385 HE2 HIS 49 HE2 HIS 49 15.355 7.738 -9.543 386 H PHE 50 HN PHE 50 13.483 1.974 -5.351 387 HA PHE 50 HA PHE 50 15.179 -0.435 -5.187 388 HB2 PHE 50 HB2 PHE 50 15.140 -0.165 -2.725 389 HB3 PHE 50 HB1 PHE 50 15.859 1.227 -3.535 390 HD1 PHE 50 HD1 PHE 50 12.793 0.069 -1.746 391 HD2 PHE 50 HD2 PHE 50 14.988 3.365 -3.319 392 HE1 PHE 50 HE1 PHE 50 11.333 1.618 -0.549 393 HE2 PHE 50 HE2 PHE 50 13.492 4.912 -2.132 394 HZ PHE 50 HZ PHE 50 11.666 4.039 -0.744 395 H VAL 51 HN VAL 51 12.129 0.540 -5.720 396 HA VAL 51 HA VAL 51 11.009 -1.874 -4.483 397 HB VAL 51 HB VAL 51 9.715 0.778 -5.133 398 HG11 VAL 51 HG11 VAL 51 7.775 -0.703 -3.886 399 HG12 VAL 51 HG12 VAL 51 8.515 -1.903 -4.953 400 HG13 VAL 51 HG13 VAL 51 7.858 -0.412 -5.628 401 HG21 VAL 51 HG21 VAL 51 9.081 0.445 -2.655 402 HG22 VAL 51 HG22 VAL 51 10.742 0.866 -3.037 403 HG23 VAL 51 HG23 VAL 51 10.321 -0.801 -2.651 404 H GLU 52 HN GLU 52 10.310 -3.384 -5.761 405 HA GLU 52 HA GLU 52 11.038 -3.083 -8.568 406 HB2 GLU 52 HB2 GLU 52 11.739 -4.995 -6.994 407 HB3 GLU 52 HB1 GLU 52 10.094 -5.591 -7.154 408 HG2 GLU 52 HG2 GLU 52 10.404 -5.882 -9.540 409 HG3 GLU 52 HG1 GLU 52 12.027 -5.179 -9.417 410 H LYS 53 HN LYS 53 8.308 -4.430 -6.739 411 HA LYS 53 HA LYS 53 6.386 -3.344 -8.626 412 HB2 LYS 53 HB2 LYS 53 5.258 -5.560 -8.815 413 HB3 LYS 53 HB1 LYS 53 6.866 -5.547 -9.528 414 HG2 LYS 53 HG2 LYS 53 7.772 -6.641 -7.573 415 HG3 LYS 53 HG1 LYS 53 6.192 -6.634 -6.806 416 HD2 LYS 53 HD2 LYS 53 6.858 -8.021 -9.402 417 HD3 LYS 53 HD1 LYS 53 6.842 -8.808 -7.829 418 HE2 LYS 53 HE2 LYS 53 4.488 -8.411 -7.585 419 HE3 LYS 53 HE1 LYS 53 4.482 -7.410 -9.038 420 HZ1 LYS 53 HZ1 LYS 53 5.123 -9.395 -10.315 421 HZ2 LYS 53 HZ2 LYS 53 3.631 -9.598 -9.534 422 HZ3 LYS 53 HZ3 LYS 53 5.027 -10.329 -8.901 423 H VAL 54 HN VAL 54 4.092 -4.181 -7.676 424 HA VAL 54 HA VAL 54 4.141 -4.145 -4.760 425 HB VAL 54 HB VAL 54 3.205 -1.896 -6.457 426 HG11 VAL 54 HG11 VAL 54 1.992 -1.844 -3.814 427 HG12 VAL 54 HG12 VAL 54 1.320 -3.103 -4.850 428 HG13 VAL 54 HG13 VAL 54 1.303 -1.421 -5.381 429 HG21 VAL 54 HG21 VAL 54 3.828 -0.883 -4.082 430 HG22 VAL 54 HG22 VAL 54 5.035 -1.248 -5.304 431 HG23 VAL 54 HG23 VAL 54 4.742 -2.380 -3.985 432 H VAL 55 HN VAL 55 2.098 -4.739 -3.801 433 HA VAL 55 HA VAL 55 0.115 -5.838 -5.633 434 HB VAL 55 HB VAL 55 2.117 -7.478 -4.567 435 HG11 VAL 55 HG11 VAL 55 -0.509 -7.926 -3.165 436 HG12 VAL 55 HG12 VAL 55 1.057 -7.577 -2.421 437 HG13 VAL 55 HG13 VAL 55 0.796 -9.115 -3.248 438 HG21 VAL 55 HG21 VAL 55 -0.546 -8.312 -5.697 439 HG22 VAL 55 HG22 VAL 55 0.960 -9.232 -5.711 440 HG23 VAL 55 HG23 VAL 55 0.827 -7.749 -6.654 441 H PHE 56 HN PHE 56 -1.880 -6.144 -4.720 442 HA PHE 56 HA PHE 56 -2.222 -5.358 -1.908 443 HB2 PHE 56 HB2 PHE 56 -3.784 -4.464 -4.334 444 HB3 PHE 56 HB1 PHE 56 -4.514 -4.468 -2.727 445 HD1 PHE 56 HD1 PHE 56 -1.640 -3.136 -4.667 446 HD2 PHE 56 HD2 PHE 56 -4.213 -2.660 -1.309 447 HE1 PHE 56 HE1 PHE 56 -0.686 -0.910 -4.264 448 HE2 PHE 56 HE2 PHE 56 -3.263 -0.424 -0.901 449 HZ PHE 56 HZ PHE 56 -1.489 0.449 -2.377 450 H HIS 57 HN HIS 57 -3.230 -6.914 -0.762 451 HA HIS 57 HA HIS 57 -4.836 -8.887 -2.268 452 HB2 HIS 57 HB2 HIS 57 -3.802 -9.129 0.576 453 HB3 HIS 57 HB1 HIS 57 -4.595 -10.385 -0.375 454 HD1 HIS 57 HD1 HIS 57 -3.129 -11.893 -1.696 455 HD2 HIS 57 HD2 HIS 57 -1.121 -8.469 -0.433 456 HE1 HIS 57 HE1 HIS 57 -0.695 -12.308 -2.180 457 HE2 HIS 57 HE2 HIS 57 0.514 -10.332 -1.175 458 H LEU 58 HN LEU 58 -6.663 -7.563 -2.424 459 HA LEU 58 HA LEU 58 -7.891 -6.265 -0.237 460 HB2 LEU 58 HB2 LEU 58 -9.504 -7.416 -2.496 461 HB3 LEU 58 HB1 LEU 58 -9.796 -5.947 -1.581 462 HG LEU 58 HG LEU 58 -7.606 -6.306 -3.624 463 HD11 LEU 58 HD11 LEU 58 -8.913 -5.133 -5.084 464 HD12 LEU 58 HD12 LEU 58 -10.054 -4.624 -3.853 465 HD13 LEU 58 HD13 LEU 58 -10.015 -6.306 -4.390 466 HD21 LEU 58 HD21 LEU 58 -7.339 -4.623 -1.647 467 HD22 LEU 58 HD22 LEU 58 -8.558 -3.703 -2.523 468 HD23 LEU 58 HD23 LEU 58 -7.026 -4.100 -3.300 469 H HIS 59 HN HIS 59 -10.328 -7.006 0.295 470 HA HIS 59 HA HIS 59 -10.092 -9.268 1.961 471 HB2 HIS 59 HB2 HIS 59 -11.744 -7.246 2.036 472 HB3 HIS 59 HB1 HIS 59 -12.739 -8.229 0.972 473 HD1 HIS 59 HD1 HIS 59 -11.172 -8.393 4.436 474 HD2 HIS 59 HD2 HIS 59 -14.333 -10.017 2.264 475 HE1 HIS 59 HE1 HIS 59 -12.575 -9.653 6.106 476 HE2 HIS 59 HE2 HIS 59 -14.535 -10.548 4.789 477 H GLU 60 HN GLU 60 -10.805 -11.347 1.752 478 HA GLU 60 HA GLU 60 -10.301 -12.544 -0.712 479 HB2 GLU 60 HB2 GLU 60 -11.774 -13.733 1.636 480 HB3 GLU 60 HB1 GLU 60 -10.998 -14.636 0.342 481 HG2 GLU 60 HG2 GLU 60 -9.634 -12.902 2.389 482 HG3 GLU 60 HG1 GLU 60 -9.635 -14.662 2.334 483 H SER 61 HN SER 61 -13.263 -11.383 0.602 484 HA SER 61 HA SER 61 -15.073 -12.851 -0.979 485 HB2 SER 61 HB2 SER 61 -15.486 -10.108 0.124 486 HB3 SER 61 HB1 SER 61 -16.720 -11.301 -0.241 487 HG SER 61 HG SER 61 -16.500 -11.808 1.787 488 H PHE 62 HN PHE 62 -12.893 -10.380 -1.801 489 HA PHE 62 HA PHE 62 -14.503 -9.233 -3.924 490 HB2 PHE 62 HB2 PHE 62 -11.633 -8.820 -3.072 491 HB3 PHE 62 HB1 PHE 62 -12.347 -8.026 -4.464 492 HD1 PHE 62 HD1 PHE 62 -13.447 -8.609 -0.943 493 HD2 PHE 62 HD2 PHE 62 -12.744 -5.824 -4.076 494 HE1 PHE 62 HE1 PHE 62 -14.236 -6.779 0.507 495 HE2 PHE 62 HE2 PHE 62 -13.532 -3.991 -2.639 496 HZ PHE 62 HZ PHE 62 -14.279 -4.467 -0.340 497 HA PRO 63 HA PRO 63 -13.068 -12.157 -7.058 498 HB2 PRO 63 HB2 PRO 63 -14.158 -10.102 -8.876 499 HB3 PRO 63 HB1 PRO 63 -14.579 -11.812 -8.738 500 HG2 PRO 63 HG2 PRO 63 -16.252 -9.896 -7.902 501 HG3 PRO 63 HG1 PRO 63 -16.100 -11.437 -7.035 502 HD2 PRO 63 HD2 PRO 63 -14.916 -8.764 -6.371 503 HD3 PRO 63 HD1 PRO 63 -15.664 -9.965 -5.293 504 H ARG 64 HN ARG 64 -11.035 -12.167 -7.847 505 HA ARG 64 HA ARG 64 -8.904 -11.464 -8.262 506 HB2 ARG 64 HB2 ARG 64 -10.419 -9.185 -9.542 507 HB3 ARG 64 HB1 ARG 64 -8.677 -9.374 -9.659 508 HG2 ARG 64 HG2 ARG 64 -8.964 -11.482 -10.825 509 HG3 ARG 64 HG1 ARG 64 -10.715 -11.350 -10.662 510 HD2 ARG 64 HD2 ARG 64 -9.951 -10.647 -12.870 511 HD3 ARG 64 HD1 ARG 64 -10.727 -9.333 -11.990 512 HE ARG 64 HE ARG 64 -7.811 -9.506 -11.867 513 HH11 ARG 64 HH11 ARG 64 -10.640 -7.974 -13.268 514 HH12 ARG 64 HH12 ARG 64 -9.779 -6.529 -13.727 515 HH21 ARG 64 HH21 ARG 64 -6.691 -7.629 -12.474 516 HH22 ARG 64 HH22 ARG 64 -7.525 -6.338 -13.278 517 HA PRO 65 HA PRO 65 -9.091 -8.432 -4.782 518 HB2 PRO 65 HB2 PRO 65 -8.058 -9.929 -2.786 519 HB3 PRO 65 HB1 PRO 65 -9.775 -9.931 -3.200 520 HG2 PRO 65 HG2 PRO 65 -7.685 -11.952 -3.779 521 HG3 PRO 65 HG1 PRO 65 -9.422 -12.167 -3.499 522 HD2 PRO 65 HD2 PRO 65 -8.125 -12.161 -5.989 523 HD3 PRO 65 HD1 PRO 65 -9.870 -12.032 -5.712 524 H LYS 66 HN LYS 66 -6.512 -10.519 -5.854 525 HA LYS 66 HA LYS 66 -4.483 -8.830 -4.750 526 HB2 LYS 66 HB2 LYS 66 -4.053 -11.219 -4.915 527 HB3 LYS 66 HB1 LYS 66 -4.284 -11.161 -6.656 528 HG2 LYS 66 HG2 LYS 66 -2.313 -9.794 -6.925 529 HG3 LYS 66 HG1 LYS 66 -2.121 -9.678 -5.176 530 HD2 LYS 66 HD2 LYS 66 -1.503 -11.905 -4.969 531 HD3 LYS 66 HD1 LYS 66 -2.158 -12.343 -6.548 532 HE2 LYS 66 HE2 LYS 66 -0.383 -11.030 -7.620 533 HE3 LYS 66 HE1 LYS 66 0.262 -10.617 -6.032 534 HZ1 LYS 66 HZ1 LYS 66 0.709 -12.937 -5.626 535 HZ2 LYS 66 HZ2 LYS 66 1.459 -12.457 -7.070 536 HZ3 LYS 66 HZ3 LYS 66 0.031 -13.369 -7.118 537 H ARG 67 HN ARG 67 -4.390 -6.895 -5.589 538 HA ARG 67 HA ARG 67 -4.455 -6.596 -8.515 539 HB2 ARG 67 HB2 ARG 67 -4.529 -4.277 -6.601 540 HB3 ARG 67 HB1 ARG 67 -5.232 -4.412 -8.208 541 HG2 ARG 67 HG2 ARG 67 -6.249 -5.774 -5.724 542 HG3 ARG 67 HG1 ARG 67 -6.938 -4.336 -6.475 543 HD2 ARG 67 HD2 ARG 67 -6.704 -7.035 -7.811 544 HD3 ARG 67 HD1 ARG 67 -8.154 -6.425 -7.016 545 HE ARG 67 HE ARG 67 -6.945 -5.021 -9.311 546 HH11 ARG 67 HH11 ARG 67 -9.671 -6.571 -7.771 547 HH12 ARG 67 HH12 ARG 67 -10.849 -5.883 -8.846 548 HH21 ARG 67 HH21 ARG 67 -8.475 -4.107 -10.742 549 HH22 ARG 67 HH22 ARG 67 -10.165 -4.505 -10.560 550 H VAL 68 HN VAL 68 -2.490 -6.472 -9.419 551 HA VAL 68 HA VAL 68 -0.258 -5.719 -7.675 552 HB VAL 68 HB VAL 68 1.148 -7.069 -8.878 553 HG11 VAL 68 HG11 VAL 68 -0.543 -8.504 -7.895 554 HG12 VAL 68 HG12 VAL 68 0.006 -9.178 -9.434 555 HG13 VAL 68 HG13 VAL 68 -1.544 -8.344 -9.342 556 HG21 VAL 68 HG21 VAL 68 0.867 -5.984 -11.017 557 HG22 VAL 68 HG22 VAL 68 -0.663 -6.826 -11.273 558 HG23 VAL 68 HG23 VAL 68 0.848 -7.737 -11.212 559 H CYS 69 HN CYS 69 1.135 -4.093 -8.159 560 HA CYS 69 HA CYS 69 0.601 -2.526 -10.588 561 HB2 CYS 69 HB2 CYS 69 1.151 -1.473 -7.800 562 HB3 CYS 69 HB1 CYS 69 1.145 -0.478 -9.254 563 HG CYS 69 HG CYS 69 -1.381 -0.060 -9.348 564 H LYS 70 HN LYS 70 2.311 -2.728 -11.845 565 HA LYS 70 HA LYS 70 4.994 -2.955 -10.630 566 HB2 LYS 70 HB2 LYS 70 4.244 -3.480 -13.518 567 HB3 LYS 70 HB1 LYS 70 5.695 -3.997 -12.673 568 HG2 LYS 70 HG2 LYS 70 4.502 -5.651 -11.446 569 HG3 LYS 70 HG1 LYS 70 2.949 -4.979 -11.942 570 HD2 LYS 70 HD2 LYS 70 3.402 -5.619 -14.253 571 HD3 LYS 70 HD1 LYS 70 4.975 -6.260 -13.774 572 HE2 LYS 70 HE2 LYS 70 3.917 -7.935 -12.393 573 HE3 LYS 70 HE1 LYS 70 2.328 -7.247 -12.719 574 HZ1 LYS 70 HZ1 LYS 70 2.756 -9.212 -14.068 575 HZ2 LYS 70 HZ2 LYS 70 4.119 -8.474 -14.750 576 HZ3 LYS 70 HZ3 LYS 70 2.574 -7.835 -15.042 577 H ASP 71 HN ASP 71 3.112 -0.596 -11.418 578 HA ASP 71 HA ASP 71 4.925 0.888 -13.188 579 HB2 ASP 71 HB2 ASP 71 1.975 1.244 -12.580 580 HB3 ASP 71 HB1 ASP 71 2.897 2.340 -13.598 581 HA PRO 72 HA PRO 72 5.521 4.414 -10.217 582 HB2 PRO 72 HB2 PRO 72 3.682 5.717 -12.216 583 HB3 PRO 72 HB1 PRO 72 5.066 6.417 -11.362 584 HG2 PRO 72 HG2 PRO 72 5.412 5.595 -13.822 585 HG3 PRO 72 HG1 PRO 72 6.616 5.145 -12.594 586 HD2 PRO 72 HD2 PRO 72 4.496 3.487 -13.865 587 HD3 PRO 72 HD1 PRO 72 6.121 3.024 -13.325 588 HA PRO 73 HA PRO 73 2.717 5.603 -7.105 589 HB2 PRO 73 HB2 PRO 73 0.604 6.662 -8.935 590 HB3 PRO 73 HB1 PRO 73 1.059 7.213 -7.316 591 HG2 PRO 73 HG2 PRO 73 2.009 8.344 -9.638 592 HG3 PRO 73 HG1 PRO 73 2.857 8.402 -8.088 593 HD2 PRO 73 HD2 PRO 73 3.683 7.081 -10.476 594 HD3 PRO 73 HD1 PRO 73 4.490 7.064 -8.897 595 H TYR 74 HN TYR 74 2.158 3.737 -6.339 596 HA TYR 74 HA TYR 74 0.603 1.850 -7.869 597 HB2 TYR 74 HB2 TYR 74 1.730 1.515 -5.092 598 HB3 TYR 74 HB1 TYR 74 1.319 0.246 -6.230 599 HD1 TYR 74 HD2 TYR 74 3.641 3.127 -5.792 600 HD2 TYR 74 HD1 TYR 74 3.006 -0.680 -7.559 601 HE1 TYR 74 HE2 TYR 74 5.968 3.092 -6.535 602 HE2 TYR 74 HE1 TYR 74 5.350 -0.726 -8.308 603 HH TYR 74 HH TYR 74 7.175 0.777 -8.741 604 H LYS 75 HN LYS 75 -1.480 1.360 -7.504 605 HA LYS 75 HA LYS 75 -2.842 2.208 -5.092 606 HB2 LYS 75 HB2 LYS 75 -4.455 3.614 -6.506 607 HB3 LYS 75 HB1 LYS 75 -2.891 4.321 -6.134 608 HG2 LYS 75 HG2 LYS 75 -2.092 3.991 -8.304 609 HG3 LYS 75 HG1 LYS 75 -3.372 2.855 -8.702 610 HD2 LYS 75 HD2 LYS 75 -4.043 4.802 -9.782 611 HD3 LYS 75 HD1 LYS 75 -4.951 4.875 -8.277 612 HE2 LYS 75 HE2 LYS 75 -4.011 7.029 -8.707 613 HE3 LYS 75 HE1 LYS 75 -3.154 6.297 -7.359 614 HZ1 LYS 75 HZ1 LYS 75 -1.615 7.339 -8.895 615 HZ2 LYS 75 HZ2 LYS 75 -2.202 6.383 -10.167 616 HZ3 LYS 75 HZ3 LYS 75 -1.377 5.659 -8.877 617 H VAL 76 HN VAL 76 -4.899 1.441 -4.912 618 HA VAL 76 HA VAL 76 -5.908 -0.261 -7.100 619 HB VAL 76 HB VAL 76 -5.936 -0.876 -4.157 620 HG11 VAL 76 HG11 VAL 76 -8.228 -1.027 -5.185 621 HG12 VAL 76 HG12 VAL 76 -7.612 -2.523 -4.479 622 HG13 VAL 76 HG13 VAL 76 -7.591 -2.296 -6.231 623 HG21 VAL 76 HG21 VAL 76 -4.071 -1.791 -5.395 624 HG22 VAL 76 HG22 VAL 76 -5.159 -2.432 -6.616 625 HG23 VAL 76 HG23 VAL 76 -5.185 -3.086 -4.980 626 H GLU 77 HN GLU 77 -7.824 0.333 -7.828 627 HA GLU 77 HA GLU 77 -9.511 2.022 -6.103 628 HB2 GLU 77 HB2 GLU 77 -9.305 2.038 -9.113 629 HB3 GLU 77 HB1 GLU 77 -10.388 3.023 -8.164 630 HG2 GLU 77 HG2 GLU 77 -8.715 4.328 -7.311 631 HG3 GLU 77 HG1 GLU 77 -7.495 3.124 -7.675 632 H GLU 78 HN GLU 78 -11.119 0.936 -5.372 633 HA GLU 78 HA GLU 78 -12.546 -0.906 -7.136 634 HB2 GLU 78 HB2 GLU 78 -10.937 -1.706 -4.812 635 HB3 GLU 78 HB1 GLU 78 -12.577 -2.341 -4.790 636 HG2 GLU 78 HG2 GLU 78 -10.424 -2.790 -6.836 637 HG3 GLU 78 HG1 GLU 78 -11.277 -3.971 -5.843 638 H SER 79 HN SER 79 -14.403 -1.935 -5.687 639 HA SER 79 HA SER 79 -15.631 0.180 -4.089 640 HB2 SER 79 HB2 SER 79 -16.348 0.526 -6.438 641 HB3 SER 79 HB1 SER 79 -17.008 -1.112 -6.460 642 HG SER 79 HG SER 79 -17.979 1.200 -5.266 643 H GLY 80 HN GLY 80 -17.375 -0.548 -2.787 644 HA2 GLY 80 HA2 GLY 80 -18.078 -3.290 -2.509 645 HA3 GLY 80 HA1 GLY 80 -16.814 -2.853 -1.364 646 H TYR 81 HN TYR 81 -18.261 -3.142 0.440 647 HA TYR 81 HA TYR 81 -19.844 -0.742 0.885 648 HB2 TYR 81 HB2 TYR 81 -21.823 -2.094 1.681 649 HB3 TYR 81 HB1 TYR 81 -21.551 -2.092 -0.055 650 HD1 TYR 81 HD2 TYR 81 -21.390 -4.143 2.998 651 HD2 TYR 81 HD1 TYR 81 -20.945 -4.095 -1.230 652 HE1 TYR 81 HE2 TYR 81 -21.396 -6.599 2.976 653 HE2 TYR 81 HE1 TYR 81 -20.952 -6.550 -1.260 654 HH TYR 81 HH TYR 81 -20.533 -8.410 0.172 655 H ALA 82 HN ALA 82 -17.414 -2.191 2.025 656 HA ALA 82 HA ALA 82 -17.981 -1.537 4.759 657 HB1 ALA 82 HB1 ALA 82 -18.907 -3.713 4.883 658 HB2 ALA 82 HB2 ALA 82 -17.306 -3.813 5.615 659 HB3 ALA 82 HB3 ALA 82 -17.565 -4.411 3.976 660 H GLY 83 HN GLY 83 -16.050 -1.785 6.151 661 HA2 GLY 83 HA2 GLY 83 -13.590 -1.457 4.561 662 HA3 GLY 83 HA1 GLY 83 -13.861 -0.776 6.160 663 H PHE 84 HN PHE 84 -11.551 -2.120 5.743 664 HA PHE 84 HA PHE 84 -11.551 -4.279 7.557 665 HB2 PHE 84 HB2 PHE 84 -10.994 -6.113 5.932 666 HB3 PHE 84 HB1 PHE 84 -12.662 -5.561 5.836 667 HD1 PHE 84 HD1 PHE 84 -13.375 -4.126 3.932 668 HD2 PHE 84 HD2 PHE 84 -9.527 -5.931 4.074 669 HE1 PHE 84 HE1 PHE 84 -13.113 -3.737 1.522 670 HE2 PHE 84 HE2 PHE 84 -9.241 -5.541 1.672 671 HZ PHE 84 HZ PHE 84 -11.031 -4.445 0.380 672 H ILE 85 HN ILE 85 -9.416 -5.075 7.967 673 HA ILE 85 HA ILE 85 -7.209 -3.468 7.268 674 HB ILE 85 HB ILE 85 -7.408 -6.286 8.319 675 HG12 ILE 85 HG12 ILE 85 -7.897 -4.389 9.838 676 HG13 ILE 85 HG11 ILE 85 -6.499 -5.333 10.342 677 HG21 ILE 85 HG21 ILE 85 -4.820 -4.809 7.816 678 HG22 ILE 85 HG22 ILE 85 -5.411 -6.186 6.882 679 HG23 ILE 85 HG23 ILE 85 -5.002 -6.386 8.585 680 HD11 ILE 85 HD11 ILE 85 -6.321 -2.753 8.823 681 HD12 ILE 85 HD12 ILE 85 -4.998 -3.657 9.557 682 HD13 ILE 85 HD13 ILE 85 -6.214 -2.888 10.576 683 H LEU 86 HN LEU 86 -5.972 -3.392 5.484 684 HA LEU 86 HA LEU 86 -6.302 -5.586 3.543 685 HB2 LEU 86 HB2 LEU 86 -7.141 -3.118 3.058 686 HB3 LEU 86 HB1 LEU 86 -5.442 -2.863 2.687 687 HG LEU 86 HG LEU 86 -6.792 -5.185 1.405 688 HD11 LEU 86 HD11 LEU 86 -7.077 -2.391 0.330 689 HD12 LEU 86 HD12 LEU 86 -8.356 -3.238 1.200 690 HD13 LEU 86 HD13 LEU 86 -7.753 -3.883 -0.325 691 HD21 LEU 86 HD21 LEU 86 -5.196 -3.386 -0.172 692 HD22 LEU 86 HD22 LEU 86 -5.042 -5.127 0.042 693 HD23 LEU 86 HD23 LEU 86 -4.321 -4.021 1.217 694 HA PRO 87 HA PRO 87 -1.914 -6.080 4.513 695 HB2 PRO 87 HB2 PRO 87 -1.793 -8.414 3.048 696 HB3 PRO 87 HB1 PRO 87 -2.237 -8.331 4.756 697 HG2 PRO 87 HG2 PRO 87 -4.004 -8.487 2.345 698 HG3 PRO 87 HG1 PRO 87 -4.150 -9.334 3.897 699 HD2 PRO 87 HD2 PRO 87 -5.658 -7.188 3.350 700 HD3 PRO 87 HD1 PRO 87 -5.007 -7.465 4.977 701 H ILE 88 HN ILE 88 -0.973 -4.485 3.264 702 HA ILE 88 HA ILE 88 -1.007 -4.803 0.362 703 HB ILE 88 HB ILE 88 0.055 -2.425 1.907 704 HG12 ILE 88 HG12 ILE 88 -2.646 -2.575 0.561 705 HG13 ILE 88 HG11 ILE 88 -2.453 -3.055 2.246 706 HG21 ILE 88 HG21 ILE 88 0.823 -2.726 -0.413 707 HG22 ILE 88 HG22 ILE 88 -0.181 -1.286 -0.216 708 HG23 ILE 88 HG23 ILE 88 -0.858 -2.740 -0.951 709 HD11 ILE 88 HD11 ILE 88 -1.810 -0.344 1.115 710 HD12 ILE 88 HD12 ILE 88 -1.661 -0.829 2.799 711 HD13 ILE 88 HD13 ILE 88 -3.249 -0.768 2.034 712 H GLU 89 HN GLU 89 0.882 -4.983 -0.827 713 HA GLU 89 HA GLU 89 3.330 -5.364 0.753 714 HB2 GLU 89 HB2 GLU 89 2.321 -6.998 -1.558 715 HB3 GLU 89 HB1 GLU 89 3.998 -7.031 -1.029 716 HG2 GLU 89 HG2 GLU 89 3.185 -7.721 1.227 717 HG3 GLU 89 HG1 GLU 89 1.572 -7.870 0.533 718 H VAL 90 HN VAL 90 5.037 -4.301 0.149 719 HA VAL 90 HA VAL 90 5.084 -3.089 -2.531 720 HB VAL 90 HB VAL 90 6.573 -2.024 -0.131 721 HG11 VAL 90 HG11 VAL 90 7.578 -0.929 -1.839 722 HG12 VAL 90 HG12 VAL 90 6.147 0.090 -1.735 723 HG13 VAL 90 HG13 VAL 90 6.226 -1.195 -2.938 724 HG21 VAL 90 HG21 VAL 90 3.973 -2.092 -0.019 725 HG22 VAL 90 HG22 VAL 90 4.081 -0.740 -1.148 726 HG23 VAL 90 HG23 VAL 90 4.837 -0.627 0.444 727 H TYR 91 HN TYR 91 6.411 -4.294 -3.749 728 HA TYR 91 HA TYR 91 8.278 -6.119 -2.544 729 HB2 TYR 91 HB2 TYR 91 7.421 -5.519 -5.331 730 HB3 TYR 91 HB1 TYR 91 8.942 -6.362 -5.090 731 HD1 TYR 91 HD1 TYR 91 5.666 -6.670 -3.312 732 HD2 TYR 91 HD2 TYR 91 8.624 -8.540 -5.718 733 HE1 TYR 91 HE1 TYR 91 4.463 -8.804 -3.130 734 HE2 TYR 91 HE2 TYR 91 7.419 -10.676 -5.561 735 HH TYR 91 HH TYR 91 5.815 -11.780 -4.101 736 H PHE 92 HN PHE 92 10.386 -6.022 -2.410 737 HA PHE 92 HA PHE 92 11.693 -3.482 -3.102 738 HB2 PHE 92 HB2 PHE 92 12.381 -5.673 -1.124 739 HB3 PHE 92 HB1 PHE 92 13.432 -4.291 -1.461 740 HD1 PHE 92 HD1 PHE 92 11.148 -2.289 -1.789 741 HD2 PHE 92 HD2 PHE 92 11.998 -5.209 1.178 742 HE1 PHE 92 HE1 PHE 92 9.986 -0.916 -0.124 743 HE2 PHE 92 HE2 PHE 92 10.802 -3.840 2.851 744 HZ PHE 92 HZ PHE 92 9.812 -1.696 2.195 745 H LYS 93 HN LYS 93 13.739 -3.545 -4.194 746 HA LYS 93 HA LYS 93 14.102 -6.041 -5.663 747 HB2 LYS 93 HB2 LYS 93 14.849 -4.795 -7.559 748 HB3 LYS 93 HB1 LYS 93 13.383 -4.054 -6.948 749 HG2 LYS 93 HG2 LYS 93 14.436 -2.178 -6.220 750 HG3 LYS 93 HG1 LYS 93 16.026 -2.954 -6.195 751 HD2 LYS 93 HD2 LYS 93 15.757 -1.377 -8.080 752 HD3 LYS 93 HD1 LYS 93 16.085 -3.046 -8.591 753 HE2 LYS 93 HE2 LYS 93 14.271 -2.228 -10.026 754 HE3 LYS 93 HE1 LYS 93 13.522 -3.277 -8.824 755 HZ1 LYS 93 HZ1 LYS 93 12.933 -1.293 -7.557 756 HZ2 LYS 93 HZ2 LYS 93 12.269 -1.266 -9.113 757 HZ3 LYS 93 HZ3 LYS 93 13.624 -0.315 -8.754 758 H ASN 94 HN ASN 94 15.518 -7.135 -4.392 759 HA ASN 94 HA ASN 94 18.243 -6.184 -4.267 760 HB2 ASN 94 HB2 ASN 94 17.051 -5.247 -2.262 761 HB3 ASN 94 HB1 ASN 94 16.814 -6.906 -1.755 762 HD21 ASN 94 HD21 ASN 94 19.695 -5.760 -3.372 763 HD22 ASN 94 HD22 ASN 94 20.750 -5.964 -2.014 764 H LYS 95 HN LYS 95 19.753 -7.873 -3.893 765 HA LYS 95 HA LYS 95 18.668 -10.542 -4.347 766 HB2 LYS 95 HB2 LYS 95 21.523 -9.583 -4.328 767 HB3 LYS 95 HB1 LYS 95 20.992 -11.191 -4.790 768 HG2 LYS 95 HG2 LYS 95 19.724 -10.202 -6.655 769 HG3 LYS 95 HG1 LYS 95 20.361 -8.615 -6.208 770 HD2 LYS 95 HD2 LYS 95 22.632 -9.389 -6.591 771 HD3 LYS 95 HD1 LYS 95 22.042 -11.009 -6.955 772 HE2 LYS 95 HE2 LYS 95 22.588 -9.789 -8.992 773 HE3 LYS 95 HE1 LYS 95 20.865 -10.152 -8.914 774 HZ1 LYS 95 HZ1 LYS 95 20.379 -7.923 -8.357 775 HZ2 LYS 95 HZ2 LYS 95 21.475 -7.845 -9.648 776 HZ3 LYS 95 HZ3 LYS 95 22.006 -7.547 -8.066 777 H GLU 96 HN GLU 96 19.526 -8.666 -1.774 778 HA GLU 96 HA GLU 96 20.435 -10.908 -0.127 779 HB2 GLU 96 HB2 GLU 96 20.394 -8.299 1.220 780 HB3 GLU 96 HB1 GLU 96 21.754 -9.407 1.025 781 HG2 GLU 96 HG2 GLU 96 20.838 -7.488 -1.100 782 HG3 GLU 96 HG1 GLU 96 22.106 -7.149 0.075 783 H GLU 97 HN GLU 97 19.441 -9.361 2.292 784 HA GLU 97 HA GLU 97 17.353 -10.730 3.124 785 HB2 GLU 97 HB2 GLU 97 16.691 -8.671 4.465 786 HB3 GLU 97 HB1 GLU 97 18.335 -9.275 4.640 787 HG2 GLU 97 HG2 GLU 97 19.102 -7.516 3.089 788 HG3 GLU 97 HG1 GLU 97 17.449 -6.905 3.009 789 HA PRO 98 HA PRO 98 13.359 -10.732 1.812 790 HB2 PRO 98 HB2 PRO 98 12.068 -8.607 3.244 791 HB3 PRO 98 HB1 PRO 98 12.033 -10.337 3.602 792 HG2 PRO 98 HG2 PRO 98 13.822 -8.213 4.673 793 HG3 PRO 98 HG1 PRO 98 13.197 -9.677 5.471 794 HD2 PRO 98 HD2 PRO 98 15.718 -9.612 4.719 795 HD3 PRO 98 HD1 PRO 98 14.752 -11.066 4.353 796 H ARG 99 HN ARG 99 12.578 -10.215 -0.071 797 HA ARG 99 HA ARG 99 13.007 -7.560 -1.197 798 HB2 ARG 99 HB2 ARG 99 11.663 -9.871 -2.559 799 HB3 ARG 99 HB1 ARG 99 12.481 -8.500 -3.292 800 HG2 ARG 99 HG2 ARG 99 14.573 -9.409 -2.156 801 HG3 ARG 99 HG1 ARG 99 13.649 -10.902 -1.972 802 HD2 ARG 99 HD2 ARG 99 14.666 -9.599 -4.443 803 HD3 ARG 99 HD1 ARG 99 14.598 -11.302 -3.996 804 HE ARG 99 HE ARG 99 12.172 -11.196 -4.454 805 HH11 ARG 99 HH11 ARG 99 14.347 -8.909 -5.977 806 HH12 ARG 99 HH12 ARG 99 13.207 -8.439 -7.207 807 HH21 ARG 99 HH21 ARG 99 10.676 -10.591 -6.105 808 HH22 ARG 99 HH22 ARG 99 11.141 -9.381 -7.275 809 H LYS 100 HN LYS 100 10.902 -8.319 0.866 810 HA LYS 100 HA LYS 100 8.807 -6.753 -0.407 811 HB2 LYS 100 HB2 LYS 100 7.002 -8.296 0.248 812 HB3 LYS 100 HB1 LYS 100 8.083 -8.997 -0.948 813 HG2 LYS 100 HG2 LYS 100 9.037 -10.460 0.587 814 HG3 LYS 100 HG1 LYS 100 8.494 -9.510 1.971 815 HD2 LYS 100 HD2 LYS 100 7.081 -11.364 1.992 816 HD3 LYS 100 HD1 LYS 100 6.118 -10.122 1.194 817 HE2 LYS 100 HE2 LYS 100 7.741 -12.139 -0.340 818 HE3 LYS 100 HE1 LYS 100 6.085 -12.449 0.174 819 HZ1 LYS 100 HZ1 LYS 100 5.444 -10.397 -1.031 820 HZ2 LYS 100 HZ2 LYS 100 6.032 -11.638 -2.029 821 HZ3 LYS 100 HZ3 LYS 100 7.025 -10.319 -1.657 822 H VAL 101 HN VAL 101 7.653 -5.526 0.936 823 HA VAL 101 HA VAL 101 7.827 -6.066 3.823 824 HB VAL 101 HB VAL 101 8.957 -3.946 3.165 825 HG11 VAL 101 HG11 VAL 101 7.800 -3.189 1.274 826 HG12 VAL 101 HG12 VAL 101 7.393 -2.031 2.549 827 HG13 VAL 101 HG13 VAL 101 6.236 -3.281 2.093 828 HG21 VAL 101 HG21 VAL 101 7.909 -2.540 4.835 829 HG22 VAL 101 HG22 VAL 101 7.959 -4.215 5.388 830 HG23 VAL 101 HG23 VAL 101 6.450 -3.531 4.783 831 H ARG 102 HN ARG 102 5.869 -5.952 4.971 832 HA ARG 102 HA ARG 102 3.487 -5.899 3.236 833 HB2 ARG 102 HB2 ARG 102 4.274 -8.140 4.301 834 HB3 ARG 102 HB1 ARG 102 3.627 -7.473 5.795 835 HG2 ARG 102 HG2 ARG 102 1.483 -7.075 4.393 836 HG3 ARG 102 HG1 ARG 102 2.183 -8.248 3.291 837 HD2 ARG 102 HD2 ARG 102 0.703 -9.384 4.782 838 HD3 ARG 102 HD1 ARG 102 2.352 -9.819 5.196 839 HE ARG 102 HE ARG 102 1.233 -7.625 6.714 840 HH11 ARG 102 HH11 ARG 102 1.794 -11.073 6.559 841 HH12 ARG 102 HH12 ARG 102 1.585 -11.315 8.261 842 HH21 ARG 102 HH21 ARG 102 0.937 -7.922 8.940 843 HH22 ARG 102 HH22 ARG 102 1.118 -9.511 9.632 844 H PHE 103 HN PHE 103 2.356 -4.117 3.630 845 HA PHE 103 HA PHE 103 2.328 -3.055 6.370 846 HB2 PHE 103 HB2 PHE 103 1.624 -1.742 3.736 847 HB3 PHE 103 HB1 PHE 103 1.477 -0.963 5.304 848 HD1 PHE 103 HD1 PHE 103 3.977 -1.835 6.616 849 HD2 PHE 103 HD2 PHE 103 3.244 -0.543 2.631 850 HE1 PHE 103 HE1 PHE 103 6.298 -1.030 6.453 851 HE2 PHE 103 HE2 PHE 103 5.564 0.250 2.456 852 HZ PHE 103 HZ PHE 103 7.093 0.011 4.369 853 H ASP 104 HN ASP 104 0.675 -3.885 7.490 854 HA ASP 104 HA ASP 104 -1.828 -4.596 6.250 855 HB2 ASP 104 HB2 ASP 104 -1.156 -4.385 9.196 856 HB3 ASP 104 HB1 ASP 104 -2.578 -5.155 8.512 857 H TYR 105 HN TYR 105 -2.575 -2.666 5.338 858 HA TYR 105 HA TYR 105 -2.794 -0.347 7.086 859 HB2 TYR 105 HB2 TYR 105 -1.937 -0.025 4.802 860 HB3 TYR 105 HB1 TYR 105 -3.457 -0.637 4.144 861 HD1 TYR 105 HD1 TYR 105 -2.237 1.982 6.506 862 HD2 TYR 105 HD2 TYR 105 -5.040 0.893 3.524 863 HE1 TYR 105 HE1 TYR 105 -3.179 4.247 6.593 864 HE2 TYR 105 HE2 TYR 105 -5.998 3.145 3.571 865 HH TYR 105 HH TYR 105 -6.034 5.088 5.552 866 H ASP 106 HN ASP 106 -4.594 0.351 7.983 867 HA ASP 106 HA ASP 106 -6.925 -1.324 7.896 868 HB2 ASP 106 HB2 ASP 106 -6.107 -0.295 9.998 869 HB3 ASP 106 HB1 ASP 106 -6.485 1.296 9.345 870 H LEU 107 HN LEU 107 -8.164 -1.170 6.123 871 HA LEU 107 HA LEU 107 -8.687 1.374 4.839 872 HB2 LEU 107 HB2 LEU 107 -9.032 -1.444 4.230 873 HB3 LEU 107 HB1 LEU 107 -10.481 -0.534 3.860 874 HG LEU 107 HG LEU 107 -9.013 0.998 2.472 875 HD11 LEU 107 HD11 LEU 107 -6.915 -0.068 1.667 876 HD12 LEU 107 HD12 LEU 107 -7.044 -1.203 3.015 877 HD13 LEU 107 HD13 LEU 107 -6.853 0.523 3.330 878 HD21 LEU 107 HD21 LEU 107 -8.844 -0.712 0.625 879 HD22 LEU 107 HD22 LEU 107 -10.432 -0.528 1.376 880 HD23 LEU 107 HD23 LEU 107 -9.408 -1.898 1.804 881 H PHE 108 HN PHE 108 -10.080 2.706 5.941 882 HA PHE 108 HA PHE 108 -12.611 1.465 6.796 883 HB2 PHE 108 HB2 PHE 108 -12.900 3.064 8.518 884 HB3 PHE 108 HB1 PHE 108 -11.238 2.512 8.662 885 HD1 PHE 108 HD2 PHE 108 -13.407 5.302 7.648 886 HD2 PHE 108 HD1 PHE 108 -9.407 4.026 8.349 887 HE1 PHE 108 HE2 PHE 108 -12.658 7.641 7.594 888 HE2 PHE 108 HE1 PHE 108 -8.656 6.370 8.307 889 HZ PHE 108 HZ PHE 108 -10.279 8.177 7.921 890 H LEU 109 HN LEU 109 -14.541 2.623 6.383 891 HA LEU 109 HA LEU 109 -14.294 4.651 4.255 892 HB2 LEU 109 HB2 LEU 109 -16.465 2.554 4.446 893 HB3 LEU 109 HB1 LEU 109 -16.186 3.676 3.128 894 HG LEU 109 HG LEU 109 -14.400 1.359 3.890 895 HD11 LEU 109 HD11 LEU 109 -16.556 0.798 2.752 896 HD12 LEU 109 HD12 LEU 109 -15.108 0.331 1.868 897 HD13 LEU 109 HD13 LEU 109 -16.013 1.765 1.385 898 HD21 LEU 109 HD21 LEU 109 -14.138 3.401 1.689 899 HD22 LEU 109 HD22 LEU 109 -13.185 1.919 1.815 900 HD23 LEU 109 HD23 LEU 109 -13.047 3.165 3.057 901 H HIS 110 HN HIS 110 -16.063 6.207 4.213 902 HA HIS 110 HA HIS 110 -17.128 6.670 6.890 903 HB2 HIS 110 HB2 HIS 110 -16.659 8.414 4.509 904 HB3 HIS 110 HB1 HIS 110 -17.884 8.893 5.681 905 HD1 HIS 110 HD1 HIS 110 -15.563 10.752 5.452 906 HD2 HIS 110 HD2 HIS 110 -15.544 7.457 7.998 907 HE1 HIS 110 HE1 HIS 110 -13.829 11.252 7.210 908 HE2 HIS 110 HE2 HIS 110 -13.920 9.299 8.804 909 H LEU 111 HN LEU 111 -19.349 7.782 6.911 910 HA LEU 111 HA LEU 111 -21.198 5.828 5.940 911 HB2 LEU 111 HB2 LEU 111 -21.201 7.996 7.852 912 HB3 LEU 111 HB1 LEU 111 -22.668 8.002 6.890 913 HG LEU 111 HG LEU 111 -22.879 6.710 9.001 914 HD11 LEU 111 HD11 LEU 111 -23.809 4.649 7.937 915 HD12 LEU 111 HD12 LEU 111 -23.137 5.207 6.404 916 HD13 LEU 111 HD13 LEU 111 -24.374 6.160 7.224 917 HD21 LEU 111 HD21 LEU 111 -20.914 4.844 7.683 918 HD22 LEU 111 HD22 LEU 111 -21.759 4.566 9.208 919 HD23 LEU 111 HD23 LEU 111 -20.572 5.866 9.080 920 H GLU 112 HN GLU 112 -23.169 6.383 4.789 921 HA GLU 112 HA GLU 112 -22.537 7.515 2.265 922 HB2 GLU 112 HB2 GLU 112 -24.256 5.648 2.939 923 HB3 GLU 112 HB1 GLU 112 -25.348 7.002 3.161 924 HG2 GLU 112 HG2 GLU 112 -25.025 7.684 0.853 925 HG3 GLU 112 HG1 GLU 112 -23.892 6.354 0.606 926 H GLY 113 HN GLY 113 -22.272 9.661 2.049 927 HA2 GLY 113 HA2 GLY 113 -23.380 11.750 1.642 928 HA3 GLY 113 HA1 GLY 113 -24.485 11.377 2.957 929 H HIS 114 HN HIS 114 -21.136 10.741 3.430 930 HA HIS 114 HA HIS 114 -20.859 13.262 4.938 931 HB2 HIS 114 HB2 HIS 114 -21.203 10.945 6.276 932 HB3 HIS 114 HB1 HIS 114 -19.455 10.863 6.038 933 HD1 HIS 114 HD1 HIS 114 -18.030 12.805 7.158 934 HD2 HIS 114 HD2 HIS 114 -22.071 12.747 8.150 935 HE1 HIS 114 HE1 HIS 114 -18.267 14.337 9.136 936 HE2 HIS 114 HE2 HIS 114 -20.744 14.427 9.599 937 HA PRO 115 HA PRO 115 -17.378 14.457 2.514 938 HB2 PRO 115 HB2 PRO 115 -16.113 14.398 5.231 939 HB3 PRO 115 HB1 PRO 115 -15.912 15.584 3.935 940 HG2 PRO 115 HG2 PRO 115 -17.638 15.934 6.005 941 HG3 PRO 115 HG1 PRO 115 -17.902 16.620 4.394 942 HD2 PRO 115 HD2 PRO 115 -19.430 14.583 5.748 943 HD3 PRO 115 HD1 PRO 115 -19.745 15.337 4.175 944 HA PRO 116 HA PRO 116 -15.340 10.573 1.614 945 HB2 PRO 116 HB2 PRO 116 -13.450 12.432 0.254 946 HB3 PRO 116 HB1 PRO 116 -14.246 10.980 -0.365 947 HG2 PRO 116 HG2 PRO 116 -15.100 13.381 -1.085 948 HG3 PRO 116 HG1 PRO 116 -16.254 12.081 -0.733 949 HD2 PRO 116 HD2 PRO 116 -15.477 14.434 0.934 950 HD3 PRO 116 HD1 PRO 116 -17.066 13.666 0.721 951 H VAL 117 HN VAL 117 -13.079 9.752 1.592 952 HA VAL 117 HA VAL 117 -11.700 10.659 4.031 953 HB VAL 117 HB VAL 117 -11.649 7.918 2.773 954 HG11 VAL 117 HG11 VAL 117 -9.790 7.925 4.019 955 HG12 VAL 117 HG12 VAL 117 -10.928 7.477 5.276 956 HG13 VAL 117 HG13 VAL 117 -10.368 9.146 5.135 957 HG21 VAL 117 HG21 VAL 117 -12.994 7.233 4.711 958 HG22 VAL 117 HG22 VAL 117 -13.865 8.241 3.557 959 HG23 VAL 117 HG23 VAL 117 -13.286 8.931 5.078 960 H ASN 118 HN ASN 118 -9.555 11.186 3.855 961 HA ASN 118 HA ASN 118 -8.051 10.169 1.569 962 HB2 ASN 118 HB2 ASN 118 -9.058 12.414 0.975 963 HB3 ASN 118 HB1 ASN 118 -8.041 13.118 2.228 964 HD21 ASN 118 HD21 ASN 118 -5.631 12.526 1.991 965 HD22 ASN 118 HD22 ASN 118 -5.000 12.567 0.380 966 H HIS 119 HN HIS 119 -6.571 9.041 2.740 967 HA HIS 119 HA HIS 119 -5.107 10.510 4.832 968 HB2 HIS 119 HB2 HIS 119 -6.754 8.882 5.772 969 HB3 HIS 119 HB1 HIS 119 -5.877 7.596 4.950 970 HD1 HIS 119 HD1 HIS 119 -4.131 6.483 6.275 971 HD2 HIS 119 HD2 HIS 119 -4.971 10.292 7.714 972 HE1 HIS 119 HE1 HIS 119 -2.729 6.748 8.348 973 HE2 HIS 119 HE2 HIS 119 -3.341 9.013 9.269 974 H LEU 120 HN LEU 120 -2.949 10.105 5.026 975 HA LEU 120 HA LEU 120 -1.671 7.960 3.546 976 HB2 LEU 120 HB2 LEU 120 -1.282 10.873 2.997 977 HB3 LEU 120 HB1 LEU 120 0.084 9.790 2.853 978 HG LEU 120 HG LEU 120 -2.480 9.315 1.360 979 HD11 LEU 120 HD11 LEU 120 -0.541 10.193 -0.414 980 HD12 LEU 120 HD12 LEU 120 -0.463 11.340 0.923 981 HD13 LEU 120 HD13 LEU 120 -1.989 11.071 0.076 982 HD21 LEU 120 HD21 LEU 120 -0.619 7.547 1.795 983 HD22 LEU 120 HD22 LEU 120 0.270 8.460 0.572 984 HD23 LEU 120 HD23 LEU 120 -1.288 7.735 0.171 985 H ARG 121 HN ARG 121 0.436 7.472 4.298 986 HA ARG 121 HA ARG 121 1.554 8.962 6.499 987 HB2 ARG 121 HB2 ARG 121 0.685 7.798 8.230 988 HB3 ARG 121 HB1 ARG 121 -0.247 6.849 7.119 989 HG2 ARG 121 HG2 ARG 121 2.574 6.047 7.495 990 HG3 ARG 121 HG1 ARG 121 1.478 5.786 8.844 991 HD2 ARG 121 HD2 ARG 121 1.021 4.745 6.030 992 HD3 ARG 121 HD1 ARG 121 1.694 3.823 7.362 993 HE ARG 121 HE ARG 121 -0.984 4.984 7.606 994 HH11 ARG 121 HH11 ARG 121 1.213 2.280 7.681 995 HH12 ARG 121 HH12 ARG 121 0.072 1.175 8.383 996 HH21 ARG 121 HH21 ARG 121 -2.513 3.560 8.585 997 HH22 ARG 121 HH22 ARG 121 -2.056 1.907 8.898 998 H CYS 122 HN CYS 122 3.700 8.845 6.398 999 HA CYS 122 HA CYS 122 4.958 6.940 4.644 1000 HB2 CYS 122 HB2 CYS 122 6.304 8.909 6.463 1001 HB3 CYS 122 HB1 CYS 122 6.991 8.128 5.051 1002 HG CYS 122 HG CYS 122 4.466 9.595 3.803 1003 H GLU 123 HN GLU 123 5.747 5.035 5.183 1004 HA GLU 123 HA GLU 123 6.223 4.360 7.996 1005 HB2 GLU 123 HB2 GLU 123 6.115 2.677 5.479 1006 HB3 GLU 123 HB1 GLU 123 6.499 2.031 7.070 1007 HG2 GLU 123 HG2 GLU 123 3.976 3.530 6.560 1008 HG3 GLU 123 HG1 GLU 123 4.099 1.808 6.208 1009 H LYS 124 HN LYS 124 8.255 3.087 8.430 1010 HA LYS 124 HA LYS 124 10.474 4.226 6.862 1011 HB2 LYS 124 HB2 LYS 124 10.152 5.519 8.909 1012 HB3 LYS 124 HB1 LYS 124 10.240 4.045 9.863 1013 HG2 LYS 124 HG2 LYS 124 12.582 3.756 8.900 1014 HG3 LYS 124 HG1 LYS 124 12.445 5.428 8.362 1015 HD2 LYS 124 HD2 LYS 124 13.551 5.455 10.432 1016 HD3 LYS 124 HD1 LYS 124 11.909 6.035 10.731 1017 HE2 LYS 124 HE2 LYS 124 11.244 4.004 11.685 1018 HE3 LYS 124 HE1 LYS 124 12.641 3.153 11.029 1019 HZ1 LYS 124 HZ1 LYS 124 14.054 4.442 12.542 1020 HZ2 LYS 124 HZ2 LYS 124 12.909 3.526 13.389 1021 HZ3 LYS 124 HZ3 LYS 124 12.679 5.194 13.194 1022 H LEU 125 HN LEU 125 11.814 2.727 6.115 1023 HA LEU 125 HA LEU 125 12.119 0.225 7.663 1024 HB2 LEU 125 HB2 LEU 125 12.606 0.567 4.712 1025 HB3 LEU 125 HB1 LEU 125 12.498 -0.932 5.605 1026 HG LEU 125 HG LEU 125 10.084 0.789 5.629 1027 HD11 LEU 125 HD11 LEU 125 10.759 0.978 3.290 1028 HD12 LEU 125 HD12 LEU 125 9.347 -0.071 3.459 1029 HD13 LEU 125 HD13 LEU 125 10.940 -0.778 3.202 1030 HD21 LEU 125 HD21 LEU 125 9.066 -1.512 5.300 1031 HD22 LEU 125 HD22 LEU 125 9.940 -1.246 6.810 1032 HD23 LEU 125 HD23 LEU 125 10.700 -2.149 5.499 1033 H THR 126 HN THR 126 14.027 0.355 8.735 1034 HA THR 126 HA THR 126 16.246 1.823 7.498 1035 HB THR 126 HB THR 126 16.437 0.709 10.261 1036 HG1 THR 126 HG1 THR 126 14.351 1.731 10.163 1037 HG21 THR 126 HG21 THR 126 18.182 2.095 8.889 1038 HG22 THR 126 HG22 THR 126 17.942 2.408 10.607 1039 HG23 THR 126 HG23 THR 126 17.193 3.460 9.405 1040 H PHE 127 HN PHE 127 17.737 0.700 6.437 1041 HA PHE 127 HA PHE 127 18.194 -2.105 7.197 1042 HB2 PHE 127 HB2 PHE 127 18.926 -0.673 4.634 1043 HB3 PHE 127 HB1 PHE 127 19.130 -2.393 4.949 1044 HD1 PHE 127 HD1 PHE 127 17.138 -3.884 5.094 1045 HD2 PHE 127 HD2 PHE 127 16.824 0.252 4.093 1046 HE1 PHE 127 HE1 PHE 127 14.853 -4.242 4.298 1047 HE2 PHE 127 HE2 PHE 127 14.542 -0.112 3.287 1048 HZ PHE 127 HZ PHE 127 13.544 -2.355 3.401 1049 H ASN 128 HN ASN 128 19.781 -2.225 8.628 1050 HA ASN 128 HA ASN 128 21.854 -0.260 8.798 1051 HB2 ASN 128 HB2 ASN 128 21.472 -2.888 10.231 1052 HB3 ASN 128 HB1 ASN 128 22.787 -1.767 10.560 1053 HD21 ASN 128 HD21 ASN 128 19.378 -2.347 10.837 1054 HD22 ASN 128 HD22 ASN 128 19.056 -1.074 11.970 1055 H ASN 129 HN ASN 129 23.526 -0.174 7.542 1056 HA ASN 129 HA ASN 129 25.278 -0.690 6.223 1057 HB2 ASN 129 HB2 ASN 129 25.415 -3.228 7.858 1058 HB3 ASN 129 HB1 ASN 129 26.724 -2.504 6.928 1059 HD21 ASN 129 HD21 ASN 129 24.962 -2.486 9.858 1060 HD22 ASN 129 HD22 ASN 129 25.871 -1.252 10.658 1061 HA PRO 130 HA PRO 130 23.017 -3.605 3.475 1062 HB2 PRO 130 HB2 PRO 130 22.205 -1.860 1.609 1063 HB3 PRO 130 HB1 PRO 130 21.299 -2.088 3.110 1064 HG2 PRO 130 HG2 PRO 130 23.133 0.120 2.319 1065 HG3 PRO 130 HG1 PRO 130 21.652 0.181 3.287 1066 HD2 PRO 130 HD2 PRO 130 24.264 0.166 4.282 1067 HD3 PRO 130 HD1 PRO 130 22.795 -0.171 5.216 1068 H THR 131 HN THR 131 23.736 -4.344 1.425 1069 HA THR 131 HA THR 131 26.479 -3.865 0.889 1070 HB THR 131 HB THR 131 25.458 -6.050 0.375 1071 HG1 THR 131 HG1 THR 131 27.006 -6.202 -1.034 1072 HG21 THR 131 HG21 THR 131 23.266 -5.357 -0.390 1073 HG22 THR 131 HG22 THR 131 24.060 -6.288 -1.661 1074 HG23 THR 131 HG23 THR 131 23.977 -4.529 -1.776 1075 H GLU 132 HN GLU 132 27.355 -3.119 -1.225 1076 HA GLU 132 HA GLU 132 26.776 -0.458 -1.690 1077 HB2 GLU 132 HB2 GLU 132 28.811 -1.769 -2.486 1078 HB3 GLU 132 HB1 GLU 132 27.812 -2.293 -3.836 1079 HG2 GLU 132 HG2 GLU 132 29.162 -0.470 -4.545 1080 HG3 GLU 132 HG1 GLU 132 27.488 0.060 -4.459 1081 H ASP 133 HN ASP 133 25.531 -3.282 -3.434 1082 HA ASP 133 HA ASP 133 24.252 -1.915 -5.522 1083 HB2 ASP 133 HB2 ASP 133 23.601 -4.608 -4.308 1084 HB3 ASP 133 HB1 ASP 133 22.953 -4.010 -5.832 1085 H PHE 134 HN PHE 134 22.833 -3.249 -2.527 1086 HA PHE 134 HA PHE 134 20.245 -2.208 -2.980 1087 HB2 PHE 134 HB2 PHE 134 20.991 -4.009 -1.252 1088 HB3 PHE 134 HB1 PHE 134 21.394 -2.635 -0.228 1089 HD1 PHE 134 HD1 PHE 134 18.520 -2.931 -2.563 1090 HD2 PHE 134 HD2 PHE 134 19.803 -2.788 1.495 1091 HE1 PHE 134 HE1 PHE 134 16.197 -2.790 -1.834 1092 HE2 PHE 134 HE2 PHE 134 17.463 -2.640 2.226 1093 HZ PHE 134 HZ PHE 134 15.653 -2.633 0.557 1094 H ARG 135 HN ARG 135 22.950 -1.117 -1.033 1095 HA ARG 135 HA ARG 135 22.130 1.278 -0.023 1096 HB2 ARG 135 HB2 ARG 135 24.175 0.573 0.644 1097 HB3 ARG 135 HB1 ARG 135 24.707 0.222 -1.002 1098 HG2 ARG 135 HG2 ARG 135 25.759 2.212 -1.029 1099 HG3 ARG 135 HG1 ARG 135 24.206 3.004 -0.812 1100 HD2 ARG 135 HD2 ARG 135 26.049 3.473 0.913 1101 HD3 ARG 135 HD1 ARG 135 24.449 3.047 1.520 1102 HE ARG 135 HE ARG 135 25.930 0.696 1.292 1103 HH11 ARG 135 HH11 ARG 135 25.996 3.672 3.131 1104 HH12 ARG 135 HH12 ARG 135 26.788 2.948 4.501 1105 HH21 ARG 135 HH21 ARG 135 26.975 -0.257 3.087 1106 HH22 ARG 135 HH22 ARG 135 27.342 0.720 4.478 1107 H ARG 136 HN ARG 136 23.498 0.769 -3.252 1108 HA ARG 136 HA ARG 136 23.531 3.366 -4.161 1109 HB2 ARG 136 HB2 ARG 136 23.609 0.690 -5.250 1110 HB3 ARG 136 HB1 ARG 136 22.895 1.867 -6.310 1111 HG2 ARG 136 HG2 ARG 136 24.841 3.198 -6.340 1112 HG3 ARG 136 HG1 ARG 136 25.554 2.264 -5.025 1113 HD2 ARG 136 HD2 ARG 136 26.583 1.535 -7.051 1114 HD3 ARG 136 HD1 ARG 136 25.471 0.264 -6.532 1115 HE ARG 136 HE ARG 136 24.406 2.190 -8.426 1116 HH11 ARG 136 HH11 ARG 136 25.929 -0.935 -7.965 1117 HH12 ARG 136 HH12 ARG 136 25.381 -1.567 -9.492 1118 HH21 ARG 136 HH21 ARG 136 23.666 1.364 -10.416 1119 HH22 ARG 136 HH22 ARG 136 24.097 -0.251 -10.894 1120 H LYS 137 HN LYS 137 20.962 0.951 -4.494 1121 HA LYS 137 HA LYS 137 19.277 2.599 -6.038 1122 HB2 LYS 137 HB2 LYS 137 18.571 0.223 -4.303 1123 HB3 LYS 137 HB1 LYS 137 17.515 0.948 -5.512 1124 HG2 LYS 137 HG2 LYS 137 19.060 0.334 -7.273 1125 HG3 LYS 137 HG1 LYS 137 20.201 -0.296 -6.085 1126 HD2 LYS 137 HD2 LYS 137 18.425 -1.923 -5.384 1127 HD3 LYS 137 HD1 LYS 137 17.469 -1.369 -6.764 1128 HE2 LYS 137 HE2 LYS 137 19.171 -2.088 -8.300 1129 HE3 LYS 137 HE1 LYS 137 20.258 -2.488 -6.976 1130 HZ1 LYS 137 HZ1 LYS 137 19.363 -4.511 -7.645 1131 HZ2 LYS 137 HZ2 LYS 137 17.798 -3.890 -7.818 1132 HZ3 LYS 137 HZ3 LYS 137 18.454 -4.112 -6.270 1133 H LEU 138 HN LEU 138 19.307 1.778 -2.617 1134 HA LEU 138 HA LEU 138 17.129 3.252 -1.725 1135 HB2 LEU 138 HB2 LEU 138 19.708 2.877 -0.228 1136 HB3 LEU 138 HB1 LEU 138 18.134 3.213 0.460 1137 HG LEU 138 HG LEU 138 19.095 0.660 -0.798 1138 HD11 LEU 138 HD11 LEU 138 19.589 1.169 1.597 1139 HD12 LEU 138 HD12 LEU 138 18.651 -0.300 1.326 1140 HD13 LEU 138 HD13 LEU 138 17.850 1.168 1.888 1141 HD21 LEU 138 HD21 LEU 138 16.281 1.373 -0.035 1142 HD22 LEU 138 HD22 LEU 138 16.844 -0.236 -0.467 1143 HD23 LEU 138 HD23 LEU 138 16.872 1.061 -1.663 1144 H LEU 139 HN LEU 139 20.440 4.322 -2.346 1145 HA LEU 139 HA LEU 139 20.126 6.926 -1.220 1146 HB2 LEU 139 HB2 LEU 139 22.105 5.996 -3.300 1147 HB3 LEU 139 HB1 LEU 139 22.243 7.435 -2.311 1148 HG LEU 139 HG LEU 139 22.207 4.642 -1.184 1149 HD11 LEU 139 HD11 LEU 139 24.461 4.483 -1.319 1150 HD12 LEU 139 HD12 LEU 139 24.700 6.233 -1.271 1151 HD13 LEU 139 HD13 LEU 139 24.180 5.456 -2.767 1152 HD21 LEU 139 HD21 LEU 139 21.520 6.488 0.298 1153 HD22 LEU 139 HD22 LEU 139 23.086 7.252 0.027 1154 HD23 LEU 139 HD23 LEU 139 22.996 5.682 0.827 1155 H LYS 140 HN LYS 140 19.654 5.539 -4.379 1156 HA LYS 140 HA LYS 140 19.466 7.968 -5.823 1157 HB2 LYS 140 HB2 LYS 140 19.381 5.178 -6.382 1158 HB3 LYS 140 HB1 LYS 140 18.011 5.966 -7.141 1159 HG2 LYS 140 HG2 LYS 140 19.312 7.238 -8.523 1160 HG3 LYS 140 HG1 LYS 140 20.706 7.172 -7.443 1161 HD2 LYS 140 HD2 LYS 140 19.665 4.746 -8.881 1162 HD3 LYS 140 HD1 LYS 140 20.867 5.822 -9.583 1163 HE2 LYS 140 HE2 LYS 140 21.122 4.392 -6.947 1164 HE3 LYS 140 HE1 LYS 140 21.836 3.865 -8.467 1165 HZ1 LYS 140 HZ1 LYS 140 22.454 6.371 -6.993 1166 HZ2 LYS 140 HZ2 LYS 140 23.063 5.993 -8.527 1167 HZ3 LYS 140 HZ3 LYS 140 23.479 5.036 -7.192 1168 H ALA 141 HN ALA 141 17.282 6.163 -3.917 1169 HA ALA 141 HA ALA 141 14.795 6.736 -4.899 1170 HB1 ALA 141 HB1 ALA 141 14.059 5.924 -2.960 1171 HB2 ALA 141 HB2 ALA 141 14.992 7.077 -2.005 1172 HB3 ALA 141 HB3 ALA 141 15.763 5.618 -2.628 1173 H1 GLY 212 HT1 GLY 212 -10.747 6.075 11.485 1174 H2 GLY 212 HT2 GLY 212 -10.621 6.351 13.150 1175 H3 GLY 212 HT3 GLY 212 -12.043 6.771 12.326 1176 HA2 GLY 212 HA1 GLY 212 -11.013 4.009 12.648 1177 HA3 GLY 212 HA2 GLY 212 -12.287 4.721 13.627 1178 H GLY 213 HN GLY 213 -12.906 2.456 12.381 1179 HA2 GLY 213 HA2 GLY 213 -13.993 2.896 9.748 1180 HA3 GLY 213 HA1 GLY 213 -14.202 1.459 10.740 1181 H LYS 214 HN LYS 214 -15.521 4.492 9.787 1182 HA LYS 214 HA LYS 214 -17.588 4.596 11.761 1183 HB2 LYS 214 HB2 LYS 214 -17.375 5.997 9.089 1184 HB3 LYS 214 HB1 LYS 214 -18.545 6.378 10.345 1185 HG2 LYS 214 HG2 LYS 214 -15.554 6.667 10.543 1186 HG3 LYS 214 HG1 LYS 214 -16.728 7.972 10.364 1187 HD2 LYS 214 HD2 LYS 214 -16.515 6.079 12.706 1188 HD3 LYS 214 HD1 LYS 214 -15.988 7.762 12.683 1189 HE2 LYS 214 HE2 LYS 214 -18.295 8.474 12.288 1190 HE3 LYS 214 HE1 LYS 214 -18.818 6.791 12.305 1191 HZ1 LYS 214 HZ1 LYS 214 -19.235 7.812 14.425 1192 HZ2 LYS 214 HZ2 LYS 214 -17.612 8.281 14.575 1193 HZ3 LYS 214 HZ3 LYS 214 -18.026 6.638 14.606 1194 H ALA 215 HN ALA 215 -17.488 3.710 8.329 1195 HA ALA 215 HA ALA 215 -20.201 2.799 8.263 1196 HB1 ALA 215 HB1 ALA 215 -19.616 1.939 6.040 1197 HB2 ALA 215 HB2 ALA 215 -17.913 2.268 6.357 1198 HB3 ALA 215 HB3 ALA 215 -19.063 3.601 6.248 1199 HA PRO 216 HA PRO 216 -19.842 -1.336 9.800 1200 HB2 PRO 216 HB2 PRO 216 -21.074 -2.790 7.780 1201 HB3 PRO 216 HB1 PRO 216 -21.907 -1.979 9.108 1202 HG2 PRO 216 HG2 PRO 216 -21.521 -1.098 6.291 1203 HG3 PRO 216 HG1 PRO 216 -22.907 -0.856 7.366 1204 HD2 PRO 216 HD2 PRO 216 -21.132 1.101 6.804 1205 HD3 PRO 216 HD1 PRO 216 -21.957 0.992 8.371 1206 H ARG 217 HN ARG 217 -18.632 -3.266 9.556 1207 HA ARG 217 HA ARG 217 -16.806 -3.280 7.246 1208 HB2 ARG 217 HB2 ARG 217 -15.978 -3.690 10.129 1209 HB3 ARG 217 HB1 ARG 217 -14.919 -3.698 8.725 1210 HG2 ARG 217 HG2 ARG 217 -15.439 -1.338 8.330 1211 HG3 ARG 217 HG1 ARG 217 -16.472 -1.335 9.760 1212 HD2 ARG 217 HD2 ARG 217 -14.375 -0.416 10.400 1213 HD3 ARG 217 HD1 ARG 217 -14.472 -2.034 11.093 1214 HE ARG 217 HE ARG 217 -13.189 -2.215 8.616 1215 HH11 ARG 217 HH11 ARG 217 -12.647 -0.962 11.835 1216 HH12 ARG 217 HH12 ARG 217 -10.914 -1.013 11.701 1217 HH21 ARG 217 HH21 ARG 217 -10.904 -2.278 8.435 1218 HH22 ARG 217 HH22 ARG 217 -9.919 -1.727 9.761 1219 H1 KCR 218 HN KCR 218 -15.916 -5.291 6.692 1220 H4 KCR 218 HA KCR 218 -17.608 -7.540 7.410 1221 H5 KCR 218 HB1 KCR 218 -16.454 -8.715 5.587 1222 H6 KCR 218 HB2 KCR 218 -15.346 -7.361 5.411 1223 H7 KCR 218 HG1 KCR 218 -17.222 -5.917 4.793 1224 H8 KCR 218 HG2 KCR 218 -18.314 -7.294 4.937 1225 H9 KCR 218 HD1 KCR 218 -17.253 -8.425 3.126 1226 H10 KCR 218 HD2 KCR 218 -15.951 -7.232 3.074 1227 H11 KCR 218 HE1 KCR 218 -17.514 -5.511 2.398 1228 H12 KCR 218 HE2 KCR 218 -18.859 -6.646 2.534 1229 H13 KCR 218 HZ1 KCR 218 -17.762 -7.910 0.699 1230 H14 KCR 218 HH1 KCR 218 -17.222 -7.697 -1.653 1231 H15 KCR 218 HJ1 KCR 218 -17.036 -4.706 -2.365 1232 H16 KCR 218 HF3 KCR 218 -17.688 -5.965 -4.573 1233 H17 KCR 218 HF1 KCR 218 -15.946 -5.975 -4.297 1234 H18 KCR 218 HF2 KCR 218 -16.912 -7.394 -3.886 1235 H GLN 219 HN GLN 219 -16.364 -6.963 9.606 1236 HA GLN 219 HA GLN 219 -14.563 -9.195 10.017 1237 HB2 GLN 219 HB2 GLN 219 -13.048 -7.324 9.447 1238 HB3 GLN 219 HB1 GLN 219 -13.747 -6.371 10.748 1239 HG2 GLN 219 HG2 GLN 219 -11.606 -7.332 11.388 1240 HG3 GLN 219 HG1 GLN 219 -12.918 -7.956 12.385 1241 HE21 GLN 219 HE21 GLN 219 -10.594 -8.698 9.910 1242 HE22 GLN 219 HE22 GLN 219 -10.758 -10.419 9.991 1243 H LEU 220 HN LEU 220 -15.895 -6.275 11.557 1244 HA LEU 220 HA LEU 220 -16.370 -7.718 14.021 1245 HB2 LEU 220 HB2 LEU 220 -17.043 -4.887 13.208 1246 HB3 LEU 220 HB1 LEU 220 -17.362 -5.559 14.792 1247 HG LEU 220 HG LEU 220 -15.420 -4.289 15.061 1248 HD11 LEU 220 HD11 LEU 220 -15.228 -6.475 16.089 1249 HD12 LEU 220 HD12 LEU 220 -13.651 -5.897 15.548 1250 HD13 LEU 220 HD13 LEU 220 -14.509 -7.124 14.615 1251 HD21 LEU 220 HD21 LEU 220 -13.471 -4.390 13.600 1252 HD22 LEU 220 HD22 LEU 220 -14.914 -3.913 12.706 1253 HD23 LEU 220 HD23 LEU 220 -14.297 -5.559 12.568 1254 H ALA 221 HN ALA 221 -17.735 -9.263 12.742 1255 HA ALA 221 HA ALA 221 -20.391 -8.267 12.059 1256 HB1 ALA 221 HB1 ALA 221 -20.765 -10.468 11.092 1257 HB2 ALA 221 HB2 ALA 221 -19.222 -11.029 11.737 1258 HB3 ALA 221 HB3 ALA 221 -19.255 -9.777 10.495 1259 H THR 222 HN THR 222 -19.037 -8.977 14.840 1260 HA THR 222 HA THR 222 -20.850 -10.883 15.966 1261 HB THR 222 HB THR 222 -19.143 -8.908 17.486 1262 HG1 THR 222 HG1 THR 222 -18.450 -11.345 16.180 1263 HG21 THR 222 HG21 THR 222 -19.108 -10.668 19.184 1264 HG22 THR 222 HG22 THR 222 -20.095 -11.700 18.149 1265 HG23 THR 222 HG23 THR 222 -20.766 -10.205 18.801 1266 H LYS 223 HN LYS 223 -22.811 -10.525 16.779 1267 HA LYS 223 HA LYS 223 -24.725 -9.504 17.446 1268 HB2 LYS 223 HB2 LYS 223 -22.822 -7.399 18.498 1269 HB3 LYS 223 HB1 LYS 223 -24.520 -7.540 18.931 1270 HG2 LYS 223 HG2 LYS 223 -24.125 -9.666 19.987 1271 HG3 LYS 223 HG1 LYS 223 -22.446 -9.660 19.444 1272 HD2 LYS 223 HD2 LYS 223 -22.066 -7.610 20.777 1273 HD3 LYS 223 HD1 LYS 223 -23.722 -7.729 21.380 1274 HE2 LYS 223 HE2 LYS 223 -23.244 -9.838 22.427 1275 HE3 LYS 223 HE1 LYS 223 -21.639 -9.883 21.700 1276 HZ1 LYS 223 HZ1 LYS 223 -21.122 -7.837 22.975 1277 HZ2 LYS 223 HZ2 LYS 223 -21.422 -9.193 23.950 1278 HZ3 LYS 223 HZ3 LYS 223 -22.610 -7.996 23.775 1279 H ALA 224 HN ALA 224 -23.869 -9.042 14.782 1280 HA ALA 224 HA ALA 224 -24.594 -6.246 14.272 1281 HB1 ALA 224 HB1 ALA 224 -22.546 -7.083 13.206 1282 HB2 ALA 224 HB2 ALA 224 -23.757 -6.610 12.017 1283 HB3 ALA 224 HB3 ALA 224 -23.492 -8.316 12.373 Start of MODEL 14 1 H1 GLY 1 HT1 GLY 1 41.370 0.713 2.630 2 H2 GLY 1 HT2 GLY 1 40.817 -0.226 3.927 3 H3 GLY 1 HT3 GLY 1 40.054 1.241 3.560 4 HA2 GLY 1 HA1 GLY 1 39.323 0.351 1.432 5 HA3 GLY 1 HA2 GLY 1 40.095 -1.176 1.838 6 H SER 2 HN SER 2 37.308 -0.636 1.239 7 HA SER 2 HA SER 2 35.269 -1.365 1.891 8 HB2 SER 2 HB2 SER 2 36.370 -3.341 2.809 9 HB3 SER 2 HB1 SER 2 36.739 -2.472 4.297 10 HG SER 2 HG SER 2 34.252 -3.394 3.332 11 H HIS 3 HN HIS 3 33.494 -0.606 3.048 12 HA HIS 3 HA HIS 3 34.110 1.410 5.107 13 HB2 HIS 3 HB2 HIS 3 32.185 1.597 2.802 14 HB3 HIS 3 HB1 HIS 3 31.979 2.579 4.249 15 HD1 HIS 3 HD1 HIS 3 33.688 4.473 4.658 16 HD2 HIS 3 HD2 HIS 3 34.331 2.330 1.150 17 HE1 HIS 3 HE1 HIS 3 35.348 5.818 3.333 18 HE2 HIS 3 HE2 HIS 3 35.679 4.539 1.188 19 H MET 4 HN MET 4 33.578 -1.263 5.647 20 HA MET 4 HA MET 4 30.826 -1.287 6.642 21 HB2 MET 4 HB2 MET 4 32.954 -3.437 6.624 22 HB3 MET 4 HB1 MET 4 31.342 -3.640 7.295 23 HG2 MET 4 HG2 MET 4 30.384 -3.210 5.075 24 HG3 MET 4 HG1 MET 4 32.013 -3.067 4.418 25 HE1 MET 4 HE1 MET 4 29.380 -5.464 6.074 26 HE2 MET 4 HE2 MET 4 30.748 -5.568 7.183 27 HE3 MET 4 HE3 MET 4 30.298 -6.964 6.204 28 H ALA 5 HN ALA 5 33.621 -0.026 7.585 29 HA ALA 5 HA ALA 5 33.700 -0.798 10.352 30 HB1 ALA 5 HB1 ALA 5 35.245 1.174 10.530 31 HB2 ALA 5 HB2 ALA 5 35.013 1.424 8.801 32 HB3 ALA 5 HB3 ALA 5 35.746 -0.069 9.387 33 H SER 6 HN SER 6 32.570 1.968 8.490 34 HA SER 6 HA SER 6 31.253 3.176 10.752 35 HB2 SER 6 HB2 SER 6 32.099 4.663 9.064 36 HB3 SER 6 HB1 SER 6 31.281 3.771 7.787 37 HG SER 6 HG SER 6 30.071 5.325 9.846 38 H SER 7 HN SER 7 29.293 2.618 11.469 39 HA SER 7 HA SER 7 27.768 0.658 9.976 40 HB2 SER 7 HB2 SER 7 28.156 0.660 12.525 41 HB3 SER 7 HB1 SER 7 26.941 1.939 12.588 42 HG SER 7 HG SER 7 25.407 0.540 12.118 43 H CYS 8 HN CYS 8 26.515 1.357 8.401 44 HA CYS 8 HA CYS 8 25.100 3.910 8.759 45 HB2 CYS 8 HB2 CYS 8 25.203 3.992 6.207 46 HB3 CYS 8 HB1 CYS 8 26.691 4.305 7.091 47 HG CYS 8 HG CYS 8 28.048 2.620 5.726 48 H ALA 9 HN ALA 9 23.062 3.531 9.113 49 HA ALA 9 HA ALA 9 21.704 1.375 7.696 50 HB1 ALA 9 HB1 ALA 9 19.805 1.910 9.131 51 HB2 ALA 9 HB2 ALA 9 20.683 3.291 9.790 52 HB3 ALA 9 HB3 ALA 9 21.264 1.653 10.088 53 H VAL 10 HN VAL 10 20.703 1.756 5.821 54 HA VAL 10 HA VAL 10 20.077 4.530 5.103 55 HB VAL 10 HB VAL 10 19.969 2.107 3.300 56 HG11 VAL 10 HG11 VAL 10 18.657 3.735 2.308 57 HG12 VAL 10 HG12 VAL 10 20.238 4.008 1.570 58 HG13 VAL 10 HG13 VAL 10 19.683 5.053 2.880 59 HG21 VAL 10 HG21 VAL 10 22.234 2.216 3.791 60 HG22 VAL 10 HG22 VAL 10 22.225 3.975 3.917 61 HG23 VAL 10 HG23 VAL 10 22.099 3.202 2.336 62 H GLN 11 HN GLN 11 18.059 5.217 5.256 63 HA GLN 11 HA GLN 11 16.009 3.187 5.797 64 HB2 GLN 11 HB2 GLN 11 15.745 6.092 6.521 65 HB3 GLN 11 HB1 GLN 11 14.914 4.707 7.216 66 HG2 GLN 11 HG2 GLN 11 16.388 4.837 8.877 67 HG3 GLN 11 HG1 GLN 11 17.551 4.170 7.740 68 HE21 GLN 11 HE21 GLN 11 16.210 7.363 7.346 69 HE22 GLN 11 HE22 GLN 11 17.666 8.224 7.711 70 H VAL 12 HN VAL 12 14.276 3.029 4.564 71 HA VAL 12 HA VAL 12 13.897 5.057 2.474 72 HB VAL 12 HB VAL 12 12.750 3.219 1.217 73 HG11 VAL 12 HG11 VAL 12 15.257 3.827 1.020 74 HG12 VAL 12 HG12 VAL 12 14.734 2.278 0.365 75 HG13 VAL 12 HG13 VAL 12 15.537 2.346 1.933 76 HG21 VAL 12 HG21 VAL 12 12.207 1.881 3.173 77 HG22 VAL 12 HG22 VAL 12 13.907 1.449 3.341 78 HG23 VAL 12 HG23 VAL 12 13.001 0.946 1.911 79 H LYS 13 HN LYS 13 11.785 5.834 2.116 80 HA LYS 13 HA LYS 13 9.878 5.069 4.208 81 HB2 LYS 13 HB2 LYS 13 10.480 7.721 2.957 82 HB3 LYS 13 HB1 LYS 13 8.899 7.416 3.669 83 HG2 LYS 13 HG2 LYS 13 9.977 6.816 5.775 84 HG3 LYS 13 HG1 LYS 13 11.550 7.192 5.068 85 HD2 LYS 13 HD2 LYS 13 10.834 9.508 4.710 86 HD3 LYS 13 HD1 LYS 13 9.265 9.132 5.426 87 HE2 LYS 13 HE2 LYS 13 10.358 8.567 7.536 88 HE3 LYS 13 HE1 LYS 13 11.931 8.923 6.822 89 HZ1 LYS 13 HZ1 LYS 13 9.722 10.882 7.161 90 HZ2 LYS 13 HZ2 LYS 13 11.263 11.212 6.533 91 HZ3 LYS 13 HZ3 LYS 13 11.091 10.763 8.160 92 H LEU 14 HN LEU 14 8.123 4.143 3.641 93 HA LEU 14 HA LEU 14 7.098 4.507 0.900 94 HB2 LEU 14 HB2 LEU 14 6.732 2.157 2.747 95 HB3 LEU 14 HB1 LEU 14 5.995 2.323 1.167 96 HG LEU 14 HG LEU 14 8.971 2.146 1.672 97 HD11 LEU 14 HD11 LEU 14 7.018 0.120 0.623 98 HD12 LEU 14 HD12 LEU 14 7.826 0.065 2.189 99 HD13 LEU 14 HD13 LEU 14 8.765 -0.084 0.703 100 HD21 LEU 14 HD21 LEU 14 7.488 1.915 -0.941 101 HD22 LEU 14 HD22 LEU 14 9.229 2.034 -0.679 102 HD23 LEU 14 HD23 LEU 14 8.194 3.427 -0.363 103 H GLU 15 HN GLU 15 4.838 4.770 0.704 104 HA GLU 15 HA GLU 15 3.659 5.866 3.170 105 HB2 GLU 15 HB2 GLU 15 4.502 7.551 1.552 106 HB3 GLU 15 HB1 GLU 15 3.408 6.903 0.341 107 HG2 GLU 15 HG2 GLU 15 1.515 7.696 1.477 108 HG3 GLU 15 HG1 GLU 15 2.431 8.011 2.951 109 H LEU 16 HN LEU 16 1.845 4.931 3.776 110 HA LEU 16 HA LEU 16 0.239 3.428 1.835 111 HB2 LEU 16 HB2 LEU 16 0.037 3.612 4.840 112 HB3 LEU 16 HB1 LEU 16 -1.146 2.801 3.842 113 HG LEU 16 HG LEU 16 0.237 1.149 4.810 114 HD11 LEU 16 HD11 LEU 16 1.577 1.045 2.252 115 HD12 LEU 16 HD12 LEU 16 -0.147 1.379 2.118 116 HD13 LEU 16 HD13 LEU 16 0.410 -0.064 2.966 117 HD21 LEU 16 HD21 LEU 16 2.672 2.346 3.580 118 HD22 LEU 16 HD22 LEU 16 2.563 1.106 4.822 119 HD23 LEU 16 HD23 LEU 16 2.153 2.779 5.204 120 H GLY 17 HN GLY 17 -1.803 4.012 1.322 121 HA2 GLY 17 HA2 GLY 17 -3.043 6.260 2.690 122 HA3 GLY 17 HA1 GLY 17 -2.592 6.530 1.007 123 H HIS 18 HN HIS 18 -5.175 6.764 1.788 124 HA HIS 18 HA HIS 18 -6.364 5.213 -0.214 125 HB2 HIS 18 HB2 HIS 18 -7.220 3.394 0.801 126 HB3 HIS 18 HB1 HIS 18 -6.142 3.742 2.145 127 HD1 HIS 18 HD1 HIS 18 -7.242 5.137 4.158 128 HD2 HIS 18 HD2 HIS 18 -9.880 3.508 1.385 129 HE1 HIS 18 HE1 HIS 18 -9.521 5.233 5.236 130 HE2 HIS 18 HE2 HIS 18 -11.044 4.048 3.630 131 H ARG 19 HN ARG 19 -8.258 6.051 -0.820 132 HA ARG 19 HA ARG 19 -9.510 8.059 0.938 133 HB2 ARG 19 HB2 ARG 19 -9.464 8.049 -2.085 134 HB3 ARG 19 HB1 ARG 19 -10.248 9.235 -1.076 135 HG2 ARG 19 HG2 ARG 19 -8.132 10.032 -0.267 136 HG3 ARG 19 HG1 ARG 19 -7.276 8.773 -1.159 137 HD2 ARG 19 HD2 ARG 19 -7.106 10.670 -2.523 138 HD3 ARG 19 HD1 ARG 19 -8.413 9.723 -3.238 139 HE ARG 19 HE ARG 19 -8.760 12.139 -1.588 140 HH11 ARG 19 HH11 ARG 19 -10.014 9.853 -3.941 141 HH12 ARG 19 HH12 ARG 19 -11.380 10.854 -4.356 142 HH21 ARG 19 HH21 ARG 19 -10.548 13.425 -2.116 143 HH22 ARG 19 HH22 ARG 19 -11.683 12.878 -3.316 144 H ALA 20 HN ALA 20 -11.816 8.081 0.878 145 HA ALA 20 HA ALA 20 -13.045 5.854 -0.597 146 HB1 ALA 20 HB1 ALA 20 -12.999 4.874 1.468 147 HB2 ALA 20 HB2 ALA 20 -14.586 5.646 1.473 148 HB3 ALA 20 HB3 ALA 20 -13.235 6.399 2.323 149 H GLN 21 HN GLN 21 -14.919 6.300 -1.568 150 HA GLN 21 HA GLN 21 -16.394 8.720 -0.773 151 HB2 GLN 21 HB2 GLN 21 -16.833 9.243 -3.118 152 HB3 GLN 21 HB1 GLN 21 -15.099 9.179 -2.838 153 HG2 GLN 21 HG2 GLN 21 -14.793 7.368 -4.119 154 HG3 GLN 21 HG1 GLN 21 -16.386 6.703 -3.782 155 HE21 GLN 21 HE21 GLN 21 -18.141 7.398 -4.993 156 HE22 GLN 21 HE22 GLN 21 -17.956 8.223 -6.502 157 H VAL 22 HN VAL 22 -18.592 8.461 -0.736 158 HA VAL 22 HA VAL 22 -19.550 5.761 -1.370 159 HB VAL 22 HB VAL 22 -19.938 6.299 0.929 160 HG11 VAL 22 HG11 VAL 22 -21.207 8.215 1.657 161 HG12 VAL 22 HG12 VAL 22 -21.376 8.772 -0.006 162 HG13 VAL 22 HG13 VAL 22 -19.784 8.728 0.755 163 HG21 VAL 22 HG21 VAL 22 -21.728 5.036 -0.015 164 HG22 VAL 22 HG22 VAL 22 -22.457 6.479 -0.712 165 HG23 VAL 22 HG23 VAL 22 -22.442 6.255 1.037 166 H ARG 23 HN ARG 23 -21.096 5.420 -2.825 167 HA ARG 23 HA ARG 23 -22.267 7.758 -4.177 168 HB2 ARG 23 HB2 ARG 23 -22.817 5.832 -5.919 169 HB3 ARG 23 HB1 ARG 23 -21.240 6.613 -5.896 170 HG2 ARG 23 HG2 ARG 23 -20.174 4.773 -5.170 171 HG3 ARG 23 HG1 ARG 23 -21.518 4.260 -4.156 172 HD2 ARG 23 HD2 ARG 23 -21.145 2.688 -5.976 173 HD3 ARG 23 HD1 ARG 23 -22.712 3.476 -6.139 174 HE ARG 23 HE ARG 23 -21.606 4.933 -7.825 175 HH11 ARG 23 HH11 ARG 23 -20.232 1.814 -7.059 176 HH12 ARG 23 HH12 ARG 23 -19.547 1.578 -8.638 177 HH21 ARG 23 HH21 ARG 23 -20.687 4.655 -9.892 178 HH22 ARG 23 HH22 ARG 23 -19.802 3.200 -10.248 179 H LYS 24 HN LYS 24 -24.443 7.997 -4.160 180 HA LYS 24 HA LYS 24 -25.882 6.547 -2.184 181 HB2 LYS 24 HB2 LYS 24 -26.260 8.959 -2.717 182 HB3 LYS 24 HB1 LYS 24 -26.953 8.479 -4.257 183 HG2 LYS 24 HG2 LYS 24 -28.854 8.773 -3.048 184 HG3 LYS 24 HG1 LYS 24 -28.555 7.070 -2.704 185 HD2 LYS 24 HD2 LYS 24 -27.381 7.782 -0.608 186 HD3 LYS 24 HD1 LYS 24 -27.894 9.430 -0.951 187 HE2 LYS 24 HE2 LYS 24 -30.199 8.803 -0.792 188 HE3 LYS 24 HE1 LYS 24 -29.773 7.098 -0.654 189 HZ1 LYS 24 HZ1 LYS 24 -28.976 9.179 1.309 190 HZ2 LYS 24 HZ2 LYS 24 -28.744 7.507 1.448 191 HZ3 LYS 24 HZ3 LYS 24 -30.314 8.154 1.500 192 H LYS 25 HN LYS 25 -25.236 5.925 -5.406 193 HA LYS 25 HA LYS 25 -27.433 3.968 -5.497 194 HB2 LYS 25 HB2 LYS 25 -27.722 5.821 -7.139 195 HB3 LYS 25 HB1 LYS 25 -26.184 5.384 -7.870 196 HG2 LYS 25 HG2 LYS 25 -28.220 3.249 -7.640 197 HG3 LYS 25 HG1 LYS 25 -28.528 4.543 -8.798 198 HD2 LYS 25 HD2 LYS 25 -26.487 4.084 -9.946 199 HD3 LYS 25 HD1 LYS 25 -25.971 2.958 -8.686 200 HE2 LYS 25 HE2 LYS 25 -27.884 1.523 -9.217 201 HE3 LYS 25 HE1 LYS 25 -28.348 2.629 -10.509 202 HZ1 LYS 25 HZ1 LYS 25 -25.703 1.293 -10.414 203 HZ2 LYS 25 HZ2 LYS 25 -26.406 2.115 -11.718 204 HZ3 LYS 25 HZ3 LYS 25 -27.042 0.628 -11.212 205 HA PRO 26 HA PRO 26 -23.728 1.347 -5.281 206 HB2 PRO 26 HB2 PRO 26 -25.854 -0.707 -5.150 207 HB3 PRO 26 HB1 PRO 26 -24.483 -0.435 -4.072 208 HG2 PRO 26 HG2 PRO 26 -26.975 0.183 -3.333 209 HG3 PRO 26 HG1 PRO 26 -25.589 1.183 -2.854 210 HD2 PRO 26 HD2 PRO 26 -27.635 1.661 -4.985 211 HD3 PRO 26 HD1 PRO 26 -26.875 2.816 -3.871 212 H THR 27 HN THR 27 -22.927 -0.381 -6.575 213 HA THR 27 HA THR 27 -23.759 -0.227 -9.317 214 HB THR 27 HB THR 27 -21.384 -0.445 -8.795 215 HG1 THR 27 HG1 THR 27 -21.291 -2.778 -9.958 216 HG21 THR 27 HG21 THR 27 -21.366 -1.700 -6.781 217 HG22 THR 27 HG22 THR 27 -20.525 -2.670 -7.990 218 HG23 THR 27 HG23 THR 27 -22.187 -3.060 -7.548 219 H VAL 28 HN VAL 28 -23.778 -2.538 -10.470 220 HA VAL 28 HA VAL 28 -26.197 -3.730 -10.067 221 HB VAL 28 HB VAL 28 -25.086 -4.158 -12.073 222 HG11 VAL 28 HG11 VAL 28 -22.784 -3.910 -11.177 223 HG12 VAL 28 HG12 VAL 28 -22.960 -5.264 -12.299 224 HG13 VAL 28 HG13 VAL 28 -22.888 -5.564 -10.563 225 HG21 VAL 28 HG21 VAL 28 -25.175 -6.703 -10.471 226 HG22 VAL 28 HG22 VAL 28 -25.036 -6.636 -12.228 227 HG23 VAL 28 HG23 VAL 28 -26.479 -6.006 -11.433 228 H GLU 29 HN GLU 29 -23.131 -4.718 -8.595 229 HA GLU 29 HA GLU 29 -24.392 -6.983 -7.299 230 HB2 GLU 29 HB2 GLU 29 -21.556 -5.965 -7.157 231 HB3 GLU 29 HB1 GLU 29 -22.125 -7.503 -6.516 232 HG2 GLU 29 HG2 GLU 29 -22.721 -8.222 -8.796 233 HG3 GLU 29 HG1 GLU 29 -22.160 -6.670 -9.414 234 H GLY 30 HN GLY 30 -24.367 -3.805 -6.628 235 HA2 GLY 30 HA2 GLY 30 -25.329 -2.809 -4.784 236 HA3 GLY 30 HA1 GLY 30 -25.245 -4.347 -3.938 237 H PHE 31 HN PHE 31 -22.475 -2.798 -5.411 238 HA PHE 31 HA PHE 31 -21.269 -2.502 -2.787 239 HB2 PHE 31 HB2 PHE 31 -20.018 -1.810 -5.454 240 HB3 PHE 31 HB1 PHE 31 -19.205 -2.086 -3.915 241 HD1 PHE 31 HD1 PHE 31 -20.932 -4.640 -3.282 242 HD2 PHE 31 HD2 PHE 31 -18.652 -3.383 -6.634 243 HE1 PHE 31 HE1 PHE 31 -20.549 -6.987 -3.903 244 HE2 PHE 31 HE2 PHE 31 -18.273 -5.717 -7.264 245 HZ PHE 31 HZ PHE 31 -19.221 -7.528 -5.898 246 H THR 32 HN THR 32 -21.152 -0.610 -1.753 247 HA THR 32 HA THR 32 -22.539 1.642 -3.014 248 HB THR 32 HB THR 32 -23.063 2.360 -0.748 249 HG1 THR 32 HG1 THR 32 -22.539 0.784 0.977 250 HG21 THR 32 HG21 THR 32 -23.701 -0.427 -1.470 251 HG22 THR 32 HG22 THR 32 -24.704 0.994 -1.670 252 HG23 THR 32 HG23 THR 32 -24.407 0.331 -0.059 253 H HIS 33 HN HIS 33 -19.515 0.780 -1.557 254 HA HIS 33 HA HIS 33 -18.749 3.626 -1.331 255 HB2 HIS 33 HB2 HIS 33 -18.137 1.233 0.373 256 HB3 HIS 33 HB1 HIS 33 -17.025 2.597 0.353 257 HD1 HIS 33 HD1 HIS 33 -20.621 1.759 1.252 258 HD2 HIS 33 HD2 HIS 33 -17.761 4.711 1.894 259 HE1 HIS 33 HE1 HIS 33 -21.566 3.253 3.052 260 HE2 HIS 33 HE2 HIS 33 -19.761 4.949 3.504 261 H ASP 34 HN ASP 34 -17.253 4.230 -2.754 262 HA ASP 34 HA ASP 34 -15.487 2.215 -3.976 263 HB2 ASP 34 HB2 ASP 34 -16.245 5.024 -4.802 264 HB3 ASP 34 HB1 ASP 34 -14.932 4.138 -5.557 265 H TRP 35 HN TRP 35 -13.354 2.205 -3.490 266 HA TRP 35 HA TRP 35 -12.274 4.612 -2.242 267 HB2 TRP 35 HB2 TRP 35 -10.946 3.162 -0.686 268 HB3 TRP 35 HB1 TRP 35 -12.668 3.245 -0.361 269 HD1 TRP 35 HD1 TRP 35 -13.957 0.963 -0.245 270 HE1 TRP 35 HE1 TRP 35 -13.242 -1.506 -0.496 271 HE3 TRP 35 HE3 TRP 35 -9.251 1.651 -2.137 272 HZ2 TRP 35 HZ2 TRP 35 -10.975 -2.959 -1.359 273 HZ3 TRP 35 HZ3 TRP 35 -7.877 -0.333 -2.634 274 HH2 TRP 35 HH2 TRP 35 -8.705 -2.581 -2.214 275 H MET 36 HN MET 36 -9.901 4.567 -2.122 276 HA MET 36 HA MET 36 -8.567 3.013 -4.207 277 HB2 MET 36 HB2 MET 36 -9.023 5.025 -5.395 278 HB3 MET 36 HB1 MET 36 -8.619 6.025 -4.005 279 HG2 MET 36 HG2 MET 36 -6.267 5.182 -4.208 280 HG3 MET 36 HG1 MET 36 -6.737 4.465 -5.749 281 HE1 MET 36 HE1 MET 36 -6.515 7.380 -3.558 282 HE2 MET 36 HE2 MET 36 -7.941 8.100 -4.325 283 HE3 MET 36 HE3 MET 36 -6.345 8.810 -4.584 284 H VAL 37 HN VAL 37 -6.631 2.289 -3.517 285 HA VAL 37 HA VAL 37 -5.613 3.365 -0.979 286 HB VAL 37 HB VAL 37 -4.159 1.152 -1.226 287 HG11 VAL 37 HG11 VAL 37 -6.995 1.185 -0.318 288 HG12 VAL 37 HG12 VAL 37 -5.630 1.746 0.630 289 HG13 VAL 37 HG13 VAL 37 -5.769 0.040 0.193 290 HG21 VAL 37 HG21 VAL 37 -5.036 0.485 -3.364 291 HG22 VAL 37 HG22 VAL 37 -6.687 0.580 -2.753 292 HG23 VAL 37 HG23 VAL 37 -5.586 -0.651 -2.133 293 H PHE 38 HN PHE 38 -3.425 3.665 -0.654 294 HA PHE 38 HA PHE 38 -1.871 4.344 -3.077 295 HB2 PHE 38 HB2 PHE 38 -2.490 5.831 -0.585 296 HB3 PHE 38 HB1 PHE 38 -0.828 5.931 -1.135 297 HD1 PHE 38 HD1 PHE 38 -0.273 7.032 -3.191 298 HD2 PHE 38 HD2 PHE 38 -4.279 6.938 -1.763 299 HE1 PHE 38 HE1 PHE 38 -0.837 8.887 -4.697 300 HE2 PHE 38 HE2 PHE 38 -4.864 8.779 -3.281 301 HZ PHE 38 HZ PHE 38 -3.159 9.766 -4.751 302 H VAL 39 HN VAL 39 -0.042 3.130 -3.242 303 HA VAL 39 HA VAL 39 1.634 3.146 -0.840 304 HB VAL 39 HB VAL 39 2.715 1.012 -1.711 305 HG11 VAL 39 HG11 VAL 39 0.956 1.367 0.181 306 HG12 VAL 39 HG12 VAL 39 1.395 -0.262 -0.334 307 HG13 VAL 39 HG13 VAL 39 -0.100 0.474 -0.913 308 HG21 VAL 39 HG21 VAL 39 1.950 0.643 -3.849 309 HG22 VAL 39 HG22 VAL 39 0.305 1.137 -3.453 310 HG23 VAL 39 HG23 VAL 39 0.910 -0.426 -2.908 311 H ARG 40 HN ARG 40 3.357 4.367 -1.183 312 HA ARG 40 HA ARG 40 4.873 4.352 -3.624 313 HB2 ARG 40 HB2 ARG 40 4.476 6.603 -4.358 314 HB3 ARG 40 HB1 ARG 40 2.899 5.832 -4.236 315 HG2 ARG 40 HG2 ARG 40 2.282 7.071 -2.395 316 HG3 ARG 40 HG1 ARG 40 3.948 7.369 -1.903 317 HD2 ARG 40 HD2 ARG 40 4.129 8.767 -4.048 318 HD3 ARG 40 HD1 ARG 40 2.363 8.702 -4.080 319 HE ARG 40 HE ARG 40 3.078 9.531 -1.529 320 HH11 ARG 40 HH11 ARG 40 3.238 10.692 -4.825 321 HH12 ARG 40 HH12 ARG 40 3.450 12.358 -4.366 322 HH21 ARG 40 HH21 ARG 40 3.392 11.710 -0.915 323 HH22 ARG 40 HH22 ARG 40 3.577 12.935 -2.136 324 H GLY 41 HN GLY 41 6.374 6.519 -3.466 325 HA2 GLY 41 HA2 GLY 41 7.268 6.641 -0.662 326 HA3 GLY 41 HA1 GLY 41 8.269 7.001 -2.063 327 HA PRO 42 HA PRO 42 5.659 10.706 -0.144 328 HB2 PRO 42 HB2 PRO 42 8.112 11.220 1.439 329 HB3 PRO 42 HB1 PRO 42 6.416 11.384 1.907 330 HG2 PRO 42 HG2 PRO 42 7.915 9.353 2.789 331 HG3 PRO 42 HG1 PRO 42 6.199 9.137 2.399 332 HD2 PRO 42 HD2 PRO 42 8.614 8.313 0.858 333 HD3 PRO 42 HD1 PRO 42 7.040 7.509 1.025 334 H GLU 43 HN GLU 43 6.396 12.999 -0.081 335 HA GLU 43 HA GLU 43 6.946 13.895 -2.526 336 HB2 GLU 43 HB2 GLU 43 7.781 15.212 0.051 337 HB3 GLU 43 HB1 GLU 43 7.666 16.029 -1.503 338 HG2 GLU 43 HG2 GLU 43 5.402 14.722 -0.009 339 HG3 GLU 43 HG1 GLU 43 5.702 16.451 -0.153 340 H HIS 44 HN HIS 44 8.479 13.952 -3.879 341 HA HIS 44 HA HIS 44 10.448 14.124 -4.941 342 HB2 HIS 44 HB2 HIS 44 12.211 15.400 -4.048 343 HB3 HIS 44 HB1 HIS 44 10.810 16.024 -3.186 344 HD1 HIS 44 HD1 HIS 44 13.646 13.522 -2.574 345 HD2 HIS 44 HD2 HIS 44 11.173 16.163 -0.509 346 HE1 HIS 44 HE1 HIS 44 14.471 13.518 -0.199 347 HE2 HIS 44 HE2 HIS 44 12.862 14.992 1.064 348 H SER 45 HN SER 45 9.944 11.787 -2.628 349 HA SER 45 HA SER 45 12.527 10.511 -3.201 350 HB2 SER 45 HB2 SER 45 10.486 9.277 -1.412 351 HB3 SER 45 HB1 SER 45 12.236 9.183 -1.300 352 HG SER 45 HG SER 45 10.747 11.566 -0.841 353 H ASN 46 HN ASN 46 12.527 9.401 -5.041 354 HA ASN 46 HA ASN 46 10.241 8.003 -6.070 355 HB2 ASN 46 HB2 ASN 46 11.763 7.106 -7.732 356 HB3 ASN 46 HB1 ASN 46 12.315 8.751 -7.440 357 HD21 ASN 46 HD21 ASN 46 14.254 9.130 -6.652 358 HD22 ASN 46 HD22 ASN 46 15.400 7.889 -6.276 359 H ILE 47 HN ILE 47 9.574 5.918 -5.508 360 HA ILE 47 HA ILE 47 11.439 4.379 -3.872 361 HB ILE 47 HB ILE 47 9.711 2.808 -3.446 362 HG12 ILE 47 HG12 ILE 47 7.908 4.464 -5.209 363 HG13 ILE 47 HG11 ILE 47 8.639 2.924 -5.675 364 HG21 ILE 47 HG21 ILE 47 9.812 4.729 -2.048 365 HG22 ILE 47 HG22 ILE 47 8.130 4.263 -2.269 366 HG23 ILE 47 HG23 ILE 47 8.790 5.644 -3.147 367 HD11 ILE 47 HD11 ILE 47 7.173 2.918 -3.139 368 HD12 ILE 47 HD12 ILE 47 7.205 1.720 -4.436 369 HD13 ILE 47 HD13 ILE 47 6.192 3.159 -4.585 370 H GLN 48 HN GLN 48 10.346 4.594 -7.108 371 HA GLN 48 HA GLN 48 10.357 1.933 -7.939 372 HB2 GLN 48 HB2 GLN 48 9.476 3.959 -9.158 373 HB3 GLN 48 HB1 GLN 48 11.135 4.349 -9.582 374 HG2 GLN 48 HG2 GLN 48 10.085 3.278 -11.445 375 HG3 GLN 48 HG1 GLN 48 11.295 2.216 -10.781 376 HE21 GLN 48 HE21 GLN 48 7.771 2.758 -10.866 377 HE22 GLN 48 HE22 GLN 48 7.370 1.122 -10.507 378 H HIS 49 HN HIS 49 12.951 3.781 -6.908 379 HA HIS 49 HA HIS 49 14.947 2.450 -8.535 380 HB2 HIS 49 HB2 HIS 49 14.987 4.613 -6.486 381 HB3 HIS 49 HB1 HIS 49 16.475 3.708 -6.755 382 HD1 HIS 49 HD1 HIS 49 16.504 3.428 -9.777 383 HD2 HIS 49 HD2 HIS 49 15.286 6.928 -7.857 384 HE1 HIS 49 HE1 HIS 49 16.760 5.272 -11.470 385 HE2 HIS 49 HE2 HIS 49 15.945 7.356 -10.324 386 H PHE 50 HN PHE 50 13.508 2.116 -5.369 387 HA PHE 50 HA PHE 50 15.230 -0.238 -4.960 388 HB2 PHE 50 HB2 PHE 50 15.164 0.174 -2.539 389 HB3 PHE 50 HB1 PHE 50 15.827 1.568 -3.398 390 HD1 PHE 50 HD1 PHE 50 12.720 0.348 -1.689 391 HD2 PHE 50 HD2 PHE 50 14.950 3.663 -3.162 392 HE1 PHE 50 HE1 PHE 50 11.205 1.879 -0.548 393 HE2 PHE 50 HE2 PHE 50 13.400 5.197 -2.032 394 HZ PHE 50 HZ PHE 50 11.524 4.307 -0.719 395 H VAL 51 HN VAL 51 12.233 0.647 -5.727 396 HA VAL 51 HA VAL 51 11.045 -1.689 -4.402 397 HB VAL 51 HB VAL 51 9.789 0.954 -5.144 398 HG11 VAL 51 HG11 VAL 51 7.814 -0.514 -3.901 399 HG12 VAL 51 HG12 VAL 51 8.566 -1.710 -4.967 400 HG13 VAL 51 HG13 VAL 51 7.920 -0.213 -5.642 401 HG21 VAL 51 HG21 VAL 51 9.055 0.631 -2.673 402 HG22 VAL 51 HG22 VAL 51 10.705 1.126 -3.022 403 HG23 VAL 51 HG23 VAL 51 10.353 -0.553 -2.617 404 H GLU 52 HN GLU 52 10.281 -3.213 -5.691 405 HA GLU 52 HA GLU 52 11.046 -2.887 -8.489 406 HB2 GLU 52 HB2 GLU 52 11.798 -4.787 -6.889 407 HB3 GLU 52 HB1 GLU 52 10.202 -5.466 -7.169 408 HG2 GLU 52 HG2 GLU 52 10.661 -5.671 -9.533 409 HG3 GLU 52 HG1 GLU 52 12.220 -4.854 -9.312 410 H LYS 53 HN LYS 53 8.345 -4.242 -6.632 411 HA LYS 53 HA LYS 53 6.428 -3.271 -8.566 412 HB2 LYS 53 HB2 LYS 53 5.360 -5.499 -8.772 413 HB3 LYS 53 HB1 LYS 53 6.988 -5.468 -9.433 414 HG2 LYS 53 HG2 LYS 53 7.845 -6.545 -7.444 415 HG3 LYS 53 HG1 LYS 53 6.241 -6.557 -6.730 416 HD2 LYS 53 HD2 LYS 53 6.993 -7.926 -9.313 417 HD3 LYS 53 HD1 LYS 53 6.956 -8.725 -7.744 418 HE2 LYS 53 HE2 LYS 53 4.600 -8.383 -7.544 419 HE3 LYS 53 HE1 LYS 53 4.595 -7.334 -8.966 420 HZ1 LYS 53 HZ1 LYS 53 3.783 -9.566 -9.483 421 HZ2 LYS 53 HZ2 LYS 53 5.253 -10.232 -8.954 422 HZ3 LYS 53 HZ3 LYS 53 5.221 -9.236 -10.322 423 H VAL 54 HN VAL 54 4.139 -4.095 -7.664 424 HA VAL 54 HA VAL 54 4.134 -4.017 -4.743 425 HB VAL 54 HB VAL 54 3.114 -1.869 -6.535 426 HG11 VAL 54 HG11 VAL 54 1.996 -1.777 -3.839 427 HG12 VAL 54 HG12 VAL 54 1.309 -3.048 -4.849 428 HG13 VAL 54 HG13 VAL 54 1.255 -1.369 -5.386 429 HG21 VAL 54 HG21 VAL 54 3.786 -0.756 -4.202 430 HG22 VAL 54 HG22 VAL 54 4.938 -1.073 -5.488 431 HG23 VAL 54 HG23 VAL 54 4.786 -2.197 -4.136 432 H VAL 55 HN VAL 55 2.125 -4.674 -3.800 433 HA VAL 55 HA VAL 55 0.162 -5.842 -5.616 434 HB VAL 55 HB VAL 55 2.193 -7.425 -4.463 435 HG11 VAL 55 HG11 VAL 55 -0.482 -7.901 -3.171 436 HG12 VAL 55 HG12 VAL 55 1.049 -7.533 -2.370 437 HG13 VAL 55 HG13 VAL 55 0.836 -9.077 -3.197 438 HG21 VAL 55 HG21 VAL 55 -0.400 -8.351 -5.681 439 HG22 VAL 55 HG22 VAL 55 1.145 -9.206 -5.650 440 HG23 VAL 55 HG23 VAL 55 0.971 -7.734 -6.605 441 H PHE 56 HN PHE 56 -1.841 -6.129 -4.702 442 HA PHE 56 HA PHE 56 -2.170 -5.284 -1.904 443 HB2 PHE 56 HB2 PHE 56 -3.794 -4.549 -4.340 444 HB3 PHE 56 HB1 PHE 56 -4.513 -4.527 -2.729 445 HD1 PHE 56 HD1 PHE 56 -1.737 -3.136 -4.759 446 HD2 PHE 56 HD2 PHE 56 -4.223 -2.697 -1.331 447 HE1 PHE 56 HE1 PHE 56 -0.830 -0.886 -4.406 448 HE2 PHE 56 HE2 PHE 56 -3.322 -0.431 -0.975 449 HZ PHE 56 HZ PHE 56 -1.615 0.471 -2.512 450 H HIS 57 HN HIS 57 -3.160 -6.774 -0.657 451 HA HIS 57 HA HIS 57 -4.593 -8.951 -2.041 452 HB2 HIS 57 HB2 HIS 57 -3.524 -8.865 0.800 453 HB3 HIS 57 HB1 HIS 57 -4.348 -10.232 0.050 454 HD1 HIS 57 HD1 HIS 57 -2.927 -11.854 -1.222 455 HD2 HIS 57 HD2 HIS 57 -0.907 -8.315 -0.381 456 HE1 HIS 57 HE1 HIS 57 -0.522 -12.284 -1.816 457 HE2 HIS 57 HE2 HIS 57 0.712 -10.196 -1.118 458 H LEU 58 HN LEU 58 -6.478 -7.720 -2.337 459 HA LEU 58 HA LEU 58 -7.948 -6.608 -0.163 460 HB2 LEU 58 HB2 LEU 58 -9.284 -7.768 -2.590 461 HB3 LEU 58 HB1 LEU 58 -9.767 -6.380 -1.633 462 HG LEU 58 HG LEU 58 -7.373 -6.378 -3.457 463 HD11 LEU 58 HD11 LEU 58 -8.730 -5.338 -5.029 464 HD12 LEU 58 HD12 LEU 58 -10.115 -5.316 -3.955 465 HD13 LEU 58 HD13 LEU 58 -9.504 -6.846 -4.591 466 HD21 LEU 58 HD21 LEU 58 -7.378 -4.666 -1.658 467 HD22 LEU 58 HD22 LEU 58 -8.957 -4.134 -2.227 468 HD23 LEU 58 HD23 LEU 58 -7.546 -3.981 -3.270 469 H HIS 59 HN HIS 59 -10.396 -7.706 -0.030 470 HA HIS 59 HA HIS 59 -9.806 -10.354 1.080 471 HB2 HIS 59 HB2 HIS 59 -11.983 -8.361 1.524 472 HB3 HIS 59 HB1 HIS 59 -12.328 -10.065 1.823 473 HD1 HIS 59 HD1 HIS 59 -12.563 -9.211 4.388 474 HD2 HIS 59 HD2 HIS 59 -8.737 -9.165 2.748 475 HE1 HIS 59 HE1 HIS 59 -10.982 -9.062 6.344 476 HE2 HIS 59 HE2 HIS 59 -8.670 -9.026 5.330 477 H GLU 60 HN GLU 60 -11.093 -12.141 0.639 478 HA GLU 60 HA GLU 60 -11.072 -12.719 -2.072 479 HB2 GLU 60 HB2 GLU 60 -12.505 -14.165 0.142 480 HB3 GLU 60 HB1 GLU 60 -12.183 -14.833 -1.454 481 HG2 GLU 60 HG2 GLU 60 -9.763 -14.562 -1.035 482 HG3 GLU 60 HG1 GLU 60 -10.141 -14.016 0.599 483 H SER 61 HN SER 61 -13.680 -11.416 -0.202 484 HA SER 61 HA SER 61 -15.830 -11.976 -1.905 485 HB2 SER 61 HB2 SER 61 -16.026 -10.928 0.354 486 HB3 SER 61 HB1 SER 61 -15.383 -9.432 -0.320 487 HG SER 61 HG SER 61 -17.288 -9.911 -1.917 488 H PHE 62 HN PHE 62 -13.093 -9.965 -2.299 489 HA PHE 62 HA PHE 62 -14.190 -8.566 -4.610 490 HB2 PHE 62 HB2 PHE 62 -11.456 -8.478 -3.293 491 HB3 PHE 62 HB1 PHE 62 -11.944 -7.491 -4.657 492 HD1 PHE 62 HD1 PHE 62 -13.078 -8.249 -1.165 493 HD2 PHE 62 HD2 PHE 62 -12.620 -5.375 -4.244 494 HE1 PHE 62 HE1 PHE 62 -13.880 -6.489 0.359 495 HE2 PHE 62 HE2 PHE 62 -13.435 -3.603 -2.759 496 HZ PHE 62 HZ PHE 62 -14.061 -4.161 -0.435 497 HA PRO 63 HA PRO 63 -12.835 -11.975 -7.181 498 HB2 PRO 63 HB2 PRO 63 -13.100 -10.051 -9.398 499 HB3 PRO 63 HB1 PRO 63 -13.942 -11.580 -9.133 500 HG2 PRO 63 HG2 PRO 63 -15.189 -9.222 -8.855 501 HG3 PRO 63 HG1 PRO 63 -15.571 -10.608 -7.818 502 HD2 PRO 63 HD2 PRO 63 -13.902 -8.195 -7.220 503 HD3 PRO 63 HD1 PRO 63 -15.065 -9.048 -6.183 504 H ARG 64 HN ARG 64 -10.778 -12.565 -7.407 505 HA ARG 64 HA ARG 64 -8.518 -12.496 -7.625 506 HB2 ARG 64 HB2 ARG 64 -9.180 -10.371 -9.671 507 HB3 ARG 64 HB1 ARG 64 -7.597 -11.109 -9.473 508 HG2 ARG 64 HG2 ARG 64 -8.675 -13.319 -9.960 509 HG3 ARG 64 HG1 ARG 64 -10.136 -12.427 -10.388 510 HD2 ARG 64 HD2 ARG 64 -8.860 -12.908 -12.372 511 HD3 ARG 64 HD1 ARG 64 -8.861 -11.173 -12.064 512 HE ARG 64 HE ARG 64 -6.589 -12.651 -11.017 513 HH11 ARG 64 HH11 ARG 64 -7.881 -10.776 -13.674 514 HH12 ARG 64 HH12 ARG 64 -6.316 -10.270 -14.249 515 HH21 ARG 64 HH21 ARG 64 -4.533 -12.010 -11.770 516 HH22 ARG 64 HH22 ARG 64 -4.410 -10.983 -13.167 517 HA PRO 65 HA PRO 65 -8.876 -8.704 -4.951 518 HB2 PRO 65 HB2 PRO 65 -7.897 -9.770 -2.646 519 HB3 PRO 65 HB1 PRO 65 -9.588 -9.901 -3.138 520 HG2 PRO 65 HG2 PRO 65 -7.378 -11.896 -3.396 521 HG3 PRO 65 HG1 PRO 65 -9.068 -12.150 -2.923 522 HD2 PRO 65 HD2 PRO 65 -8.149 -12.692 -5.413 523 HD3 PRO 65 HD1 PRO 65 -9.805 -12.145 -5.103 524 H LYS 66 HN LYS 66 -6.193 -10.756 -5.552 525 HA LYS 66 HA LYS 66 -4.220 -8.957 -4.570 526 HB2 LYS 66 HB2 LYS 66 -3.711 -11.322 -4.681 527 HB3 LYS 66 HB1 LYS 66 -3.999 -11.335 -6.414 528 HG2 LYS 66 HG2 LYS 66 -2.064 -9.951 -6.801 529 HG3 LYS 66 HG1 LYS 66 -1.822 -9.752 -5.064 530 HD2 LYS 66 HD2 LYS 66 -1.149 -11.943 -4.772 531 HD3 LYS 66 HD1 LYS 66 -1.874 -12.484 -6.287 532 HE2 LYS 66 HE2 LYS 66 -0.162 -11.229 -7.522 533 HE3 LYS 66 HE1 LYS 66 0.558 -10.722 -5.993 534 HZ1 LYS 66 HZ1 LYS 66 0.984 -13.041 -5.463 535 HZ2 LYS 66 HZ2 LYS 66 1.729 -12.619 -6.929 536 HZ3 LYS 66 HZ3 LYS 66 0.295 -13.530 -6.934 537 H ARG 67 HN ARG 67 -4.277 -7.012 -5.466 538 HA ARG 67 HA ARG 67 -4.321 -6.791 -8.395 539 HB2 ARG 67 HB2 ARG 67 -4.444 -4.476 -6.455 540 HB3 ARG 67 HB1 ARG 67 -4.956 -4.522 -8.137 541 HG2 ARG 67 HG2 ARG 67 -6.310 -5.854 -5.807 542 HG3 ARG 67 HG1 ARG 67 -6.876 -4.445 -6.703 543 HD2 ARG 67 HD2 ARG 67 -6.831 -5.997 -8.755 544 HD3 ARG 67 HD1 ARG 67 -6.740 -7.315 -7.573 545 HE ARG 67 HE ARG 67 -8.837 -5.645 -6.808 546 HH11 ARG 67 HH11 ARG 67 -8.056 -7.676 -9.556 547 HH12 ARG 67 HH12 ARG 67 -9.717 -8.097 -9.866 548 HH21 ARG 67 HH21 ARG 67 -10.990 -6.178 -7.211 549 HH22 ARG 67 HH22 ARG 67 -11.379 -7.258 -8.517 550 H VAL 68 HN VAL 68 -2.364 -6.679 -9.326 551 HA VAL 68 HA VAL 68 -0.124 -5.806 -7.656 552 HB VAL 68 HB VAL 68 1.311 -7.088 -8.902 553 HG11 VAL 68 HG11 VAL 68 -0.274 -8.595 -7.853 554 HG12 VAL 68 HG12 VAL 68 0.261 -9.252 -9.402 555 HG13 VAL 68 HG13 VAL 68 -1.326 -8.497 -9.267 556 HG21 VAL 68 HG21 VAL 68 0.943 -6.057 -11.037 557 HG22 VAL 68 HG22 VAL 68 -0.591 -6.909 -11.230 558 HG23 VAL 68 HG23 VAL 68 0.926 -7.812 -11.226 559 H CYS 69 HN CYS 69 1.222 -4.143 -8.211 560 HA CYS 69 HA CYS 69 0.625 -2.685 -10.690 561 HB2 CYS 69 HB2 CYS 69 1.064 -1.466 -7.949 562 HB3 CYS 69 HB1 CYS 69 1.008 -0.551 -9.452 563 HG CYS 69 HG CYS 69 -1.687 -2.335 -9.400 564 H LYS 70 HN LYS 70 2.377 -2.860 -11.900 565 HA LYS 70 HA LYS 70 5.034 -2.974 -10.610 566 HB2 LYS 70 HB2 LYS 70 4.384 -3.623 -13.494 567 HB3 LYS 70 HB1 LYS 70 5.809 -4.090 -12.579 568 HG2 LYS 70 HG2 LYS 70 4.593 -5.709 -11.334 569 HG3 LYS 70 HG1 LYS 70 3.050 -5.084 -11.912 570 HD2 LYS 70 HD2 LYS 70 3.646 -5.775 -14.193 571 HD3 LYS 70 HD1 LYS 70 5.163 -6.437 -13.580 572 HE2 LYS 70 HE2 LYS 70 3.941 -8.007 -12.186 573 HE3 LYS 70 HE1 LYS 70 2.409 -7.316 -12.720 574 HZ1 LYS 70 HZ1 LYS 70 3.001 -9.383 -13.884 575 HZ2 LYS 70 HZ2 LYS 70 4.380 -8.624 -14.515 576 HZ3 LYS 70 HZ3 LYS 70 2.840 -8.066 -14.942 577 H ASP 71 HN ASP 71 3.074 -0.733 -11.683 578 HA ASP 71 HA ASP 71 4.991 0.744 -13.337 579 HB2 ASP 71 HB2 ASP 71 1.978 0.851 -13.105 580 HB3 ASP 71 HB1 ASP 71 2.891 2.108 -13.927 581 HA PRO 72 HA PRO 72 5.299 4.313 -10.469 582 HB2 PRO 72 HB2 PRO 72 3.589 5.650 -12.552 583 HB3 PRO 72 HB1 PRO 72 4.960 6.310 -11.650 584 HG2 PRO 72 HG2 PRO 72 5.380 5.474 -14.090 585 HG3 PRO 72 HG1 PRO 72 6.514 4.975 -12.814 586 HD2 PRO 72 HD2 PRO 72 4.351 3.414 -14.144 587 HD3 PRO 72 HD1 PRO 72 5.958 2.884 -13.614 588 HA PRO 73 HA PRO 73 2.490 5.601 -7.491 589 HB2 PRO 73 HB2 PRO 73 0.338 6.531 -9.352 590 HB3 PRO 73 HB1 PRO 73 0.765 7.145 -7.750 591 HG2 PRO 73 HG2 PRO 73 1.684 8.228 -10.108 592 HG3 PRO 73 HG1 PRO 73 2.526 8.370 -8.558 593 HD2 PRO 73 HD2 PRO 73 3.408 7.000 -10.893 594 HD3 PRO 73 HD1 PRO 73 4.201 7.049 -9.309 595 H TYR 74 HN TYR 74 1.974 3.785 -6.607 596 HA TYR 74 HA TYR 74 0.440 1.756 -7.991 597 HB2 TYR 74 HB2 TYR 74 1.636 1.607 -5.226 598 HB3 TYR 74 HB1 TYR 74 1.248 0.270 -6.294 599 HD1 TYR 74 HD2 TYR 74 3.533 3.181 -5.918 600 HD2 TYR 74 HD1 TYR 74 2.897 -0.614 -7.714 601 HE1 TYR 74 HE2 TYR 74 5.850 3.177 -6.711 602 HE2 TYR 74 HE1 TYR 74 5.223 -0.624 -8.521 603 HH TYR 74 HH TYR 74 7.562 1.490 -7.375 604 H LYS 75 HN LYS 75 -1.636 1.292 -7.565 605 HA LYS 75 HA LYS 75 -2.924 2.080 -5.104 606 HB2 LYS 75 HB2 LYS 75 -4.625 3.484 -6.415 607 HB3 LYS 75 HB1 LYS 75 -3.070 4.223 -6.064 608 HG2 LYS 75 HG2 LYS 75 -2.342 4.038 -8.257 609 HG3 LYS 75 HG1 LYS 75 -3.553 2.829 -8.668 610 HD2 LYS 75 HD2 LYS 75 -4.137 4.962 -9.655 611 HD3 LYS 75 HD1 LYS 75 -5.315 4.559 -8.404 612 HE2 LYS 75 HE2 LYS 75 -4.312 6.071 -6.864 613 HE3 LYS 75 HE1 LYS 75 -2.937 6.338 -7.928 614 HZ1 LYS 75 HZ1 LYS 75 -5.746 7.149 -8.472 615 HZ2 LYS 75 HZ2 LYS 75 -4.438 7.378 -9.527 616 HZ3 LYS 75 HZ3 LYS 75 -4.474 8.184 -8.037 617 H VAL 76 HN VAL 76 -4.998 1.298 -4.886 618 HA VAL 76 HA VAL 76 -6.060 -0.302 -7.132 619 HB VAL 76 HB VAL 76 -6.328 -0.863 -4.183 620 HG11 VAL 76 HG11 VAL 76 -8.546 -0.906 -5.425 621 HG12 VAL 76 HG12 VAL 76 -8.070 -2.410 -4.620 622 HG13 VAL 76 HG13 VAL 76 -7.876 -2.247 -6.365 623 HG21 VAL 76 HG21 VAL 76 -4.406 -1.900 -5.283 624 HG22 VAL 76 HG22 VAL 76 -5.463 -2.553 -6.530 625 HG23 VAL 76 HG23 VAL 76 -5.609 -3.116 -4.867 626 H GLU 77 HN GLU 77 -7.854 0.503 -7.964 627 HA GLU 77 HA GLU 77 -9.504 2.272 -6.278 628 HB2 GLU 77 HB2 GLU 77 -9.475 2.325 -9.285 629 HB3 GLU 77 HB1 GLU 77 -10.081 3.541 -8.182 630 HG2 GLU 77 HG2 GLU 77 -8.171 4.609 -8.313 631 HG3 GLU 77 HG1 GLU 77 -7.375 3.209 -7.601 632 H GLU 78 HN GLU 78 -11.179 1.137 -5.587 633 HA GLU 78 HA GLU 78 -13.011 0.125 -7.416 634 HB2 GLU 78 HB2 GLU 78 -12.887 -2.300 -7.227 635 HB3 GLU 78 HB1 GLU 78 -11.272 -1.724 -7.626 636 HG2 GLU 78 HG2 GLU 78 -10.556 -2.093 -5.354 637 HG3 GLU 78 HG1 GLU 78 -12.188 -2.587 -4.891 638 H SER 79 HN SER 79 -14.608 -1.581 -6.087 639 HA SER 79 HA SER 79 -15.441 0.291 -3.983 640 HB2 SER 79 HB2 SER 79 -16.491 0.797 -6.159 641 HB3 SER 79 HB1 SER 79 -17.143 -0.838 -6.220 642 HG SER 79 HG SER 79 -18.097 1.360 -4.962 643 H GLY 80 HN GLY 80 -17.235 -0.492 -2.638 644 HA2 GLY 80 HA2 GLY 80 -17.870 -3.257 -2.403 645 HA3 GLY 80 HA1 GLY 80 -16.623 -2.801 -1.245 646 H TYR 81 HN TYR 81 -18.219 -3.246 0.492 647 HA TYR 81 HA TYR 81 -19.749 -0.805 0.975 648 HB2 TYR 81 HB2 TYR 81 -21.731 -2.125 1.799 649 HB3 TYR 81 HB1 TYR 81 -21.490 -2.116 0.058 650 HD1 TYR 81 HD2 TYR 81 -21.054 -4.194 3.102 651 HD2 TYR 81 HD1 TYR 81 -21.249 -4.129 -1.144 652 HE1 TYR 81 HE2 TYR 81 -21.169 -6.646 3.078 653 HE2 TYR 81 HE1 TYR 81 -21.372 -6.584 -1.174 654 HH TYR 81 HH TYR 81 -21.935 -8.437 1.644 655 H ALA 82 HN ALA 82 -17.338 -2.238 2.141 656 HA ALA 82 HA ALA 82 -17.901 -1.472 4.835 657 HB1 ALA 82 HB1 ALA 82 -18.871 -3.625 5.077 658 HB2 ALA 82 HB2 ALA 82 -17.279 -3.703 5.821 659 HB3 ALA 82 HB3 ALA 82 -17.540 -4.396 4.222 660 H GLY 83 HN GLY 83 -15.982 -1.782 6.248 661 HA2 GLY 83 HA2 GLY 83 -13.528 -1.460 4.683 662 HA3 GLY 83 HA1 GLY 83 -13.751 -1.004 6.368 663 H PHE 84 HN PHE 84 -11.512 -2.282 5.873 664 HA PHE 84 HA PHE 84 -11.536 -4.590 7.447 665 HB2 PHE 84 HB2 PHE 84 -11.004 -6.327 5.771 666 HB3 PHE 84 HB1 PHE 84 -12.632 -5.698 5.571 667 HD1 PHE 84 HD1 PHE 84 -13.011 -3.958 3.735 668 HD2 PHE 84 HD2 PHE 84 -9.510 -6.364 3.984 669 HE1 PHE 84 HE1 PHE 84 -12.564 -3.538 1.357 670 HE2 PHE 84 HE2 PHE 84 -9.042 -5.946 1.615 671 HZ PHE 84 HZ PHE 84 -10.565 -4.534 0.284 672 H ILE 85 HN ILE 85 -9.431 -5.399 7.844 673 HA ILE 85 HA ILE 85 -7.217 -3.740 7.252 674 HB ILE 85 HB ILE 85 -7.395 -6.586 8.237 675 HG12 ILE 85 HG12 ILE 85 -8.041 -4.793 9.805 676 HG13 ILE 85 HG11 ILE 85 -6.589 -5.641 10.327 677 HG21 ILE 85 HG21 ILE 85 -4.878 -4.974 7.831 678 HG22 ILE 85 HG22 ILE 85 -5.345 -6.422 6.939 679 HG23 ILE 85 HG23 ILE 85 -4.981 -6.528 8.661 680 HD11 ILE 85 HD11 ILE 85 -6.538 -3.028 8.856 681 HD12 ILE 85 HD12 ILE 85 -5.197 -3.841 9.662 682 HD13 ILE 85 HD13 ILE 85 -6.523 -3.170 10.613 683 H LEU 86 HN LEU 86 -6.120 -3.540 5.416 684 HA LEU 86 HA LEU 86 -6.286 -5.738 3.466 685 HB2 LEU 86 HB2 LEU 86 -7.175 -3.258 3.047 686 HB3 LEU 86 HB1 LEU 86 -5.484 -2.987 2.662 687 HG LEU 86 HG LEU 86 -6.847 -5.287 1.344 688 HD11 LEU 86 HD11 LEU 86 -7.112 -2.493 0.265 689 HD12 LEU 86 HD12 LEU 86 -8.376 -3.268 1.221 690 HD13 LEU 86 HD13 LEU 86 -7.872 -3.977 -0.311 691 HD21 LEU 86 HD21 LEU 86 -5.297 -3.511 -0.262 692 HD22 LEU 86 HD22 LEU 86 -5.062 -5.230 0.041 693 HD23 LEU 86 HD23 LEU 86 -4.384 -4.031 1.148 694 HA PRO 87 HA PRO 87 -1.927 -5.978 4.535 695 HB2 PRO 87 HB2 PRO 87 -1.955 -8.478 3.058 696 HB3 PRO 87 HB1 PRO 87 -1.700 -8.214 4.782 697 HG2 PRO 87 HG2 PRO 87 -3.925 -9.414 3.765 698 HG3 PRO 87 HG1 PRO 87 -3.910 -8.510 5.289 699 HD2 PRO 87 HD2 PRO 87 -4.870 -7.660 2.587 700 HD3 PRO 87 HD1 PRO 87 -5.566 -7.329 4.189 701 H ILE 88 HN ILE 88 -1.012 -4.460 3.236 702 HA ILE 88 HA ILE 88 -1.003 -4.885 0.353 703 HB ILE 88 HB ILE 88 -0.022 -2.455 1.859 704 HG12 ILE 88 HG12 ILE 88 -2.682 -2.634 0.467 705 HG13 ILE 88 HG11 ILE 88 -2.527 -3.203 2.129 706 HG21 ILE 88 HG21 ILE 88 0.803 -2.728 -0.431 707 HG22 ILE 88 HG22 ILE 88 -0.281 -1.343 -0.281 708 HG23 ILE 88 HG23 ILE 88 -0.860 -2.842 -1.009 709 HD11 ILE 88 HD11 ILE 88 -1.832 -0.431 1.205 710 HD12 ILE 88 HD12 ILE 88 -1.854 -1.021 2.862 711 HD13 ILE 88 HD13 ILE 88 -3.357 -0.895 1.949 712 H GLU 89 HN GLU 89 0.870 -5.053 -0.842 713 HA GLU 89 HA GLU 89 3.349 -5.414 0.705 714 HB2 GLU 89 HB2 GLU 89 2.300 -6.918 -1.669 715 HB3 GLU 89 HB1 GLU 89 4.018 -6.889 -1.289 716 HG2 GLU 89 HG2 GLU 89 3.449 -7.779 0.962 717 HG3 GLU 89 HG1 GLU 89 1.789 -7.971 0.406 718 H VAL 90 HN VAL 90 5.023 -4.247 0.152 719 HA VAL 90 HA VAL 90 5.074 -3.024 -2.521 720 HB VAL 90 HB VAL 90 6.507 -1.908 -0.112 721 HG11 VAL 90 HG11 VAL 90 7.534 -0.861 -1.848 722 HG12 VAL 90 HG12 VAL 90 6.121 0.184 -1.729 723 HG13 VAL 90 HG13 VAL 90 6.168 -1.102 -2.935 724 HG21 VAL 90 HG21 VAL 90 3.902 -2.007 -0.053 725 HG22 VAL 90 HG22 VAL 90 4.020 -0.666 -1.193 726 HG23 VAL 90 HG23 VAL 90 4.739 -0.528 0.413 727 H TYR 91 HN TYR 91 6.433 -4.199 -3.711 728 HA TYR 91 HA TYR 91 8.304 -6.002 -2.461 729 HB2 TYR 91 HB2 TYR 91 7.453 -5.450 -5.257 730 HB3 TYR 91 HB1 TYR 91 8.994 -6.257 -5.008 731 HD1 TYR 91 HD1 TYR 91 5.715 -6.595 -3.246 732 HD2 TYR 91 HD2 TYR 91 8.730 -8.470 -5.580 733 HE1 TYR 91 HE1 TYR 91 4.566 -8.747 -2.999 734 HE2 TYR 91 HE2 TYR 91 7.574 -10.631 -5.356 735 HH TYR 91 HH TYR 91 4.394 -10.877 -4.053 736 H PHE 92 HN PHE 92 10.440 -5.893 -2.340 737 HA PHE 92 HA PHE 92 11.661 -3.305 -3.015 738 HB2 PHE 92 HB2 PHE 92 12.444 -5.473 -1.047 739 HB3 PHE 92 HB1 PHE 92 13.438 -4.052 -1.391 740 HD1 PHE 92 HD1 PHE 92 11.119 -2.104 -1.684 741 HD2 PHE 92 HD2 PHE 92 12.019 -5.049 1.247 742 HE1 PHE 92 HE1 PHE 92 9.927 -0.781 -0.008 743 HE2 PHE 92 HE2 PHE 92 10.793 -3.723 2.933 744 HZ PHE 92 HZ PHE 92 9.763 -1.590 2.303 745 H LYS 93 HN LYS 93 13.744 -3.311 -4.059 746 HA LYS 93 HA LYS 93 14.110 -5.743 -5.632 747 HB2 LYS 93 HB2 LYS 93 14.862 -4.396 -7.478 748 HB3 LYS 93 HB1 LYS 93 13.365 -3.729 -6.853 749 HG2 LYS 93 HG2 LYS 93 14.409 -1.900 -5.915 750 HG3 LYS 93 HG1 LYS 93 16.008 -2.616 -6.101 751 HD2 LYS 93 HD2 LYS 93 15.588 -0.859 -7.776 752 HD3 LYS 93 HD1 LYS 93 15.849 -2.434 -8.519 753 HE2 LYS 93 HE2 LYS 93 13.303 -2.637 -8.613 754 HE3 LYS 93 HE1 LYS 93 13.246 -0.923 -8.199 755 HZ1 LYS 93 HZ1 LYS 93 13.145 -1.357 -10.604 756 HZ2 LYS 93 HZ2 LYS 93 14.713 -2.004 -10.538 757 HZ3 LYS 93 HZ3 LYS 93 14.451 -0.379 -10.158 758 H ASN 94 HN ASN 94 15.471 -6.807 -4.255 759 HA ASN 94 HA ASN 94 18.242 -6.093 -4.510 760 HB2 ASN 94 HB2 ASN 94 18.713 -6.331 -2.068 761 HB3 ASN 94 HB1 ASN 94 17.831 -4.861 -2.485 762 HD21 ASN 94 HD21 ASN 94 18.040 -6.179 0.053 763 HD22 ASN 94 HD22 ASN 94 16.441 -6.632 0.535 764 H LYS 95 HN LYS 95 19.601 -7.802 -3.322 765 HA LYS 95 HA LYS 95 18.341 -10.449 -3.649 766 HB2 LYS 95 HB2 LYS 95 21.248 -9.680 -3.756 767 HB3 LYS 95 HB1 LYS 95 20.595 -11.281 -4.071 768 HG2 LYS 95 HG2 LYS 95 19.447 -10.474 -6.023 769 HG3 LYS 95 HG1 LYS 95 19.981 -8.825 -5.689 770 HD2 LYS 95 HD2 LYS 95 22.309 -9.511 -5.983 771 HD3 LYS 95 HD1 LYS 95 21.787 -11.168 -6.294 772 HE2 LYS 95 HE2 LYS 95 20.671 -10.515 -8.299 773 HE3 LYS 95 HE1 LYS 95 20.917 -8.805 -7.945 774 HZ1 LYS 95 HZ1 LYS 95 23.047 -10.788 -8.563 775 HZ2 LYS 95 HZ2 LYS 95 23.309 -9.156 -8.177 776 HZ3 LYS 95 HZ3 LYS 95 22.483 -9.566 -9.598 777 H GLU 96 HN GLU 96 19.010 -8.306 -1.404 778 HA GLU 96 HA GLU 96 20.380 -10.000 0.541 779 HB2 GLU 96 HB2 GLU 96 19.776 -7.043 0.438 780 HB3 GLU 96 HB1 GLU 96 20.567 -7.831 1.800 781 HG2 GLU 96 HG2 GLU 96 21.600 -7.723 -1.024 782 HG3 GLU 96 HG1 GLU 96 22.154 -6.736 0.325 783 H GLU 97 HN GLU 97 19.493 -8.578 2.821 784 HA GLU 97 HA GLU 97 17.387 -9.754 3.960 785 HB2 GLU 97 HB2 GLU 97 18.264 -6.882 4.152 786 HB3 GLU 97 HB1 GLU 97 17.027 -7.567 5.203 787 HG2 GLU 97 HG2 GLU 97 19.883 -8.499 4.963 788 HG3 GLU 97 HG1 GLU 97 19.190 -7.578 6.299 789 HA PRO 98 HA PRO 98 13.317 -9.510 3.012 790 HB2 PRO 98 HB2 PRO 98 12.866 -6.732 4.072 791 HB3 PRO 98 HB1 PRO 98 11.806 -8.152 4.163 792 HG2 PRO 98 HG2 PRO 98 13.265 -7.506 6.216 793 HG3 PRO 98 HG1 PRO 98 13.172 -9.209 5.737 794 HD2 PRO 98 HD2 PRO 98 15.386 -7.227 5.398 795 HD3 PRO 98 HD1 PRO 98 15.524 -8.974 5.688 796 H ARG 99 HN ARG 99 12.754 -9.512 1.057 797 HA ARG 99 HA ARG 99 13.281 -7.162 -0.620 798 HB2 ARG 99 HB2 ARG 99 12.688 -9.996 -1.556 799 HB3 ARG 99 HB1 ARG 99 13.206 -8.643 -2.551 800 HG2 ARG 99 HG2 ARG 99 15.350 -8.700 -1.837 801 HG3 ARG 99 HG1 ARG 99 14.919 -9.308 -0.243 802 HD2 ARG 99 HD2 ARG 99 16.180 -11.004 -1.432 803 HD3 ARG 99 HD1 ARG 99 14.519 -11.553 -1.293 804 HE ARG 99 HE ARG 99 14.711 -10.261 -3.731 805 HH11 ARG 99 HH11 ARG 99 16.162 -13.019 -2.148 806 HH12 ARG 99 HH12 ARG 99 16.495 -13.867 -3.629 807 HH21 ARG 99 HH21 ARG 99 15.143 -11.372 -5.698 808 HH22 ARG 99 HH22 ARG 99 15.911 -12.936 -5.641 809 H LYS 100 HN LYS 100 11.047 -7.833 1.293 810 HA LYS 100 HA LYS 100 8.993 -6.575 -0.271 811 HB2 LYS 100 HB2 LYS 100 7.242 -8.247 0.237 812 HB3 LYS 100 HB1 LYS 100 8.474 -8.874 -0.847 813 HG2 LYS 100 HG2 LYS 100 9.366 -10.278 0.760 814 HG3 LYS 100 HG1 LYS 100 8.694 -9.340 2.093 815 HD2 LYS 100 HD2 LYS 100 7.399 -11.295 2.033 816 HD3 LYS 100 HD1 LYS 100 6.404 -10.082 1.231 817 HE2 LYS 100 HE2 LYS 100 8.176 -11.962 -0.306 818 HE3 LYS 100 HE1 LYS 100 6.538 -12.399 0.171 819 HZ1 LYS 100 HZ1 LYS 100 5.761 -10.386 -1.016 820 HZ2 LYS 100 HZ2 LYS 100 6.491 -11.538 -2.031 821 HZ3 LYS 100 HZ3 LYS 100 7.347 -10.149 -1.584 822 H VAL 101 HN VAL 101 7.608 -5.445 1.010 823 HA VAL 101 HA VAL 101 7.749 -5.950 3.902 824 HB VAL 101 HB VAL 101 8.890 -3.843 3.257 825 HG11 VAL 101 HG11 VAL 101 7.758 -3.093 1.345 826 HG12 VAL 101 HG12 VAL 101 7.363 -1.919 2.609 827 HG13 VAL 101 HG13 VAL 101 6.186 -3.152 2.157 828 HG21 VAL 101 HG21 VAL 101 7.839 -2.441 4.925 829 HG22 VAL 101 HG22 VAL 101 7.862 -4.122 5.465 830 HG23 VAL 101 HG23 VAL 101 6.369 -3.414 4.846 831 H ARG 102 HN ARG 102 5.791 -5.898 5.014 832 HA ARG 102 HA ARG 102 3.422 -5.755 3.273 833 HB2 ARG 102 HB2 ARG 102 3.982 -8.012 4.351 834 HB3 ARG 102 HB1 ARG 102 3.552 -7.251 5.880 835 HG2 ARG 102 HG2 ARG 102 1.328 -6.693 4.969 836 HG3 ARG 102 HG1 ARG 102 1.719 -7.566 3.493 837 HD2 ARG 102 HD2 ARG 102 0.556 -9.162 4.683 838 HD3 ARG 102 HD1 ARG 102 2.213 -9.537 5.162 839 HE ARG 102 HE ARG 102 0.588 -7.741 6.832 840 HH11 ARG 102 HH11 ARG 102 2.211 -10.822 6.430 841 HH12 ARG 102 HH12 ARG 102 2.147 -11.213 8.125 842 HH21 ARG 102 HH21 ARG 102 0.494 -8.235 9.020 843 HH22 ARG 102 HH22 ARG 102 1.141 -9.745 9.607 844 H PHE 103 HN PHE 103 2.052 -4.201 3.691 845 HA PHE 103 HA PHE 103 2.164 -2.971 6.368 846 HB2 PHE 103 HB2 PHE 103 1.433 -1.721 3.718 847 HB3 PHE 103 HB1 PHE 103 1.330 -0.903 5.269 848 HD1 PHE 103 HD1 PHE 103 3.829 -1.719 6.572 849 HD2 PHE 103 HD2 PHE 103 3.070 -0.638 2.528 850 HE1 PHE 103 HE1 PHE 103 6.153 -0.939 6.348 851 HE2 PHE 103 HE2 PHE 103 5.394 0.131 2.294 852 HZ PHE 103 HZ PHE 103 6.937 -0.015 4.206 853 H ASP 104 HN ASP 104 0.554 -3.839 7.500 854 HA ASP 104 HA ASP 104 -1.942 -4.604 6.280 855 HB2 ASP 104 HB2 ASP 104 -1.258 -4.426 9.223 856 HB3 ASP 104 HB1 ASP 104 -2.634 -5.261 8.521 857 H TYR 105 HN TYR 105 -2.702 -2.695 5.396 858 HA TYR 105 HA TYR 105 -2.982 -0.394 7.157 859 HB2 TYR 105 HB2 TYR 105 -2.058 -0.040 4.905 860 HB3 TYR 105 HB1 TYR 105 -3.535 -0.689 4.191 861 HD1 TYR 105 HD1 TYR 105 -2.458 1.994 6.567 862 HD2 TYR 105 HD2 TYR 105 -5.135 0.778 3.512 863 HE1 TYR 105 HE1 TYR 105 -3.471 4.234 6.580 864 HE2 TYR 105 HE2 TYR 105 -6.154 2.996 3.493 865 HH TYR 105 HH TYR 105 -5.802 5.190 5.947 866 H ASP 106 HN ASP 106 -4.795 0.103 8.144 867 HA ASP 106 HA ASP 106 -7.096 -1.569 7.877 868 HB2 ASP 106 HB2 ASP 106 -6.345 -0.595 10.042 869 HB3 ASP 106 HB1 ASP 106 -6.794 0.999 9.447 870 H LEU 107 HN LEU 107 -8.229 -1.356 6.032 871 HA LEU 107 HA LEU 107 -8.741 1.192 4.807 872 HB2 LEU 107 HB2 LEU 107 -9.122 -1.605 4.178 873 HB3 LEU 107 HB1 LEU 107 -10.573 -0.689 3.821 874 HG LEU 107 HG LEU 107 -9.111 0.856 2.441 875 HD11 LEU 107 HD11 LEU 107 -7.005 -0.165 1.619 876 HD12 LEU 107 HD12 LEU 107 -7.128 -1.350 2.927 877 HD13 LEU 107 HD13 LEU 107 -6.946 0.365 3.305 878 HD21 LEU 107 HD21 LEU 107 -8.936 -0.845 0.581 879 HD22 LEU 107 HD22 LEU 107 -10.525 -0.657 1.332 880 HD23 LEU 107 HD23 LEU 107 -9.509 -2.034 1.755 881 H PHE 108 HN PHE 108 -10.008 2.540 6.036 882 HA PHE 108 HA PHE 108 -12.584 1.436 6.936 883 HB2 PHE 108 HB2 PHE 108 -12.748 3.258 8.531 884 HB3 PHE 108 HB1 PHE 108 -11.225 2.409 8.763 885 HD1 PHE 108 HD2 PHE 108 -12.779 5.492 7.472 886 HD2 PHE 108 HD1 PHE 108 -9.137 3.535 8.496 887 HE1 PHE 108 HE2 PHE 108 -11.588 7.639 7.331 888 HE2 PHE 108 HE1 PHE 108 -7.947 5.685 8.370 889 HZ PHE 108 HZ PHE 108 -9.172 7.737 7.781 890 H LEU 109 HN LEU 109 -14.493 2.550 6.465 891 HA LEU 109 HA LEU 109 -14.228 4.626 4.369 892 HB2 LEU 109 HB2 LEU 109 -16.445 2.574 4.551 893 HB3 LEU 109 HB1 LEU 109 -16.147 3.707 3.245 894 HG LEU 109 HG LEU 109 -14.436 1.321 3.969 895 HD11 LEU 109 HD11 LEU 109 -16.612 0.898 2.784 896 HD12 LEU 109 HD12 LEU 109 -15.167 0.352 1.939 897 HD13 LEU 109 HD13 LEU 109 -15.973 1.838 1.439 898 HD21 LEU 109 HD21 LEU 109 -14.068 3.388 1.804 899 HD22 LEU 109 HD22 LEU 109 -13.157 1.882 1.944 900 HD23 LEU 109 HD23 LEU 109 -13.018 3.116 3.197 901 H HIS 110 HN HIS 110 -15.991 6.225 4.385 902 HA HIS 110 HA HIS 110 -17.127 6.502 7.073 903 HB2 HIS 110 HB2 HIS 110 -16.570 8.527 4.917 904 HB3 HIS 110 HB1 HIS 110 -17.623 8.893 6.281 905 HD1 HIS 110 HD1 HIS 110 -15.011 10.461 5.905 906 HD2 HIS 110 HD2 HIS 110 -15.366 7.043 8.252 907 HE1 HIS 110 HE1 HIS 110 -13.095 10.552 7.537 908 HE2 HIS 110 HE2 HIS 110 -13.317 8.464 8.939 909 H LEU 111 HN LEU 111 -19.311 7.627 7.144 910 HA LEU 111 HA LEU 111 -21.134 5.791 6.034 911 HB2 LEU 111 HB2 LEU 111 -21.188 7.889 7.966 912 HB3 LEU 111 HB1 LEU 111 -22.558 8.081 6.888 913 HG LEU 111 HG LEU 111 -23.129 6.740 8.864 914 HD11 LEU 111 HD11 LEU 111 -23.889 4.653 7.579 915 HD12 LEU 111 HD12 LEU 111 -23.173 5.435 6.166 916 HD13 LEU 111 HD13 LEU 111 -24.487 6.224 7.042 917 HD21 LEU 111 HD21 LEU 111 -21.036 4.864 7.791 918 HD22 LEU 111 HD22 LEU 111 -22.177 4.478 9.082 919 HD23 LEU 111 HD23 LEU 111 -20.977 5.752 9.315 920 H GLU 112 HN GLU 112 -23.092 6.342 4.871 921 HA GLU 112 HA GLU 112 -22.525 7.489 2.348 922 HB2 GLU 112 HB2 GLU 112 -24.131 5.610 2.829 923 HB3 GLU 112 HB1 GLU 112 -25.225 6.799 3.520 924 HG2 GLU 112 HG2 GLU 112 -25.270 7.954 1.327 925 HG3 GLU 112 HG1 GLU 112 -24.287 6.640 0.667 926 H GLY 113 HN GLY 113 -22.518 9.583 1.857 927 HA2 GLY 113 HA2 GLY 113 -23.189 11.792 1.772 928 HA3 GLY 113 HA1 GLY 113 -24.547 11.378 2.810 929 H HIS 114 HN HIS 114 -21.274 10.610 3.666 930 HA HIS 114 HA HIS 114 -21.306 12.780 5.676 931 HB2 HIS 114 HB2 HIS 114 -21.690 10.249 6.478 932 HB3 HIS 114 HB1 HIS 114 -19.928 10.185 6.343 933 HD1 HIS 114 HD1 HIS 114 -18.572 11.270 8.185 934 HD2 HIS 114 HD2 HIS 114 -22.640 12.137 8.425 935 HE1 HIS 114 HE1 HIS 114 -18.901 12.397 10.408 936 HE2 HIS 114 HE2 HIS 114 -21.370 12.875 10.559 937 HA PRO 115 HA PRO 115 -17.501 14.528 4.191 938 HB2 PRO 115 HB2 PRO 115 -16.627 13.582 6.907 939 HB3 PRO 115 HB1 PRO 115 -16.211 15.083 6.069 940 HG2 PRO 115 HG2 PRO 115 -18.215 14.921 7.899 941 HG3 PRO 115 HG1 PRO 115 -18.223 16.066 6.549 942 HD2 PRO 115 HD2 PRO 115 -19.983 13.841 7.014 943 HD3 PRO 115 HD1 PRO 115 -20.036 15.019 5.696 944 HA PRO 116 HA PRO 116 -15.715 10.908 2.521 945 HB2 PRO 116 HB2 PRO 116 -13.857 12.014 0.922 946 HB3 PRO 116 HB1 PRO 116 -15.589 12.164 0.603 947 HG2 PRO 116 HG2 PRO 116 -13.708 14.131 1.830 948 HG3 PRO 116 HG1 PRO 116 -15.013 14.404 0.660 949 HD2 PRO 116 HD2 PRO 116 -15.233 14.878 3.354 950 HD3 PRO 116 HD1 PRO 116 -16.611 14.508 2.292 951 H VAL 117 HN VAL 117 -13.405 10.133 1.857 952 HA VAL 117 HA VAL 117 -11.782 10.245 4.309 953 HB VAL 117 HB VAL 117 -12.436 7.949 2.470 954 HG11 VAL 117 HG11 VAL 117 -10.240 8.124 4.502 955 HG12 VAL 117 HG12 VAL 117 -10.085 7.781 2.785 956 HG13 VAL 117 HG13 VAL 117 -10.852 6.608 3.857 957 HG21 VAL 117 HG21 VAL 117 -13.070 6.851 4.589 958 HG22 VAL 117 HG22 VAL 117 -14.020 8.295 4.245 959 HG23 VAL 117 HG23 VAL 117 -12.725 8.357 5.439 960 H ASN 118 HN ASN 118 -9.800 11.041 4.037 961 HA ASN 118 HA ASN 118 -8.281 10.294 1.655 962 HB2 ASN 118 HB2 ASN 118 -9.347 12.570 1.294 963 HB3 ASN 118 HB1 ASN 118 -8.351 13.161 2.617 964 HD21 ASN 118 HD21 ASN 118 -5.946 12.824 2.332 965 HD22 ASN 118 HD22 ASN 118 -5.313 12.970 0.727 966 H HIS 119 HN HIS 119 -6.825 9.037 2.822 967 HA HIS 119 HA HIS 119 -5.345 10.434 4.953 968 HB2 HIS 119 HB2 HIS 119 -7.067 8.797 5.819 969 HB3 HIS 119 HB1 HIS 119 -6.103 7.519 5.082 970 HD1 HIS 119 HD1 HIS 119 -4.035 6.746 6.319 971 HD2 HIS 119 HD2 HIS 119 -5.789 10.102 8.026 972 HE1 HIS 119 HE1 HIS 119 -2.838 7.097 8.498 973 HE2 HIS 119 HE2 HIS 119 -3.788 9.238 9.421 974 H LEU 120 HN LEU 120 -3.198 9.978 5.174 975 HA LEU 120 HA LEU 120 -1.914 7.857 3.671 976 HB2 LEU 120 HB2 LEU 120 -1.580 10.773 3.091 977 HB3 LEU 120 HB1 LEU 120 -0.197 9.713 2.939 978 HG LEU 120 HG LEU 120 -2.740 9.057 1.498 979 HD11 LEU 120 HD11 LEU 120 -0.887 10.300 -0.245 980 HD12 LEU 120 HD12 LEU 120 -1.195 11.410 1.093 981 HD13 LEU 120 HD13 LEU 120 -2.539 10.796 0.126 982 HD21 LEU 120 HD21 LEU 120 -0.742 7.491 1.765 983 HD22 LEU 120 HD22 LEU 120 0.114 8.601 0.692 984 HD23 LEU 120 HD23 LEU 120 -1.337 7.772 0.126 985 H ARG 121 HN ARG 121 0.126 7.303 4.481 986 HA ARG 121 HA ARG 121 1.217 8.863 6.709 987 HB2 ARG 121 HB2 ARG 121 0.631 7.447 8.393 988 HB3 ARG 121 HB1 ARG 121 -0.428 6.647 7.290 989 HG2 ARG 121 HG2 ARG 121 2.424 5.814 7.349 990 HG3 ARG 121 HG1 ARG 121 1.384 5.342 8.684 991 HD2 ARG 121 HD2 ARG 121 0.591 4.743 5.828 992 HD3 ARG 121 HD1 ARG 121 1.698 3.718 6.711 993 HE ARG 121 HE ARG 121 -1.054 4.286 7.605 994 HH11 ARG 121 HH11 ARG 121 1.711 2.170 7.279 995 HH12 ARG 121 HH12 ARG 121 0.955 0.829 8.078 996 HH21 ARG 121 HH21 ARG 121 -2.066 2.520 8.662 997 HH22 ARG 121 HH22 ARG 121 -1.185 1.035 8.886 998 H CYS 122 HN CYS 122 3.411 8.797 6.732 999 HA CYS 122 HA CYS 122 4.765 7.131 4.783 1000 HB2 CYS 122 HB2 CYS 122 6.010 9.080 6.694 1001 HB3 CYS 122 HB1 CYS 122 6.701 8.456 5.207 1002 HG CYS 122 HG CYS 122 4.405 9.720 3.765 1003 H GLU 123 HN GLU 123 5.676 5.252 5.192 1004 HA GLU 123 HA GLU 123 6.172 4.407 7.957 1005 HB2 GLU 123 HB2 GLU 123 6.081 2.881 5.344 1006 HB3 GLU 123 HB1 GLU 123 6.493 2.153 6.896 1007 HG2 GLU 123 HG2 GLU 123 3.939 3.638 6.580 1008 HG3 GLU 123 HG1 GLU 123 4.072 1.988 5.972 1009 H LYS 124 HN LYS 124 8.202 3.255 8.392 1010 HA LYS 124 HA LYS 124 10.430 4.365 6.819 1011 HB2 LYS 124 HB2 LYS 124 9.884 5.532 8.989 1012 HB3 LYS 124 HB1 LYS 124 10.327 4.043 9.806 1013 HG2 LYS 124 HG2 LYS 124 12.602 4.246 8.881 1014 HG3 LYS 124 HG1 LYS 124 12.121 5.752 8.103 1015 HD2 LYS 124 HD2 LYS 124 12.150 5.191 11.051 1016 HD3 LYS 124 HD1 LYS 124 13.287 6.194 10.145 1017 HE2 LYS 124 HE2 LYS 124 11.184 7.435 9.352 1018 HE3 LYS 124 HE1 LYS 124 10.396 6.669 10.727 1019 HZ1 LYS 124 HZ1 LYS 124 11.181 8.840 11.355 1020 HZ2 LYS 124 HZ2 LYS 124 12.759 8.465 10.858 1021 HZ3 LYS 124 HZ3 LYS 124 12.074 7.663 12.187 1022 H LEU 125 HN LEU 125 11.863 2.870 6.152 1023 HA LEU 125 HA LEU 125 12.068 0.362 7.710 1024 HB2 LEU 125 HB2 LEU 125 12.555 0.647 4.752 1025 HB3 LEU 125 HB1 LEU 125 12.441 -0.838 5.669 1026 HG LEU 125 HG LEU 125 10.037 0.885 5.723 1027 HD11 LEU 125 HD11 LEU 125 10.702 1.114 3.377 1028 HD12 LEU 125 HD12 LEU 125 9.265 0.102 3.548 1029 HD13 LEU 125 HD13 LEU 125 10.834 -0.643 3.251 1030 HD21 LEU 125 HD21 LEU 125 9.003 -1.398 5.359 1031 HD22 LEU 125 HD22 LEU 125 9.912 -1.178 6.858 1032 HD23 LEU 125 HD23 LEU 125 10.637 -2.052 5.507 1033 H THR 126 HN THR 126 14.010 0.216 8.677 1034 HA THR 126 HA THR 126 16.256 1.750 7.561 1035 HB THR 126 HB THR 126 16.463 0.476 10.237 1036 HG1 THR 126 HG1 THR 126 14.388 1.356 10.370 1037 HG21 THR 126 HG21 THR 126 18.185 1.950 9.028 1038 HG22 THR 126 HG22 THR 126 17.827 2.308 10.720 1039 HG23 THR 126 HG23 THR 126 17.116 3.293 9.442 1040 H PHE 127 HN PHE 127 17.896 0.723 6.634 1041 HA PHE 127 HA PHE 127 18.269 -2.141 7.215 1042 HB2 PHE 127 HB2 PHE 127 18.950 -0.667 4.664 1043 HB3 PHE 127 HB1 PHE 127 19.132 -2.399 4.946 1044 HD1 PHE 127 HD1 PHE 127 17.145 -3.846 5.117 1045 HD2 PHE 127 HD2 PHE 127 16.835 0.301 4.208 1046 HE1 PHE 127 HE1 PHE 127 14.834 -4.180 4.382 1047 HE2 PHE 127 HE2 PHE 127 14.527 -0.025 3.467 1048 HZ PHE 127 HZ PHE 127 13.516 -2.263 3.561 1049 H ASN 128 HN ASN 128 19.891 -2.350 8.556 1050 HA ASN 128 HA ASN 128 21.960 -0.370 8.759 1051 HB2 ASN 128 HB2 ASN 128 21.496 -2.973 10.207 1052 HB3 ASN 128 HB1 ASN 128 22.837 -1.883 10.548 1053 HD21 ASN 128 HD21 ASN 128 19.377 -2.303 10.699 1054 HD22 ASN 128 HD22 ASN 128 19.079 -1.010 11.812 1055 H ASN 129 HN ASN 129 23.660 -0.317 7.509 1056 HA ASN 129 HA ASN 129 25.444 -0.873 6.247 1057 HB2 ASN 129 HB2 ASN 129 25.440 -3.343 7.991 1058 HB3 ASN 129 HB1 ASN 129 26.773 -2.838 6.956 1059 HD21 ASN 129 HD21 ASN 129 25.099 -2.325 9.918 1060 HD22 ASN 129 HD22 ASN 129 26.175 -1.132 10.570 1061 HA PRO 130 HA PRO 130 23.163 -3.773 3.473 1062 HB2 PRO 130 HB2 PRO 130 22.244 -2.042 1.662 1063 HB3 PRO 130 HB1 PRO 130 21.421 -2.259 3.213 1064 HG2 PRO 130 HG2 PRO 130 23.232 -0.062 2.316 1065 HG3 PRO 130 HG1 PRO 130 21.778 0.021 3.325 1066 HD2 PRO 130 HD2 PRO 130 24.415 0.000 4.251 1067 HD3 PRO 130 HD1 PRO 130 22.971 -0.328 5.228 1068 H THR 131 HN THR 131 23.883 -4.567 1.494 1069 HA THR 131 HA THR 131 26.567 -4.067 0.776 1070 HB THR 131 HB THR 131 25.418 -6.251 0.309 1071 HG1 THR 131 HG1 THR 131 26.204 -6.199 -2.079 1072 HG21 THR 131 HG21 THR 131 23.278 -5.388 -0.515 1073 HG22 THR 131 HG22 THR 131 24.030 -6.443 -1.711 1074 HG23 THR 131 HG23 THR 131 24.090 -4.692 -1.917 1075 H GLU 132 HN GLU 132 27.323 -3.352 -1.420 1076 HA GLU 132 HA GLU 132 26.661 -0.693 -1.829 1077 HB2 GLU 132 HB2 GLU 132 28.721 -1.859 -2.703 1078 HB3 GLU 132 HB1 GLU 132 27.726 -2.482 -4.012 1079 HG2 GLU 132 HG2 GLU 132 28.843 -0.591 -4.860 1080 HG3 GLU 132 HG1 GLU 132 27.169 -0.103 -4.592 1081 H ASP 133 HN ASP 133 25.488 -3.517 -3.685 1082 HA ASP 133 HA ASP 133 24.092 -2.176 -5.675 1083 HB2 ASP 133 HB2 ASP 133 23.479 -4.820 -4.333 1084 HB3 ASP 133 HB1 ASP 133 22.627 -4.236 -5.758 1085 H PHE 134 HN PHE 134 22.803 -3.301 -2.537 1086 HA PHE 134 HA PHE 134 20.201 -2.239 -2.969 1087 HB2 PHE 134 HB2 PHE 134 20.897 -4.070 -1.292 1088 HB3 PHE 134 HB1 PHE 134 21.420 -2.745 -0.256 1089 HD1 PHE 134 HD1 PHE 134 18.472 -2.628 -2.471 1090 HD2 PHE 134 HD2 PHE 134 19.878 -3.062 1.523 1091 HE1 PHE 134 HE1 PHE 134 16.183 -2.412 -1.644 1092 HE2 PHE 134 HE2 PHE 134 17.578 -2.819 2.356 1093 HZ PHE 134 HZ PHE 134 15.721 -2.493 0.766 1094 H ARG 135 HN ARG 135 22.896 -1.222 -0.950 1095 HA ARG 135 HA ARG 135 22.156 1.223 0.016 1096 HB2 ARG 135 HB2 ARG 135 24.174 0.396 0.701 1097 HB3 ARG 135 HB1 ARG 135 24.702 0.045 -0.942 1098 HG2 ARG 135 HG2 ARG 135 25.821 1.999 -0.981 1099 HG3 ARG 135 HG1 ARG 135 24.324 2.858 -0.651 1100 HD2 ARG 135 HD2 ARG 135 26.319 3.085 1.004 1101 HD3 ARG 135 HD1 ARG 135 24.694 2.840 1.643 1102 HE ARG 135 HE ARG 135 25.503 0.338 1.547 1103 HH11 ARG 135 HH11 ARG 135 27.399 3.118 2.482 1104 HH12 ARG 135 HH12 ARG 135 28.311 2.258 3.682 1105 HH21 ARG 135 HH21 ARG 135 26.711 -0.816 3.088 1106 HH22 ARG 135 HH22 ARG 135 27.920 0.008 4.032 1107 H ARG 136 HN ARG 136 23.566 0.556 -3.097 1108 HA ARG 136 HA ARG 136 23.860 3.108 -4.115 1109 HB2 ARG 136 HB2 ARG 136 24.916 1.154 -4.999 1110 HB3 ARG 136 HB1 ARG 136 23.380 0.420 -5.407 1111 HG2 ARG 136 HG2 ARG 136 23.120 2.378 -7.038 1112 HG3 ARG 136 HG1 ARG 136 24.856 2.617 -6.763 1113 HD2 ARG 136 HD2 ARG 136 24.831 1.165 -8.583 1114 HD3 ARG 136 HD1 ARG 136 25.059 0.102 -7.188 1115 HE ARG 136 HE ARG 136 22.357 0.494 -8.264 1116 HH11 ARG 136 HH11 ARG 136 25.129 -1.559 -7.629 1117 HH12 ARG 136 HH12 ARG 136 24.283 -3.038 -7.990 1118 HH21 ARG 136 HH21 ARG 136 21.248 -1.465 -8.781 1119 HH22 ARG 136 HH22 ARG 136 22.097 -2.981 -8.666 1120 H LYS 137 HN LYS 137 21.087 0.894 -4.390 1121 HA LYS 137 HA LYS 137 19.616 2.731 -6.025 1122 HB2 LYS 137 HB2 LYS 137 18.807 0.203 -4.601 1123 HB3 LYS 137 HB1 LYS 137 17.686 1.160 -5.576 1124 HG2 LYS 137 HG2 LYS 137 19.195 0.866 -7.519 1125 HG3 LYS 137 HG1 LYS 137 20.237 -0.156 -6.532 1126 HD2 LYS 137 HD2 LYS 137 17.385 -0.914 -6.626 1127 HD3 LYS 137 HD1 LYS 137 18.291 -1.100 -8.128 1128 HE2 LYS 137 HE2 LYS 137 18.394 -3.159 -6.908 1129 HE3 LYS 137 HE1 LYS 137 19.988 -2.409 -6.887 1130 HZ1 LYS 137 HZ1 LYS 137 19.485 -1.572 -4.654 1131 HZ2 LYS 137 HZ2 LYS 137 19.453 -3.265 -4.730 1132 HZ3 LYS 137 HZ3 LYS 137 18.003 -2.396 -4.685 1133 H LEU 138 HN LEU 138 19.455 1.764 -2.617 1134 HA LEU 138 HA LEU 138 17.325 3.334 -1.776 1135 HB2 LEU 138 HB2 LEU 138 19.846 2.811 -0.216 1136 HB3 LEU 138 HB1 LEU 138 18.288 3.264 0.443 1137 HG LEU 138 HG LEU 138 19.093 0.638 -0.773 1138 HD11 LEU 138 HD11 LEU 138 19.559 1.092 1.625 1139 HD12 LEU 138 HD12 LEU 138 18.476 -0.270 1.345 1140 HD13 LEU 138 HD13 LEU 138 17.824 1.280 1.875 1141 HD21 LEU 138 HD21 LEU 138 16.304 1.519 -0.080 1142 HD22 LEU 138 HD22 LEU 138 16.794 -0.106 -0.546 1143 HD23 LEU 138 HD23 LEU 138 16.922 1.219 -1.702 1144 H LEU 139 HN LEU 139 20.647 4.257 -2.447 1145 HA LEU 139 HA LEU 139 20.451 6.880 -1.312 1146 HB2 LEU 139 HB2 LEU 139 22.433 5.777 -3.301 1147 HB3 LEU 139 HB1 LEU 139 22.612 7.270 -2.402 1148 HG LEU 139 HG LEU 139 22.436 4.541 -1.138 1149 HD11 LEU 139 HD11 LEU 139 24.669 4.312 -1.210 1150 HD12 LEU 139 HD12 LEU 139 24.964 6.051 -1.081 1151 HD13 LEU 139 HD13 LEU 139 24.516 5.345 -2.635 1152 HD21 LEU 139 HD21 LEU 139 21.685 6.435 0.234 1153 HD22 LEU 139 HD22 LEU 139 23.262 7.197 0.014 1154 HD23 LEU 139 HD23 LEU 139 23.135 5.661 0.873 1155 H LYS 140 HN LYS 140 20.133 5.539 -4.564 1156 HA LYS 140 HA LYS 140 19.942 7.981 -5.947 1157 HB2 LYS 140 HB2 LYS 140 19.759 5.237 -6.621 1158 HB3 LYS 140 HB1 LYS 140 18.314 6.033 -7.205 1159 HG2 LYS 140 HG2 LYS 140 19.503 7.481 -8.587 1160 HG3 LYS 140 HG1 LYS 140 21.030 7.143 -7.766 1161 HD2 LYS 140 HD2 LYS 140 19.693 4.803 -8.936 1162 HD3 LYS 140 HD1 LYS 140 20.261 6.002 -10.098 1163 HE2 LYS 140 HE2 LYS 140 21.795 4.056 -9.307 1164 HE3 LYS 140 HE1 LYS 140 22.464 5.664 -9.566 1165 HZ1 LYS 140 HZ1 LYS 140 21.688 4.485 -6.944 1166 HZ2 LYS 140 HZ2 LYS 140 22.288 6.052 -7.164 1167 HZ3 LYS 140 HZ3 LYS 140 23.265 4.718 -7.504 1168 H ALA 141 HN ALA 141 17.724 6.262 -3.995 1169 HA ALA 141 HA ALA 141 15.375 7.591 -4.996 1170 HB1 ALA 141 HB1 ALA 141 14.201 6.412 -3.297 1171 HB2 ALA 141 HB2 ALA 141 15.693 6.077 -2.417 1172 HB3 ALA 141 HB3 ALA 141 15.401 5.313 -3.979 1173 H1 GLY 212 HT1 GLY 212 -24.359 7.155 11.974 1174 H2 GLY 212 HT2 GLY 212 -24.126 6.591 13.556 1175 H3 GLY 212 HT3 GLY 212 -23.299 5.865 12.266 1176 HA2 GLY 212 HA1 GLY 212 -22.920 8.629 13.270 1177 HA3 GLY 212 HA2 GLY 212 -21.805 7.285 13.481 1178 H GLY 213 HN GLY 213 -20.074 8.100 12.384 1179 HA2 GLY 213 HA2 GLY 213 -20.521 8.728 9.527 1180 HA3 GLY 213 HA1 GLY 213 -19.249 9.447 10.505 1181 H LYS 214 HN LYS 214 -19.390 6.361 11.509 1182 HA LYS 214 HA LYS 214 -17.153 5.585 9.775 1183 HB2 LYS 214 HB2 LYS 214 -16.800 5.629 12.232 1184 HB3 LYS 214 HB1 LYS 214 -18.078 4.440 12.423 1185 HG2 LYS 214 HG2 LYS 214 -16.007 3.303 12.588 1186 HG3 LYS 214 HG1 LYS 214 -16.717 2.875 11.030 1187 HD2 LYS 214 HD2 LYS 214 -15.259 4.411 9.888 1188 HD3 LYS 214 HD1 LYS 214 -14.638 5.024 11.422 1189 HE2 LYS 214 HE2 LYS 214 -14.315 2.217 10.365 1190 HE3 LYS 214 HE1 LYS 214 -13.066 3.462 10.406 1191 HZ1 LYS 214 HZ1 LYS 214 -14.386 2.204 12.753 1192 HZ2 LYS 214 HZ2 LYS 214 -13.283 3.486 12.846 1193 HZ3 LYS 214 HZ3 LYS 214 -12.783 1.981 12.257 1194 H ALA 215 HN ALA 215 -17.658 4.280 8.118 1195 HA ALA 215 HA ALA 215 -20.168 2.951 7.914 1196 HB1 ALA 215 HB1 ALA 215 -19.290 2.039 5.825 1197 HB2 ALA 215 HB2 ALA 215 -17.670 2.588 6.254 1198 HB3 ALA 215 HB3 ALA 215 -18.949 3.765 5.952 1199 HA PRO 216 HA PRO 216 -19.500 -0.866 9.946 1200 HB2 PRO 216 HB2 PRO 216 -20.738 -2.631 8.259 1201 HB3 PRO 216 HB1 PRO 216 -21.594 -1.542 9.353 1202 HG2 PRO 216 HG2 PRO 216 -21.027 -1.229 6.435 1203 HG3 PRO 216 HG1 PRO 216 -22.521 -0.886 7.325 1204 HD2 PRO 216 HD2 PRO 216 -20.829 1.065 6.598 1205 HD3 PRO 216 HD1 PRO 216 -21.718 1.128 8.136 1206 H ARG 217 HN ARG 217 -18.779 -3.182 9.612 1207 HA ARG 217 HA ARG 217 -16.748 -3.441 7.517 1208 HB2 ARG 217 HB2 ARG 217 -15.563 -2.481 9.416 1209 HB3 ARG 217 HB1 ARG 217 -16.250 -3.681 10.499 1210 HG2 ARG 217 HG2 ARG 217 -14.935 -5.410 9.574 1211 HG3 ARG 217 HG1 ARG 217 -14.458 -4.409 8.201 1212 HD2 ARG 217 HD2 ARG 217 -13.698 -3.952 11.086 1213 HD3 ARG 217 HD1 ARG 217 -12.647 -4.598 9.826 1214 HE ARG 217 HE ARG 217 -13.809 -1.967 9.357 1215 HH11 ARG 217 HH11 ARG 217 -11.011 -3.825 10.372 1216 HH12 ARG 217 HH12 ARG 217 -9.900 -2.498 10.142 1217 HH21 ARG 217 HH21 ARG 217 -12.351 -0.255 9.033 1218 HH22 ARG 217 HH22 ARG 217 -10.661 -0.469 9.379 1219 H1 KCR 218 HN KCR 218 -16.157 -5.595 7.061 1220 H4 KCR 218 HA KCR 218 -18.386 -7.399 7.528 1221 H5 KCR 218 HB1 KCR 218 -17.354 -8.789 5.800 1222 H6 KCR 218 HB2 KCR 218 -15.926 -7.765 5.810 1223 H7 KCR 218 HG1 KCR 218 -17.278 -5.884 5.026 1224 H8 KCR 218 HG2 KCR 218 -18.696 -6.933 4.987 1225 H9 KCR 218 HD1 KCR 218 -17.666 -8.334 3.311 1226 H10 KCR 218 HD2 KCR 218 -16.171 -7.400 3.408 1227 H11 KCR 218 HE1 KCR 218 -17.287 -5.439 2.555 1228 H12 KCR 218 HE2 KCR 218 -18.839 -6.275 2.575 1229 H13 KCR 218 HZ1 KCR 218 -17.751 -7.821 0.896 1230 H14 KCR 218 HH1 KCR 218 -17.063 -7.743 -1.424 1231 H15 KCR 218 HJ1 KCR 218 -16.795 -4.786 -2.268 1232 H16 KCR 218 HF3 KCR 218 -15.900 -5.841 -4.292 1233 H17 KCR 218 HF1 KCR 218 -16.139 -7.448 -3.608 1234 H18 KCR 218 HF2 KCR 218 -17.510 -6.561 -4.275 1235 H GLN 219 HN GLN 219 -14.839 -7.536 7.892 1236 HA GLN 219 HA GLN 219 -13.474 -8.935 9.045 1237 HB2 GLN 219 HB2 GLN 219 -14.616 -7.888 10.973 1238 HB3 GLN 219 HB1 GLN 219 -15.841 -9.143 10.925 1239 HG2 GLN 219 HG2 GLN 219 -14.085 -9.416 12.684 1240 HG3 GLN 219 HG1 GLN 219 -14.305 -10.802 11.619 1241 HE21 GLN 219 HE21 GLN 219 -12.204 -8.159 12.494 1242 HE22 GLN 219 HE22 GLN 219 -10.789 -8.769 11.700 1243 H LEU 220 HN LEU 220 -14.332 -10.089 6.933 1244 HA LEU 220 HA LEU 220 -15.015 -12.837 7.719 1245 HB2 LEU 220 HB2 LEU 220 -16.965 -11.789 6.661 1246 HB3 LEU 220 HB1 LEU 220 -15.986 -11.328 5.284 1247 HG LEU 220 HG LEU 220 -15.633 -13.751 4.792 1248 HD11 LEU 220 HD11 LEU 220 -17.109 -15.382 5.847 1249 HD12 LEU 220 HD12 LEU 220 -17.725 -14.133 6.930 1250 HD13 LEU 220 HD13 LEU 220 -16.036 -14.632 7.028 1251 HD21 LEU 220 HD21 LEU 220 -17.872 -14.109 3.870 1252 HD22 LEU 220 HD22 LEU 220 -17.320 -12.455 3.610 1253 HD23 LEU 220 HD23 LEU 220 -18.495 -12.802 4.877 1254 H ALA 221 HN ALA 221 -13.728 -14.377 6.855 1255 HA ALA 221 HA ALA 221 -11.979 -15.349 5.805 1256 HB1 ALA 221 HB1 ALA 221 -11.583 -14.807 3.471 1257 HB2 ALA 221 HB2 ALA 221 -12.524 -13.325 3.640 1258 HB3 ALA 221 HB3 ALA 221 -13.313 -14.894 3.806 1259 H THR 222 HN THR 222 -10.704 -14.448 7.569 1260 HA THR 222 HA THR 222 -9.091 -12.171 7.331 1261 HB THR 222 HB THR 222 -7.536 -13.529 8.892 1262 HG1 THR 222 HG1 THR 222 -9.625 -15.203 9.526 1263 HG21 THR 222 HG21 THR 222 -9.071 -13.231 10.790 1264 HG22 THR 222 HG22 THR 222 -10.414 -13.029 9.665 1265 HG23 THR 222 HG23 THR 222 -9.108 -11.845 9.700 1266 H LYS 223 HN LYS 223 -7.461 -11.720 5.991 1267 HA LYS 223 HA LYS 223 -6.227 -13.946 4.528 1268 HB2 LYS 223 HB2 LYS 223 -7.340 -12.240 3.141 1269 HB3 LYS 223 HB1 LYS 223 -6.301 -11.002 3.831 1270 HG2 LYS 223 HG2 LYS 223 -5.611 -11.753 1.572 1271 HG3 LYS 223 HG1 LYS 223 -4.362 -11.957 2.802 1272 HD2 LYS 223 HD2 LYS 223 -4.447 -13.916 1.379 1273 HD3 LYS 223 HD1 LYS 223 -4.984 -14.334 3.005 1274 HE2 LYS 223 HE2 LYS 223 -7.337 -14.068 2.210 1275 HE3 LYS 223 HE1 LYS 223 -6.706 -13.858 0.578 1276 HZ1 LYS 223 HZ1 LYS 223 -6.410 -16.264 2.296 1277 HZ2 LYS 223 HZ2 LYS 223 -5.662 -16.065 0.789 1278 HZ3 LYS 223 HZ3 LYS 223 -7.349 -16.131 0.891 1279 H ALA 224 HN ALA 224 -4.834 -14.480 6.240 1280 HA ALA 224 HA ALA 224 -2.414 -12.865 6.282 1281 HB1 ALA 224 HB1 ALA 224 -2.254 -12.892 8.723 1282 HB2 ALA 224 HB2 ALA 224 -3.843 -13.650 8.824 1283 HB3 ALA 224 HB3 ALA 224 -3.686 -12.013 8.189 Start of MODEL 15 1 H1 GLY 1 HT1 GLY 1 37.373 -10.583 7.116 2 H2 GLY 1 HT2 GLY 1 39.000 -10.706 7.575 3 H3 GLY 1 HT3 GLY 1 38.209 -12.042 6.894 4 HA2 GLY 1 HA1 GLY 1 39.656 -11.019 5.269 5 HA3 GLY 1 HA2 GLY 1 37.967 -10.878 4.798 6 H SER 2 HN SER 2 39.770 -9.190 3.662 7 HA SER 2 HA SER 2 40.074 -6.760 5.127 8 HB2 SER 2 HB2 SER 2 40.789 -5.868 2.860 9 HB3 SER 2 HB1 SER 2 41.711 -7.241 3.471 10 HG SER 2 HG SER 2 40.919 -7.268 1.182 11 H HIS 3 HN HIS 3 37.507 -8.116 3.347 12 HA HIS 3 HA HIS 3 36.252 -5.642 2.608 13 HB2 HIS 3 HB2 HIS 3 35.281 -8.497 2.668 14 HB3 HIS 3 HB1 HIS 3 34.209 -7.156 2.282 15 HD1 HIS 3 HD1 HIS 3 35.897 -9.642 0.574 16 HD2 HIS 3 HD2 HIS 3 35.740 -5.510 0.093 17 HE1 HIS 3 HE1 HIS 3 36.555 -9.208 -1.816 18 HE2 HIS 3 HE2 HIS 3 36.263 -6.727 -2.133 19 H MET 4 HN MET 4 36.555 -4.707 4.772 20 HA MET 4 HA MET 4 34.500 -5.554 6.691 21 HB2 MET 4 HB2 MET 4 36.797 -3.621 7.075 22 HB3 MET 4 HB1 MET 4 35.690 -4.174 8.324 23 HG2 MET 4 HG2 MET 4 36.525 -6.440 8.085 24 HG3 MET 4 HG1 MET 4 37.605 -5.918 6.794 25 HE1 MET 4 HE1 MET 4 40.108 -6.663 9.683 26 HE2 MET 4 HE2 MET 4 39.674 -6.978 8.002 27 HE3 MET 4 HE3 MET 4 38.630 -7.548 9.304 28 H ALA 5 HN ALA 5 35.940 -2.383 6.044 29 HA ALA 5 HA ALA 5 35.085 -0.366 5.477 30 HB1 ALA 5 HB1 ALA 5 33.097 -0.235 4.082 31 HB2 ALA 5 HB2 ALA 5 32.719 -1.921 4.438 32 HB3 ALA 5 HB3 ALA 5 34.171 -1.517 3.523 33 H SER 6 HN SER 6 33.194 1.148 5.900 34 HA SER 6 HA SER 6 31.968 0.424 8.478 35 HB2 SER 6 HB2 SER 6 33.713 2.194 8.636 36 HB3 SER 6 HB1 SER 6 32.772 3.187 7.525 37 HG SER 6 HG SER 6 32.437 2.750 10.209 38 H SER 7 HN SER 7 30.247 -0.466 7.148 39 HA SER 7 HA SER 7 28.619 1.385 5.649 40 HB2 SER 7 HB2 SER 7 28.878 -0.980 4.931 41 HB3 SER 7 HB1 SER 7 28.065 -1.502 6.406 42 HG SER 7 HG SER 7 26.987 -0.708 4.090 43 H CYS 8 HN CYS 8 26.130 1.163 6.197 44 HA CYS 8 HA CYS 8 25.616 1.412 9.036 45 HB2 CYS 8 HB2 CYS 8 25.432 3.807 7.194 46 HB3 CYS 8 HB1 CYS 8 24.834 3.759 8.848 47 HG CYS 8 HG CYS 8 27.954 2.845 8.943 48 H ALA 9 HN ALA 9 23.273 2.274 9.328 49 HA ALA 9 HA ALA 9 21.595 0.571 7.727 50 HB1 ALA 9 HB1 ALA 9 19.799 1.232 9.249 51 HB2 ALA 9 HB2 ALA 9 20.840 2.488 9.932 52 HB3 ALA 9 HB3 ALA 9 21.254 0.790 10.153 53 H VAL 10 HN VAL 10 20.557 1.123 5.954 54 HA VAL 10 HA VAL 10 20.252 3.979 5.329 55 HB VAL 10 HB VAL 10 19.892 1.665 3.420 56 HG11 VAL 10 HG11 VAL 10 18.786 3.471 2.482 57 HG12 VAL 10 HG12 VAL 10 20.409 3.636 1.802 58 HG13 VAL 10 HG13 VAL 10 19.918 4.644 3.163 59 HG21 VAL 10 HG21 VAL 10 22.190 1.600 4.087 60 HG22 VAL 10 HG22 VAL 10 22.336 3.352 3.957 61 HG23 VAL 10 HG23 VAL 10 22.120 2.375 2.505 62 H GLN 11 HN GLN 11 18.284 4.877 5.220 63 HA GLN 11 HA GLN 11 16.015 3.095 5.831 64 HB2 GLN 11 HB2 GLN 11 16.239 6.021 6.551 65 HB3 GLN 11 HB1 GLN 11 15.056 4.858 7.139 66 HG2 GLN 11 HG2 GLN 11 16.361 4.350 8.849 67 HG3 GLN 11 HG1 GLN 11 17.656 3.886 7.749 68 HE21 GLN 11 HE21 GLN 11 16.346 7.118 7.954 69 HE22 GLN 11 HE22 GLN 11 17.752 7.853 8.639 70 H VAL 12 HN VAL 12 14.401 3.019 4.413 71 HA VAL 12 HA VAL 12 14.031 5.322 2.621 72 HB VAL 12 HB VAL 12 12.792 3.539 1.171 73 HG11 VAL 12 HG11 VAL 12 15.771 3.881 1.345 74 HG12 VAL 12 HG12 VAL 12 14.643 4.735 0.306 75 HG13 VAL 12 HG13 VAL 12 14.980 3.028 0.029 76 HG21 VAL 12 HG21 VAL 12 12.911 1.686 2.630 77 HG22 VAL 12 HG22 VAL 12 14.657 1.843 2.805 78 HG23 VAL 12 HG23 VAL 12 13.963 1.343 1.260 79 H LYS 13 HN LYS 13 11.946 6.086 2.334 80 HA LYS 13 HA LYS 13 9.997 4.980 4.228 81 HB2 LYS 13 HB2 LYS 13 10.422 7.753 3.175 82 HB3 LYS 13 HB1 LYS 13 8.844 7.265 3.791 83 HG2 LYS 13 HG2 LYS 13 9.973 8.285 5.658 84 HG3 LYS 13 HG1 LYS 13 10.083 6.534 5.904 85 HD2 LYS 13 HD2 LYS 13 12.352 6.572 4.944 86 HD3 LYS 13 HD1 LYS 13 12.226 8.324 4.759 87 HE2 LYS 13 HE2 LYS 13 11.655 8.249 7.309 88 HE3 LYS 13 HE1 LYS 13 12.466 6.686 7.243 89 HZ1 LYS 13 HZ1 LYS 13 14.105 8.241 7.805 90 HZ2 LYS 13 HZ2 LYS 13 13.589 9.358 6.640 91 HZ3 LYS 13 HZ3 LYS 13 14.367 7.933 6.157 92 H LEU 14 HN LEU 14 8.275 4.004 3.542 93 HA LEU 14 HA LEU 14 7.264 4.593 0.828 94 HB2 LEU 14 HB2 LEU 14 6.845 2.127 2.510 95 HB3 LEU 14 HB1 LEU 14 6.085 2.424 0.963 96 HG LEU 14 HG LEU 14 9.069 2.168 1.368 97 HD11 LEU 14 HD11 LEU 14 7.070 0.191 0.301 98 HD12 LEU 14 HD12 LEU 14 7.886 0.086 1.860 99 HD13 LEU 14 HD13 LEU 14 8.818 -0.030 0.365 100 HD21 LEU 14 HD21 LEU 14 7.527 1.965 -1.203 101 HD22 LEU 14 HD22 LEU 14 9.261 2.202 -0.967 102 HD23 LEU 14 HD23 LEU 14 8.134 3.511 -0.604 103 H GLU 15 HN GLU 15 4.982 4.857 0.625 104 HA GLU 15 HA GLU 15 3.801 5.829 3.142 105 HB2 GLU 15 HB2 GLU 15 4.575 7.604 1.595 106 HB3 GLU 15 HB1 GLU 15 3.501 6.972 0.358 107 HG2 GLU 15 HG2 GLU 15 1.581 7.628 1.557 108 HG3 GLU 15 HG1 GLU 15 2.514 7.961 3.015 109 H LEU 16 HN LEU 16 1.969 4.914 3.728 110 HA LEU 16 HA LEU 16 0.372 3.404 1.783 111 HB2 LEU 16 HB2 LEU 16 0.192 3.607 4.784 112 HB3 LEU 16 HB1 LEU 16 -1.038 2.834 3.817 113 HG LEU 16 HG LEU 16 0.274 1.114 4.721 114 HD11 LEU 16 HD11 LEU 16 1.703 1.087 2.196 115 HD12 LEU 16 HD12 LEU 16 -0.026 1.396 2.036 116 HD13 LEU 16 HD13 LEU 16 0.540 -0.062 2.856 117 HD21 LEU 16 HD21 LEU 16 2.734 2.396 3.640 118 HD22 LEU 16 HD22 LEU 16 2.628 1.017 4.725 119 HD23 LEU 16 HD23 LEU 16 2.184 2.629 5.293 120 H GLY 17 HN GLY 17 -1.672 3.982 1.258 121 HA2 GLY 17 HA2 GLY 17 -2.941 6.203 2.627 122 HA3 GLY 17 HA1 GLY 17 -2.470 6.502 0.955 123 H HIS 18 HN HIS 18 -5.046 6.733 1.634 124 HA HIS 18 HA HIS 18 -6.178 5.191 -0.410 125 HB2 HIS 18 HB2 HIS 18 -7.165 3.408 0.579 126 HB3 HIS 18 HB1 HIS 18 -6.035 3.674 1.900 127 HD1 HIS 18 HD1 HIS 18 -7.071 5.394 3.821 128 HD2 HIS 18 HD2 HIS 18 -9.747 3.345 1.383 129 HE1 HIS 18 HE1 HIS 18 -9.288 5.481 5.017 130 HE2 HIS 18 HE2 HIS 18 -10.871 4.191 3.554 131 H ARG 19 HN ARG 19 -8.225 5.902 -0.952 132 HA ARG 19 HA ARG 19 -9.313 8.081 0.711 133 HB2 ARG 19 HB2 ARG 19 -9.977 7.972 -2.180 134 HB3 ARG 19 HB1 ARG 19 -9.806 9.357 -1.137 135 HG2 ARG 19 HG2 ARG 19 -7.300 8.944 -1.244 136 HG3 ARG 19 HG1 ARG 19 -7.654 7.793 -2.511 137 HD2 ARG 19 HD2 ARG 19 -7.099 9.898 -3.496 138 HD3 ARG 19 HD1 ARG 19 -8.797 9.544 -3.728 139 HE ARG 19 HE ARG 19 -8.242 11.211 -1.455 140 HH11 ARG 19 HH11 ARG 19 -8.962 11.108 -4.880 141 HH12 ARG 19 HH12 ARG 19 -9.539 12.749 -4.941 142 HH21 ARG 19 HH21 ARG 19 -9.021 13.371 -1.527 143 HH22 ARG 19 HH22 ARG 19 -9.592 14.028 -3.032 144 H ALA 20 HN ALA 20 -11.642 8.180 0.736 145 HA ALA 20 HA ALA 20 -13.037 5.945 -0.531 146 HB1 ALA 20 HB1 ALA 20 -12.928 4.909 1.491 147 HB2 ALA 20 HB2 ALA 20 -14.403 5.856 1.713 148 HB3 ALA 20 HB3 ALA 20 -12.878 6.427 2.391 149 H GLN 21 HN GLN 21 -14.982 6.421 -1.268 150 HA GLN 21 HA GLN 21 -16.405 8.781 -0.346 151 HB2 GLN 21 HB2 GLN 21 -16.644 9.777 -2.496 152 HB3 GLN 21 HB1 GLN 21 -14.937 9.464 -2.276 153 HG2 GLN 21 HG2 GLN 21 -15.095 8.756 -4.372 154 HG3 GLN 21 HG1 GLN 21 -15.573 7.254 -3.614 155 HE21 GLN 21 HE21 GLN 21 -17.671 6.527 -3.831 156 HE22 GLN 21 HE22 GLN 21 -18.815 7.271 -4.893 157 H VAL 22 HN VAL 22 -18.650 8.646 -0.714 158 HA VAL 22 HA VAL 22 -19.494 5.909 -1.378 159 HB VAL 22 HB VAL 22 -20.075 6.845 0.901 160 HG11 VAL 22 HG11 VAL 22 -21.960 8.349 1.074 161 HG12 VAL 22 HG12 VAL 22 -22.012 8.520 -0.680 162 HG13 VAL 22 HG13 VAL 22 -20.621 9.120 0.225 163 HG21 VAL 22 HG21 VAL 22 -21.280 4.946 0.264 164 HG22 VAL 22 HG22 VAL 22 -22.176 5.821 -0.975 165 HG23 VAL 22 HG23 VAL 22 -22.517 6.111 0.731 166 H ARG 23 HN ARG 23 -20.950 5.514 -2.939 167 HA ARG 23 HA ARG 23 -21.974 7.801 -4.469 168 HB2 ARG 23 HB2 ARG 23 -22.875 5.704 -5.880 169 HB3 ARG 23 HB1 ARG 23 -21.259 6.363 -6.095 170 HG2 ARG 23 HG2 ARG 23 -20.240 4.584 -5.156 171 HG3 ARG 23 HG1 ARG 23 -21.569 4.266 -4.047 172 HD2 ARG 23 HD2 ARG 23 -21.322 2.494 -5.729 173 HD3 ARG 23 HD1 ARG 23 -22.877 3.311 -5.860 174 HE ARG 23 HE ARG 23 -22.073 4.430 -7.818 175 HH11 ARG 23 HH11 ARG 23 -19.913 1.969 -6.589 176 HH12 ARG 23 HH12 ARG 23 -19.162 1.664 -8.124 177 HH21 ARG 23 HH21 ARG 23 -21.087 4.038 -9.859 178 HH22 ARG 23 HH22 ARG 23 -19.850 2.819 -9.993 179 H LYS 24 HN LYS 24 -24.114 8.294 -4.481 180 HA LYS 24 HA LYS 24 -25.538 7.437 -2.173 181 HB2 LYS 24 HB2 LYS 24 -25.563 9.672 -3.683 182 HB3 LYS 24 HB1 LYS 24 -27.056 8.908 -4.211 183 HG2 LYS 24 HG2 LYS 24 -27.594 10.359 -2.410 184 HG3 LYS 24 HG1 LYS 24 -27.686 8.707 -1.792 185 HD2 LYS 24 HD2 LYS 24 -25.372 8.971 -0.913 186 HD3 LYS 24 HD1 LYS 24 -25.420 10.662 -1.415 187 HE2 LYS 24 HE2 LYS 24 -25.962 10.663 0.877 188 HE3 LYS 24 HE1 LYS 24 -27.490 10.888 0.028 189 HZ1 LYS 24 HZ1 LYS 24 -28.045 8.601 0.384 190 HZ2 LYS 24 HZ2 LYS 24 -27.589 9.265 1.878 191 HZ3 LYS 24 HZ3 LYS 24 -26.512 8.265 1.029 192 H LYS 25 HN LYS 25 -25.224 6.121 -5.207 193 HA LYS 25 HA LYS 25 -27.533 4.382 -4.699 194 HB2 LYS 25 HB2 LYS 25 -28.058 5.870 -6.593 195 HB3 LYS 25 HB1 LYS 25 -26.620 5.325 -7.432 196 HG2 LYS 25 HG2 LYS 25 -28.404 4.145 -8.371 197 HG3 LYS 25 HG1 LYS 25 -27.610 3.028 -7.273 198 HD2 LYS 25 HD2 LYS 25 -29.301 3.513 -5.560 199 HD3 LYS 25 HD1 LYS 25 -30.132 4.560 -6.718 200 HE2 LYS 25 HE2 LYS 25 -30.573 2.730 -8.175 201 HE3 LYS 25 HE1 LYS 25 -29.521 1.664 -7.244 202 HZ1 LYS 25 HZ1 LYS 25 -32.040 2.867 -6.217 203 HZ2 LYS 25 HZ2 LYS 25 -31.062 1.734 -5.420 204 HZ3 LYS 25 HZ3 LYS 25 -31.900 1.290 -6.826 205 HA PRO 26 HA PRO 26 -24.063 1.474 -4.695 206 HB2 PRO 26 HB2 PRO 26 -26.250 -0.464 -4.326 207 HB3 PRO 26 HB1 PRO 26 -24.829 -0.169 -3.324 208 HG2 PRO 26 HG2 PRO 26 -27.291 0.569 -2.551 209 HG3 PRO 26 HG1 PRO 26 -25.848 1.516 -2.139 210 HD2 PRO 26 HD2 PRO 26 -27.928 2.031 -4.229 211 HD3 PRO 26 HD1 PRO 26 -27.065 3.174 -3.179 212 H THR 27 HN THR 27 -23.432 -0.302 -5.988 213 HA THR 27 HA THR 27 -24.512 -0.241 -8.650 214 HB THR 27 HB THR 27 -22.102 -0.491 -8.354 215 HG1 THR 27 HG1 THR 27 -22.084 -2.819 -9.441 216 HG21 THR 27 HG21 THR 27 -21.862 -1.646 -6.305 217 HG22 THR 27 HG22 THR 27 -21.234 -2.734 -7.545 218 HG23 THR 27 HG23 THR 27 -22.843 -2.999 -6.876 219 H VAL 28 HN VAL 28 -24.694 -2.590 -9.696 220 HA VAL 28 HA VAL 28 -27.069 -3.731 -8.974 221 HB VAL 28 HB VAL 28 -26.204 -4.242 -11.083 222 HG11 VAL 28 HG11 VAL 28 -23.810 -3.985 -10.477 223 HG12 VAL 28 HG12 VAL 28 -24.125 -5.381 -11.515 224 HG13 VAL 28 HG13 VAL 28 -23.849 -5.612 -9.789 225 HG21 VAL 28 HG21 VAL 28 -26.121 -6.724 -9.381 226 HG22 VAL 28 HG22 VAL 28 -26.185 -6.729 -11.145 227 HG23 VAL 28 HG23 VAL 28 -27.522 -6.052 -10.215 228 H GLU 29 HN GLU 29 -23.853 -4.646 -7.839 229 HA GLU 29 HA GLU 29 -24.901 -6.881 -6.332 230 HB2 GLU 29 HB2 GLU 29 -22.102 -5.768 -6.475 231 HB3 GLU 29 HB1 GLU 29 -22.564 -7.322 -5.787 232 HG2 GLU 29 HG2 GLU 29 -23.370 -8.031 -8.023 233 HG3 GLU 29 HG1 GLU 29 -22.826 -6.485 -8.671 234 H GLY 30 HN GLY 30 -24.877 -3.662 -5.791 235 HA2 GLY 30 HA2 GLY 30 -25.707 -2.616 -3.907 236 HA3 GLY 30 HA1 GLY 30 -25.538 -4.126 -3.022 237 H PHE 31 HN PHE 31 -22.933 -2.575 -4.761 238 HA PHE 31 HA PHE 31 -21.497 -2.241 -2.254 239 HB2 PHE 31 HB2 PHE 31 -20.503 -1.747 -5.074 240 HB3 PHE 31 HB1 PHE 31 -19.528 -1.874 -3.613 241 HD1 PHE 31 HD1 PHE 31 -21.177 -4.317 -2.536 242 HD2 PHE 31 HD2 PHE 31 -19.280 -3.462 -6.233 243 HE1 PHE 31 HE1 PHE 31 -20.893 -6.721 -2.937 244 HE2 PHE 31 HE2 PHE 31 -18.999 -5.857 -6.651 245 HZ PHE 31 HZ PHE 31 -19.804 -7.496 -5.004 246 H THR 32 HN THR 32 -21.366 -0.349 -1.264 247 HA THR 32 HA THR 32 -22.693 1.936 -2.516 248 HB THR 32 HB THR 32 -22.964 2.766 -0.215 249 HG1 THR 32 HG1 THR 32 -22.492 0.942 1.402 250 HG21 THR 32 HG21 THR 32 -23.887 0.005 -0.761 251 HG22 THR 32 HG22 THR 32 -24.756 1.496 -1.076 252 HG23 THR 32 HG23 THR 32 -24.478 0.959 0.585 253 H HIS 33 HN HIS 33 -19.659 0.983 -1.078 254 HA HIS 33 HA HIS 33 -18.745 3.787 -1.035 255 HB2 HIS 33 HB2 HIS 33 -18.194 1.421 0.720 256 HB3 HIS 33 HB1 HIS 33 -16.986 2.697 0.607 257 HD1 HIS 33 HD1 HIS 33 -20.469 2.014 1.875 258 HD2 HIS 33 HD2 HIS 33 -17.624 5.052 1.911 259 HE1 HIS 33 HE1 HIS 33 -21.271 3.684 3.580 260 HE2 HIS 33 HE2 HIS 33 -19.422 5.379 3.737 261 H ASP 34 HN ASP 34 -17.261 4.330 -2.472 262 HA ASP 34 HA ASP 34 -15.613 2.233 -3.726 263 HB2 ASP 34 HB2 ASP 34 -16.308 5.047 -4.601 264 HB3 ASP 34 HB1 ASP 34 -15.083 4.068 -5.396 265 H TRP 35 HN TRP 35 -13.483 2.179 -3.364 266 HA TRP 35 HA TRP 35 -12.254 4.537 -2.157 267 HB2 TRP 35 HB2 TRP 35 -11.021 3.089 -0.545 268 HB3 TRP 35 HB1 TRP 35 -12.746 3.202 -0.245 269 HD1 TRP 35 HD1 TRP 35 -14.083 0.947 -0.129 270 HE1 TRP 35 HE1 TRP 35 -13.409 -1.540 -0.365 271 HE3 TRP 35 HE3 TRP 35 -9.320 1.534 -1.928 272 HZ2 TRP 35 HZ2 TRP 35 -11.155 -3.042 -1.191 273 HZ3 TRP 35 HZ3 TRP 35 -7.977 -0.475 -2.405 274 HH2 TRP 35 HH2 TRP 35 -8.858 -2.705 -2.014 275 H MET 36 HN MET 36 -9.987 4.605 -2.265 276 HA MET 36 HA MET 36 -8.724 2.772 -4.184 277 HB2 MET 36 HB2 MET 36 -9.067 4.726 -5.498 278 HB3 MET 36 HB1 MET 36 -8.614 5.788 -4.169 279 HG2 MET 36 HG2 MET 36 -6.316 4.857 -4.291 280 HG3 MET 36 HG1 MET 36 -6.799 3.984 -5.744 281 HE1 MET 36 HE1 MET 36 -6.564 7.126 -3.887 282 HE2 MET 36 HE2 MET 36 -7.828 7.894 -4.869 283 HE3 MET 36 HE3 MET 36 -6.145 8.384 -5.065 284 H VAL 37 HN VAL 37 -6.704 2.110 -3.587 285 HA VAL 37 HA VAL 37 -5.676 3.211 -1.066 286 HB VAL 37 HB VAL 37 -4.165 1.025 -1.378 287 HG11 VAL 37 HG11 VAL 37 -6.916 1.176 -0.258 288 HG12 VAL 37 HG12 VAL 37 -5.425 1.554 0.586 289 HG13 VAL 37 HG13 VAL 37 -5.777 -0.108 0.104 290 HG21 VAL 37 HG21 VAL 37 -5.133 0.267 -3.418 291 HG22 VAL 37 HG22 VAL 37 -6.764 0.440 -2.770 292 HG23 VAL 37 HG23 VAL 37 -5.688 -0.804 -2.132 293 H PHE 38 HN PHE 38 -3.461 3.449 -0.763 294 HA PHE 38 HA PHE 38 -1.956 4.227 -3.181 295 HB2 PHE 38 HB2 PHE 38 -2.677 5.698 -0.723 296 HB3 PHE 38 HB1 PHE 38 -0.996 5.840 -1.197 297 HD1 PHE 38 HD1 PHE 38 -0.401 6.871 -3.291 298 HD2 PHE 38 HD2 PHE 38 -4.415 6.827 -1.913 299 HE1 PHE 38 HE1 PHE 38 -0.926 8.719 -4.822 300 HE2 PHE 38 HE2 PHE 38 -4.970 8.659 -3.454 301 HZ PHE 38 HZ PHE 38 -3.239 9.618 -4.914 302 H VAL 39 HN VAL 39 -0.129 2.989 -3.336 303 HA VAL 39 HA VAL 39 1.580 3.147 -0.958 304 HB VAL 39 HB VAL 39 2.741 1.042 -1.828 305 HG11 VAL 39 HG11 VAL 39 1.015 1.390 0.120 306 HG12 VAL 39 HG12 VAL 39 1.563 -0.223 -0.337 307 HG13 VAL 39 HG13 VAL 39 0.002 0.371 -0.904 308 HG21 VAL 39 HG21 VAL 39 1.918 0.536 -3.901 309 HG22 VAL 39 HG22 VAL 39 0.280 1.041 -3.486 310 HG23 VAL 39 HG23 VAL 39 0.909 -0.494 -2.887 311 H ARG 40 HN ARG 40 3.340 4.289 -1.322 312 HA ARG 40 HA ARG 40 4.812 4.316 -3.778 313 HB2 ARG 40 HB2 ARG 40 4.443 6.669 -4.360 314 HB3 ARG 40 HB1 ARG 40 2.922 5.782 -4.455 315 HG2 ARG 40 HG2 ARG 40 2.061 6.776 -2.551 316 HG3 ARG 40 HG1 ARG 40 3.651 7.209 -1.932 317 HD2 ARG 40 HD2 ARG 40 3.855 8.909 -3.724 318 HD3 ARG 40 HD1 ARG 40 2.211 8.505 -4.258 319 HE ARG 40 HE ARG 40 2.597 9.320 -1.466 320 HH11 ARG 40 HH11 ARG 40 1.469 10.152 -4.692 321 HH12 ARG 40 HH12 ARG 40 0.442 11.434 -4.118 322 HH21 ARG 40 HH21 ARG 40 1.293 11.009 -0.744 323 HH22 ARG 40 HH22 ARG 40 0.356 11.932 -1.884 324 H GLY 41 HN GLY 41 6.308 6.461 -3.615 325 HA2 GLY 41 HA2 GLY 41 7.258 6.573 -0.840 326 HA3 GLY 41 HA1 GLY 41 8.170 7.068 -2.259 327 HA PRO 42 HA PRO 42 5.800 10.655 -0.025 328 HB2 PRO 42 HB2 PRO 42 8.558 11.397 0.768 329 HB3 PRO 42 HB1 PRO 42 7.062 11.472 1.704 330 HG2 PRO 42 HG2 PRO 42 8.891 9.592 2.190 331 HG3 PRO 42 HG1 PRO 42 7.161 9.245 2.278 332 HD2 PRO 42 HD2 PRO 42 9.113 8.554 0.135 333 HD3 PRO 42 HD1 PRO 42 7.762 7.603 0.780 334 H GLU 43 HN GLU 43 6.303 12.972 -0.331 335 HA GLU 43 HA GLU 43 6.526 13.736 -2.924 336 HB2 GLU 43 HB2 GLU 43 7.436 15.301 -0.501 337 HB3 GLU 43 HB1 GLU 43 7.128 15.992 -2.086 338 HG2 GLU 43 HG2 GLU 43 5.201 16.466 -0.881 339 HG3 GLU 43 HG1 GLU 43 4.760 15.048 -1.827 340 H HIS 44 HN HIS 44 8.049 13.540 -4.352 341 HA HIS 44 HA HIS 44 9.970 13.979 -5.464 342 HB2 HIS 44 HB2 HIS 44 11.294 15.655 -4.700 343 HB3 HIS 44 HB1 HIS 44 10.244 15.692 -3.287 344 HD1 HIS 44 HD1 HIS 44 13.649 14.633 -4.415 345 HD2 HIS 44 HD2 HIS 44 11.383 14.697 -0.934 346 HE1 HIS 44 HE1 HIS 44 15.258 14.120 -2.556 347 HE2 HIS 44 HE2 HIS 44 13.811 13.901 -0.510 348 H SER 45 HN SER 45 9.974 11.980 -2.634 349 HA SER 45 HA SER 45 12.391 10.571 -3.379 350 HB2 SER 45 HB2 SER 45 11.393 8.909 -1.616 351 HB3 SER 45 HB1 SER 45 12.010 10.465 -1.071 352 HG SER 45 HG SER 45 9.307 10.149 -1.792 353 H ASN 46 HN ASN 46 12.434 9.300 -5.119 354 HA ASN 46 HA ASN 46 9.953 8.025 -6.003 355 HB2 ASN 46 HB2 ASN 46 12.623 8.496 -7.310 356 HB3 ASN 46 HB1 ASN 46 11.499 7.313 -7.970 357 HD21 ASN 46 HD21 ASN 46 12.482 9.806 -9.124 358 HD22 ASN 46 HD22 ASN 46 11.077 10.758 -9.470 359 H ILE 47 HN ILE 47 9.532 5.960 -5.640 360 HA ILE 47 HA ILE 47 11.526 4.450 -4.170 361 HB ILE 47 HB ILE 47 9.820 2.916 -3.582 362 HG12 ILE 47 HG12 ILE 47 7.916 4.475 -5.316 363 HG13 ILE 47 HG11 ILE 47 8.718 2.984 -5.824 364 HG21 ILE 47 HG21 ILE 47 9.953 4.912 -2.284 365 HG22 ILE 47 HG22 ILE 47 8.265 4.429 -2.432 366 HG23 ILE 47 HG23 ILE 47 8.892 5.763 -3.402 367 HD11 ILE 47 HD11 ILE 47 7.214 3.016 -3.271 368 HD12 ILE 47 HD12 ILE 47 7.499 1.684 -4.390 369 HD13 ILE 47 HD13 ILE 47 6.317 2.935 -4.784 370 H GLN 48 HN GLN 48 10.253 4.576 -7.348 371 HA GLN 48 HA GLN 48 10.404 1.901 -8.151 372 HB2 GLN 48 HB2 GLN 48 9.401 3.771 -9.465 373 HB3 GLN 48 HB1 GLN 48 11.015 4.382 -9.786 374 HG2 GLN 48 HG2 GLN 48 10.456 3.258 -11.724 375 HG3 GLN 48 HG1 GLN 48 11.455 2.113 -10.868 376 HE21 GLN 48 HE21 GLN 48 8.065 2.853 -10.206 377 HE22 GLN 48 HE22 GLN 48 7.472 1.284 -10.619 378 H HIS 49 HN HIS 49 12.824 3.886 -7.065 379 HA HIS 49 HA HIS 49 15.029 2.776 -8.548 380 HB2 HIS 49 HB2 HIS 49 14.716 4.702 -6.290 381 HB3 HIS 49 HB1 HIS 49 16.278 3.889 -6.465 382 HD1 HIS 49 HD1 HIS 49 16.640 3.924 -9.481 383 HD2 HIS 49 HD2 HIS 49 15.202 7.161 -7.299 384 HE1 HIS 49 HE1 HIS 49 17.048 5.950 -10.914 385 HE2 HIS 49 HE2 HIS 49 16.265 7.906 -9.541 386 H PHE 50 HN PHE 50 13.529 2.258 -5.367 387 HA PHE 50 HA PHE 50 15.312 -0.052 -5.040 388 HB2 PHE 50 HB2 PHE 50 15.057 0.174 -2.598 389 HB3 PHE 50 HB1 PHE 50 15.788 1.596 -3.336 390 HD1 PHE 50 HD1 PHE 50 12.637 0.306 -1.848 391 HD2 PHE 50 HD2 PHE 50 14.884 3.702 -3.066 392 HE1 PHE 50 HE1 PHE 50 11.043 1.770 -0.706 393 HE2 PHE 50 HE2 PHE 50 13.268 5.172 -1.946 394 HZ PHE 50 HZ PHE 50 11.341 4.206 -0.761 395 H VAL 51 HN VAL 51 12.306 0.692 -5.919 396 HA VAL 51 HA VAL 51 11.141 -1.743 -4.746 397 HB VAL 51 HB VAL 51 9.818 0.920 -5.339 398 HG11 VAL 51 HG11 VAL 51 7.838 -0.560 -4.225 399 HG12 VAL 51 HG12 VAL 51 8.641 -1.789 -5.216 400 HG13 VAL 51 HG13 VAL 51 8.026 -0.316 -5.967 401 HG21 VAL 51 HG21 VAL 51 9.085 0.537 -2.921 402 HG22 VAL 51 HG22 VAL 51 10.773 0.947 -3.202 403 HG23 VAL 51 HG23 VAL 51 10.314 -0.723 -2.872 404 H GLU 52 HN GLU 52 10.107 -3.117 -6.089 405 HA GLU 52 HA GLU 52 10.774 -2.756 -8.931 406 HB2 GLU 52 HB2 GLU 52 11.736 -4.677 -7.678 407 HB3 GLU 52 HB1 GLU 52 10.111 -5.265 -7.370 408 HG2 GLU 52 HG2 GLU 52 11.103 -6.521 -9.147 409 HG3 GLU 52 HG1 GLU 52 9.781 -5.550 -9.795 410 H LYS 53 HN LYS 53 8.228 -4.262 -6.975 411 HA LYS 53 HA LYS 53 6.174 -3.303 -8.800 412 HB2 LYS 53 HB2 LYS 53 5.157 -5.575 -8.911 413 HB3 LYS 53 HB1 LYS 53 6.728 -5.478 -9.696 414 HG2 LYS 53 HG2 LYS 53 7.785 -6.627 -7.950 415 HG3 LYS 53 HG1 LYS 53 6.405 -6.463 -6.880 416 HD2 LYS 53 HD2 LYS 53 6.270 -7.985 -9.451 417 HD3 LYS 53 HD1 LYS 53 6.828 -8.734 -7.955 418 HE2 LYS 53 HE2 LYS 53 4.159 -7.714 -8.693 419 HE3 LYS 53 HE1 LYS 53 4.607 -9.208 -7.883 420 HZ1 LYS 53 HZ1 LYS 53 5.230 -7.763 -5.952 421 HZ2 LYS 53 HZ2 LYS 53 3.582 -7.939 -6.264 422 HZ3 LYS 53 HZ3 LYS 53 4.382 -6.516 -6.718 423 H VAL 54 HN VAL 54 3.938 -4.152 -7.820 424 HA VAL 54 HA VAL 54 4.066 -4.152 -4.898 425 HB VAL 54 HB VAL 54 3.013 -1.950 -6.582 426 HG11 VAL 54 HG11 VAL 54 1.901 -1.891 -3.906 427 HG12 VAL 54 HG12 VAL 54 1.227 -3.194 -4.881 428 HG13 VAL 54 HG13 VAL 54 1.132 -1.527 -5.449 429 HG21 VAL 54 HG21 VAL 54 3.705 -0.874 -4.287 430 HG22 VAL 54 HG22 VAL 54 4.896 -1.298 -5.503 431 HG23 VAL 54 HG23 VAL 54 4.612 -2.368 -4.128 432 H VAL 55 HN VAL 55 2.063 -4.798 -3.897 433 HA VAL 55 HA VAL 55 0.053 -5.918 -5.679 434 HB VAL 55 HB VAL 55 2.089 -7.546 -4.588 435 HG11 VAL 55 HG11 VAL 55 -0.596 -8.073 -3.328 436 HG12 VAL 55 HG12 VAL 55 0.917 -7.699 -2.496 437 HG13 VAL 55 HG13 VAL 55 0.742 -9.223 -3.366 438 HG21 VAL 55 HG21 VAL 55 -0.515 -8.316 -5.886 439 HG22 VAL 55 HG22 VAL 55 0.953 -9.289 -5.807 440 HG23 VAL 55 HG23 VAL 55 0.937 -7.790 -6.736 441 H PHE 56 HN PHE 56 -1.920 -6.211 -4.735 442 HA PHE 56 HA PHE 56 -2.206 -5.365 -1.931 443 HB2 PHE 56 HB2 PHE 56 -3.826 -4.581 -4.355 444 HB3 PHE 56 HB1 PHE 56 -4.534 -4.546 -2.741 445 HD1 PHE 56 HD1 PHE 56 -1.727 -3.215 -4.773 446 HD2 PHE 56 HD2 PHE 56 -4.227 -2.712 -1.361 447 HE1 PHE 56 HE1 PHE 56 -0.802 -0.966 -4.439 448 HE2 PHE 56 HE2 PHE 56 -3.302 -0.454 -1.025 449 HZ PHE 56 HZ PHE 56 -1.581 0.417 -2.562 450 H HIS 57 HN HIS 57 -3.251 -6.839 -0.699 451 HA HIS 57 HA HIS 57 -4.758 -8.956 -2.110 452 HB2 HIS 57 HB2 HIS 57 -3.634 -8.943 0.716 453 HB3 HIS 57 HB1 HIS 57 -4.527 -10.269 -0.022 454 HD1 HIS 57 HD1 HIS 57 -3.203 -11.954 -1.299 455 HD2 HIS 57 HD2 HIS 57 -1.027 -8.482 -0.542 456 HE1 HIS 57 HE1 HIS 57 -0.822 -12.482 -1.932 457 HE2 HIS 57 HE2 HIS 57 0.505 -10.445 -1.239 458 H LEU 58 HN LEU 58 -6.609 -7.625 -2.349 459 HA LEU 58 HA LEU 58 -7.845 -6.321 -0.150 460 HB2 LEU 58 HB2 LEU 58 -9.440 -7.273 -2.498 461 HB3 LEU 58 HB1 LEU 58 -9.621 -5.795 -1.571 462 HG LEU 58 HG LEU 58 -7.569 -6.397 -3.681 463 HD11 LEU 58 HD11 LEU 58 -8.673 -4.956 -4.982 464 HD12 LEU 58 HD12 LEU 58 -9.366 -4.051 -3.646 465 HD13 LEU 58 HD13 LEU 58 -10.023 -5.631 -4.084 466 HD21 LEU 58 HD21 LEU 58 -7.683 -4.108 -1.728 467 HD22 LEU 58 HD22 LEU 58 -6.830 -4.021 -3.268 468 HD23 LEU 58 HD23 LEU 58 -6.339 -5.201 -2.053 469 H HIS 59 HN HIS 59 -10.406 -7.013 0.103 470 HA HIS 59 HA HIS 59 -10.231 -9.464 1.609 471 HB2 HIS 59 HB2 HIS 59 -11.611 -7.378 2.208 472 HB3 HIS 59 HB1 HIS 59 -12.759 -7.927 0.995 473 HD1 HIS 59 HD1 HIS 59 -14.596 -9.333 1.893 474 HD2 HIS 59 HD2 HIS 59 -11.186 -9.512 4.280 475 HE1 HIS 59 HE1 HIS 59 -15.234 -10.715 3.896 476 HE2 HIS 59 HE2 HIS 59 -13.124 -10.931 5.255 477 H GLU 60 HN GLU 60 -11.271 -11.368 1.205 478 HA GLU 60 HA GLU 60 -11.136 -12.345 -1.375 479 HB2 GLU 60 HB2 GLU 60 -12.716 -13.443 0.947 480 HB3 GLU 60 HB1 GLU 60 -12.317 -14.338 -0.512 481 HG2 GLU 60 HG2 GLU 60 -9.944 -14.124 0.001 482 HG3 GLU 60 HG1 GLU 60 -10.341 -13.214 1.458 483 H SER 61 HN SER 61 -13.837 -10.841 0.202 484 HA SER 61 HA SER 61 -15.898 -11.671 -1.504 485 HB2 SER 61 HB2 SER 61 -16.987 -9.505 -0.731 486 HB3 SER 61 HB1 SER 61 -16.475 -10.609 0.546 487 HG SER 61 HG SER 61 -15.328 -8.170 -0.273 488 H PHE 62 HN PHE 62 -13.313 -9.442 -1.918 489 HA PHE 62 HA PHE 62 -14.475 -8.108 -4.216 490 HB2 PHE 62 HB2 PHE 62 -11.679 -8.026 -3.042 491 HB3 PHE 62 HB1 PHE 62 -12.247 -7.015 -4.361 492 HD1 PHE 62 HD1 PHE 62 -13.088 -7.867 -0.832 493 HD2 PHE 62 HD2 PHE 62 -13.023 -4.912 -3.875 494 HE1 PHE 62 HE1 PHE 62 -13.842 -6.176 0.793 495 HE2 PHE 62 HE2 PHE 62 -13.778 -3.216 -2.270 496 HZ PHE 62 HZ PHE 62 -14.187 -3.848 0.075 497 HA PRO 63 HA PRO 63 -13.294 -11.520 -6.871 498 HB2 PRO 63 HB2 PRO 63 -13.659 -9.460 -8.973 499 HB3 PRO 63 HB1 PRO 63 -14.387 -11.064 -8.829 500 HG2 PRO 63 HG2 PRO 63 -15.813 -8.861 -8.344 501 HG3 PRO 63 HG1 PRO 63 -16.035 -10.327 -7.372 502 HD2 PRO 63 HD2 PRO 63 -14.573 -7.806 -6.697 503 HD3 PRO 63 HD1 PRO 63 -15.582 -8.838 -5.661 504 H ARG 64 HN ARG 64 -11.307 -12.124 -7.313 505 HA ARG 64 HA ARG 64 -9.051 -12.072 -7.644 506 HB2 ARG 64 HB2 ARG 64 -9.577 -9.732 -9.474 507 HB3 ARG 64 HB1 ARG 64 -8.314 -10.949 -9.605 508 HG2 ARG 64 HG2 ARG 64 -10.035 -12.646 -10.085 509 HG3 ARG 64 HG1 ARG 64 -11.264 -11.389 -10.010 510 HD2 ARG 64 HD2 ARG 64 -10.604 -11.918 -12.306 511 HD3 ARG 64 HD1 ARG 64 -10.259 -10.243 -11.881 512 HE ARG 64 HE ARG 64 -8.047 -12.074 -11.523 513 HH11 ARG 64 HH11 ARG 64 -9.656 -9.812 -13.655 514 HH12 ARG 64 HH12 ARG 64 -8.275 -9.602 -14.691 515 HH21 ARG 64 HH21 ARG 64 -6.229 -11.815 -12.879 516 HH22 ARG 64 HH22 ARG 64 -6.328 -10.759 -14.261 517 HA PRO 65 HA PRO 65 -9.023 -8.394 -4.802 518 HB2 PRO 65 HB2 PRO 65 -7.905 -9.591 -2.634 519 HB3 PRO 65 HB1 PRO 65 -9.635 -9.627 -2.983 520 HG2 PRO 65 HG2 PRO 65 -7.561 -11.717 -3.444 521 HG3 PRO 65 HG1 PRO 65 -9.243 -11.894 -2.905 522 HD2 PRO 65 HD2 PRO 65 -8.409 -12.370 -5.466 523 HD3 PRO 65 HD1 PRO 65 -10.052 -11.862 -5.042 524 H LYS 66 HN LYS 66 -6.452 -10.527 -5.698 525 HA LYS 66 HA LYS 66 -4.403 -8.803 -4.686 526 HB2 LYS 66 HB2 LYS 66 -3.997 -11.195 -4.677 527 HB3 LYS 66 HB1 LYS 66 -4.218 -11.267 -6.420 528 HG2 LYS 66 HG2 LYS 66 -2.224 -10.011 -6.809 529 HG3 LYS 66 HG1 LYS 66 -2.059 -9.646 -5.093 530 HD2 LYS 66 HD2 LYS 66 -1.380 -11.778 -4.563 531 HD3 LYS 66 HD1 LYS 66 -2.101 -12.492 -6.007 532 HE2 LYS 66 HE2 LYS 66 -0.376 -11.420 -7.376 533 HE3 LYS 66 HE1 LYS 66 0.329 -10.703 -5.930 534 HZ1 LYS 66 HZ1 LYS 66 0.092 -13.619 -6.455 535 HZ2 LYS 66 HZ2 LYS 66 0.824 -12.908 -5.102 536 HZ3 LYS 66 HZ3 LYS 66 1.508 -12.705 -6.639 537 H ARG 67 HN ARG 67 -4.259 -6.919 -5.671 538 HA ARG 67 HA ARG 67 -4.204 -6.853 -8.611 539 HB2 ARG 67 HB2 ARG 67 -4.373 -4.456 -6.775 540 HB3 ARG 67 HB1 ARG 67 -4.788 -4.553 -8.482 541 HG2 ARG 67 HG2 ARG 67 -6.293 -5.811 -6.199 542 HG3 ARG 67 HG1 ARG 67 -6.796 -4.418 -7.157 543 HD2 ARG 67 HD2 ARG 67 -6.796 -5.895 -9.168 544 HD3 ARG 67 HD1 ARG 67 -6.465 -7.266 -8.096 545 HE ARG 67 HE ARG 67 -8.643 -7.265 -7.451 546 HH11 ARG 67 HH11 ARG 67 -8.007 -4.240 -9.124 547 HH12 ARG 67 HH12 ARG 67 -9.686 -3.771 -9.157 548 HH21 ARG 67 HH21 ARG 67 -10.824 -6.650 -7.505 549 HH22 ARG 67 HH22 ARG 67 -11.287 -5.131 -8.214 550 H VAL 68 HN VAL 68 -2.271 -6.575 -9.592 551 HA VAL 68 HA VAL 68 -0.026 -5.764 -7.872 552 HB VAL 68 HB VAL 68 1.389 -7.173 -8.951 553 HG11 VAL 68 HG11 VAL 68 -0.362 -8.590 -8.063 554 HG12 VAL 68 HG12 VAL 68 0.312 -9.290 -9.539 555 HG13 VAL 68 HG13 VAL 68 -1.251 -8.475 -9.584 556 HG21 VAL 68 HG21 VAL 68 1.429 -6.245 -11.108 557 HG22 VAL 68 HG22 VAL 68 -0.230 -6.750 -11.448 558 HG23 VAL 68 HG23 VAL 68 1.052 -7.957 -11.334 559 H CYS 69 HN CYS 69 1.319 -4.124 -8.425 560 HA CYS 69 HA CYS 69 0.875 -2.871 -11.053 561 HB2 CYS 69 HB2 CYS 69 -0.049 -1.232 -9.729 562 HB3 CYS 69 HB1 CYS 69 1.070 -1.445 -8.408 563 HG CYS 69 HG CYS 69 2.315 0.703 -9.115 564 H LYS 70 HN LYS 70 2.585 -2.735 -12.239 565 HA LYS 70 HA LYS 70 5.241 -2.976 -10.978 566 HB2 LYS 70 HB2 LYS 70 4.514 -3.406 -13.891 567 HB3 LYS 70 HB1 LYS 70 6.020 -3.843 -13.097 568 HG2 LYS 70 HG2 LYS 70 5.026 -5.657 -11.964 569 HG3 LYS 70 HG1 LYS 70 3.405 -5.054 -12.271 570 HD2 LYS 70 HD2 LYS 70 3.611 -5.550 -14.617 571 HD3 LYS 70 HD1 LYS 70 5.294 -6.037 -14.398 572 HE2 LYS 70 HE2 LYS 70 2.989 -7.363 -12.984 573 HE3 LYS 70 HE1 LYS 70 3.607 -7.913 -14.543 574 HZ1 LYS 70 HZ1 LYS 70 5.648 -8.502 -13.605 575 HZ2 LYS 70 HZ2 LYS 70 4.506 -9.038 -12.470 576 HZ3 LYS 70 HZ3 LYS 70 5.378 -7.613 -12.191 577 H ASP 71 HN ASP 71 3.222 -0.666 -11.658 578 HA ASP 71 HA ASP 71 5.023 0.959 -13.339 579 HB2 ASP 71 HB2 ASP 71 2.066 1.018 -12.820 580 HB3 ASP 71 HB1 ASP 71 2.883 2.466 -13.398 581 HA PRO 72 HA PRO 72 5.647 4.330 -10.226 582 HB2 PRO 72 HB2 PRO 72 3.785 5.731 -12.133 583 HB3 PRO 72 HB1 PRO 72 5.193 6.380 -11.281 584 HG2 PRO 72 HG2 PRO 72 5.468 5.666 -13.787 585 HG3 PRO 72 HG1 PRO 72 6.704 5.163 -12.610 586 HD2 PRO 72 HD2 PRO 72 4.547 3.557 -13.894 587 HD3 PRO 72 HD1 PRO 72 6.187 3.076 -13.412 588 HA PRO 73 HA PRO 73 2.719 5.447 -7.095 589 HB2 PRO 73 HB2 PRO 73 0.785 6.655 -9.035 590 HB3 PRO 73 HB1 PRO 73 1.122 7.124 -7.364 591 HG2 PRO 73 HG2 PRO 73 2.304 8.300 -9.549 592 HG3 PRO 73 HG1 PRO 73 3.036 8.253 -7.939 593 HD2 PRO 73 HD2 PRO 73 3.975 6.996 -10.317 594 HD3 PRO 73 HD1 PRO 73 4.659 6.866 -8.687 595 H TYR 74 HN TYR 74 2.007 3.621 -6.363 596 HA TYR 74 HA TYR 74 0.489 1.772 -8.016 597 HB2 TYR 74 HB2 TYR 74 1.540 1.385 -5.208 598 HB3 TYR 74 HB1 TYR 74 1.132 0.134 -6.369 599 HD1 TYR 74 HD2 TYR 74 3.525 2.890 -5.708 600 HD2 TYR 74 HD1 TYR 74 2.793 -0.716 -7.806 601 HE1 TYR 74 HE2 TYR 74 5.857 2.834 -6.422 602 HE2 TYR 74 HE1 TYR 74 5.142 -0.773 -8.542 603 HH TYR 74 HH TYR 74 7.024 0.633 -8.799 604 H LYS 75 HN LYS 75 -1.617 1.229 -7.656 605 HA LYS 75 HA LYS 75 -2.956 2.026 -5.193 606 HB2 LYS 75 HB2 LYS 75 -4.605 3.414 -6.299 607 HB3 LYS 75 HB1 LYS 75 -3.005 4.049 -6.638 608 HG2 LYS 75 HG2 LYS 75 -3.077 2.910 -8.839 609 HG3 LYS 75 HG1 LYS 75 -4.719 2.404 -8.482 610 HD2 LYS 75 HD2 LYS 75 -4.748 4.332 -9.897 611 HD3 LYS 75 HD1 LYS 75 -5.371 4.778 -8.319 612 HE2 LYS 75 HE2 LYS 75 -3.887 6.482 -9.241 613 HE3 LYS 75 HE1 LYS 75 -3.242 5.779 -7.769 614 HZ1 LYS 75 HZ1 LYS 75 -2.438 4.795 -10.437 615 HZ2 LYS 75 HZ2 LYS 75 -1.641 4.578 -8.957 616 HZ3 LYS 75 HZ3 LYS 75 -1.650 6.101 -9.698 617 H VAL 76 HN VAL 76 -5.090 1.320 -5.080 618 HA VAL 76 HA VAL 76 -6.063 -0.497 -7.174 619 HB VAL 76 HB VAL 76 -6.022 -1.069 -4.224 620 HG11 VAL 76 HG11 VAL 76 -8.335 -1.270 -5.163 621 HG12 VAL 76 HG12 VAL 76 -7.671 -2.767 -4.503 622 HG13 VAL 76 HG13 VAL 76 -7.718 -2.516 -6.250 623 HG21 VAL 76 HG21 VAL 76 -4.173 -1.959 -5.501 624 HG22 VAL 76 HG22 VAL 76 -5.284 -2.667 -6.668 625 HG23 VAL 76 HG23 VAL 76 -5.240 -3.271 -5.013 626 H GLU 77 HN GLU 77 -8.053 0.015 -7.831 627 HA GLU 77 HA GLU 77 -9.637 1.812 -6.114 628 HB2 GLU 77 HB2 GLU 77 -9.914 1.593 -9.103 629 HB3 GLU 77 HB1 GLU 77 -10.534 2.848 -8.054 630 HG2 GLU 77 HG2 GLU 77 -8.769 4.008 -8.767 631 HG3 GLU 77 HG1 GLU 77 -7.884 3.040 -7.591 632 H GLU 78 HN GLU 78 -11.322 0.843 -5.240 633 HA GLU 78 HA GLU 78 -12.773 -1.158 -6.800 634 HB2 GLU 78 HB2 GLU 78 -11.098 -1.743 -4.484 635 HB3 GLU 78 HB1 GLU 78 -12.759 -2.272 -4.251 636 HG2 GLU 78 HG2 GLU 78 -10.804 -3.125 -6.365 637 HG3 GLU 78 HG1 GLU 78 -11.641 -4.104 -5.162 638 H SER 79 HN SER 79 -14.659 -1.996 -5.343 639 HA SER 79 HA SER 79 -15.823 0.210 -3.816 640 HB2 SER 79 HB2 SER 79 -16.569 0.429 -6.185 641 HB3 SER 79 HB1 SER 79 -17.275 -1.185 -6.081 642 HG SER 79 HG SER 79 -18.124 1.226 -4.969 643 H GLY 80 HN GLY 80 -17.451 -0.425 -2.382 644 HA2 GLY 80 HA2 GLY 80 -18.272 -3.116 -1.991 645 HA3 GLY 80 HA1 GLY 80 -16.908 -2.729 -0.946 646 H TYR 81 HN TYR 81 -18.248 -2.882 0.970 647 HA TYR 81 HA TYR 81 -19.682 -0.379 1.396 648 HB2 TYR 81 HB2 TYR 81 -21.638 -1.540 2.433 649 HB3 TYR 81 HB1 TYR 81 -21.498 -1.770 0.691 650 HD1 TYR 81 HD2 TYR 81 -21.128 -3.407 3.966 651 HD2 TYR 81 HD1 TYR 81 -21.114 -3.945 -0.252 652 HE1 TYR 81 HE2 TYR 81 -21.220 -5.841 4.282 653 HE2 TYR 81 HE1 TYR 81 -21.216 -6.383 0.054 654 HH TYR 81 HH TYR 81 -20.699 -8.054 1.726 655 H ALA 82 HN ALA 82 -17.276 -2.112 2.460 656 HA ALA 82 HA ALA 82 -17.575 -1.142 5.147 657 HB1 ALA 82 HB1 ALA 82 -18.654 -3.185 5.574 658 HB2 ALA 82 HB2 ALA 82 -16.998 -3.430 6.120 659 HB3 ALA 82 HB3 ALA 82 -17.526 -4.089 4.571 660 H GLY 83 HN GLY 83 -15.617 -1.477 6.450 661 HA2 GLY 83 HA2 GLY 83 -13.244 -1.346 4.735 662 HA3 GLY 83 HA1 GLY 83 -13.367 -0.730 6.377 663 H PHE 84 HN PHE 84 -11.206 -2.022 6.138 664 HA PHE 84 HA PHE 84 -11.206 -4.271 7.749 665 HB2 PHE 84 HB2 PHE 84 -10.711 -6.086 6.118 666 HB3 PHE 84 HB1 PHE 84 -12.354 -5.480 5.969 667 HD1 PHE 84 HD1 PHE 84 -12.813 -3.776 4.106 668 HD2 PHE 84 HD2 PHE 84 -9.323 -6.206 4.247 669 HE1 PHE 84 HE1 PHE 84 -12.476 -3.412 1.704 670 HE2 PHE 84 HE2 PHE 84 -8.963 -5.844 1.849 671 HZ PHE 84 HZ PHE 84 -10.538 -4.447 0.560 672 H ILE 85 HN ILE 85 -9.061 -5.124 8.057 673 HA ILE 85 HA ILE 85 -6.910 -3.423 7.314 674 HB ILE 85 HB ILE 85 -6.981 -6.206 8.472 675 HG12 ILE 85 HG12 ILE 85 -7.596 -4.335 9.958 676 HG13 ILE 85 HG11 ILE 85 -6.104 -5.122 10.459 677 HG21 ILE 85 HG21 ILE 85 -4.543 -4.565 7.816 678 HG22 ILE 85 HG22 ILE 85 -5.001 -6.107 7.092 679 HG23 ILE 85 HG23 ILE 85 -4.544 -6.032 8.795 680 HD11 ILE 85 HD11 ILE 85 -6.179 -2.591 8.851 681 HD12 ILE 85 HD12 ILE 85 -4.784 -3.334 9.629 682 HD13 ILE 85 HD13 ILE 85 -6.076 -2.641 10.609 683 H LEU 86 HN LEU 86 -5.917 -3.302 5.423 684 HA LEU 86 HA LEU 86 -6.184 -5.580 3.580 685 HB2 LEU 86 HB2 LEU 86 -7.063 -3.134 3.081 686 HB3 LEU 86 HB1 LEU 86 -5.380 -2.857 2.668 687 HG LEU 86 HG LEU 86 -6.704 -5.216 1.442 688 HD11 LEU 86 HD11 LEU 86 -7.087 -2.462 0.299 689 HD12 LEU 86 HD12 LEU 86 -8.309 -3.266 1.288 690 HD13 LEU 86 HD13 LEU 86 -7.798 -3.987 -0.237 691 HD21 LEU 86 HD21 LEU 86 -5.262 -3.471 -0.272 692 HD22 LEU 86 HD22 LEU 86 -4.923 -5.150 0.139 693 HD23 LEU 86 HD23 LEU 86 -4.297 -3.845 1.151 694 HA PRO 87 HA PRO 87 -1.803 -5.973 4.454 695 HB2 PRO 87 HB2 PRO 87 -2.041 -8.436 2.900 696 HB3 PRO 87 HB1 PRO 87 -1.616 -8.229 4.600 697 HG2 PRO 87 HG2 PRO 87 -3.964 -9.315 3.812 698 HG3 PRO 87 HG1 PRO 87 -3.799 -8.368 5.302 699 HD2 PRO 87 HD2 PRO 87 -4.888 -7.536 2.637 700 HD3 PRO 87 HD1 PRO 87 -5.493 -7.167 4.268 701 H ILE 88 HN ILE 88 -0.893 -4.447 3.147 702 HA ILE 88 HA ILE 88 -0.928 -4.859 0.259 703 HB ILE 88 HB ILE 88 0.110 -2.435 1.749 704 HG12 ILE 88 HG12 ILE 88 -2.583 -2.607 0.406 705 HG13 ILE 88 HG11 ILE 88 -2.399 -3.124 2.080 706 HG21 ILE 88 HG21 ILE 88 0.888 -2.731 -0.555 707 HG22 ILE 88 HG22 ILE 88 -0.181 -1.336 -0.400 708 HG23 ILE 88 HG23 ILE 88 -0.785 -2.836 -1.103 709 HD11 ILE 88 HD11 ILE 88 -1.746 -0.385 1.025 710 HD12 ILE 88 HD12 ILE 88 -1.642 -0.910 2.700 711 HD13 ILE 88 HD13 ILE 88 -3.209 -0.832 1.895 712 H GLU 89 HN GLU 89 0.953 -5.011 -0.953 713 HA GLU 89 HA GLU 89 3.439 -5.366 0.587 714 HB2 GLU 89 HB2 GLU 89 2.459 -6.964 -1.772 715 HB3 GLU 89 HB1 GLU 89 4.114 -7.010 -1.181 716 HG2 GLU 89 HG2 GLU 89 3.266 -7.787 1.002 717 HG3 GLU 89 HG1 GLU 89 1.643 -7.847 0.314 718 H VAL 90 HN VAL 90 5.096 -4.220 -0.034 719 HA VAL 90 HA VAL 90 5.096 -3.083 -2.747 720 HB VAL 90 HB VAL 90 6.636 -1.925 -0.423 721 HG11 VAL 90 HG11 VAL 90 7.562 -0.817 -2.155 722 HG12 VAL 90 HG12 VAL 90 6.063 0.108 -2.136 723 HG13 VAL 90 HG13 VAL 90 6.249 -1.247 -3.248 724 HG21 VAL 90 HG21 VAL 90 4.035 -2.031 -0.234 725 HG22 VAL 90 HG22 VAL 90 4.095 -0.705 -1.396 726 HG23 VAL 90 HG23 VAL 90 4.894 -0.546 0.170 727 H TYR 91 HN TYR 91 6.378 -4.309 -3.963 728 HA TYR 91 HA TYR 91 8.331 -6.080 -2.826 729 HB2 TYR 91 HB2 TYR 91 7.292 -5.511 -5.529 730 HB3 TYR 91 HB1 TYR 91 8.934 -6.134 -5.463 731 HD1 TYR 91 HD1 TYR 91 5.747 -6.890 -3.673 732 HD2 TYR 91 HD2 TYR 91 9.026 -8.373 -5.916 733 HE1 TYR 91 HE1 TYR 91 4.862 -9.145 -3.443 734 HE2 TYR 91 HE2 TYR 91 8.134 -10.654 -5.723 735 HH TYR 91 HH TYR 91 6.684 -11.932 -4.259 736 H PHE 92 HN PHE 92 10.458 -5.971 -2.783 737 HA PHE 92 HA PHE 92 11.682 -3.358 -3.375 738 HB2 PHE 92 HB2 PHE 92 12.341 -5.519 -1.363 739 HB3 PHE 92 HB1 PHE 92 13.396 -4.142 -1.680 740 HD1 PHE 92 HD1 PHE 92 11.166 -2.109 -2.055 741 HD2 PHE 92 HD2 PHE 92 11.851 -5.078 0.908 742 HE1 PHE 92 HE1 PHE 92 9.994 -0.722 -0.414 743 HE2 PHE 92 HE2 PHE 92 10.639 -3.695 2.558 744 HZ PHE 92 HZ PHE 92 9.739 -1.509 1.895 745 H LYS 93 HN LYS 93 13.913 -3.379 -4.150 746 HA LYS 93 HA LYS 93 14.514 -5.748 -5.789 747 HB2 LYS 93 HB2 LYS 93 15.767 -2.991 -5.891 748 HB3 LYS 93 HB1 LYS 93 16.051 -4.302 -7.029 749 HG2 LYS 93 HG2 LYS 93 13.806 -4.149 -7.854 750 HG3 LYS 93 HG1 LYS 93 13.383 -2.977 -6.603 751 HD2 LYS 93 HD2 LYS 93 14.951 -1.368 -7.553 752 HD3 LYS 93 HD1 LYS 93 15.485 -2.552 -8.744 753 HE2 LYS 93 HE2 LYS 93 12.989 -2.582 -9.471 754 HE3 LYS 93 HE1 LYS 93 12.880 -1.057 -8.587 755 HZ1 LYS 93 HZ1 LYS 93 14.789 -1.597 -10.792 756 HZ2 LYS 93 HZ2 LYS 93 14.585 -0.128 -9.974 757 HZ3 LYS 93 HZ3 LYS 93 13.338 -0.736 -10.944 758 H ASN 94 HN ASN 94 15.482 -7.107 -4.260 759 HA ASN 94 HA ASN 94 17.998 -6.124 -3.085 760 HB2 ASN 94 HB2 ASN 94 16.019 -7.936 -1.670 761 HB3 ASN 94 HB1 ASN 94 17.564 -7.389 -1.039 762 HD21 ASN 94 HD21 ASN 94 16.571 -6.568 0.783 763 HD22 ASN 94 HD22 ASN 94 15.661 -5.099 0.747 764 H LYS 95 HN LYS 95 19.631 -7.686 -2.869 765 HA LYS 95 HA LYS 95 18.970 -10.396 -3.811 766 HB2 LYS 95 HB2 LYS 95 21.642 -9.007 -3.660 767 HB3 LYS 95 HB1 LYS 95 21.437 -10.696 -4.093 768 HG2 LYS 95 HG2 LYS 95 20.000 -9.919 -6.001 769 HG3 LYS 95 HG1 LYS 95 20.513 -8.277 -5.618 770 HD2 LYS 95 HD2 LYS 95 22.356 -10.559 -6.336 771 HD3 LYS 95 HD1 LYS 95 21.836 -9.286 -7.438 772 HE2 LYS 95 HE2 LYS 95 23.865 -8.463 -6.773 773 HE3 LYS 95 HE1 LYS 95 22.810 -7.712 -5.580 774 HZ1 LYS 95 HZ1 LYS 95 24.676 -8.593 -4.447 775 HZ2 LYS 95 HZ2 LYS 95 24.541 -10.095 -5.213 776 HZ3 LYS 95 HZ3 LYS 95 23.375 -9.613 -4.081 777 H GLU 96 HN GLU 96 19.185 -8.588 -1.208 778 HA GLU 96 HA GLU 96 20.201 -10.710 0.532 779 HB2 GLU 96 HB2 GLU 96 20.497 -8.864 2.242 780 HB3 GLU 96 HB1 GLU 96 21.584 -8.775 0.864 781 HG2 GLU 96 HG2 GLU 96 20.341 -6.994 -0.098 782 HG3 GLU 96 HG1 GLU 96 19.050 -7.181 1.095 783 H GLU 97 HN GLU 97 19.014 -9.248 2.841 784 HA GLU 97 HA GLU 97 16.884 -10.810 3.396 785 HB2 GLU 97 HB2 GLU 97 16.188 -9.043 5.035 786 HB3 GLU 97 HB1 GLU 97 17.870 -9.549 5.127 787 HG2 GLU 97 HG2 GLU 97 18.477 -7.517 3.842 788 HG3 GLU 97 HG1 GLU 97 16.786 -7.015 3.933 789 HA PRO 98 HA PRO 98 12.997 -10.588 1.944 790 HB2 PRO 98 HB2 PRO 98 11.649 -8.444 3.312 791 HB3 PRO 98 HB1 PRO 98 11.506 -10.184 3.593 792 HG2 PRO 98 HG2 PRO 98 13.241 -8.186 4.931 793 HG3 PRO 98 HG1 PRO 98 12.516 -9.671 5.583 794 HD2 PRO 98 HD2 PRO 98 15.104 -9.619 5.073 795 HD3 PRO 98 HD1 PRO 98 14.149 -11.037 4.565 796 H ARG 99 HN ARG 99 12.550 -10.059 0.010 797 HA ARG 99 HA ARG 99 13.075 -7.411 -1.052 798 HB2 ARG 99 HB2 ARG 99 12.288 -10.022 -2.315 799 HB3 ARG 99 HB1 ARG 99 12.494 -8.528 -3.226 800 HG2 ARG 99 HG2 ARG 99 14.764 -8.372 -2.700 801 HG3 ARG 99 HG1 ARG 99 14.632 -9.589 -1.435 802 HD2 ARG 99 HD2 ARG 99 15.741 -10.267 -3.595 803 HD3 ARG 99 HD1 ARG 99 14.493 -11.345 -3.012 804 HE ARG 99 HE ARG 99 13.426 -9.435 -4.830 805 HH11 ARG 99 HH11 ARG 99 15.380 -12.328 -4.701 806 HH12 ARG 99 HH12 ARG 99 14.940 -12.857 -6.300 807 HH21 ARG 99 HH21 ARG 99 12.859 -10.100 -6.942 808 HH22 ARG 99 HH22 ARG 99 13.504 -11.579 -7.583 809 H LYS 100 HN LYS 100 10.842 -8.146 0.758 810 HA LYS 100 HA LYS 100 8.800 -6.633 -0.657 811 HB2 LYS 100 HB2 LYS 100 6.993 -8.157 0.082 812 HB3 LYS 100 HB1 LYS 100 8.081 -8.912 -1.075 813 HG2 LYS 100 HG2 LYS 100 9.073 -10.261 0.563 814 HG3 LYS 100 HG1 LYS 100 8.466 -9.257 1.880 815 HD2 LYS 100 HD2 LYS 100 7.118 -11.155 1.972 816 HD3 LYS 100 HD1 LYS 100 6.132 -9.989 1.094 817 HE2 LYS 100 HE2 LYS 100 7.847 -12.024 -0.313 818 HE3 LYS 100 HE1 LYS 100 6.198 -12.371 0.202 819 HZ1 LYS 100 HZ1 LYS 100 6.108 -11.682 -2.034 820 HZ2 LYS 100 HZ2 LYS 100 7.085 -10.329 -1.750 821 HZ3 LYS 100 HZ3 LYS 100 5.507 -10.386 -1.113 822 H VAL 101 HN VAL 101 7.603 -5.351 0.679 823 HA VAL 101 HA VAL 101 7.880 -5.820 3.566 824 HB VAL 101 HB VAL 101 8.951 -3.702 2.851 825 HG11 VAL 101 HG11 VAL 101 7.764 -2.961 0.987 826 HG12 VAL 101 HG12 VAL 101 7.317 -1.820 2.264 827 HG13 VAL 101 HG13 VAL 101 6.205 -3.112 1.811 828 HG21 VAL 101 HG21 VAL 101 7.924 -2.297 4.534 829 HG22 VAL 101 HG22 VAL 101 8.021 -3.967 5.096 830 HG23 VAL 101 HG23 VAL 101 6.484 -3.315 4.530 831 H ARG 102 HN ARG 102 5.998 -5.840 4.756 832 HA ARG 102 HA ARG 102 3.544 -5.808 3.140 833 HB2 ARG 102 HB2 ARG 102 4.281 -8.030 4.062 834 HB3 ARG 102 HB1 ARG 102 4.030 -7.370 5.672 835 HG2 ARG 102 HG2 ARG 102 1.691 -7.055 5.263 836 HG3 ARG 102 HG1 ARG 102 1.868 -7.540 3.575 837 HD2 ARG 102 HD2 ARG 102 0.978 -9.391 4.842 838 HD3 ARG 102 HD1 ARG 102 2.633 -9.773 4.363 839 HE ARG 102 HE ARG 102 2.786 -8.610 6.876 840 HH11 ARG 102 HH11 ARG 102 1.431 -11.511 5.438 841 HH12 ARG 102 HH12 ARG 102 1.489 -12.421 6.922 842 HH21 ARG 102 HH21 ARG 102 2.862 -9.792 8.804 843 HH22 ARG 102 HH22 ARG 102 2.307 -11.437 8.844 844 H PHE 103 HN PHE 103 2.269 -4.178 3.562 845 HA PHE 103 HA PHE 103 2.342 -3.004 6.262 846 HB2 PHE 103 HB2 PHE 103 1.622 -1.737 3.612 847 HB3 PHE 103 HB1 PHE 103 1.487 -0.932 5.167 848 HD1 PHE 103 HD1 PHE 103 4.000 -1.761 6.477 849 HD2 PHE 103 HD2 PHE 103 3.232 -0.570 2.467 850 HE1 PHE 103 HE1 PHE 103 6.308 -0.925 6.285 851 HE2 PHE 103 HE2 PHE 103 5.541 0.252 2.262 852 HZ PHE 103 HZ PHE 103 7.079 0.079 4.175 853 H ASP 104 HN ASP 104 0.725 -3.942 7.359 854 HA ASP 104 HA ASP 104 -1.818 -4.555 6.187 855 HB2 ASP 104 HB2 ASP 104 -0.838 -4.505 9.041 856 HB3 ASP 104 HB1 ASP 104 -2.509 -4.862 8.629 857 H TYR 105 HN TYR 105 -2.509 -2.624 5.268 858 HA TYR 105 HA TYR 105 -2.689 -0.287 6.985 859 HB2 TYR 105 HB2 TYR 105 -1.863 0.014 4.695 860 HB3 TYR 105 HB1 TYR 105 -3.385 -0.615 4.053 861 HD1 TYR 105 HD1 TYR 105 -2.237 1.987 6.466 862 HD2 TYR 105 HD2 TYR 105 -4.916 0.945 3.350 863 HE1 TYR 105 HE1 TYR 105 -3.206 4.233 6.580 864 HE2 TYR 105 HE2 TYR 105 -5.896 3.184 3.423 865 HH TYR 105 HH TYR 105 -6.034 5.041 5.543 866 H ASP 106 HN ASP 106 -4.428 0.342 8.000 867 HA ASP 106 HA ASP 106 -6.836 -1.179 7.920 868 HB2 ASP 106 HB2 ASP 106 -5.946 -0.060 9.964 869 HB3 ASP 106 HB1 ASP 106 -6.340 1.498 9.243 870 H LEU 107 HN LEU 107 -8.069 -1.053 6.143 871 HA LEU 107 HA LEU 107 -8.475 1.424 4.734 872 HB2 LEU 107 HB2 LEU 107 -8.973 -1.380 4.298 873 HB3 LEU 107 HB1 LEU 107 -10.417 -0.449 3.943 874 HG LEU 107 HG LEU 107 -8.988 0.963 2.409 875 HD11 LEU 107 HD11 LEU 107 -6.906 -0.114 1.612 876 HD12 LEU 107 HD12 LEU 107 -7.006 -1.224 2.985 877 HD13 LEU 107 HD13 LEU 107 -6.806 0.508 3.264 878 HD21 LEU 107 HD21 LEU 107 -8.890 -0.830 0.658 879 HD22 LEU 107 HD22 LEU 107 -10.448 -0.639 1.467 880 HD23 LEU 107 HD23 LEU 107 -9.381 -1.971 1.913 881 H PHE 108 HN PHE 108 -9.573 2.896 5.962 882 HA PHE 108 HA PHE 108 -12.078 1.997 7.189 883 HB2 PHE 108 HB2 PHE 108 -11.996 4.022 8.576 884 HB3 PHE 108 HB1 PHE 108 -10.557 3.037 8.785 885 HD1 PHE 108 HD2 PHE 108 -11.890 6.173 7.428 886 HD2 PHE 108 HD1 PHE 108 -8.383 3.865 8.150 887 HE1 PHE 108 HE2 PHE 108 -10.501 8.154 6.993 888 HE2 PHE 108 HE1 PHE 108 -6.991 5.849 7.719 889 HZ PHE 108 HZ PHE 108 -8.048 7.993 7.139 890 H LEU 109 HN LEU 109 -13.980 2.700 6.488 891 HA LEU 109 HA LEU 109 -14.001 4.838 4.452 892 HB2 LEU 109 HB2 LEU 109 -16.166 2.777 4.913 893 HB3 LEU 109 HB1 LEU 109 -15.984 3.854 3.542 894 HG LEU 109 HG LEU 109 -14.259 1.460 4.196 895 HD11 LEU 109 HD11 LEU 109 -16.530 1.076 3.172 896 HD12 LEU 109 HD12 LEU 109 -15.162 0.478 2.237 897 HD13 LEU 109 HD13 LEU 109 -15.960 1.978 1.770 898 HD21 LEU 109 HD21 LEU 109 -13.998 3.468 1.960 899 HD22 LEU 109 HD22 LEU 109 -13.100 1.953 2.085 900 HD23 LEU 109 HD23 LEU 109 -12.862 3.221 3.288 901 H HIS 110 HN HIS 110 -15.747 6.418 4.656 902 HA HIS 110 HA HIS 110 -16.677 6.648 7.426 903 HB2 HIS 110 HB2 HIS 110 -16.276 8.694 5.262 904 HB3 HIS 110 HB1 HIS 110 -17.293 9.039 6.657 905 HD1 HIS 110 HD1 HIS 110 -14.489 10.432 5.946 906 HD2 HIS 110 HD2 HIS 110 -15.155 7.484 8.798 907 HE1 HIS 110 HE1 HIS 110 -12.619 10.665 7.603 908 HE2 HIS 110 HE2 HIS 110 -13.146 8.995 9.417 909 H LEU 111 HN LEU 111 -18.876 7.861 7.572 910 HA LEU 111 HA LEU 111 -20.723 5.891 6.906 911 HB2 LEU 111 HB2 LEU 111 -20.786 8.517 8.207 912 HB3 LEU 111 HB1 LEU 111 -22.308 8.026 7.495 913 HG LEU 111 HG LEU 111 -21.818 7.463 9.984 914 HD11 LEU 111 HD11 LEU 111 -22.805 5.267 8.168 915 HD12 LEU 111 HD12 LEU 111 -23.757 6.670 8.651 916 HD13 LEU 111 HD13 LEU 111 -23.212 5.514 9.865 917 HD21 LEU 111 HD21 LEU 111 -20.342 5.235 8.587 918 HD22 LEU 111 HD22 LEU 111 -20.759 5.277 10.303 919 HD23 LEU 111 HD23 LEU 111 -19.631 6.460 9.641 920 H GLU 112 HN GLU 112 -22.253 5.607 5.481 921 HA GLU 112 HA GLU 112 -22.132 6.611 2.893 922 HB2 GLU 112 HB2 GLU 112 -23.245 4.489 3.736 923 HB3 GLU 112 HB1 GLU 112 -24.594 5.488 4.246 924 HG2 GLU 112 HG2 GLU 112 -23.643 5.429 1.402 925 HG3 GLU 112 HG1 GLU 112 -24.793 4.255 2.033 926 H GLY 113 HN GLY 113 -22.666 8.507 2.089 927 HA2 GLY 113 HA2 GLY 113 -24.535 10.106 1.776 928 HA3 GLY 113 HA1 GLY 113 -24.649 10.144 3.531 929 H HIS 114 HN HIS 114 -22.069 10.403 4.353 930 HA HIS 114 HA HIS 114 -20.914 12.624 2.841 931 HB2 HIS 114 HB2 HIS 114 -22.554 13.574 4.505 932 HB3 HIS 114 HB1 HIS 114 -21.552 12.903 5.786 933 HD1 HIS 114 HD1 HIS 114 -19.492 14.218 6.472 934 HD2 HIS 114 HD2 HIS 114 -21.347 15.725 3.064 935 HE1 HIS 114 HE1 HIS 114 -18.413 16.447 6.037 936 HE2 HIS 114 HE2 HIS 114 -19.657 17.407 4.068 937 HA PRO 115 HA PRO 115 -17.491 10.386 4.832 938 HB2 PRO 115 HB2 PRO 115 -16.815 8.640 2.923 939 HB3 PRO 115 HB1 PRO 115 -18.178 8.335 4.004 940 HG2 PRO 115 HG2 PRO 115 -18.192 8.972 1.144 941 HG3 PRO 115 HG1 PRO 115 -19.487 8.302 2.148 942 HD2 PRO 115 HD2 PRO 115 -19.014 11.086 1.351 943 HD3 PRO 115 HD1 PRO 115 -20.470 10.354 2.060 944 HA PRO 116 HA PRO 116 -14.547 12.589 2.153 945 HB2 PRO 116 HB2 PRO 116 -13.507 14.242 3.983 946 HB3 PRO 116 HB1 PRO 116 -15.045 14.603 3.193 947 HG2 PRO 116 HG2 PRO 116 -14.515 13.677 5.955 948 HG3 PRO 116 HG1 PRO 116 -15.863 14.637 5.330 949 HD2 PRO 116 HD2 PRO 116 -15.815 11.828 5.859 950 HD3 PRO 116 HD1 PRO 116 -17.135 12.783 5.153 951 H VAL 117 HN VAL 117 -13.239 10.695 1.958 952 HA VAL 117 HA VAL 117 -11.415 10.303 4.243 953 HB VAL 117 HB VAL 117 -12.406 8.256 2.267 954 HG11 VAL 117 HG11 VAL 117 -10.252 8.024 4.357 955 HG12 VAL 117 HG12 VAL 117 -10.070 7.838 2.616 956 HG13 VAL 117 HG13 VAL 117 -10.997 6.655 3.537 957 HG21 VAL 117 HG21 VAL 117 -13.209 7.121 4.302 958 HG22 VAL 117 HG22 VAL 117 -13.959 8.699 4.061 959 HG23 VAL 117 HG23 VAL 117 -12.679 8.505 5.258 960 H ASN 118 HN ASN 118 -9.531 11.132 3.869 961 HA ASN 118 HA ASN 118 -8.042 10.263 1.512 962 HB2 ASN 118 HB2 ASN 118 -8.966 12.564 1.028 963 HB3 ASN 118 HB1 ASN 118 -8.022 13.173 2.390 964 HD21 ASN 118 HD21 ASN 118 -5.649 13.005 2.227 965 HD22 ASN 118 HD22 ASN 118 -4.911 12.913 0.663 966 H HIS 119 HN HIS 119 -6.445 9.116 2.582 967 HA HIS 119 HA HIS 119 -5.055 10.503 4.764 968 HB2 HIS 119 HB2 HIS 119 -6.870 8.886 5.583 969 HB3 HIS 119 HB1 HIS 119 -5.808 7.603 5.006 970 HD1 HIS 119 HD1 HIS 119 -4.207 6.744 6.687 971 HD2 HIS 119 HD2 HIS 119 -5.436 10.618 7.545 972 HE1 HIS 119 HE1 HIS 119 -3.134 7.326 8.885 973 HE2 HIS 119 HE2 HIS 119 -4.088 9.578 9.487 974 H LEU 120 HN LEU 120 -2.912 10.095 4.952 975 HA LEU 120 HA LEU 120 -1.685 7.845 3.575 976 HB2 LEU 120 HB2 LEU 120 -1.217 10.729 2.922 977 HB3 LEU 120 HB1 LEU 120 0.085 9.574 2.752 978 HG LEU 120 HG LEU 120 -2.538 9.049 1.408 979 HD11 LEU 120 HD11 LEU 120 -0.652 10.190 -0.394 980 HD12 LEU 120 HD12 LEU 120 -0.944 11.330 0.921 981 HD13 LEU 120 HD13 LEU 120 -2.295 10.721 -0.035 982 HD21 LEU 120 HD21 LEU 120 -0.633 7.378 1.614 983 HD22 LEU 120 HD22 LEU 120 0.264 8.433 0.518 984 HD23 LEU 120 HD23 LEU 120 -1.247 7.691 -0.010 985 H ARG 121 HN ARG 121 0.359 7.281 4.369 986 HA ARG 121 HA ARG 121 1.515 8.839 6.533 987 HB2 ARG 121 HB2 ARG 121 0.770 7.615 8.280 988 HB3 ARG 121 HB1 ARG 121 -0.252 6.737 7.192 989 HG2 ARG 121 HG2 ARG 121 2.572 5.854 7.452 990 HG3 ARG 121 HG1 ARG 121 1.469 5.526 8.781 991 HD2 ARG 121 HD2 ARG 121 1.015 4.664 5.906 992 HD3 ARG 121 HD1 ARG 121 1.656 3.654 7.191 993 HE ARG 121 HE ARG 121 -1.056 4.777 7.246 994 HH11 ARG 121 HH11 ARG 121 1.280 2.266 8.006 995 HH12 ARG 121 HH12 ARG 121 0.120 1.270 8.840 996 HH21 ARG 121 HH21 ARG 121 -2.573 3.467 8.367 997 HH22 ARG 121 HH22 ARG 121 -2.071 1.921 9.000 998 H CYS 122 HN CYS 122 3.682 8.699 6.533 999 HA CYS 122 HA CYS 122 4.935 6.877 4.662 1000 HB2 CYS 122 HB2 CYS 122 7.008 8.125 5.275 1001 HB3 CYS 122 HB1 CYS 122 5.719 9.132 4.630 1002 HG CYS 122 HG CYS 122 5.730 10.805 6.553 1003 H GLU 123 HN GLU 123 5.931 5.061 5.135 1004 HA GLU 123 HA GLU 123 6.363 4.318 7.940 1005 HB2 GLU 123 HB2 GLU 123 6.367 2.620 5.434 1006 HB3 GLU 123 HB1 GLU 123 6.540 2.018 7.082 1007 HG2 GLU 123 HG2 GLU 123 4.169 3.619 6.279 1008 HG3 GLU 123 HG1 GLU 123 4.238 1.894 5.929 1009 H LYS 124 HN LYS 124 8.340 3.147 8.429 1010 HA LYS 124 HA LYS 124 10.605 4.310 6.940 1011 HB2 LYS 124 HB2 LYS 124 10.255 5.455 9.066 1012 HB3 LYS 124 HB1 LYS 124 10.305 3.917 9.917 1013 HG2 LYS 124 HG2 LYS 124 12.669 3.683 8.934 1014 HG3 LYS 124 HG1 LYS 124 12.550 5.410 8.611 1015 HD2 LYS 124 HD2 LYS 124 13.620 5.137 10.693 1016 HD3 LYS 124 HD1 LYS 124 11.988 5.730 11.017 1017 HE2 LYS 124 HE2 LYS 124 11.225 3.582 11.633 1018 HE3 LYS 124 HE1 LYS 124 12.681 2.819 10.998 1019 HZ1 LYS 124 HZ1 LYS 124 13.959 3.774 12.772 1020 HZ2 LYS 124 HZ2 LYS 124 12.627 2.975 13.449 1021 HZ3 LYS 124 HZ3 LYS 124 12.629 4.666 13.330 1022 H LEU 125 HN LEU 125 11.770 2.788 5.986 1023 HA LEU 125 HA LEU 125 12.055 0.195 7.356 1024 HB2 LEU 125 HB2 LEU 125 12.622 0.863 4.478 1025 HB3 LEU 125 HB1 LEU 125 12.538 -0.733 5.190 1026 HG LEU 125 HG LEU 125 10.119 1.018 5.276 1027 HD11 LEU 125 HD11 LEU 125 10.835 1.167 2.969 1028 HD12 LEU 125 HD12 LEU 125 9.421 0.118 3.100 1029 HD13 LEU 125 HD13 LEU 125 11.024 -0.586 2.893 1030 HD21 LEU 125 HD21 LEU 125 9.049 -1.250 4.988 1031 HD22 LEU 125 HD22 LEU 125 9.943 -1.007 6.490 1032 HD23 LEU 125 HD23 LEU 125 10.662 -1.939 5.176 1033 H THR 126 HN THR 126 13.843 0.351 8.611 1034 HA THR 126 HA THR 126 16.258 1.606 7.534 1035 HB THR 126 HB THR 126 16.129 0.396 10.267 1036 HG1 THR 126 HG1 THR 126 15.216 2.409 11.005 1037 HG21 THR 126 HG21 THR 126 18.141 1.538 9.090 1038 HG22 THR 126 HG22 THR 126 17.798 1.901 10.780 1039 HG23 THR 126 HG23 THR 126 17.311 3.033 9.518 1040 H PHE 127 HN PHE 127 17.823 0.410 6.674 1041 HA PHE 127 HA PHE 127 17.909 -2.462 7.337 1042 HB2 PHE 127 HB2 PHE 127 18.787 -1.101 4.780 1043 HB3 PHE 127 HB1 PHE 127 18.892 -2.828 5.109 1044 HD1 PHE 127 HD2 PHE 127 16.669 -0.030 4.417 1045 HD2 PHE 127 HD1 PHE 127 16.915 -4.239 5.055 1046 HE1 PHE 127 HE2 PHE 127 14.375 -0.280 3.611 1047 HE2 PHE 127 HE1 PHE 127 14.610 -4.490 4.241 1048 HZ PHE 127 HZ PHE 127 13.338 -2.504 3.525 1049 H ASN 128 HN ASN 128 19.427 -2.705 8.826 1050 HA ASN 128 HA ASN 128 21.658 -0.957 9.054 1051 HB2 ASN 128 HB2 ASN 128 22.325 -2.247 10.949 1052 HB3 ASN 128 HB1 ASN 128 20.573 -2.122 10.991 1053 HD21 ASN 128 HD21 ASN 128 19.324 -3.970 10.503 1054 HD22 ASN 128 HD22 ASN 128 20.004 -5.558 10.621 1055 H ASN 129 HN ASN 129 23.333 -0.951 7.811 1056 HA ASN 129 HA ASN 129 25.157 -1.584 6.628 1057 HB2 ASN 129 HB2 ASN 129 25.193 -2.936 9.001 1058 HB3 ASN 129 HB1 ASN 129 25.346 -4.256 7.845 1059 HD21 ASN 129 HD21 ASN 129 27.239 -4.544 6.777 1060 HD22 ASN 129 HD22 ASN 129 28.641 -3.550 7.016 1061 HA PRO 130 HA PRO 130 22.897 -4.495 3.821 1062 HB2 PRO 130 HB2 PRO 130 21.974 -2.787 1.987 1063 HB3 PRO 130 HB1 PRO 130 21.131 -3.012 3.524 1064 HG2 PRO 130 HG2 PRO 130 22.864 -0.771 2.624 1065 HG3 PRO 130 HG1 PRO 130 21.448 -0.741 3.685 1066 HD2 PRO 130 HD2 PRO 130 24.152 -0.728 4.484 1067 HD3 PRO 130 HD1 PRO 130 22.743 -0.980 5.530 1068 H THR 131 HN THR 131 23.323 -4.851 1.440 1069 HA THR 131 HA THR 131 26.107 -4.522 0.908 1070 HB THR 131 HB THR 131 24.949 -6.522 0.118 1071 HG1 THR 131 HG1 THR 131 26.687 -6.129 -1.140 1072 HG21 THR 131 HG21 THR 131 22.747 -5.729 -0.384 1073 HG22 THR 131 HG22 THR 131 23.441 -6.335 -1.891 1074 HG23 THR 131 HG23 THR 131 23.369 -4.599 -1.591 1075 H GLU 132 HN GLU 132 26.990 -3.470 -1.075 1076 HA GLU 132 HA GLU 132 26.358 -0.735 -1.182 1077 HB2 GLU 132 HB2 GLU 132 28.482 -1.930 -2.028 1078 HB3 GLU 132 HB1 GLU 132 27.574 -2.231 -3.505 1079 HG2 GLU 132 HG2 GLU 132 28.951 -0.290 -3.781 1080 HG3 GLU 132 HG1 GLU 132 27.254 0.192 -3.766 1081 H ASP 133 HN ASP 133 25.314 -3.425 -3.265 1082 HA ASP 133 HA ASP 133 23.977 -2.031 -5.252 1083 HB2 ASP 133 HB2 ASP 133 23.261 -4.688 -4.015 1084 HB3 ASP 133 HB1 ASP 133 22.510 -4.046 -5.463 1085 H PHE 134 HN PHE 134 22.802 -3.056 -2.072 1086 HA PHE 134 HA PHE 134 20.144 -2.117 -2.557 1087 HB2 PHE 134 HB2 PHE 134 20.908 -3.929 -0.841 1088 HB3 PHE 134 HB1 PHE 134 21.265 -2.548 0.197 1089 HD1 PHE 134 HD1 PHE 134 18.523 -2.716 -2.252 1090 HD2 PHE 134 HD2 PHE 134 19.590 -2.858 1.867 1091 HE1 PHE 134 HE1 PHE 134 16.175 -2.522 -1.646 1092 HE2 PHE 134 HE2 PHE 134 17.217 -2.673 2.478 1093 HZ PHE 134 HZ PHE 134 15.512 -2.499 0.712 1094 H ARG 135 HN ARG 135 22.816 -1.021 -0.517 1095 HA ARG 135 HA ARG 135 21.956 1.424 0.336 1096 HB2 ARG 135 HB2 ARG 135 23.999 0.950 1.159 1097 HB3 ARG 135 HB1 ARG 135 24.577 0.301 -0.373 1098 HG2 ARG 135 HG2 ARG 135 25.525 2.286 -0.917 1099 HG3 ARG 135 HG1 ARG 135 24.039 3.132 -0.537 1100 HD2 ARG 135 HD2 ARG 135 26.021 3.816 0.822 1101 HD3 ARG 135 HD1 ARG 135 24.656 3.254 1.776 1102 HE ARG 135 HE ARG 135 26.358 1.095 1.337 1103 HH11 ARG 135 HH11 ARG 135 26.264 4.127 3.082 1104 HH12 ARG 135 HH12 ARG 135 27.594 3.714 4.133 1105 HH21 ARG 135 HH21 ARG 135 28.098 0.547 2.701 1106 HH22 ARG 135 HH22 ARG 135 28.660 1.685 3.887 1107 H ARG 136 HN ARG 136 23.266 0.652 -2.807 1108 HA ARG 136 HA ARG 136 23.516 3.130 -3.979 1109 HB2 ARG 136 HB2 ARG 136 23.729 0.515 -4.711 1110 HB3 ARG 136 HB1 ARG 136 22.399 1.115 -5.661 1111 HG2 ARG 136 HG2 ARG 136 23.762 2.782 -6.676 1112 HG3 ARG 136 HG1 ARG 136 25.113 2.360 -5.614 1113 HD2 ARG 136 HD2 ARG 136 25.422 1.322 -7.783 1114 HD3 ARG 136 HD1 ARG 136 25.120 0.097 -6.547 1115 HE ARG 136 HE ARG 136 22.889 1.033 -8.210 1116 HH11 ARG 136 HH11 ARG 136 25.070 -1.522 -7.200 1117 HH12 ARG 136 HH12 ARG 136 24.161 -2.778 -7.988 1118 HH21 ARG 136 HH21 ARG 136 21.710 -0.602 -9.267 1119 HH22 ARG 136 HH22 ARG 136 22.246 -2.256 -9.171 1120 H LYS 137 HN LYS 137 20.785 0.914 -4.156 1121 HA LYS 137 HA LYS 137 19.170 2.597 -5.721 1122 HB2 LYS 137 HB2 LYS 137 18.175 0.467 -3.837 1123 HB3 LYS 137 HB1 LYS 137 17.399 1.054 -5.295 1124 HG2 LYS 137 HG2 LYS 137 19.359 0.137 -6.577 1125 HG3 LYS 137 HG1 LYS 137 19.872 -0.632 -5.075 1126 HD2 LYS 137 HD2 LYS 137 17.479 -1.598 -5.022 1127 HD3 LYS 137 HD1 LYS 137 17.434 -1.163 -6.732 1128 HE2 LYS 137 HE2 LYS 137 18.143 -3.410 -6.669 1129 HE3 LYS 137 HE1 LYS 137 19.603 -2.467 -6.963 1130 HZ1 LYS 137 HZ1 LYS 137 18.739 -3.466 -4.310 1131 HZ2 LYS 137 HZ2 LYS 137 20.184 -2.645 -4.654 1132 HZ3 LYS 137 HZ3 LYS 137 19.918 -4.199 -5.281 1133 H LEU 138 HN LEU 138 19.135 1.842 -2.297 1134 HA LEU 138 HA LEU 138 16.969 3.348 -1.454 1135 HB2 LEU 138 HB2 LEU 138 19.498 2.898 0.108 1136 HB3 LEU 138 HB1 LEU 138 17.915 3.265 0.760 1137 HG LEU 138 HG LEU 138 18.822 0.708 -0.537 1138 HD11 LEU 138 HD11 LEU 138 19.365 1.020 1.844 1139 HD12 LEU 138 HD12 LEU 138 18.210 -0.289 1.577 1140 HD13 LEU 138 HD13 LEU 138 17.648 1.271 2.177 1141 HD21 LEU 138 HD21 LEU 138 16.031 1.512 0.212 1142 HD22 LEU 138 HD22 LEU 138 16.534 -0.118 -0.215 1143 HD23 LEU 138 HD23 LEU 138 16.628 1.177 -1.409 1144 H LEU 139 HN LEU 139 20.323 4.359 -1.901 1145 HA LEU 139 HA LEU 139 19.975 6.979 -0.841 1146 HB2 LEU 139 HB2 LEU 139 22.098 5.843 -2.655 1147 HB3 LEU 139 HB1 LEU 139 22.189 7.408 -1.872 1148 HG LEU 139 HG LEU 139 22.012 4.776 -0.415 1149 HD11 LEU 139 HD11 LEU 139 24.128 4.577 -1.170 1150 HD12 LEU 139 HD12 LEU 139 24.449 5.674 0.185 1151 HD13 LEU 139 HD13 LEU 139 24.306 6.317 -1.452 1152 HD21 LEU 139 HD21 LEU 139 21.087 6.708 0.766 1153 HD22 LEU 139 HD22 LEU 139 22.633 7.544 0.596 1154 HD23 LEU 139 HD23 LEU 139 22.528 6.063 1.554 1155 H LYS 140 HN LYS 140 19.663 5.586 -4.033 1156 HA LYS 140 HA LYS 140 19.713 8.029 -5.472 1157 HB2 LYS 140 HB2 LYS 140 19.554 5.269 -6.085 1158 HB3 LYS 140 HB1 LYS 140 18.227 6.091 -6.879 1159 HG2 LYS 140 HG2 LYS 140 19.597 7.383 -8.185 1160 HG3 LYS 140 HG1 LYS 140 20.972 7.207 -7.090 1161 HD2 LYS 140 HD2 LYS 140 19.820 4.901 -8.641 1162 HD3 LYS 140 HD1 LYS 140 21.113 5.919 -9.262 1163 HE2 LYS 140 HE2 LYS 140 21.175 4.359 -6.691 1164 HE3 LYS 140 HE1 LYS 140 21.926 3.876 -8.207 1165 HZ1 LYS 140 HZ1 LYS 140 22.589 6.392 -6.774 1166 HZ2 LYS 140 HZ2 LYS 140 23.415 5.715 -8.091 1167 HZ3 LYS 140 HZ3 LYS 140 23.458 4.951 -6.578 1168 H ALA 141 HN ALA 141 17.280 6.310 -3.776 1169 HA ALA 141 HA ALA 141 14.936 6.919 -5.038 1170 HB1 ALA 141 HB1 ALA 141 13.864 6.362 -3.086 1171 HB2 ALA 141 HB2 ALA 141 15.086 7.123 -2.069 1172 HB3 ALA 141 HB3 ALA 141 15.436 5.594 -2.875 1173 H1 GLY 212 HT1 GLY 212 -8.986 2.092 11.088 1174 H2 GLY 212 HT2 GLY 212 -8.289 2.087 12.637 1175 H3 GLY 212 HT3 GLY 212 -8.705 3.557 11.900 1176 HA2 GLY 212 HA1 GLY 212 -10.607 1.453 12.768 1177 HA3 GLY 212 HA2 GLY 212 -10.317 2.980 13.591 1178 H GLY 213 HN GLY 213 -12.709 1.719 12.170 1179 HA2 GLY 213 HA2 GLY 213 -13.222 3.985 10.338 1180 HA3 GLY 213 HA1 GLY 213 -13.717 2.343 9.953 1181 H LYS 214 HN LYS 214 -15.013 5.111 10.672 1182 HA LYS 214 HA LYS 214 -16.807 4.471 12.793 1183 HB2 LYS 214 HB2 LYS 214 -16.971 6.511 10.572 1184 HB3 LYS 214 HB1 LYS 214 -18.165 6.377 11.857 1185 HG2 LYS 214 HG2 LYS 214 -16.396 6.809 13.511 1186 HG3 LYS 214 HG1 LYS 214 -15.240 7.009 12.191 1187 HD2 LYS 214 HD2 LYS 214 -16.491 8.897 11.338 1188 HD3 LYS 214 HD1 LYS 214 -17.737 8.662 12.565 1189 HE2 LYS 214 HE2 LYS 214 -16.240 10.477 13.187 1190 HE3 LYS 214 HE1 LYS 214 -16.099 9.133 14.319 1191 HZ1 LYS 214 HZ1 LYS 214 -13.950 10.107 13.647 1192 HZ2 LYS 214 HZ2 LYS 214 -14.241 9.609 12.055 1193 HZ3 LYS 214 HZ3 LYS 214 -14.069 8.452 13.287 1194 H ALA 215 HN ALA 215 -16.883 4.134 9.298 1195 HA ALA 215 HA ALA 215 -19.550 3.111 9.176 1196 HB1 ALA 215 HB1 ALA 215 -18.954 2.478 6.872 1197 HB2 ALA 215 HB2 ALA 215 -17.270 2.890 7.203 1198 HB3 ALA 215 HB3 ALA 215 -18.507 4.147 7.229 1199 HA PRO 216 HA PRO 216 -19.040 -1.123 10.283 1200 HB2 PRO 216 HB2 PRO 216 -20.112 -2.090 7.730 1201 HB3 PRO 216 HB1 PRO 216 -20.754 -2.262 9.348 1202 HG2 PRO 216 HG2 PRO 216 -21.821 -0.625 7.450 1203 HG3 PRO 216 HG1 PRO 216 -22.016 -0.384 9.192 1204 HD2 PRO 216 HD2 PRO 216 -20.345 1.086 7.254 1205 HD3 PRO 216 HD1 PRO 216 -21.014 1.620 8.806 1206 H ARG 217 HN ARG 217 -17.686 -2.899 9.993 1207 HA ARG 217 HA ARG 217 -16.142 -3.029 7.520 1208 HB2 ARG 217 HB2 ARG 217 -14.050 -3.406 8.919 1209 HB3 ARG 217 HB1 ARG 217 -14.638 -1.757 8.790 1210 HG2 ARG 217 HG2 ARG 217 -15.631 -1.924 11.004 1211 HG3 ARG 217 HG1 ARG 217 -15.074 -3.596 11.133 1212 HD2 ARG 217 HD2 ARG 217 -13.632 -1.842 12.259 1213 HD3 ARG 217 HD1 ARG 217 -12.807 -2.947 11.158 1214 HE ARG 217 HE ARG 217 -13.686 -0.441 9.997 1215 HH11 ARG 217 HH11 ARG 217 -11.083 -2.167 11.568 1216 HH12 ARG 217 HH12 ARG 217 -9.827 -1.170 10.868 1217 HH21 ARG 217 HH21 ARG 217 -12.030 0.875 9.080 1218 HH22 ARG 217 HH22 ARG 217 -10.365 0.569 9.489 1219 H1 KCR 218 HN KCR 218 -14.986 -5.047 7.241 1220 H4 KCR 218 HA KCR 218 -16.767 -7.166 8.171 1221 H5 KCR 218 HB1 KCR 218 -15.934 -8.437 6.257 1222 H6 KCR 218 HB2 KCR 218 -14.767 -7.168 5.910 1223 H7 KCR 218 HG1 KCR 218 -16.602 -5.601 5.496 1224 H8 KCR 218 HG2 KCR 218 -17.763 -6.891 5.819 1225 H9 KCR 218 HD1 KCR 218 -16.979 -8.148 3.929 1226 H10 KCR 218 HD2 KCR 218 -15.672 -6.994 3.654 1227 H11 KCR 218 HE1 KCR 218 -17.296 -5.247 3.160 1228 H12 KCR 218 HE2 KCR 218 -18.619 -6.375 3.472 1229 H13 KCR 218 HZ1 KCR 218 -17.796 -7.658 1.540 1230 H14 KCR 218 HH1 KCR 218 -17.441 -7.536 -0.825 1231 H15 KCR 218 HJ1 KCR 218 -17.070 -4.588 -1.640 1232 H16 KCR 218 HF3 KCR 218 -17.994 -6.120 -3.629 1233 H17 KCR 218 HF1 KCR 218 -16.270 -5.766 -3.710 1234 H18 KCR 218 HF2 KCR 218 -16.822 -7.311 -3.062 1235 H GLN 219 HN GLN 219 -14.057 -6.012 9.408 1236 HA GLN 219 HA GLN 219 -12.532 -8.409 9.753 1237 HB2 GLN 219 HB2 GLN 219 -11.492 -6.209 10.083 1238 HB3 GLN 219 HB1 GLN 219 -12.578 -5.885 11.427 1239 HG2 GLN 219 HG2 GLN 219 -11.583 -7.625 12.737 1240 HG3 GLN 219 HG1 GLN 219 -10.612 -8.162 11.369 1241 HE21 GLN 219 HE21 GLN 219 -9.925 -5.501 10.499 1242 HE22 GLN 219 HE22 GLN 219 -8.795 -4.873 11.650 1243 H LEU 220 HN LEU 220 -15.346 -7.059 11.122 1244 HA LEU 220 HA LEU 220 -15.537 -9.305 13.002 1245 HB2 LEU 220 HB2 LEU 220 -16.897 -7.791 14.459 1246 HB3 LEU 220 HB1 LEU 220 -15.203 -7.356 14.343 1247 HG LEU 220 HG LEU 220 -16.185 -5.774 12.404 1248 HD11 LEU 220 HD11 LEU 220 -18.286 -4.779 13.156 1249 HD12 LEU 220 HD12 LEU 220 -18.414 -6.005 14.416 1250 HD13 LEU 220 HD13 LEU 220 -18.487 -6.475 12.718 1251 HD21 LEU 220 HD21 LEU 220 -16.174 -5.148 15.351 1252 HD22 LEU 220 HD22 LEU 220 -16.152 -3.962 14.046 1253 HD23 LEU 220 HD23 LEU 220 -14.790 -5.063 14.262 1254 H ALA 221 HN ALA 221 -17.529 -10.340 13.062 1255 HA ALA 221 HA ALA 221 -19.272 -9.672 10.785 1256 HB1 ALA 221 HB1 ALA 221 -19.964 -12.007 10.823 1257 HB2 ALA 221 HB2 ALA 221 -18.956 -12.295 12.241 1258 HB3 ALA 221 HB3 ALA 221 -18.210 -11.879 10.698 1259 H THR 222 HN THR 222 -19.299 -10.639 14.183 1260 HA THR 222 HA THR 222 -20.870 -10.452 15.824 1261 HB THR 222 HB THR 222 -22.138 -8.182 14.317 1262 HG1 THR 222 HG1 THR 222 -20.281 -7.017 15.578 1263 HG21 THR 222 HG21 THR 222 -22.274 -7.206 16.569 1264 HG22 THR 222 HG22 THR 222 -21.456 -8.623 17.230 1265 HG23 THR 222 HG23 THR 222 -23.055 -8.787 16.502 1266 H LYS 223 HN LYS 223 -21.596 -12.510 14.519 1267 HA LYS 223 HA LYS 223 -24.210 -12.249 13.294 1268 HB2 LYS 223 HB2 LYS 223 -22.612 -14.712 14.020 1269 HB3 LYS 223 HB1 LYS 223 -24.095 -14.703 13.076 1270 HG2 LYS 223 HG2 LYS 223 -22.972 -13.362 11.352 1271 HG3 LYS 223 HG1 LYS 223 -21.481 -13.427 12.293 1272 HD2 LYS 223 HD2 LYS 223 -21.448 -15.100 10.529 1273 HD3 LYS 223 HD1 LYS 223 -21.490 -15.877 12.112 1274 HE2 LYS 223 HE2 LYS 223 -23.003 -17.009 10.608 1275 HE3 LYS 223 HE1 LYS 223 -23.919 -16.185 11.869 1276 HZ1 LYS 223 HZ1 LYS 223 -24.291 -14.352 10.265 1277 HZ2 LYS 223 HZ2 LYS 223 -24.979 -15.822 9.777 1278 HZ3 LYS 223 HZ3 LYS 223 -23.539 -15.285 9.064 1279 H ALA 224 HN ALA 224 -22.911 -12.709 16.394 1280 HA ALA 224 HA ALA 224 -25.591 -12.952 17.496 1281 HB1 ALA 224 HB1 ALA 224 -23.359 -14.822 18.293 1282 HB2 ALA 224 HB2 ALA 224 -24.803 -15.267 17.382 1283 HB3 ALA 224 HB3 ALA 224 -24.947 -14.722 19.053 Start of MODEL 16 1 H1 GLY 1 HT1 GLY 1 30.507 1.893 20.143 2 H2 GLY 1 HT2 GLY 1 30.585 3.112 21.312 3 H3 GLY 1 HT3 GLY 1 29.296 2.012 21.323 4 HA2 GLY 1 HA1 GLY 1 30.837 1.432 23.053 5 HA3 GLY 1 HA2 GLY 1 30.845 0.200 21.799 6 H SER 2 HN SER 2 32.970 -0.183 22.983 7 HA SER 2 HA SER 2 35.097 1.664 22.660 8 HB2 SER 2 HB2 SER 2 35.029 -0.224 24.337 9 HB3 SER 2 HB1 SER 2 35.338 -1.336 23.003 10 HG SER 2 HG SER 2 37.362 -0.712 22.927 11 H HIS 3 HN HIS 3 36.576 1.900 21.083 12 HA HIS 3 HA HIS 3 37.647 1.710 19.094 13 HB2 HIS 3 HB2 HIS 3 37.916 -0.672 19.516 14 HB3 HIS 3 HB1 HIS 3 36.292 -0.991 18.924 15 HD1 HIS 3 HD1 HIS 3 36.147 -1.694 16.564 16 HD2 HIS 3 HD2 HIS 3 39.654 0.406 17.347 17 HE1 HIS 3 HE1 HIS 3 37.481 -1.781 14.435 18 HE2 HIS 3 HE2 HIS 3 39.670 -0.664 14.986 19 H MET 4 HN MET 4 34.348 1.781 19.502 20 HA MET 4 HA MET 4 32.592 2.565 18.308 21 HB2 MET 4 HB2 MET 4 34.746 3.652 16.484 22 HB3 MET 4 HB1 MET 4 33.050 4.110 16.435 23 HG2 MET 4 HG2 MET 4 33.228 5.011 18.698 24 HG3 MET 4 HG1 MET 4 34.932 4.557 18.740 25 HE1 MET 4 HE1 MET 4 36.747 5.565 17.022 26 HE2 MET 4 HE2 MET 4 36.371 6.820 15.841 27 HE3 MET 4 HE3 MET 4 35.695 5.202 15.654 28 H ALA 5 HN ALA 5 31.819 2.719 15.799 29 HA ALA 5 HA ALA 5 32.778 0.562 14.155 30 HB1 ALA 5 HB1 ALA 5 30.664 -0.671 14.078 31 HB2 ALA 5 HB2 ALA 5 30.008 0.370 15.342 32 HB3 ALA 5 HB3 ALA 5 31.366 -0.699 15.697 33 H SER 6 HN SER 6 31.978 0.680 12.039 34 HA SER 6 HA SER 6 30.819 3.256 11.355 35 HB2 SER 6 HB2 SER 6 32.772 2.355 10.106 36 HB3 SER 6 HB1 SER 6 31.782 1.003 9.567 37 HG SER 6 HG SER 6 31.983 3.476 8.529 38 H SER 7 HN SER 7 28.760 2.684 12.395 39 HA SER 7 HA SER 7 27.144 0.665 11.092 40 HB2 SER 7 HB2 SER 7 26.352 2.703 13.198 41 HB3 SER 7 HB1 SER 7 25.434 1.273 12.721 42 HG SER 7 HG SER 7 27.552 1.510 14.436 43 H CYS 8 HN CYS 8 26.401 1.144 9.138 44 HA CYS 8 HA CYS 8 25.368 3.860 8.686 45 HB2 CYS 8 HB2 CYS 8 25.849 3.245 6.215 46 HB3 CYS 8 HB1 CYS 8 27.174 3.730 7.260 47 HG CYS 8 HG CYS 8 28.356 1.329 7.489 48 H ALA 9 HN ALA 9 23.267 3.679 8.987 49 HA ALA 9 HA ALA 9 21.849 1.458 7.702 50 HB1 ALA 9 HB1 ALA 9 19.993 2.006 9.144 51 HB2 ALA 9 HB2 ALA 9 20.837 3.433 9.742 52 HB3 ALA 9 HB3 ALA 9 21.457 1.823 10.108 53 H VAL 10 HN VAL 10 20.788 1.809 5.877 54 HA VAL 10 HA VAL 10 20.282 4.574 5.051 55 HB VAL 10 HB VAL 10 20.068 2.070 3.378 56 HG11 VAL 10 HG11 VAL 10 18.765 3.678 2.343 57 HG12 VAL 10 HG12 VAL 10 20.327 3.847 1.539 58 HG13 VAL 10 HG13 VAL 10 19.851 4.994 2.793 59 HG21 VAL 10 HG21 VAL 10 22.343 2.173 3.843 60 HG22 VAL 10 HG22 VAL 10 22.365 3.936 3.835 61 HG23 VAL 10 HG23 VAL 10 22.198 3.049 2.321 62 H GLN 11 HN GLN 11 18.316 5.362 5.289 63 HA GLN 11 HA GLN 11 16.127 3.490 5.841 64 HB2 GLN 11 HB2 GLN 11 16.117 6.476 6.305 65 HB3 GLN 11 HB1 GLN 11 15.026 5.281 6.982 66 HG2 GLN 11 HG2 GLN 11 16.390 4.819 8.696 67 HG3 GLN 11 HG1 GLN 11 17.825 4.847 7.670 68 HE21 GLN 11 HE21 GLN 11 15.606 7.516 7.772 69 HE22 GLN 11 HE22 GLN 11 16.640 8.604 8.630 70 H VAL 12 HN VAL 12 14.485 3.268 4.497 71 HA VAL 12 HA VAL 12 14.168 5.285 2.385 72 HB VAL 12 HB VAL 12 13.049 3.455 1.088 73 HG11 VAL 12 HG11 VAL 12 15.597 4.096 1.032 74 HG12 VAL 12 HG12 VAL 12 15.042 2.642 0.207 75 HG13 VAL 12 HG13 VAL 12 15.806 2.518 1.790 76 HG21 VAL 12 HG21 VAL 12 12.502 2.087 3.027 77 HG22 VAL 12 HG22 VAL 12 14.205 1.669 3.203 78 HG23 VAL 12 HG23 VAL 12 13.315 1.176 1.758 79 H LYS 13 HN LYS 13 12.115 6.128 2.055 80 HA LYS 13 HA LYS 13 10.155 5.352 4.086 81 HB2 LYS 13 HB2 LYS 13 10.802 7.985 2.828 82 HB3 LYS 13 HB1 LYS 13 9.196 7.695 3.476 83 HG2 LYS 13 HG2 LYS 13 10.188 7.124 5.638 84 HG3 LYS 13 HG1 LYS 13 11.782 7.521 4.987 85 HD2 LYS 13 HD2 LYS 13 11.091 9.807 4.592 86 HD3 LYS 13 HD1 LYS 13 9.450 9.431 5.123 87 HE2 LYS 13 HE2 LYS 13 10.275 8.931 7.357 88 HE3 LYS 13 HE1 LYS 13 11.927 9.253 6.833 89 HZ1 LYS 13 HZ1 LYS 13 10.905 11.133 8.010 90 HZ2 LYS 13 HZ2 LYS 13 9.730 11.249 6.795 91 HZ3 LYS 13 HZ3 LYS 13 11.361 11.532 6.427 92 H LEU 14 HN LEU 14 8.392 4.444 3.497 93 HA LEU 14 HA LEU 14 7.443 4.756 0.732 94 HB2 LEU 14 HB2 LEU 14 6.943 2.556 2.738 95 HB3 LEU 14 HB1 LEU 14 6.117 2.681 1.195 96 HG LEU 14 HG LEU 14 9.102 2.335 1.549 97 HD11 LEU 14 HD11 LEU 14 7.046 0.361 0.598 98 HD12 LEU 14 HD12 LEU 14 7.742 0.372 2.218 99 HD13 LEU 14 HD13 LEU 14 8.772 0.077 0.816 100 HD21 LEU 14 HD21 LEU 14 7.489 2.045 -0.974 101 HD22 LEU 14 HD22 LEU 14 9.243 2.110 -0.793 102 HD23 LEU 14 HD23 LEU 14 8.275 3.558 -0.515 103 H GLU 15 HN GLU 15 4.894 4.526 0.731 104 HA GLU 15 HA GLU 15 3.743 5.977 2.998 105 HB2 GLU 15 HB2 GLU 15 4.470 7.651 1.377 106 HB3 GLU 15 HB1 GLU 15 3.602 6.816 0.099 107 HG2 GLU 15 HG2 GLU 15 1.483 7.327 1.194 108 HG3 GLU 15 HG1 GLU 15 2.351 8.140 2.497 109 H LEU 16 HN LEU 16 1.974 4.957 3.644 110 HA LEU 16 HA LEU 16 0.336 3.432 1.735 111 HB2 LEU 16 HB2 LEU 16 0.284 3.644 4.728 112 HB3 LEU 16 HB1 LEU 16 -1.102 3.033 3.857 113 HG LEU 16 HG LEU 16 -0.076 1.101 4.506 114 HD11 LEU 16 HD11 LEU 16 1.679 1.103 2.224 115 HD12 LEU 16 HD12 LEU 16 0.053 1.668 1.837 116 HD13 LEU 16 HD13 LEU 16 0.286 0.082 2.577 117 HD21 LEU 16 HD21 LEU 16 2.593 2.307 3.895 118 HD22 LEU 16 HD22 LEU 16 2.279 0.744 4.663 119 HD23 LEU 16 HD23 LEU 16 1.854 2.241 5.498 120 H GLY 17 HN GLY 17 -1.735 3.980 1.271 121 HA2 GLY 17 HA2 GLY 17 -2.990 6.211 2.630 122 HA3 GLY 17 HA1 GLY 17 -2.549 6.509 0.955 123 H HIS 18 HN HIS 18 -5.121 6.706 1.748 124 HA HIS 18 HA HIS 18 -6.318 5.200 -0.287 125 HB2 HIS 18 HB2 HIS 18 -7.183 3.368 0.711 126 HB3 HIS 18 HB1 HIS 18 -6.114 3.698 2.068 127 HD1 HIS 18 HD1 HIS 18 -7.231 5.166 4.052 128 HD2 HIS 18 HD2 HIS 18 -9.843 3.446 1.304 129 HE1 HIS 18 HE1 HIS 18 -9.526 5.319 5.094 130 HE2 HIS 18 HE2 HIS 18 -11.050 4.140 3.484 131 H ARG 19 HN ARG 19 -8.245 6.041 -0.843 132 HA ARG 19 HA ARG 19 -9.440 8.040 0.965 133 HB2 ARG 19 HB2 ARG 19 -9.464 8.040 -2.059 134 HB3 ARG 19 HB1 ARG 19 -10.236 9.222 -1.031 135 HG2 ARG 19 HG2 ARG 19 -8.105 9.996 -0.232 136 HG3 ARG 19 HG1 ARG 19 -7.275 8.750 -1.170 137 HD2 ARG 19 HD2 ARG 19 -7.201 10.851 -2.366 138 HD3 ARG 19 HD1 ARG 19 -8.229 9.697 -3.223 139 HE ARG 19 HE ARG 19 -10.066 10.985 -1.842 140 HH11 ARG 19 HH11 ARG 19 -7.297 12.282 -3.546 141 HH12 ARG 19 HH12 ARG 19 -8.078 13.793 -3.909 142 HH21 ARG 19 HH21 ARG 19 -11.090 12.946 -2.318 143 HH22 ARG 19 HH22 ARG 19 -10.243 14.177 -3.210 144 H ALA 20 HN ALA 20 -11.789 8.197 0.781 145 HA ALA 20 HA ALA 20 -13.104 6.009 -0.626 146 HB1 ALA 20 HB1 ALA 20 -12.993 4.853 1.354 147 HB2 ALA 20 HB2 ALA 20 -14.520 5.710 1.550 148 HB3 ALA 20 HB3 ALA 20 -13.062 6.316 2.333 149 H GLN 21 HN GLN 21 -15.048 6.567 -1.430 150 HA GLN 21 HA GLN 21 -16.621 8.580 -0.051 151 HB2 GLN 21 HB2 GLN 21 -16.763 10.091 -1.747 152 HB3 GLN 21 HB1 GLN 21 -15.194 9.458 -2.170 153 HG2 GLN 21 HG2 GLN 21 -17.777 8.604 -3.376 154 HG3 GLN 21 HG1 GLN 21 -16.625 9.728 -4.065 155 HE21 GLN 21 HE21 GLN 21 -17.674 7.258 -5.128 156 HE22 GLN 21 HE22 GLN 21 -16.314 6.240 -5.437 157 H VAL 22 HN VAL 22 -18.913 8.500 -0.912 158 HA VAL 22 HA VAL 22 -19.499 5.745 -1.718 159 HB VAL 22 HB VAL 22 -20.540 6.477 0.397 160 HG11 VAL 22 HG11 VAL 22 -22.319 8.097 0.416 161 HG12 VAL 22 HG12 VAL 22 -22.083 8.426 -1.300 162 HG13 VAL 22 HG13 VAL 22 -20.825 8.847 -0.136 163 HG21 VAL 22 HG21 VAL 22 -21.691 4.749 -0.669 164 HG22 VAL 22 HG22 VAL 22 -22.310 5.812 -1.928 165 HG23 VAL 22 HG23 VAL 22 -22.934 5.933 -0.283 166 H ARG 23 HN ARG 23 -20.409 5.321 -3.616 167 HA ARG 23 HA ARG 23 -21.054 7.564 -5.370 168 HB2 ARG 23 HB2 ARG 23 -21.572 5.505 -6.960 169 HB3 ARG 23 HB1 ARG 23 -19.926 6.038 -6.668 170 HG2 ARG 23 HG2 ARG 23 -19.368 4.184 -5.545 171 HG3 ARG 23 HG1 ARG 23 -20.952 4.027 -4.790 172 HD2 ARG 23 HD2 ARG 23 -20.423 2.186 -6.355 173 HD3 ARG 23 HD1 ARG 23 -21.864 3.088 -6.814 174 HE ARG 23 HE ARG 23 -20.378 4.267 -8.447 175 HH11 ARG 23 HH11 ARG 23 -19.496 1.100 -7.252 176 HH12 ARG 23 HH12 ARG 23 -18.665 0.638 -8.706 177 HH21 ARG 23 HH21 ARG 23 -19.292 3.674 -10.360 178 HH22 ARG 23 HH22 ARG 23 -18.570 2.101 -10.484 179 H LYS 24 HN LYS 24 -23.104 7.957 -6.154 180 HA LYS 24 HA LYS 24 -25.113 7.432 -4.207 181 HB2 LYS 24 HB2 LYS 24 -25.235 8.868 -6.862 182 HB3 LYS 24 HB1 LYS 24 -26.560 8.815 -5.706 183 HG2 LYS 24 HG2 LYS 24 -23.837 9.870 -5.038 184 HG3 LYS 24 HG1 LYS 24 -25.148 10.887 -5.641 185 HD2 LYS 24 HD2 LYS 24 -26.517 10.247 -3.725 186 HD3 LYS 24 HD1 LYS 24 -25.224 9.197 -3.141 187 HE2 LYS 24 HE2 LYS 24 -23.760 11.125 -2.881 188 HE3 LYS 24 HE1 LYS 24 -25.025 12.183 -3.504 189 HZ1 LYS 24 HZ1 LYS 24 -26.409 11.581 -1.618 190 HZ2 LYS 24 HZ2 LYS 24 -24.935 12.239 -1.092 191 HZ3 LYS 24 HZ3 LYS 24 -25.193 10.561 -1.021 192 H LYS 25 HN LYS 25 -24.055 5.728 -6.849 193 HA LYS 25 HA LYS 25 -26.496 4.113 -6.824 194 HB2 LYS 25 HB2 LYS 25 -26.632 5.504 -8.826 195 HB3 LYS 25 HB1 LYS 25 -25.020 5.009 -9.317 196 HG2 LYS 25 HG2 LYS 25 -26.995 2.852 -8.910 197 HG3 LYS 25 HG1 LYS 25 -27.263 3.925 -10.284 198 HD2 LYS 25 HD2 LYS 25 -25.065 3.428 -11.147 199 HD3 LYS 25 HD1 LYS 25 -24.684 2.471 -9.714 200 HE2 LYS 25 HE2 LYS 25 -25.268 0.972 -11.486 201 HE3 LYS 25 HE1 LYS 25 -26.564 0.971 -10.288 202 HZ1 LYS 25 HZ1 LYS 25 -27.897 2.333 -11.674 203 HZ2 LYS 25 HZ2 LYS 25 -27.327 1.057 -12.633 204 HZ3 LYS 25 HZ3 LYS 25 -26.627 2.597 -12.767 205 HA PRO 26 HA PRO 26 -23.167 1.154 -5.919 206 HB2 PRO 26 HB2 PRO 26 -25.607 -0.517 -5.670 207 HB3 PRO 26 HB1 PRO 26 -24.235 -0.357 -4.569 208 HG2 PRO 26 HG2 PRO 26 -26.578 0.760 -3.990 209 HG3 PRO 26 HG1 PRO 26 -25.053 1.591 -3.619 210 HD2 PRO 26 HD2 PRO 26 -26.986 2.064 -5.863 211 HD3 PRO 26 HD1 PRO 26 -26.072 3.244 -4.903 212 H THR 27 HN THR 27 -22.463 -0.682 -7.017 213 HA THR 27 HA THR 27 -23.138 -0.710 -9.791 214 HB THR 27 HB THR 27 -20.847 -1.129 -9.166 215 HG1 THR 27 HG1 THR 27 -20.743 -3.498 -10.014 216 HG21 THR 27 HG21 THR 27 -21.045 -2.036 -6.986 217 HG22 THR 27 HG22 THR 27 -20.240 -3.254 -7.979 218 HG23 THR 27 HG23 THR 27 -21.949 -3.429 -7.581 219 H VAL 28 HN VAL 28 -23.423 -3.025 -10.819 220 HA VAL 28 HA VAL 28 -25.943 -3.981 -10.393 221 HB VAL 28 HB VAL 28 -24.812 -4.600 -12.352 222 HG11 VAL 28 HG11 VAL 28 -22.527 -4.554 -11.398 223 HG12 VAL 28 HG12 VAL 28 -22.812 -5.953 -12.440 224 HG13 VAL 28 HG13 VAL 28 -22.827 -6.142 -10.686 225 HG21 VAL 28 HG21 VAL 28 -25.214 -7.044 -10.643 226 HG22 VAL 28 HG22 VAL 28 -25.041 -7.067 -12.399 227 HG23 VAL 28 HG23 VAL 28 -26.419 -6.251 -11.658 228 H GLU 29 HN GLU 29 -23.014 -4.976 -8.721 229 HA GLU 29 HA GLU 29 -24.405 -7.132 -7.361 230 HB2 GLU 29 HB2 GLU 29 -21.532 -6.243 -7.125 231 HB3 GLU 29 HB1 GLU 29 -22.211 -7.759 -6.537 232 HG2 GLU 29 HG2 GLU 29 -22.736 -8.402 -8.866 233 HG3 GLU 29 HG1 GLU 29 -22.030 -6.885 -9.419 234 H GLY 30 HN GLY 30 -24.176 -3.901 -6.888 235 HA2 GLY 30 HA2 GLY 30 -25.198 -2.744 -5.174 236 HA3 GLY 30 HA1 GLY 30 -25.263 -4.230 -4.235 237 H PHE 31 HN PHE 31 -22.329 -2.916 -5.614 238 HA PHE 31 HA PHE 31 -21.257 -2.530 -2.943 239 HB2 PHE 31 HB2 PHE 31 -19.841 -2.086 -5.582 240 HB3 PHE 31 HB1 PHE 31 -19.107 -2.299 -3.995 241 HD1 PHE 31 HD1 PHE 31 -21.030 -4.677 -3.257 242 HD2 PHE 31 HD2 PHE 31 -18.541 -3.837 -6.595 243 HE1 PHE 31 HE1 PHE 31 -20.814 -7.081 -3.693 244 HE2 PHE 31 HE2 PHE 31 -18.321 -6.241 -7.039 245 HZ PHE 31 HZ PHE 31 -19.460 -7.868 -5.588 246 H THR 32 HN THR 32 -21.264 -0.597 -1.985 247 HA THR 32 HA THR 32 -22.394 1.627 -3.519 248 HB THR 32 HB THR 32 -23.719 2.092 -1.771 249 HG1 THR 32 HG1 THR 32 -22.970 2.436 0.284 250 HG21 THR 32 HG21 THR 32 -23.827 -0.376 -1.883 251 HG22 THR 32 HG22 THR 32 -24.245 0.275 -0.305 252 HG23 THR 32 HG23 THR 32 -22.661 -0.458 -0.572 253 H HIS 33 HN HIS 33 -19.647 0.789 -1.542 254 HA HIS 33 HA HIS 33 -18.817 3.612 -1.444 255 HB2 HIS 33 HB2 HIS 33 -18.456 1.306 0.392 256 HB3 HIS 33 HB1 HIS 33 -17.113 2.449 0.291 257 HD1 HIS 33 HD1 HIS 33 -20.748 2.245 1.296 258 HD2 HIS 33 HD2 HIS 33 -17.530 4.869 1.521 259 HE1 HIS 33 HE1 HIS 33 -21.464 4.067 2.870 260 HE2 HIS 33 HE2 HIS 33 -19.411 5.490 3.180 261 H ASP 34 HN ASP 34 -17.149 4.242 -2.615 262 HA ASP 34 HA ASP 34 -15.428 2.184 -3.837 263 HB2 ASP 34 HB2 ASP 34 -16.337 4.888 -4.782 264 HB3 ASP 34 HB1 ASP 34 -14.824 4.214 -5.373 265 H TRP 35 HN TRP 35 -13.292 2.258 -3.543 266 HA TRP 35 HA TRP 35 -12.175 4.572 -2.186 267 HB2 TRP 35 HB2 TRP 35 -10.962 3.074 -0.583 268 HB3 TRP 35 HB1 TRP 35 -12.691 3.202 -0.320 269 HD1 TRP 35 HD1 TRP 35 -14.070 0.954 -0.308 270 HE1 TRP 35 HE1 TRP 35 -13.411 -1.531 -0.581 271 HE3 TRP 35 HE3 TRP 35 -9.250 1.539 -1.945 272 HZ2 TRP 35 HZ2 TRP 35 -11.148 -3.032 -1.370 273 HZ3 TRP 35 HZ3 TRP 35 -7.906 -0.470 -2.425 274 HH2 TRP 35 HH2 TRP 35 -8.821 -2.701 -2.115 275 H MET 36 HN MET 36 -9.946 4.755 -2.300 276 HA MET 36 HA MET 36 -8.600 3.050 -4.278 277 HB2 MET 36 HB2 MET 36 -9.098 5.060 -5.470 278 HB3 MET 36 HB1 MET 36 -8.615 6.065 -4.110 279 HG2 MET 36 HG2 MET 36 -6.289 5.128 -4.412 280 HG3 MET 36 HG1 MET 36 -6.859 4.478 -5.952 281 HE1 MET 36 HE1 MET 36 -6.448 7.324 -3.680 282 HE2 MET 36 HE2 MET 36 -7.886 8.097 -4.367 283 HE3 MET 36 HE3 MET 36 -6.286 8.781 -4.670 284 H VAL 37 HN VAL 37 -6.686 2.297 -3.581 285 HA VAL 37 HA VAL 37 -5.628 3.392 -1.074 286 HB VAL 37 HB VAL 37 -4.150 1.175 -1.419 287 HG11 VAL 37 HG11 VAL 37 -6.906 1.270 -0.299 288 HG12 VAL 37 HG12 VAL 37 -5.453 1.775 0.547 289 HG13 VAL 37 HG13 VAL 37 -5.685 0.079 0.110 290 HG21 VAL 37 HG21 VAL 37 -5.240 0.552 -3.495 291 HG22 VAL 37 HG22 VAL 37 -6.811 0.586 -2.691 292 HG23 VAL 37 HG23 VAL 37 -5.606 -0.617 -2.226 293 H PHE 38 HN PHE 38 -3.385 3.509 -0.753 294 HA PHE 38 HA PHE 38 -1.835 4.303 -3.140 295 HB2 PHE 38 HB2 PHE 38 -2.478 5.736 -0.618 296 HB3 PHE 38 HB1 PHE 38 -0.814 5.849 -1.156 297 HD1 PHE 38 HD2 PHE 38 -4.283 6.826 -1.844 298 HD2 PHE 38 HD1 PHE 38 -0.224 7.053 -3.106 299 HE1 PHE 38 HE2 PHE 38 -4.847 8.717 -3.309 300 HE2 PHE 38 HE1 PHE 38 -0.771 8.962 -4.554 301 HZ PHE 38 HZ PHE 38 -3.104 9.795 -4.667 302 H VAL 39 HN VAL 39 -0.008 3.117 -3.303 303 HA VAL 39 HA VAL 39 1.657 3.098 -0.901 304 HB VAL 39 HB VAL 39 2.739 0.964 -1.786 305 HG11 VAL 39 HG11 VAL 39 0.993 1.318 0.125 306 HG12 VAL 39 HG12 VAL 39 1.458 -0.307 -0.381 307 HG13 VAL 39 HG13 VAL 39 -0.055 0.398 -0.954 308 HG21 VAL 39 HG21 VAL 39 1.952 0.557 -3.899 309 HG22 VAL 39 HG22 VAL 39 0.320 1.094 -3.504 310 HG23 VAL 39 HG23 VAL 39 0.893 -0.475 -2.940 311 H ARG 40 HN ARG 40 3.417 4.267 -1.252 312 HA ARG 40 HA ARG 40 4.943 4.197 -3.669 313 HB2 ARG 40 HB2 ARG 40 4.524 6.399 -4.550 314 HB3 ARG 40 HB1 ARG 40 2.979 5.560 -4.461 315 HG2 ARG 40 HG2 ARG 40 2.190 6.888 -2.773 316 HG3 ARG 40 HG1 ARG 40 3.801 7.251 -2.156 317 HD2 ARG 40 HD2 ARG 40 4.149 8.601 -4.291 318 HD3 ARG 40 HD1 ARG 40 2.402 8.435 -4.548 319 HE ARG 40 HE ARG 40 2.528 9.359 -2.019 320 HH11 ARG 40 HH11 ARG 40 4.031 10.469 -4.994 321 HH12 ARG 40 HH12 ARG 40 4.042 12.141 -4.503 322 HH21 ARG 40 HH21 ARG 40 2.591 11.522 -1.369 323 HH22 ARG 40 HH22 ARG 40 3.268 12.739 -2.413 324 H GLY 41 HN GLY 41 6.347 6.443 -3.642 325 HA2 GLY 41 HA2 GLY 41 7.238 6.714 -0.854 326 HA3 GLY 41 HA1 GLY 41 8.216 7.060 -2.267 327 HA PRO 42 HA PRO 42 5.793 10.830 -0.430 328 HB2 PRO 42 HB2 PRO 42 8.340 11.616 0.783 329 HB3 PRO 42 HB1 PRO 42 6.734 11.541 1.509 330 HG2 PRO 42 HG2 PRO 42 8.720 9.785 2.092 331 HG3 PRO 42 HG1 PRO 42 7.006 9.385 2.178 332 HD2 PRO 42 HD2 PRO 42 9.018 8.625 0.146 333 HD3 PRO 42 HD1 PRO 42 7.584 7.751 0.707 334 H GLU 43 HN GLU 43 6.449 13.128 -0.639 335 HA GLU 43 HA GLU 43 7.128 13.845 -3.182 336 HB2 GLU 43 HB2 GLU 43 7.370 15.313 -0.574 337 HB3 GLU 43 HB1 GLU 43 7.799 16.079 -2.095 338 HG2 GLU 43 HG2 GLU 43 5.545 16.660 -1.424 339 HG3 GLU 43 HG1 GLU 43 5.538 15.737 -2.923 340 H HIS 44 HN HIS 44 8.861 13.643 -4.308 341 HA HIS 44 HA HIS 44 10.948 14.130 -5.064 342 HB2 HIS 44 HB2 HIS 44 12.225 15.643 -3.957 343 HB3 HIS 44 HB1 HIS 44 10.971 15.642 -2.723 344 HD1 HIS 44 HD1 HIS 44 14.383 14.173 -3.456 345 HD2 HIS 44 HD2 HIS 44 11.744 14.651 -0.273 346 HE1 HIS 44 HE1 HIS 44 15.671 13.518 -1.400 347 HE2 HIS 44 HE2 HIS 44 14.096 13.908 0.523 348 H SER 45 HN SER 45 10.325 11.915 -2.507 349 HA SER 45 HA SER 45 12.740 10.391 -3.069 350 HB2 SER 45 HB2 SER 45 11.568 8.756 -1.418 351 HB3 SER 45 HB1 SER 45 12.191 10.275 -0.782 352 HG SER 45 HG SER 45 9.541 10.104 -1.707 353 H ASN 46 HN ASN 46 12.768 9.206 -4.873 354 HA ASN 46 HA ASN 46 10.290 8.049 -5.902 355 HB2 ASN 46 HB2 ASN 46 13.112 8.204 -6.971 356 HB3 ASN 46 HB1 ASN 46 11.878 7.215 -7.736 357 HD21 ASN 46 HD21 ASN 46 13.376 9.558 -8.691 358 HD22 ASN 46 HD22 ASN 46 12.178 10.709 -9.181 359 H ILE 47 HN ILE 47 9.710 5.994 -5.449 360 HA ILE 47 HA ILE 47 11.611 4.415 -3.929 361 HB ILE 47 HB ILE 47 9.864 2.943 -3.348 362 HG12 ILE 47 HG12 ILE 47 8.014 4.484 -5.162 363 HG13 ILE 47 HG11 ILE 47 8.801 2.969 -5.615 364 HG21 ILE 47 HG21 ILE 47 10.002 4.975 -2.107 365 HG22 ILE 47 HG22 ILE 47 8.317 4.491 -2.261 366 HG23 ILE 47 HG23 ILE 47 8.956 5.799 -3.258 367 HD11 ILE 47 HD11 ILE 47 7.339 2.978 -3.064 368 HD12 ILE 47 HD12 ILE 47 7.459 1.723 -4.299 369 HD13 ILE 47 HD13 ILE 47 6.364 3.088 -4.528 370 H GLN 48 HN GLN 48 10.394 4.550 -7.123 371 HA GLN 48 HA GLN 48 10.502 1.865 -7.904 372 HB2 GLN 48 HB2 GLN 48 9.472 3.619 -9.263 373 HB3 GLN 48 HB1 GLN 48 11.031 4.395 -9.484 374 HG2 GLN 48 HG2 GLN 48 10.470 3.257 -11.488 375 HG3 GLN 48 HG1 GLN 48 11.788 2.396 -10.730 376 HE21 GLN 48 HE21 GLN 48 8.460 2.182 -9.676 377 HE22 GLN 48 HE22 GLN 48 8.230 0.538 -10.151 378 H HIS 49 HN HIS 49 12.950 3.831 -6.850 379 HA HIS 49 HA HIS 49 15.118 2.698 -8.357 380 HB2 HIS 49 HB2 HIS 49 14.888 4.563 -6.031 381 HB3 HIS 49 HB1 HIS 49 16.437 3.777 -6.344 382 HD1 HIS 49 HD1 HIS 49 16.498 3.932 -9.423 383 HD2 HIS 49 HD2 HIS 49 15.366 7.073 -6.938 384 HE1 HIS 49 HE1 HIS 49 16.805 6.026 -10.784 385 HE2 HIS 49 HE2 HIS 49 15.922 7.887 -9.333 386 H PHE 50 HN PHE 50 13.673 2.199 -5.152 387 HA PHE 50 HA PHE 50 15.415 -0.141 -4.857 388 HB2 PHE 50 HB2 PHE 50 15.141 0.086 -2.414 389 HB3 PHE 50 HB1 PHE 50 15.914 1.483 -3.158 390 HD1 PHE 50 HD1 PHE 50 12.794 0.276 -1.591 391 HD2 PHE 50 HD2 PHE 50 14.978 3.610 -3.064 392 HE1 PHE 50 HE1 PHE 50 11.229 1.784 -0.484 393 HE2 PHE 50 HE2 PHE 50 13.378 5.133 -1.975 394 HZ PHE 50 HZ PHE 50 11.496 4.219 -0.680 395 H VAL 51 HN VAL 51 12.392 0.696 -5.657 396 HA VAL 51 HA VAL 51 11.193 -1.762 -4.564 397 HB VAL 51 HB VAL 51 9.911 0.932 -5.084 398 HG11 VAL 51 HG11 VAL 51 7.915 -0.476 -3.959 399 HG12 VAL 51 HG12 VAL 51 8.701 -1.772 -4.874 400 HG13 VAL 51 HG13 VAL 51 8.121 -0.332 -5.712 401 HG21 VAL 51 HG21 VAL 51 9.240 0.583 -2.659 402 HG22 VAL 51 HG22 VAL 51 10.941 0.914 -2.971 403 HG23 VAL 51 HG23 VAL 51 10.409 -0.733 -2.629 404 H GLU 52 HN GLU 52 10.091 -3.051 -5.971 405 HA GLU 52 HA GLU 52 10.663 -2.487 -8.805 406 HB2 GLU 52 HB2 GLU 52 11.716 -4.488 -7.751 407 HB3 GLU 52 HB1 GLU 52 10.115 -5.134 -7.437 408 HG2 GLU 52 HG2 GLU 52 11.011 -6.214 -9.353 409 HG3 GLU 52 HG1 GLU 52 9.700 -5.162 -9.887 410 H LYS 53 HN LYS 53 8.282 -4.357 -6.946 411 HA LYS 53 HA LYS 53 6.160 -3.317 -8.673 412 HB2 LYS 53 HB2 LYS 53 5.183 -5.605 -8.785 413 HB3 LYS 53 HB1 LYS 53 6.738 -5.476 -9.594 414 HG2 LYS 53 HG2 LYS 53 7.838 -6.522 -7.720 415 HG3 LYS 53 HG1 LYS 53 6.325 -6.601 -6.831 416 HD2 LYS 53 HD2 LYS 53 6.917 -7.976 -9.454 417 HD3 LYS 53 HD1 LYS 53 6.951 -8.750 -7.873 418 HE2 LYS 53 HE2 LYS 53 4.592 -8.382 -7.582 419 HE3 LYS 53 HE1 LYS 53 4.537 -7.414 -9.055 420 HZ1 LYS 53 HZ1 LYS 53 3.716 -9.677 -9.394 421 HZ2 LYS 53 HZ2 LYS 53 5.218 -10.303 -8.917 422 HZ3 LYS 53 HZ3 LYS 53 5.097 -9.377 -10.332 423 H VAL 54 HN VAL 54 3.979 -4.243 -7.682 424 HA VAL 54 HA VAL 54 4.050 -4.163 -4.776 425 HB VAL 54 HB VAL 54 3.120 -1.932 -6.492 426 HG11 VAL 54 HG11 VAL 54 1.892 -1.868 -3.867 427 HG12 VAL 54 HG12 VAL 54 1.222 -3.129 -4.898 428 HG13 VAL 54 HG13 VAL 54 1.211 -1.449 -5.436 429 HG21 VAL 54 HG21 VAL 54 3.721 -0.884 -4.141 430 HG22 VAL 54 HG22 VAL 54 4.953 -1.301 -5.320 431 HG23 VAL 54 HG23 VAL 54 4.607 -2.392 -3.977 432 H VAL 55 HN VAL 55 2.024 -4.777 -3.808 433 HA VAL 55 HA VAL 55 0.036 -5.895 -5.617 434 HB VAL 55 HB VAL 55 2.079 -7.527 -4.491 435 HG11 VAL 55 HG11 VAL 55 -0.664 -8.132 -3.407 436 HG12 VAL 55 HG12 VAL 55 0.792 -7.768 -2.478 437 HG13 VAL 55 HG13 VAL 55 0.690 -9.264 -3.408 438 HG21 VAL 55 HG21 VAL 55 -0.433 -8.347 -5.944 439 HG22 VAL 55 HG22 VAL 55 1.093 -9.233 -5.853 440 HG23 VAL 55 HG23 VAL 55 1.016 -7.700 -6.718 441 H PHE 56 HN PHE 56 -1.939 -6.195 -4.697 442 HA PHE 56 HA PHE 56 -2.264 -5.287 -1.914 443 HB2 PHE 56 HB2 PHE 56 -3.850 -4.566 -4.390 444 HB3 PHE 56 HB1 PHE 56 -4.566 -4.464 -2.780 445 HD1 PHE 56 HD1 PHE 56 -1.689 -3.262 -4.818 446 HD2 PHE 56 HD2 PHE 56 -4.281 -2.547 -1.515 447 HE1 PHE 56 HE1 PHE 56 -0.739 -1.017 -4.575 448 HE2 PHE 56 HE2 PHE 56 -3.324 -0.290 -1.269 449 HZ PHE 56 HZ PHE 56 -1.546 0.474 -2.795 450 H HIS 57 HN HIS 57 -3.391 -6.688 -0.650 451 HA HIS 57 HA HIS 57 -4.856 -8.855 -2.036 452 HB2 HIS 57 HB2 HIS 57 -3.803 -8.789 0.814 453 HB3 HIS 57 HB1 HIS 57 -4.671 -10.130 0.068 454 HD1 HIS 57 HD1 HIS 57 -3.230 -11.913 -0.825 455 HD2 HIS 57 HD2 HIS 57 -1.220 -8.272 -0.638 456 HE1 HIS 57 HE1 HIS 57 -0.857 -12.407 -1.503 457 HE2 HIS 57 HE2 HIS 57 0.384 -10.244 -1.119 458 H LEU 58 HN LEU 58 -6.710 -7.583 -2.342 459 HA LEU 58 HA LEU 58 -8.016 -6.278 -0.162 460 HB2 LEU 58 HB2 LEU 58 -9.571 -7.191 -2.542 461 HB3 LEU 58 HB1 LEU 58 -9.702 -5.690 -1.643 462 HG LEU 58 HG LEU 58 -7.658 -6.411 -3.724 463 HD11 LEU 58 HD11 LEU 58 -8.710 -5.001 -5.076 464 HD12 LEU 58 HD12 LEU 58 -9.282 -3.958 -3.782 465 HD13 LEU 58 HD13 LEU 58 -10.093 -5.492 -4.109 466 HD21 LEU 58 HD21 LEU 58 -7.658 -4.118 -1.774 467 HD22 LEU 58 HD22 LEU 58 -6.844 -4.036 -3.336 468 HD23 LEU 58 HD23 LEU 58 -6.357 -5.247 -2.152 469 H HIS 59 HN HIS 59 -10.569 -6.984 -0.010 470 HA HIS 59 HA HIS 59 -10.491 -9.383 1.549 471 HB2 HIS 59 HB2 HIS 59 -11.927 -7.371 2.026 472 HB3 HIS 59 HB1 HIS 59 -12.902 -7.792 0.628 473 HD1 HIS 59 HD1 HIS 59 -11.993 -9.120 4.067 474 HD2 HIS 59 HD2 HIS 59 -14.904 -9.588 1.126 475 HE1 HIS 59 HE1 HIS 59 -13.804 -10.519 5.112 476 HE2 HIS 59 HE2 HIS 59 -15.605 -10.697 3.358 477 H GLU 60 HN GLU 60 -11.396 -11.356 1.127 478 HA GLU 60 HA GLU 60 -10.914 -12.329 -1.439 479 HB2 GLU 60 HB2 GLU 60 -12.435 -13.582 0.832 480 HB3 GLU 60 HB1 GLU 60 -11.934 -14.445 -0.616 481 HG2 GLU 60 HG2 GLU 60 -9.580 -13.890 -0.073 482 HG3 GLU 60 HG1 GLU 60 -10.139 -13.173 1.438 483 H SER 61 HN SER 61 -13.888 -11.141 -0.099 484 HA SER 61 HA SER 61 -15.666 -12.257 -1.970 485 HB2 SER 61 HB2 SER 61 -16.410 -11.126 0.101 486 HB3 SER 61 HB1 SER 61 -15.881 -9.581 -0.565 487 HG SER 61 HG SER 61 -17.409 -10.483 -2.407 488 H PHE 62 HN PHE 62 -13.315 -9.745 -2.255 489 HA PHE 62 HA PHE 62 -14.464 -8.499 -4.587 490 HB2 PHE 62 HB2 PHE 62 -11.690 -8.350 -3.374 491 HB3 PHE 62 HB1 PHE 62 -12.217 -7.397 -4.748 492 HD1 PHE 62 HD1 PHE 62 -13.333 -8.124 -1.252 493 HD2 PHE 62 HD2 PHE 62 -12.845 -5.245 -4.332 494 HE1 PHE 62 HE1 PHE 62 -14.099 -6.357 0.279 495 HE2 PHE 62 HE2 PHE 62 -13.617 -3.473 -2.820 496 HZ PHE 62 HZ PHE 62 -14.243 -4.026 -0.504 497 HA PRO 63 HA PRO 63 -13.056 -11.734 -7.403 498 HB2 PRO 63 HB2 PRO 63 -13.520 -9.587 -9.400 499 HB3 PRO 63 HB1 PRO 63 -14.165 -11.232 -9.346 500 HG2 PRO 63 HG2 PRO 63 -15.714 -9.140 -8.772 501 HG3 PRO 63 HG1 PRO 63 -15.860 -10.660 -7.870 502 HD2 PRO 63 HD2 PRO 63 -14.523 -8.102 -7.071 503 HD3 PRO 63 HD1 PRO 63 -15.514 -9.210 -6.097 504 H ARG 64 HN ARG 64 -10.967 -12.160 -7.780 505 HA ARG 64 HA ARG 64 -8.711 -11.859 -7.821 506 HB2 ARG 64 HB2 ARG 64 -9.638 -9.762 -9.766 507 HB3 ARG 64 HB1 ARG 64 -7.931 -9.977 -9.410 508 HG2 ARG 64 HG2 ARG 64 -8.092 -12.315 -10.143 509 HG3 ARG 64 HG1 ARG 64 -9.786 -12.051 -10.555 510 HD2 ARG 64 HD2 ARG 64 -8.304 -11.888 -12.498 511 HD3 ARG 64 HD1 ARG 64 -9.184 -10.395 -12.188 512 HE ARG 64 HE ARG 64 -6.978 -9.766 -10.971 513 HH11 ARG 64 HH11 ARG 64 -7.227 -11.645 -13.912 514 HH12 ARG 64 HH12 ARG 64 -5.708 -11.085 -14.546 515 HH21 ARG 64 HH21 ARG 64 -5.000 -9.018 -11.788 516 HH22 ARG 64 HH22 ARG 64 -4.438 -9.572 -13.343 517 HA PRO 65 HA PRO 65 -9.041 -8.433 -4.736 518 HB2 PRO 65 HB2 PRO 65 -8.029 -9.808 -2.620 519 HB3 PRO 65 HB1 PRO 65 -9.744 -9.798 -3.047 520 HG2 PRO 65 HG2 PRO 65 -7.673 -11.878 -3.552 521 HG3 PRO 65 HG1 PRO 65 -9.389 -12.069 -3.153 522 HD2 PRO 65 HD2 PRO 65 -8.349 -12.336 -5.681 523 HD3 PRO 65 HD1 PRO 65 -10.033 -11.900 -5.335 524 H LYS 66 HN LYS 66 -6.460 -10.572 -5.614 525 HA LYS 66 HA LYS 66 -4.419 -8.871 -4.580 526 HB2 LYS 66 HB2 LYS 66 -3.964 -11.246 -4.688 527 HB3 LYS 66 HB1 LYS 66 -4.270 -11.264 -6.418 528 HG2 LYS 66 HG2 LYS 66 -2.317 -9.910 -6.838 529 HG3 LYS 66 HG1 LYS 66 -2.049 -9.708 -5.108 530 HD2 LYS 66 HD2 LYS 66 -1.304 -11.853 -4.829 531 HD3 LYS 66 HD1 LYS 66 -2.156 -12.463 -6.249 532 HE2 LYS 66 HE2 LYS 66 -0.563 -11.321 -7.697 533 HE3 LYS 66 HE1 LYS 66 0.256 -10.647 -6.289 534 HZ1 LYS 66 HZ1 LYS 66 0.030 -13.546 -6.915 535 HZ2 LYS 66 HZ2 LYS 66 0.851 -12.871 -5.592 536 HZ3 LYS 66 HZ3 LYS 66 1.413 -12.594 -7.168 537 H ARG 67 HN ARG 67 -4.272 -6.968 -5.474 538 HA ARG 67 HA ARG 67 -4.430 -6.733 -8.402 539 HB2 ARG 67 HB2 ARG 67 -4.340 -4.376 -6.536 540 HB3 ARG 67 HB1 ARG 67 -5.107 -4.510 -8.115 541 HG2 ARG 67 HG2 ARG 67 -6.083 -5.804 -5.575 542 HG3 ARG 67 HG1 ARG 67 -6.742 -4.343 -6.311 543 HD2 ARG 67 HD2 ARG 67 -6.676 -7.071 -7.611 544 HD3 ARG 67 HD1 ARG 67 -8.071 -6.363 -6.792 545 HE ARG 67 HE ARG 67 -6.906 -4.859 -9.016 546 HH11 ARG 67 HH11 ARG 67 -9.434 -6.977 -7.849 547 HH12 ARG 67 HH12 ARG 67 -10.596 -6.461 -9.034 548 HH21 ARG 67 HH21 ARG 67 -8.421 -4.196 -10.605 549 HH22 ARG 67 HH22 ARG 67 -10.011 -4.897 -10.618 550 H VAL 68 HN VAL 68 -2.620 -6.070 -9.528 551 HA VAL 68 HA VAL 68 -0.232 -5.689 -7.854 552 HB VAL 68 HB VAL 68 1.074 -7.013 -9.190 553 HG11 VAL 68 HG11 VAL 68 -0.587 -8.453 -8.158 554 HG12 VAL 68 HG12 VAL 68 -0.128 -9.080 -9.744 555 HG13 VAL 68 HG13 VAL 68 -1.661 -8.234 -9.544 556 HG21 VAL 68 HG21 VAL 68 0.766 -5.894 -11.271 557 HG22 VAL 68 HG22 VAL 68 -0.859 -6.562 -11.455 558 HG23 VAL 68 HG23 VAL 68 0.548 -7.626 -11.534 559 H CYS 69 HN CYS 69 1.199 -4.103 -8.359 560 HA CYS 69 HA CYS 69 0.620 -2.455 -10.723 561 HB2 CYS 69 HB2 CYS 69 1.220 -1.540 -7.906 562 HB3 CYS 69 HB1 CYS 69 1.369 -0.478 -9.304 563 HG CYS 69 HG CYS 69 -1.590 -2.015 -9.118 564 H LYS 70 HN LYS 70 2.300 -2.503 -12.043 565 HA LYS 70 HA LYS 70 4.982 -3.140 -10.966 566 HB2 LYS 70 HB2 LYS 70 4.074 -3.210 -13.857 567 HB3 LYS 70 HB1 LYS 70 5.529 -3.922 -13.180 568 HG2 LYS 70 HG2 LYS 70 4.347 -5.690 -12.202 569 HG3 LYS 70 HG1 LYS 70 2.811 -4.836 -12.322 570 HD2 LYS 70 HD2 LYS 70 2.790 -5.089 -14.710 571 HD3 LYS 70 HD1 LYS 70 4.417 -5.767 -14.695 572 HE2 LYS 70 HE2 LYS 70 2.161 -7.058 -13.197 573 HE3 LYS 70 HE1 LYS 70 2.432 -7.379 -14.910 574 HZ1 LYS 70 HZ1 LYS 70 4.545 -8.286 -14.456 575 HZ2 LYS 70 HZ2 LYS 70 3.497 -8.977 -13.316 576 HZ3 LYS 70 HZ3 LYS 70 4.545 -7.728 -12.856 577 H ASP 71 HN ASP 71 3.330 -0.509 -11.432 578 HA ASP 71 HA ASP 71 5.397 0.949 -12.924 579 HB2 ASP 71 HB2 ASP 71 2.403 1.088 -13.096 580 HB3 ASP 71 HB1 ASP 71 3.379 2.480 -13.551 581 HA PRO 72 HA PRO 72 5.652 4.478 -9.994 582 HB2 PRO 72 HB2 PRO 72 3.949 5.671 -12.172 583 HB3 PRO 72 HB1 PRO 72 5.212 6.448 -11.208 584 HG2 PRO 72 HG2 PRO 72 5.791 5.538 -13.616 585 HG3 PRO 72 HG1 PRO 72 6.925 5.280 -12.275 586 HD2 PRO 72 HD2 PRO 72 5.200 3.341 -13.677 587 HD3 PRO 72 HD1 PRO 72 6.697 3.072 -12.767 588 HA PRO 73 HA PRO 73 2.832 5.570 -6.990 589 HB2 PRO 73 HB2 PRO 73 0.851 6.817 -8.857 590 HB3 PRO 73 HB1 PRO 73 1.250 7.268 -7.195 591 HG2 PRO 73 HG2 PRO 73 2.368 8.451 -9.411 592 HG3 PRO 73 HG1 PRO 73 3.152 8.385 -7.828 593 HD2 PRO 73 HD2 PRO 73 4.001 7.135 -10.243 594 HD3 PRO 73 HD1 PRO 73 4.737 6.990 -8.637 595 H TYR 74 HN TYR 74 2.159 3.714 -6.299 596 HA TYR 74 HA TYR 74 0.620 1.922 -7.973 597 HB2 TYR 74 HB2 TYR 74 1.679 1.447 -5.180 598 HB3 TYR 74 HB1 TYR 74 1.258 0.226 -6.369 599 HD1 TYR 74 HD2 TYR 74 3.641 3.049 -5.816 600 HD2 TYR 74 HD1 TYR 74 2.979 -0.722 -7.647 601 HE1 TYR 74 HE2 TYR 74 5.992 2.965 -6.488 602 HE2 TYR 74 HE1 TYR 74 5.349 -0.810 -8.330 603 HH TYR 74 HH TYR 74 7.211 0.561 -8.646 604 H LYS 75 HN LYS 75 -1.457 1.191 -7.498 605 HA LYS 75 HA LYS 75 -2.847 2.162 -5.148 606 HB2 LYS 75 HB2 LYS 75 -4.440 3.537 -6.365 607 HB3 LYS 75 HB1 LYS 75 -2.817 4.139 -6.645 608 HG2 LYS 75 HG2 LYS 75 -2.779 3.015 -8.816 609 HG3 LYS 75 HG1 LYS 75 -4.397 2.401 -8.528 610 HD2 LYS 75 HD2 LYS 75 -4.521 4.291 -9.969 611 HD3 LYS 75 HD1 LYS 75 -5.200 4.747 -8.415 612 HE2 LYS 75 HE2 LYS 75 -3.825 6.527 -9.283 613 HE3 LYS 75 HE1 LYS 75 -3.070 5.825 -7.864 614 HZ1 LYS 75 HZ1 LYS 75 -2.334 5.170 -10.664 615 HZ2 LYS 75 HZ2 LYS 75 -1.557 4.610 -9.266 616 HZ3 LYS 75 HZ3 LYS 75 -1.490 6.252 -9.669 617 H VAL 76 HN VAL 76 -5.013 1.517 -5.085 618 HA VAL 76 HA VAL 76 -5.976 -0.299 -7.174 619 HB VAL 76 HB VAL 76 -5.989 -0.877 -4.229 620 HG11 VAL 76 HG11 VAL 76 -8.287 -1.036 -5.225 621 HG12 VAL 76 HG12 VAL 76 -7.669 -2.531 -4.522 622 HG13 VAL 76 HG13 VAL 76 -7.670 -2.311 -6.274 623 HG21 VAL 76 HG21 VAL 76 -4.142 -1.819 -5.428 624 HG22 VAL 76 HG22 VAL 76 -5.207 -2.431 -6.684 625 HG23 VAL 76 HG23 VAL 76 -5.274 -3.113 -5.061 626 H GLU 77 HN GLU 77 -7.913 0.300 -7.890 627 HA GLU 77 HA GLU 77 -9.547 2.061 -6.183 628 HB2 GLU 77 HB2 GLU 77 -9.910 1.959 -9.145 629 HB3 GLU 77 HB1 GLU 77 -10.233 3.276 -8.036 630 HG2 GLU 77 HG2 GLU 77 -8.371 4.151 -8.885 631 HG3 GLU 77 HG1 GLU 77 -7.573 3.024 -7.787 632 H GLU 78 HN GLU 78 -11.096 0.902 -5.312 633 HA GLU 78 HA GLU 78 -12.543 -0.966 -7.052 634 HB2 GLU 78 HB2 GLU 78 -10.981 -1.663 -4.651 635 HB3 GLU 78 HB1 GLU 78 -12.597 -2.360 -4.707 636 HG2 GLU 78 HG2 GLU 78 -10.314 -2.753 -6.611 637 HG3 GLU 78 HG1 GLU 78 -11.213 -3.952 -5.683 638 H SER 79 HN SER 79 -14.393 -1.973 -5.627 639 HA SER 79 HA SER 79 -15.704 0.166 -4.126 640 HB2 SER 79 HB2 SER 79 -16.351 0.383 -6.524 641 HB3 SER 79 HB1 SER 79 -17.000 -1.256 -6.470 642 HG SER 79 HG SER 79 -17.992 1.119 -5.391 643 H GLY 80 HN GLY 80 -17.199 -0.533 -2.653 644 HA2 GLY 80 HA2 GLY 80 -18.027 -3.271 -2.424 645 HA3 GLY 80 HA1 GLY 80 -16.770 -2.840 -1.268 646 H TYR 81 HN TYR 81 -18.267 -3.063 0.527 647 HA TYR 81 HA TYR 81 -19.816 -0.616 0.855 648 HB2 TYR 81 HB2 TYR 81 -21.838 -1.874 1.651 649 HB3 TYR 81 HB1 TYR 81 -21.497 -2.048 -0.067 650 HD1 TYR 81 HD2 TYR 81 -21.372 -3.799 3.187 651 HD2 TYR 81 HD1 TYR 81 -20.954 -4.152 -1.032 652 HE1 TYR 81 HE2 TYR 81 -21.378 -6.249 3.394 653 HE2 TYR 81 HE1 TYR 81 -20.960 -6.600 -0.833 654 HH TYR 81 HH TYR 81 -21.885 -8.221 1.997 655 H ALA 82 HN ALA 82 -17.427 -2.119 2.052 656 HA ALA 82 HA ALA 82 -17.902 -1.290 4.738 657 HB1 ALA 82 HB1 ALA 82 -18.993 -3.413 4.955 658 HB2 ALA 82 HB2 ALA 82 -17.432 -3.523 5.758 659 HB3 ALA 82 HB3 ALA 82 -17.655 -4.240 4.163 660 H GLY 83 HN GLY 83 -15.967 -1.664 6.117 661 HA2 GLY 83 HA2 GLY 83 -13.538 -1.483 4.476 662 HA3 GLY 83 HA1 GLY 83 -13.716 -0.877 6.116 663 H PHE 84 HN PHE 84 -11.523 -2.175 5.889 664 HA PHE 84 HA PHE 84 -11.562 -4.414 7.535 665 HB2 PHE 84 HB2 PHE 84 -10.991 -6.224 5.899 666 HB3 PHE 84 HB1 PHE 84 -12.647 -5.654 5.749 667 HD1 PHE 84 HD1 PHE 84 -13.213 -4.069 3.867 668 HD2 PHE 84 HD2 PHE 84 -9.520 -6.174 4.057 669 HE1 PHE 84 HE1 PHE 84 -12.871 -3.668 1.470 670 HE2 PHE 84 HE2 PHE 84 -9.158 -5.774 1.667 671 HZ PHE 84 HZ PHE 84 -10.831 -4.521 0.358 672 H ILE 85 HN ILE 85 -9.397 -5.263 7.905 673 HA ILE 85 HA ILE 85 -7.236 -3.555 7.227 674 HB ILE 85 HB ILE 85 -7.321 -6.367 8.311 675 HG12 ILE 85 HG12 ILE 85 -7.912 -4.509 9.827 676 HG13 ILE 85 HG11 ILE 85 -6.438 -5.334 10.325 677 HG21 ILE 85 HG21 ILE 85 -4.819 -4.760 7.767 678 HG22 ILE 85 HG22 ILE 85 -5.326 -6.210 6.899 679 HG23 ILE 85 HG23 ILE 85 -4.902 -6.310 8.607 680 HD11 ILE 85 HD11 ILE 85 -6.469 -2.775 8.759 681 HD12 ILE 85 HD12 ILE 85 -5.081 -3.558 9.509 682 HD13 ILE 85 HD13 ILE 85 -6.351 -2.861 10.515 683 H LEU 86 HN LEU 86 -6.075 -3.425 5.421 684 HA LEU 86 HA LEU 86 -6.323 -5.639 3.492 685 HB2 LEU 86 HB2 LEU 86 -7.206 -3.194 3.011 686 HB3 LEU 86 HB1 LEU 86 -5.507 -2.885 2.684 687 HG LEU 86 HG LEU 86 -6.735 -5.232 1.340 688 HD11 LEU 86 HD11 LEU 86 -7.119 -2.464 0.236 689 HD12 LEU 86 HD12 LEU 86 -8.365 -3.296 1.169 690 HD13 LEU 86 HD13 LEU 86 -7.790 -3.988 -0.348 691 HD21 LEU 86 HD21 LEU 86 -5.242 -3.401 -0.248 692 HD22 LEU 86 HD22 LEU 86 -4.913 -5.096 0.099 693 HD23 LEU 86 HD23 LEU 86 -4.340 -3.836 1.199 694 HA PRO 87 HA PRO 87 -1.935 -5.928 4.476 695 HB2 PRO 87 HB2 PRO 87 -2.076 -8.357 2.852 696 HB3 PRO 87 HB1 PRO 87 -1.625 -8.177 4.547 697 HG2 PRO 87 HG2 PRO 87 -3.941 -9.347 3.774 698 HG3 PRO 87 HG1 PRO 87 -3.781 -8.441 5.290 699 HD2 PRO 87 HD2 PRO 87 -4.999 -7.594 2.693 700 HD3 PRO 87 HD1 PRO 87 -5.542 -7.270 4.354 701 H ILE 88 HN ILE 88 -0.470 -4.902 3.279 702 HA ILE 88 HA ILE 88 -0.894 -4.804 0.378 703 HB ILE 88 HB ILE 88 0.347 -2.500 1.825 704 HG12 ILE 88 HG12 ILE 88 -2.375 -3.228 2.251 705 HG13 ILE 88 HG11 ILE 88 -1.509 -1.779 2.771 706 HG21 ILE 88 HG21 ILE 88 0.610 -2.588 -0.519 707 HG22 ILE 88 HG22 ILE 88 -0.494 -1.275 -0.140 708 HG23 ILE 88 HG23 ILE 88 -1.115 -2.802 -0.772 709 HD11 ILE 88 HD11 ILE 88 -2.179 -0.567 0.922 710 HD12 ILE 88 HD12 ILE 88 -3.620 -1.380 1.538 711 HD13 ILE 88 HD13 ILE 88 -2.804 -1.995 0.098 712 H GLU 89 HN GLU 89 0.975 -4.913 -0.871 713 HA GLU 89 HA GLU 89 3.447 -5.317 0.663 714 HB2 GLU 89 HB2 GLU 89 2.380 -6.920 -1.635 715 HB3 GLU 89 HB1 GLU 89 4.067 -6.980 -1.130 716 HG2 GLU 89 HG2 GLU 89 3.299 -7.687 1.122 717 HG3 GLU 89 HG1 GLU 89 1.654 -7.752 0.495 718 H VAL 90 HN VAL 90 5.116 -4.204 0.076 719 HA VAL 90 HA VAL 90 5.155 -2.991 -2.604 720 HB VAL 90 HB VAL 90 6.652 -1.905 -0.220 721 HG11 VAL 90 HG11 VAL 90 7.594 -0.713 -1.876 722 HG12 VAL 90 HG12 VAL 90 6.072 0.171 -1.898 723 HG13 VAL 90 HG13 VAL 90 6.336 -1.155 -3.028 724 HG21 VAL 90 HG21 VAL 90 4.053 -2.022 -0.069 725 HG22 VAL 90 HG22 VAL 90 4.120 -0.667 -1.196 726 HG23 VAL 90 HG23 VAL 90 4.898 -0.543 0.383 727 H TYR 91 HN TYR 91 6.456 -4.209 -3.827 728 HA TYR 91 HA TYR 91 8.350 -6.020 -2.627 729 HB2 TYR 91 HB2 TYR 91 7.448 -5.459 -5.406 730 HB3 TYR 91 HB1 TYR 91 8.977 -6.294 -5.183 731 HD1 TYR 91 HD1 TYR 91 5.722 -6.560 -3.368 732 HD2 TYR 91 HD2 TYR 91 8.672 -8.508 -5.727 733 HE1 TYR 91 HE1 TYR 91 4.532 -8.695 -3.106 734 HE2 TYR 91 HE2 TYR 91 7.478 -10.643 -5.476 735 HH TYR 91 HH TYR 91 5.886 -11.712 -4.063 736 H PHE 92 HN PHE 92 10.488 -5.962 -2.571 737 HA PHE 92 HA PHE 92 11.723 -3.368 -3.210 738 HB2 PHE 92 HB2 PHE 92 12.402 -5.512 -1.181 739 HB3 PHE 92 HB1 PHE 92 13.467 -4.147 -1.526 740 HD1 PHE 92 HD1 PHE 92 11.203 -2.117 -1.891 741 HD2 PHE 92 HD2 PHE 92 11.993 -5.015 1.114 742 HE1 PHE 92 HE1 PHE 92 10.046 -0.713 -0.250 743 HE2 PHE 92 HE2 PHE 92 10.807 -3.609 2.765 744 HZ PHE 92 HZ PHE 92 9.854 -1.455 2.077 745 H LYS 93 HN LYS 93 13.939 -3.381 -4.014 746 HA LYS 93 HA LYS 93 14.513 -5.737 -5.688 747 HB2 LYS 93 HB2 LYS 93 15.730 -2.970 -5.847 748 HB3 LYS 93 HB1 LYS 93 15.985 -4.288 -6.982 749 HG2 LYS 93 HG2 LYS 93 13.722 -4.132 -7.754 750 HG3 LYS 93 HG1 LYS 93 13.341 -2.931 -6.512 751 HD2 LYS 93 HD2 LYS 93 14.890 -1.358 -7.494 752 HD3 LYS 93 HD1 LYS 93 15.461 -2.568 -8.641 753 HE2 LYS 93 HE2 LYS 93 12.927 -2.610 -9.357 754 HE3 LYS 93 HE1 LYS 93 12.910 -1.010 -8.606 755 HZ1 LYS 93 HZ1 LYS 93 13.375 -0.954 -10.999 756 HZ2 LYS 93 HZ2 LYS 93 14.798 -1.836 -10.740 757 HZ3 LYS 93 HZ3 LYS 93 14.627 -0.284 -10.077 758 H ASN 94 HN ASN 94 15.625 -7.062 -4.203 759 HA ASN 94 HA ASN 94 18.363 -6.265 -3.841 760 HB2 ASN 94 HB2 ASN 94 18.463 -6.638 -1.437 761 HB3 ASN 94 HB1 ASN 94 17.324 -5.350 -1.803 762 HD21 ASN 94 HD21 ASN 94 15.997 -5.468 -0.109 763 HD22 ASN 94 HD22 ASN 94 15.094 -6.868 0.357 764 H LYS 95 HN LYS 95 19.703 -8.034 -2.991 765 HA LYS 95 HA LYS 95 18.566 -10.690 -3.634 766 HB2 LYS 95 HB2 LYS 95 20.496 -9.858 -5.033 767 HB3 LYS 95 HB1 LYS 95 21.468 -9.858 -3.573 768 HG2 LYS 95 HG2 LYS 95 20.483 -12.392 -3.569 769 HG3 LYS 95 HG1 LYS 95 20.665 -12.072 -5.295 770 HD2 LYS 95 HD2 LYS 95 22.805 -11.781 -3.188 771 HD3 LYS 95 HD1 LYS 95 22.697 -13.062 -4.395 772 HE2 LYS 95 HE2 LYS 95 23.008 -10.127 -5.014 773 HE3 LYS 95 HE1 LYS 95 24.330 -11.292 -4.973 774 HZ1 LYS 95 HZ1 LYS 95 23.204 -12.534 -6.747 775 HZ2 LYS 95 HZ2 LYS 95 23.600 -10.957 -7.220 776 HZ3 LYS 95 HZ3 LYS 95 21.998 -11.343 -6.818 777 H GLU 96 HN GLU 96 19.220 -8.687 -1.246 778 HA GLU 96 HA GLU 96 20.279 -10.633 0.652 779 HB2 GLU 96 HB2 GLU 96 20.267 -8.330 2.077 780 HB3 GLU 96 HB1 GLU 96 21.625 -8.786 1.060 781 HG2 GLU 96 HG2 GLU 96 19.374 -7.017 0.153 782 HG3 GLU 96 HG1 GLU 96 20.882 -6.418 0.845 783 H GLU 97 HN GLU 97 19.141 -8.969 2.858 784 HA GLU 97 HA GLU 97 17.080 -10.474 3.710 785 HB2 GLU 97 HB2 GLU 97 16.371 -8.511 5.082 786 HB3 GLU 97 HB1 GLU 97 18.088 -8.891 5.167 787 HG2 GLU 97 HG2 GLU 97 18.486 -7.081 3.491 788 HG3 GLU 97 HG1 GLU 97 16.781 -6.651 3.644 789 HA PRO 98 HA PRO 98 13.114 -10.502 2.259 790 HB2 PRO 98 HB2 PRO 98 11.802 -8.222 3.433 791 HB3 PRO 98 HB1 PRO 98 11.662 -9.922 3.894 792 HG2 PRO 98 HG2 PRO 98 13.437 -7.804 4.990 793 HG3 PRO 98 HG1 PRO 98 12.726 -9.219 5.799 794 HD2 PRO 98 HD2 PRO 98 15.300 -9.215 5.219 795 HD3 PRO 98 HD1 PRO 98 14.339 -10.678 4.885 796 H ARG 99 HN ARG 99 12.522 -10.129 0.248 797 HA ARG 99 HA ARG 99 13.025 -7.580 -1.047 798 HB2 ARG 99 HB2 ARG 99 12.210 -10.290 -1.995 799 HB3 ARG 99 HB1 ARG 99 11.909 -8.892 -3.022 800 HG2 ARG 99 HG2 ARG 99 14.213 -8.311 -3.005 801 HG3 ARG 99 HG1 ARG 99 14.559 -9.608 -1.862 802 HD2 ARG 99 HD2 ARG 99 15.120 -10.102 -4.255 803 HD3 ARG 99 HD1 ARG 99 14.039 -11.290 -3.541 804 HE ARG 99 HE ARG 99 12.713 -9.136 -4.947 805 HH11 ARG 99 HH11 ARG 99 14.134 -12.318 -5.214 806 HH12 ARG 99 HH12 ARG 99 13.305 -12.707 -6.694 807 HH21 ARG 99 HH21 ARG 99 11.623 -9.620 -6.882 808 HH22 ARG 99 HH22 ARG 99 11.866 -11.163 -7.653 809 H LYS 100 HN LYS 100 10.874 -8.046 0.992 810 HA LYS 100 HA LYS 100 8.825 -6.558 -0.389 811 HB2 LYS 100 HB2 LYS 100 6.993 -8.074 0.304 812 HB3 LYS 100 HB1 LYS 100 8.071 -8.807 -0.878 813 HG2 LYS 100 HG2 LYS 100 9.042 -10.219 0.714 814 HG3 LYS 100 HG1 LYS 100 8.449 -9.251 2.064 815 HD2 LYS 100 HD2 LYS 100 7.072 -11.133 2.088 816 HD3 LYS 100 HD1 LYS 100 6.104 -9.924 1.246 817 HE2 LYS 100 HE2 LYS 100 7.798 -11.958 -0.195 818 HE3 LYS 100 HE1 LYS 100 6.120 -12.254 0.253 819 HZ1 LYS 100 HZ1 LYS 100 5.516 -10.257 -1.035 820 HZ2 LYS 100 HZ2 LYS 100 6.207 -11.486 -1.983 821 HZ3 LYS 100 HZ3 LYS 100 7.132 -10.134 -1.557 822 H VAL 101 HN VAL 101 7.657 -5.295 0.939 823 HA VAL 101 HA VAL 101 7.863 -5.807 3.825 824 HB VAL 101 HB VAL 101 8.998 -3.708 3.147 825 HG11 VAL 101 HG11 VAL 101 7.851 -2.956 1.246 826 HG12 VAL 101 HG12 VAL 101 7.466 -1.778 2.512 827 HG13 VAL 101 HG13 VAL 101 6.286 -3.013 2.073 828 HG21 VAL 101 HG21 VAL 101 8.010 -2.294 4.828 829 HG22 VAL 101 HG22 VAL 101 7.989 -3.975 5.373 830 HG23 VAL 101 HG23 VAL 101 6.511 -3.225 4.769 831 H ARG 102 HN ARG 102 5.928 -5.906 4.948 832 HA ARG 102 HA ARG 102 3.541 -5.826 3.221 833 HB2 ARG 102 HB2 ARG 102 4.369 -8.074 4.244 834 HB3 ARG 102 HB1 ARG 102 3.696 -7.449 5.744 835 HG2 ARG 102 HG2 ARG 102 1.573 -7.038 4.293 836 HG3 ARG 102 HG1 ARG 102 2.296 -8.225 3.223 837 HD2 ARG 102 HD2 ARG 102 0.782 -9.338 4.697 838 HD3 ARG 102 HD1 ARG 102 2.423 -9.769 5.146 839 HE ARG 102 HE ARG 102 0.830 -7.754 6.608 840 HH11 ARG 102 HH11 ARG 102 3.053 -10.467 6.545 841 HH12 ARG 102 HH12 ARG 102 3.224 -10.530 8.275 842 HH21 ARG 102 HH21 ARG 102 1.040 -7.822 8.870 843 HH22 ARG 102 HH22 ARG 102 2.061 -9.032 9.605 844 H PHE 103 HN PHE 103 2.480 -4.025 3.617 845 HA PHE 103 HA PHE 103 2.387 -2.991 6.360 846 HB2 PHE 103 HB2 PHE 103 1.688 -1.699 3.717 847 HB3 PHE 103 HB1 PHE 103 1.534 -0.908 5.273 848 HD1 PHE 103 HD1 PHE 103 4.043 -1.736 6.600 849 HD2 PHE 103 HD2 PHE 103 3.291 -0.521 2.592 850 HE1 PHE 103 HE1 PHE 103 6.350 -0.886 6.426 851 HE2 PHE 103 HE2 PHE 103 5.594 0.315 2.409 852 HZ PHE 103 HZ PHE 103 7.124 0.138 4.327 853 H ASP 104 HN ASP 104 0.684 -3.654 7.505 854 HA ASP 104 HA ASP 104 -1.753 -4.517 6.186 855 HB2 ASP 104 HB2 ASP 104 -1.190 -4.318 9.151 856 HB3 ASP 104 HB1 ASP 104 -2.522 -5.180 8.393 857 H TYR 105 HN TYR 105 -2.570 -2.648 5.266 858 HA TYR 105 HA TYR 105 -2.827 -0.284 6.939 859 HB2 TYR 105 HB2 TYR 105 -2.034 -0.071 4.599 860 HB3 TYR 105 HB1 TYR 105 -3.591 -0.685 4.036 861 HD1 TYR 105 HD1 TYR 105 -2.248 2.011 6.254 862 HD2 TYR 105 HD2 TYR 105 -5.171 0.842 3.414 863 HE1 TYR 105 HE1 TYR 105 -3.160 4.297 6.289 864 HE2 TYR 105 HE2 TYR 105 -6.101 3.101 3.416 865 HH TYR 105 HH TYR 105 -4.504 5.757 4.721 866 H ASP 106 HN ASP 106 -4.615 0.364 7.903 867 HA ASP 106 HA ASP 106 -6.956 -1.295 7.837 868 HB2 ASP 106 HB2 ASP 106 -6.211 -0.291 9.934 869 HB3 ASP 106 HB1 ASP 106 -6.428 1.322 9.262 870 H LEU 107 HN LEU 107 -8.261 -1.176 6.124 871 HA LEU 107 HA LEU 107 -8.709 1.308 4.719 872 HB2 LEU 107 HB2 LEU 107 -9.101 -1.506 4.241 873 HB3 LEU 107 HB1 LEU 107 -10.577 -0.627 3.893 874 HG LEU 107 HG LEU 107 -9.212 0.854 2.370 875 HD11 LEU 107 HD11 LEU 107 -7.084 -0.123 1.565 876 HD12 LEU 107 HD12 LEU 107 -7.131 -1.242 2.931 877 HD13 LEU 107 HD13 LEU 107 -7.009 0.496 3.217 878 HD21 LEU 107 HD21 LEU 107 -9.022 -0.932 0.613 879 HD22 LEU 107 HD22 LEU 107 -10.592 -0.795 1.408 880 HD23 LEU 107 HD23 LEU 107 -9.483 -2.089 1.864 881 H PHE 108 HN PHE 108 -9.875 2.706 6.029 882 HA PHE 108 HA PHE 108 -12.457 1.695 7.001 883 HB2 PHE 108 HB2 PHE 108 -12.544 3.568 8.547 884 HB3 PHE 108 HB1 PHE 108 -11.040 2.686 8.768 885 HD1 PHE 108 HD2 PHE 108 -12.559 5.791 7.534 886 HD2 PHE 108 HD1 PHE 108 -8.919 3.732 8.328 887 HE1 PHE 108 HE2 PHE 108 -11.321 7.901 7.302 888 HE2 PHE 108 HE1 PHE 108 -7.677 5.844 8.105 889 HZ PHE 108 HZ PHE 108 -8.877 7.929 7.586 890 H LEU 109 HN LEU 109 -14.338 2.570 6.315 891 HA LEU 109 HA LEU 109 -14.146 4.720 4.299 892 HB2 LEU 109 HB2 LEU 109 -16.409 2.737 4.625 893 HB3 LEU 109 HB1 LEU 109 -16.135 3.835 3.285 894 HG LEU 109 HG LEU 109 -14.486 1.394 3.964 895 HD11 LEU 109 HD11 LEU 109 -16.690 0.971 2.903 896 HD12 LEU 109 HD12 LEU 109 -15.321 0.486 1.909 897 HD13 LEU 109 HD13 LEU 109 -16.186 1.979 1.549 898 HD21 LEU 109 HD21 LEU 109 -14.141 3.414 1.753 899 HD22 LEU 109 HD22 LEU 109 -13.273 1.882 1.885 900 HD23 LEU 109 HD23 LEU 109 -13.041 3.134 3.105 901 H HIS 110 HN HIS 110 -15.805 6.396 4.434 902 HA HIS 110 HA HIS 110 -16.934 6.626 7.125 903 HB2 HIS 110 HB2 HIS 110 -16.242 8.651 5.034 904 HB3 HIS 110 HB1 HIS 110 -17.490 9.036 6.219 905 HD1 HIS 110 HD1 HIS 110 -14.471 10.271 5.936 906 HD2 HIS 110 HD2 HIS 110 -15.897 7.629 8.811 907 HE1 HIS 110 HE1 HIS 110 -12.947 10.539 7.910 908 HE2 HIS 110 HE2 HIS 110 -13.959 9.092 9.710 909 H LEU 111 HN LEU 111 -19.132 7.812 7.162 910 HA LEU 111 HA LEU 111 -20.870 5.782 6.387 911 HB2 LEU 111 HB2 LEU 111 -20.999 8.178 7.925 912 HB3 LEU 111 HB1 LEU 111 -22.422 8.073 6.902 913 HG LEU 111 HG LEU 111 -22.716 7.051 9.163 914 HD11 LEU 111 HD11 LEU 111 -23.675 4.906 8.299 915 HD12 LEU 111 HD12 LEU 111 -22.963 5.291 6.732 916 HD13 LEU 111 HD13 LEU 111 -24.192 6.348 7.427 917 HD21 LEU 111 HD21 LEU 111 -20.757 5.026 8.091 918 HD22 LEU 111 HD22 LEU 111 -21.670 4.891 9.598 919 HD23 LEU 111 HD23 LEU 111 -20.454 6.157 9.413 920 H GLU 112 HN GLU 112 -22.262 5.430 4.882 921 HA GLU 112 HA GLU 112 -22.152 6.529 2.341 922 HB2 GLU 112 HB2 GLU 112 -23.097 4.307 2.992 923 HB3 GLU 112 HB1 GLU 112 -24.506 5.137 3.630 924 HG2 GLU 112 HG2 GLU 112 -25.128 5.899 1.460 925 HG3 GLU 112 HG1 GLU 112 -23.616 5.312 0.766 926 H GLY 113 HN GLY 113 -22.816 8.397 1.582 927 HA2 GLY 113 HA2 GLY 113 -24.779 9.885 1.293 928 HA3 GLY 113 HA1 GLY 113 -24.919 9.853 3.046 929 H HIS 114 HN HIS 114 -22.371 10.221 3.913 930 HA HIS 114 HA HIS 114 -21.289 12.546 2.493 931 HB2 HIS 114 HB2 HIS 114 -22.019 12.659 5.440 932 HB3 HIS 114 HB1 HIS 114 -21.140 13.896 4.556 933 HD1 HIS 114 HD1 HIS 114 -22.495 15.614 3.296 934 HD2 HIS 114 HD2 HIS 114 -24.798 12.472 4.758 935 HE1 HIS 114 HE1 HIS 114 -24.892 16.303 2.945 936 HE2 HIS 114 HE2 HIS 114 -26.267 14.354 3.770 937 HA PRO 115 HA PRO 115 -17.874 10.217 4.424 938 HB2 PRO 115 HB2 PRO 115 -17.108 8.657 2.389 939 HB3 PRO 115 HB1 PRO 115 -18.511 8.253 3.384 940 HG2 PRO 115 HG2 PRO 115 -18.418 9.146 0.595 941 HG3 PRO 115 HG1 PRO 115 -19.749 8.394 1.483 942 HD2 PRO 115 HD2 PRO 115 -19.247 11.236 0.955 943 HD3 PRO 115 HD1 PRO 115 -20.731 10.448 1.537 944 HA PRO 116 HA PRO 116 -14.729 12.572 2.154 945 HB2 PRO 116 HB2 PRO 116 -13.850 14.098 4.177 946 HB3 PRO 116 HB1 PRO 116 -15.284 14.539 3.245 947 HG2 PRO 116 HG2 PRO 116 -15.080 13.499 5.999 948 HG3 PRO 116 HG1 PRO 116 -16.361 14.466 5.252 949 HD2 PRO 116 HD2 PRO 116 -16.299 11.623 5.675 950 HD3 PRO 116 HD1 PRO 116 -17.584 12.596 4.930 951 H VAL 117 HN VAL 117 -13.424 10.684 1.976 952 HA VAL 117 HA VAL 117 -11.744 10.193 4.355 953 HB VAL 117 HB VAL 117 -12.638 8.199 2.279 954 HG11 VAL 117 HG11 VAL 117 -10.638 7.931 4.503 955 HG12 VAL 117 HG12 VAL 117 -10.356 7.717 2.781 956 HG13 VAL 117 HG13 VAL 117 -11.357 6.563 3.662 957 HG21 VAL 117 HG21 VAL 117 -13.592 7.035 4.238 958 HG22 VAL 117 HG22 VAL 117 -14.324 8.612 3.945 959 HG23 VAL 117 HG23 VAL 117 -13.143 8.415 5.240 960 H ASN 118 HN ASN 118 -9.791 10.964 4.079 961 HA ASN 118 HA ASN 118 -8.277 10.140 1.723 962 HB2 ASN 118 HB2 ASN 118 -9.137 12.497 1.331 963 HB3 ASN 118 HB1 ASN 118 -8.165 13.002 2.705 964 HD21 ASN 118 HD21 ASN 118 -5.780 12.536 2.525 965 HD22 ASN 118 HD22 ASN 118 -5.072 12.629 0.950 966 H HIS 119 HN HIS 119 -6.936 8.789 2.916 967 HA HIS 119 HA HIS 119 -5.543 10.054 5.193 968 HB2 HIS 119 HB2 HIS 119 -7.344 8.299 5.773 969 HB3 HIS 119 HB1 HIS 119 -6.199 7.127 5.123 970 HD1 HIS 119 HD1 HIS 119 -5.787 5.977 7.381 971 HD2 HIS 119 HD2 HIS 119 -4.935 10.053 7.391 972 HE1 HIS 119 HE1 HIS 119 -4.588 6.418 9.543 973 HE2 HIS 119 HE2 HIS 119 -3.906 8.840 9.434 974 H LEU 120 HN LEU 120 -3.416 9.890 5.222 975 HA LEU 120 HA LEU 120 -2.017 7.816 3.724 976 HB2 LEU 120 HB2 LEU 120 -1.939 10.744 3.139 977 HB3 LEU 120 HB1 LEU 120 -0.470 9.811 2.948 978 HG LEU 120 HG LEU 120 -2.963 8.850 1.610 979 HD11 LEU 120 HD11 LEU 120 -1.354 10.461 -0.146 980 HD12 LEU 120 HD12 LEU 120 -1.966 11.436 1.195 981 HD13 LEU 120 HD13 LEU 120 -3.090 10.542 0.171 982 HD21 LEU 120 HD21 LEU 120 -0.746 7.597 1.730 983 HD22 LEU 120 HD22 LEU 120 -0.114 8.852 0.656 984 HD23 LEU 120 HD23 LEU 120 -1.451 7.831 0.125 985 H ARG 121 HN ARG 121 0.159 7.529 4.346 986 HA ARG 121 HA ARG 121 1.281 9.109 6.496 987 HB2 ARG 121 HB2 ARG 121 0.822 7.731 8.251 988 HB3 ARG 121 HB1 ARG 121 -0.280 6.894 7.220 989 HG2 ARG 121 HG2 ARG 121 2.591 6.091 7.202 990 HG3 ARG 121 HG1 ARG 121 1.560 5.598 8.544 991 HD2 ARG 121 HD2 ARG 121 0.981 5.008 5.627 992 HD3 ARG 121 HD1 ARG 121 1.728 3.903 6.762 993 HE ARG 121 HE ARG 121 -0.990 4.939 7.155 994 HH11 ARG 121 HH11 ARG 121 1.389 2.381 7.251 995 HH12 ARG 121 HH12 ARG 121 0.327 1.234 8.015 996 HH21 ARG 121 HH21 ARG 121 -2.379 3.455 8.219 997 HH22 ARG 121 HH22 ARG 121 -1.824 1.839 8.551 998 H CYS 122 HN CYS 122 3.580 8.908 6.529 999 HA CYS 122 HA CYS 122 4.680 7.086 4.515 1000 HB2 CYS 122 HB2 CYS 122 6.086 9.306 5.968 1001 HB3 CYS 122 HB1 CYS 122 6.682 8.422 4.575 1002 HG CYS 122 HG CYS 122 4.576 9.388 2.903 1003 H GLU 123 HN GLU 123 5.808 5.330 5.012 1004 HA GLU 123 HA GLU 123 6.390 4.752 7.822 1005 HB2 GLU 123 HB2 GLU 123 6.745 2.855 5.496 1006 HB3 GLU 123 HB1 GLU 123 6.501 2.451 7.191 1007 HG2 GLU 123 HG2 GLU 123 4.460 1.951 6.167 1008 HG3 GLU 123 HG1 GLU 123 4.208 3.526 6.925 1009 H LYS 124 HN LYS 124 8.466 3.559 8.264 1010 HA LYS 124 HA LYS 124 10.675 4.614 6.635 1011 HB2 LYS 124 HB2 LYS 124 10.462 5.935 8.675 1012 HB3 LYS 124 HB1 LYS 124 10.476 4.470 9.645 1013 HG2 LYS 124 HG2 LYS 124 12.792 4.039 8.667 1014 HG3 LYS 124 HG1 LYS 124 12.712 5.706 8.093 1015 HD2 LYS 124 HD2 LYS 124 12.195 5.054 10.953 1016 HD3 LYS 124 HD1 LYS 124 13.841 5.240 10.332 1017 HE2 LYS 124 HE2 LYS 124 13.539 7.451 9.801 1018 HE3 LYS 124 HE1 LYS 124 11.792 7.264 9.660 1019 HZ1 LYS 124 HZ1 LYS 124 11.607 7.172 12.038 1020 HZ2 LYS 124 HZ2 LYS 124 12.533 8.541 11.648 1021 HZ3 LYS 124 HZ3 LYS 124 13.291 7.141 12.227 1022 H LEU 125 HN LEU 125 11.986 3.053 5.924 1023 HA LEU 125 HA LEU 125 12.189 0.575 7.524 1024 HB2 LEU 125 HB2 LEU 125 12.756 0.852 4.582 1025 HB3 LEU 125 HB1 LEU 125 12.603 -0.629 5.495 1026 HG LEU 125 HG LEU 125 10.219 1.142 5.419 1027 HD11 LEU 125 HD11 LEU 125 10.897 1.262 3.101 1028 HD12 LEU 125 HD12 LEU 125 9.525 0.160 3.258 1029 HD13 LEU 125 HD13 LEU 125 11.153 -0.487 3.061 1030 HD21 LEU 125 HD21 LEU 125 9.141 -1.136 5.164 1031 HD22 LEU 125 HD22 LEU 125 10.024 -0.861 6.668 1032 HD23 LEU 125 HD23 LEU 125 10.755 -1.820 5.382 1033 H THR 126 HN THR 126 14.074 0.581 8.614 1034 HA THR 126 HA THR 126 16.389 1.964 7.440 1035 HB THR 126 HB THR 126 16.495 0.837 10.192 1036 HG1 THR 126 HG1 THR 126 14.458 1.850 10.198 1037 HG21 THR 126 HG21 THR 126 18.319 2.112 8.940 1038 HG22 THR 126 HG22 THR 126 17.944 2.630 10.586 1039 HG23 THR 126 HG23 THR 126 17.326 3.546 9.211 1040 H PHE 127 HN PHE 127 17.926 0.800 6.509 1041 HA PHE 127 HA PHE 127 18.196 -2.028 7.280 1042 HB2 PHE 127 HB2 PHE 127 18.988 -0.688 4.684 1043 HB3 PHE 127 HB1 PHE 127 19.131 -2.409 5.045 1044 HD1 PHE 127 HD1 PHE 127 17.132 -3.825 5.179 1045 HD2 PHE 127 HD2 PHE 127 16.871 0.303 4.174 1046 HE1 PHE 127 HE1 PHE 127 14.831 -4.160 4.396 1047 HE2 PHE 127 HE2 PHE 127 14.572 -0.027 3.387 1048 HZ PHE 127 HZ PHE 127 13.545 -2.256 3.507 1049 H ASN 128 HN ASN 128 19.793 -2.258 8.670 1050 HA ASN 128 HA ASN 128 21.937 -0.355 8.858 1051 HB2 ASN 128 HB2 ASN 128 21.306 -2.870 10.389 1052 HB3 ASN 128 HB1 ASN 128 22.741 -1.895 10.684 1053 HD21 ASN 128 HD21 ASN 128 19.269 -2.027 10.908 1054 HD22 ASN 128 HD22 ASN 128 19.093 -0.664 11.969 1055 H ASN 129 HN ASN 129 23.649 -0.400 7.655 1056 HA ASN 129 HA ASN 129 25.405 -1.044 6.402 1057 HB2 ASN 129 HB2 ASN 129 25.317 -3.583 8.040 1058 HB3 ASN 129 HB1 ASN 129 26.693 -2.978 7.124 1059 HD21 ASN 129 HD21 ASN 129 25.011 -2.909 10.063 1060 HD22 ASN 129 HD22 ASN 129 25.982 -1.714 10.867 1061 HA PRO 130 HA PRO 130 23.073 -3.802 3.568 1062 HB2 PRO 130 HB2 PRO 130 22.281 -2.005 1.753 1063 HB3 PRO 130 HB1 PRO 130 21.390 -2.239 3.263 1064 HG2 PRO 130 HG2 PRO 130 23.254 -0.056 2.479 1065 HG3 PRO 130 HG1 PRO 130 21.798 0.014 3.484 1066 HD2 PRO 130 HD2 PRO 130 24.451 -0.101 4.401 1067 HD3 PRO 130 HD1 PRO 130 22.992 -0.364 5.373 1068 H THR 131 HN THR 131 23.939 -4.684 1.721 1069 HA THR 131 HA THR 131 26.606 -4.136 1.016 1070 HB THR 131 HB THR 131 25.604 -6.352 0.614 1071 HG1 THR 131 HG1 THR 131 27.023 -6.576 -0.906 1072 HG21 THR 131 HG21 THR 131 23.365 -5.782 -0.046 1073 HG22 THR 131 HG22 THR 131 24.126 -6.641 -1.388 1074 HG23 THR 131 HG23 THR 131 23.958 -4.887 -1.448 1075 H GLU 132 HN GLU 132 27.365 -3.480 -1.203 1076 HA GLU 132 HA GLU 132 26.734 -0.798 -1.564 1077 HB2 GLU 132 HB2 GLU 132 28.801 -2.049 -2.410 1078 HB3 GLU 132 HB1 GLU 132 27.816 -2.487 -3.802 1079 HG2 GLU 132 HG2 GLU 132 29.123 -0.570 -4.359 1080 HG3 GLU 132 HG1 GLU 132 27.433 -0.083 -4.229 1081 H ASP 133 HN ASP 133 25.545 -3.593 -3.441 1082 HA ASP 133 HA ASP 133 24.264 -2.136 -5.465 1083 HB2 ASP 133 HB2 ASP 133 23.508 -4.852 -4.362 1084 HB3 ASP 133 HB1 ASP 133 22.929 -4.173 -5.875 1085 H PHE 134 HN PHE 134 22.909 -3.475 -2.447 1086 HA PHE 134 HA PHE 134 20.301 -2.448 -2.856 1087 HB2 PHE 134 HB2 PHE 134 21.031 -4.276 -1.179 1088 HB3 PHE 134 HB1 PHE 134 21.527 -2.941 -0.143 1089 HD1 PHE 134 HD1 PHE 134 18.590 -2.933 -2.375 1090 HD2 PHE 134 HD2 PHE 134 19.981 -3.200 1.635 1091 HE1 PHE 134 HE1 PHE 134 16.297 -2.669 -1.570 1092 HE2 PHE 134 HE2 PHE 134 17.680 -2.939 2.449 1093 HZ PHE 134 HZ PHE 134 15.833 -2.672 0.841 1094 H ARG 135 HN ARG 135 23.010 -1.393 -0.901 1095 HA ARG 135 HA ARG 135 22.172 0.985 0.156 1096 HB2 ARG 135 HB2 ARG 135 24.196 0.220 0.846 1097 HB3 ARG 135 HB1 ARG 135 24.763 -0.067 -0.801 1098 HG2 ARG 135 HG2 ARG 135 25.819 1.919 -0.733 1099 HG3 ARG 135 HG1 ARG 135 24.264 2.702 -0.507 1100 HD2 ARG 135 HD2 ARG 135 26.120 3.044 1.271 1101 HD3 ARG 135 HD1 ARG 135 24.473 2.711 1.803 1102 HE ARG 135 HE ARG 135 25.694 0.255 1.615 1103 HH11 ARG 135 HH11 ARG 135 26.299 3.228 3.354 1104 HH12 ARG 135 HH12 ARG 135 27.046 2.425 4.704 1105 HH21 ARG 135 HH21 ARG 135 26.653 -0.807 3.397 1106 HH22 ARG 135 HH22 ARG 135 27.237 0.136 4.735 1107 H ARG 136 HN ARG 136 23.589 0.495 -3.023 1108 HA ARG 136 HA ARG 136 23.727 3.066 -3.963 1109 HB2 ARG 136 HB2 ARG 136 23.927 0.441 -4.934 1110 HB3 ARG 136 HB1 ARG 136 22.893 1.350 -5.993 1111 HG2 ARG 136 HG2 ARG 136 24.586 2.962 -6.423 1112 HG3 ARG 136 HG1 ARG 136 25.631 2.235 -5.194 1113 HD2 ARG 136 HD2 ARG 136 26.405 1.445 -7.295 1114 HD3 ARG 136 HD1 ARG 136 25.534 0.112 -6.527 1115 HE ARG 136 HE ARG 136 23.698 1.455 -8.109 1116 HH11 ARG 136 HH11 ARG 136 26.667 -0.348 -8.572 1117 HH12 ARG 136 HH12 ARG 136 26.233 -0.881 -10.175 1118 HH21 ARG 136 HH21 ARG 136 23.120 0.755 -10.178 1119 HH22 ARG 136 HH22 ARG 136 24.200 -0.260 -11.093 1120 H LYS 137 HN LYS 137 21.071 0.752 -4.382 1121 HA LYS 137 HA LYS 137 19.478 2.548 -5.870 1122 HB2 LYS 137 HB2 LYS 137 18.773 0.011 -4.398 1123 HB3 LYS 137 HB1 LYS 137 17.614 0.921 -5.362 1124 HG2 LYS 137 HG2 LYS 137 19.162 0.654 -7.314 1125 HG3 LYS 137 HG1 LYS 137 20.129 -0.431 -6.317 1126 HD2 LYS 137 HD2 LYS 137 17.287 -1.107 -6.347 1127 HD3 LYS 137 HD1 LYS 137 18.034 -1.162 -7.939 1128 HE2 LYS 137 HE2 LYS 137 18.133 -3.335 -6.833 1129 HE3 LYS 137 HE1 LYS 137 19.741 -2.683 -7.119 1130 HZ1 LYS 137 HZ1 LYS 137 19.781 -1.968 -4.782 1131 HZ2 LYS 137 HZ2 LYS 137 19.623 -3.646 -4.937 1132 HZ3 LYS 137 HZ3 LYS 137 18.276 -2.705 -4.537 1133 H LEU 138 HN LEU 138 19.461 1.596 -2.475 1134 HA LEU 138 HA LEU 138 17.285 3.098 -1.590 1135 HB2 LEU 138 HB2 LEU 138 19.832 2.593 -0.070 1136 HB3 LEU 138 HB1 LEU 138 18.279 3.019 0.616 1137 HG LEU 138 HG LEU 138 19.077 0.417 -0.656 1138 HD11 LEU 138 HD11 LEU 138 19.641 0.984 1.749 1139 HD12 LEU 138 HD12 LEU 138 18.738 -0.508 1.474 1140 HD13 LEU 138 HD13 LEU 138 17.903 0.933 2.055 1141 HD21 LEU 138 HD21 LEU 138 16.331 1.330 0.161 1142 HD22 LEU 138 HD22 LEU 138 16.774 -0.335 -0.203 1143 HD23 LEU 138 HD23 LEU 138 16.865 0.897 -1.461 1144 H LEU 139 HN LEU 139 20.682 4.030 -1.964 1145 HA LEU 139 HA LEU 139 20.362 6.627 -0.843 1146 HB2 LEU 139 HB2 LEU 139 22.531 5.460 -2.582 1147 HB3 LEU 139 HB1 LEU 139 22.629 7.024 -1.796 1148 HG LEU 139 HG LEU 139 22.340 4.386 -0.360 1149 HD11 LEU 139 HD11 LEU 139 24.499 4.216 -1.045 1150 HD12 LEU 139 HD12 LEU 139 24.731 5.211 0.401 1151 HD13 LEU 139 HD13 LEU 139 24.705 5.969 -1.192 1152 HD21 LEU 139 HD21 LEU 139 21.355 6.301 0.793 1153 HD22 LEU 139 HD22 LEU 139 22.899 7.148 0.701 1154 HD23 LEU 139 HD23 LEU 139 22.762 5.665 1.645 1155 H LYS 140 HN LYS 140 20.021 5.320 -4.049 1156 HA LYS 140 HA LYS 140 20.083 7.782 -5.446 1157 HB2 LYS 140 HB2 LYS 140 19.732 5.033 -6.099 1158 HB3 LYS 140 HB1 LYS 140 18.423 5.959 -6.807 1159 HG2 LYS 140 HG2 LYS 140 19.869 7.281 -8.076 1160 HG3 LYS 140 HG1 LYS 140 21.278 6.773 -7.141 1161 HD2 LYS 140 HD2 LYS 140 19.653 4.804 -8.715 1162 HD3 LYS 140 HD1 LYS 140 20.948 5.737 -9.462 1163 HE2 LYS 140 HE2 LYS 140 21.293 4.055 -6.996 1164 HE3 LYS 140 HE1 LYS 140 21.576 3.467 -8.629 1165 HZ1 LYS 140 HZ1 LYS 140 23.654 4.181 -8.204 1166 HZ2 LYS 140 HZ2 LYS 140 23.164 5.279 -7.008 1167 HZ3 LYS 140 HZ3 LYS 140 23.032 5.695 -8.645 1168 H ALA 141 HN ALA 141 17.671 6.062 -3.684 1169 HA ALA 141 HA ALA 141 15.335 7.237 -4.683 1170 HB1 ALA 141 HB1 ALA 141 14.268 6.308 -2.854 1171 HB2 ALA 141 HB2 ALA 141 15.656 6.547 -1.795 1172 HB3 ALA 141 HB3 ALA 141 15.692 5.285 -3.027 1173 H1 GLY 212 HT1 GLY 212 -10.378 4.428 11.762 1174 H2 GLY 212 HT2 GLY 212 -9.783 5.665 12.756 1175 H3 GLY 212 HT3 GLY 212 -10.293 6.023 11.180 1176 HA2 GLY 212 HA1 GLY 212 -11.963 5.226 13.491 1177 HA3 GLY 212 HA2 GLY 212 -11.989 6.761 12.633 1178 H GLY 213 HN GLY 213 -12.673 3.323 12.355 1179 HA2 GLY 213 HA2 GLY 213 -14.131 3.681 9.878 1180 HA3 GLY 213 HA1 GLY 213 -13.929 2.178 10.769 1181 H LYS 214 HN LYS 214 -15.751 5.151 10.542 1182 HA LYS 214 HA LYS 214 -17.622 4.366 12.588 1183 HB2 LYS 214 HB2 LYS 214 -17.728 6.635 10.591 1184 HB3 LYS 214 HB1 LYS 214 -18.820 6.426 11.956 1185 HG2 LYS 214 HG2 LYS 214 -16.963 6.651 13.503 1186 HG3 LYS 214 HG1 LYS 214 -15.840 6.809 12.154 1187 HD2 LYS 214 HD2 LYS 214 -17.039 8.853 11.445 1188 HD3 LYS 214 HD1 LYS 214 -18.076 8.706 12.867 1189 HE2 LYS 214 HE2 LYS 214 -16.153 8.930 14.327 1190 HE3 LYS 214 HE1 LYS 214 -15.073 8.980 12.935 1191 HZ1 LYS 214 HZ1 LYS 214 -17.081 11.009 13.736 1192 HZ2 LYS 214 HZ2 LYS 214 -16.313 11.012 12.225 1193 HZ3 LYS 214 HZ3 LYS 214 -15.397 11.193 13.640 1194 H ALA 215 HN ALA 215 -17.271 3.924 9.207 1195 HA ALA 215 HA ALA 215 -20.031 3.158 8.761 1196 HB1 ALA 215 HB1 ALA 215 -19.210 2.506 6.513 1197 HB2 ALA 215 HB2 ALA 215 -17.570 2.907 7.021 1198 HB3 ALA 215 HB3 ALA 215 -18.797 4.169 6.931 1199 HA PRO 216 HA PRO 216 -19.656 -1.142 9.791 1200 HB2 PRO 216 HB2 PRO 216 -20.645 -2.061 7.206 1201 HB3 PRO 216 HB1 PRO 216 -21.393 -2.173 8.786 1202 HG2 PRO 216 HG2 PRO 216 -22.239 -0.520 6.769 1203 HG3 PRO 216 HG1 PRO 216 -22.594 -0.279 8.486 1204 HD2 PRO 216 HD2 PRO 216 -20.715 1.156 6.724 1205 HD3 PRO 216 HD1 PRO 216 -21.501 1.696 8.219 1206 H ARG 217 HN ARG 217 -18.151 -2.754 9.621 1207 HA ARG 217 HA ARG 217 -16.660 -2.955 7.104 1208 HB2 ARG 217 HB2 ARG 217 -14.533 -3.119 8.242 1209 HB3 ARG 217 HB1 ARG 217 -15.301 -1.598 8.661 1210 HG2 ARG 217 HG2 ARG 217 -15.827 -2.349 10.833 1211 HG3 ARG 217 HG1 ARG 217 -15.447 -4.025 10.423 1212 HD2 ARG 217 HD2 ARG 217 -13.676 -2.912 11.760 1213 HD3 ARG 217 HD1 ARG 217 -13.111 -3.497 10.195 1214 HE ARG 217 HE ARG 217 -13.950 -0.710 10.313 1215 HH11 ARG 217 HH11 ARG 217 -11.282 -3.005 10.400 1216 HH12 ARG 217 HH12 ARG 217 -10.080 -1.800 10.019 1217 HH21 ARG 217 HH21 ARG 217 -12.356 0.846 9.790 1218 HH22 ARG 217 HH22 ARG 217 -10.688 0.376 9.665 1219 H1 KCR 218 HN KCR 218 -15.626 -4.989 6.784 1220 H4 KCR 218 HA KCR 218 -17.308 -7.111 7.828 1221 H5 KCR 218 HB1 KCR 218 -16.359 -8.464 6.053 1222 H6 KCR 218 HB2 KCR 218 -15.134 -7.241 5.731 1223 H7 KCR 218 HG1 KCR 218 -16.927 -5.669 5.088 1224 H8 KCR 218 HG2 KCR 218 -18.102 -6.964 5.317 1225 H9 KCR 218 HD1 KCR 218 -17.128 -8.256 3.561 1226 H10 KCR 218 HD2 KCR 218 -15.773 -7.135 3.421 1227 H11 KCR 218 HE1 KCR 218 -17.256 -5.382 2.649 1228 H12 KCR 218 HE2 KCR 218 -18.655 -6.434 2.879 1229 H13 KCR 218 HZ1 KCR 218 -17.691 -7.870 1.136 1230 H14 KCR 218 HH1 KCR 218 -17.071 -7.891 -1.193 1231 H15 KCR 218 HJ1 KCR 218 -17.162 -4.986 -2.227 1232 H16 KCR 218 HF3 KCR 218 -17.624 -6.543 -4.224 1233 H17 KCR 218 HF1 KCR 218 -15.883 -6.334 -4.052 1234 H18 KCR 218 HF2 KCR 218 -16.661 -7.790 -3.430 1235 H GLN 219 HN GLN 219 -16.165 -6.587 9.961 1236 HA GLN 219 HA GLN 219 -13.508 -7.519 10.356 1237 HB2 GLN 219 HB2 GLN 219 -14.029 -7.354 12.755 1238 HB3 GLN 219 HB1 GLN 219 -14.512 -5.906 11.884 1239 HG2 GLN 219 HG2 GLN 219 -16.821 -6.619 11.912 1240 HG3 GLN 219 HG1 GLN 219 -16.368 -8.135 12.691 1241 HE21 GLN 219 HE21 GLN 219 -16.851 -4.736 13.101 1242 HE22 GLN 219 HE22 GLN 219 -16.763 -4.721 14.830 1243 H LEU 220 HN LEU 220 -16.690 -8.958 10.521 1244 HA LEU 220 HA LEU 220 -15.576 -11.523 11.344 1245 HB2 LEU 220 HB2 LEU 220 -17.733 -10.836 12.290 1246 HB3 LEU 220 HB1 LEU 220 -18.410 -10.709 10.678 1247 HG LEU 220 HG LEU 220 -18.122 -13.133 10.365 1248 HD11 LEU 220 HD11 LEU 220 -17.193 -13.099 13.232 1249 HD12 LEU 220 HD12 LEU 220 -16.208 -13.478 11.820 1250 HD13 LEU 220 HD13 LEU 220 -17.538 -14.542 12.277 1251 HD21 LEU 220 HD21 LEU 220 -19.876 -13.846 11.907 1252 HD22 LEU 220 HD22 LEU 220 -20.235 -12.262 11.220 1253 HD23 LEU 220 HD23 LEU 220 -19.628 -12.390 12.870 1254 H ALA 221 HN ALA 221 -14.489 -12.475 9.761 1255 HA ALA 221 HA ALA 221 -15.624 -12.421 7.049 1256 HB1 ALA 221 HB1 ALA 221 -12.763 -12.851 7.908 1257 HB2 ALA 221 HB2 ALA 221 -13.430 -11.358 7.246 1258 HB3 ALA 221 HB3 ALA 221 -13.349 -12.809 6.245 1259 H THR 222 HN THR 222 -15.802 -14.317 5.884 1260 HA THR 222 HA THR 222 -16.036 -16.536 5.463 1261 HB THR 222 HB THR 222 -14.122 -17.165 7.704 1262 HG1 THR 222 HG1 THR 222 -13.668 -15.463 5.683 1263 HG21 THR 222 HG21 THR 222 -15.116 -19.042 6.468 1264 HG22 THR 222 HG22 THR 222 -13.382 -18.922 6.167 1265 HG23 THR 222 HG23 THR 222 -14.529 -18.353 4.954 1266 H LYS 223 HN LYS 223 -17.696 -15.150 7.397 1267 HA LYS 223 HA LYS 223 -19.143 -17.359 8.449 1268 HB2 LYS 223 HB2 LYS 223 -17.338 -17.222 10.147 1269 HB3 LYS 223 HB1 LYS 223 -17.774 -15.548 10.455 1270 HG2 LYS 223 HG2 LYS 223 -19.951 -16.246 11.282 1271 HG3 LYS 223 HG1 LYS 223 -19.559 -17.931 10.926 1272 HD2 LYS 223 HD2 LYS 223 -17.715 -17.852 12.518 1273 HD3 LYS 223 HD1 LYS 223 -18.057 -16.154 12.851 1274 HE2 LYS 223 HE2 LYS 223 -18.972 -17.541 14.608 1275 HE3 LYS 223 HE1 LYS 223 -20.276 -16.788 13.697 1276 HZ1 LYS 223 HZ1 LYS 223 -20.683 -19.142 14.198 1277 HZ2 LYS 223 HZ2 LYS 223 -19.323 -19.572 13.283 1278 HZ3 LYS 223 HZ3 LYS 223 -20.654 -18.838 12.532 1279 H ALA 224 HN ALA 224 -21.248 -16.766 8.644 1280 HA ALA 224 HA ALA 224 -21.896 -13.935 8.972 1281 HB1 ALA 224 HB1 ALA 224 -21.817 -14.305 6.557 1282 HB2 ALA 224 HB2 ALA 224 -23.462 -13.976 7.101 1283 HB3 ALA 224 HB3 ALA 224 -22.974 -15.627 6.720 Start of MODEL 17 1 H1 GLY 1 HT1 GLY 1 24.191 -4.985 19.648 2 H2 GLY 1 HT2 GLY 1 25.668 -5.372 18.906 3 H3 GLY 1 HT3 GLY 1 24.302 -6.338 18.627 4 HA2 GLY 1 HA1 GLY 1 23.195 -4.501 17.514 5 HA3 GLY 1 HA2 GLY 1 24.622 -3.509 17.794 6 H SER 2 HN SER 2 23.933 -3.625 15.283 7 HA SER 2 HA SER 2 25.806 -5.551 14.079 8 HB2 SER 2 HB2 SER 2 23.579 -6.238 13.481 9 HB3 SER 2 HB1 SER 2 23.135 -4.593 13.030 10 HG SER 2 HG SER 2 23.916 -4.952 11.128 11 H HIS 3 HN HIS 3 27.484 -4.595 13.172 12 HA HIS 3 HA HIS 3 27.083 -2.213 11.559 13 HB2 HIS 3 HB2 HIS 3 28.903 -0.948 12.593 14 HB3 HIS 3 HB1 HIS 3 27.636 -1.276 13.765 15 HD1 HIS 3 HD1 HIS 3 28.223 -2.840 15.746 16 HD2 HIS 3 HD2 HIS 3 31.384 -2.126 13.132 17 HE1 HIS 3 HE1 HIS 3 30.288 -3.650 16.934 18 HE2 HIS 3 HE2 HIS 3 32.171 -3.319 15.292 19 H MET 4 HN MET 4 28.294 -2.247 9.765 20 HA MET 4 HA MET 4 30.442 -4.260 9.616 21 HB2 MET 4 HB2 MET 4 28.336 -4.383 8.088 22 HB3 MET 4 HB1 MET 4 29.072 -3.042 7.226 23 HG2 MET 4 HG2 MET 4 30.449 -5.674 7.694 24 HG3 MET 4 HG1 MET 4 29.489 -5.314 6.263 25 HE1 MET 4 HE1 MET 4 30.158 -2.324 5.612 26 HE2 MET 4 HE2 MET 4 30.171 -3.606 4.401 27 HE3 MET 4 HE3 MET 4 31.540 -2.501 4.530 28 H ALA 5 HN ALA 5 32.262 -3.206 10.081 29 HA ALA 5 HA ALA 5 33.941 -1.679 10.134 30 HB1 ALA 5 HB1 ALA 5 33.885 -1.850 7.668 31 HB2 ALA 5 HB2 ALA 5 34.368 -0.257 8.232 32 HB3 ALA 5 HB3 ALA 5 32.734 -0.521 7.623 33 H SER 6 HN SER 6 31.369 0.266 8.713 34 HA SER 6 HA SER 6 31.157 1.808 11.192 35 HB2 SER 6 HB2 SER 6 32.624 3.044 9.631 36 HB3 SER 6 HB1 SER 6 31.371 2.966 8.397 37 HG SER 6 HG SER 6 31.010 4.896 9.297 38 H SER 7 HN SER 7 29.101 1.754 11.829 39 HA SER 7 HA SER 7 27.139 0.442 10.285 40 HB2 SER 7 HB2 SER 7 27.267 0.525 12.808 41 HB3 SER 7 HB1 SER 7 26.628 2.167 12.719 42 HG SER 7 HG SER 7 24.765 1.195 12.738 43 H CYS 8 HN CYS 8 26.284 1.270 8.528 44 HA CYS 8 HA CYS 8 25.274 4.034 8.619 45 HB2 CYS 8 HB2 CYS 8 26.172 2.574 6.126 46 HB3 CYS 8 HB1 CYS 8 25.740 4.275 6.272 47 HG CYS 8 HG CYS 8 28.459 2.875 7.810 48 H ALA 9 HN ALA 9 23.149 3.865 8.934 49 HA ALA 9 HA ALA 9 21.705 1.624 7.715 50 HB1 ALA 9 HB1 ALA 9 19.884 2.167 9.247 51 HB2 ALA 9 HB2 ALA 9 20.768 3.595 9.799 52 HB3 ALA 9 HB3 ALA 9 21.408 1.985 10.127 53 H VAL 10 HN VAL 10 20.698 1.929 5.870 54 HA VAL 10 HA VAL 10 19.952 4.645 5.068 55 HB VAL 10 HB VAL 10 19.892 2.173 3.334 56 HG11 VAL 10 HG11 VAL 10 18.621 3.791 2.279 57 HG12 VAL 10 HG12 VAL 10 20.221 4.039 1.572 58 HG13 VAL 10 HG13 VAL 10 19.648 5.111 2.850 59 HG21 VAL 10 HG21 VAL 10 22.153 2.262 3.860 60 HG22 VAL 10 HG22 VAL 10 22.170 4.023 3.920 61 HG23 VAL 10 HG23 VAL 10 22.045 3.195 2.368 62 H GLN 11 HN GLN 11 17.911 5.213 5.403 63 HA GLN 11 HA GLN 11 15.949 3.054 5.674 64 HB2 GLN 11 HB2 GLN 11 14.925 5.278 6.945 65 HB3 GLN 11 HB1 GLN 11 15.419 3.777 7.668 66 HG2 GLN 11 HG2 GLN 11 16.557 5.384 8.871 67 HG3 GLN 11 HG1 GLN 11 17.747 4.772 7.735 68 HE21 GLN 11 HE21 GLN 11 15.848 7.497 8.681 69 HE22 GLN 11 HE22 GLN 11 16.602 8.645 7.627 70 H VAL 12 HN VAL 12 14.367 2.964 4.383 71 HA VAL 12 HA VAL 12 13.868 5.242 2.612 72 HB VAL 12 HB VAL 12 12.769 3.509 1.156 73 HG11 VAL 12 HG11 VAL 12 15.244 4.237 1.003 74 HG12 VAL 12 HG12 VAL 12 14.790 2.733 0.208 75 HG13 VAL 12 HG13 VAL 12 15.602 2.693 1.772 76 HG21 VAL 12 HG21 VAL 12 12.297 1.928 2.950 77 HG22 VAL 12 HG22 VAL 12 14.016 1.565 3.075 78 HG23 VAL 12 HG23 VAL 12 13.135 1.178 1.594 79 H LYS 13 HN LYS 13 11.770 6.023 2.370 80 HA LYS 13 HA LYS 13 9.889 5.004 4.374 81 HB2 LYS 13 HB2 LYS 13 10.441 7.781 3.387 82 HB3 LYS 13 HB1 LYS 13 8.894 7.383 4.122 83 HG2 LYS 13 HG2 LYS 13 10.005 6.640 6.127 84 HG3 LYS 13 HG1 LYS 13 11.579 6.998 5.412 85 HD2 LYS 13 HD2 LYS 13 10.945 9.369 5.233 86 HD3 LYS 13 HD1 LYS 13 9.390 9.001 5.985 87 HE2 LYS 13 HE2 LYS 13 10.487 8.309 8.015 88 HE3 LYS 13 HE1 LYS 13 12.072 8.504 7.270 89 HZ1 LYS 13 HZ1 LYS 13 11.702 10.867 7.118 90 HZ2 LYS 13 HZ2 LYS 13 11.463 10.366 8.721 91 HZ3 LYS 13 HZ3 LYS 13 10.131 10.705 7.730 92 H LEU 14 HN LEU 14 8.134 4.144 3.740 93 HA LEU 14 HA LEU 14 7.102 4.764 1.048 94 HB2 LEU 14 HB2 LEU 14 6.695 2.278 2.690 95 HB3 LEU 14 HB1 LEU 14 5.942 2.593 1.145 96 HG LEU 14 HG LEU 14 8.932 2.371 1.523 97 HD11 LEU 14 HD11 LEU 14 6.978 0.327 0.503 98 HD12 LEU 14 HD12 LEU 14 7.798 0.261 2.063 99 HD13 LEU 14 HD13 LEU 14 8.731 0.153 0.568 100 HD21 LEU 14 HD21 LEU 14 7.311 2.129 -0.996 101 HD22 LEU 14 HD22 LEU 14 9.059 2.321 -0.828 102 HD23 LEU 14 HD23 LEU 14 7.983 3.664 -0.441 103 H GLU 15 HN GLU 15 4.896 5.150 0.880 104 HA GLU 15 HA GLU 15 3.685 5.946 3.440 105 HB2 GLU 15 HB2 GLU 15 4.470 7.850 2.124 106 HB3 GLU 15 HB1 GLU 15 3.532 7.304 0.744 107 HG2 GLU 15 HG2 GLU 15 1.478 7.732 1.908 108 HG3 GLU 15 HG1 GLU 15 2.360 8.137 3.383 109 H LEU 16 HN LEU 16 1.820 5.066 3.915 110 HA LEU 16 HA LEU 16 0.259 3.700 1.843 111 HB2 LEU 16 HB2 LEU 16 -0.030 3.746 4.832 112 HB3 LEU 16 HB1 LEU 16 -1.177 2.981 3.770 113 HG LEU 16 HG LEU 16 0.163 1.277 4.702 114 HD11 LEU 16 HD11 LEU 16 1.589 1.397 2.155 115 HD12 LEU 16 HD12 LEU 16 -0.165 1.537 2.059 116 HD13 LEU 16 HD13 LEU 16 0.570 0.132 2.833 117 HD21 LEU 16 HD21 LEU 16 2.664 2.525 3.671 118 HD22 LEU 16 HD22 LEU 16 2.482 1.231 4.849 119 HD23 LEU 16 HD23 LEU 16 2.052 2.887 5.279 120 H GLY 17 HN GLY 17 -1.562 4.566 1.094 121 HA2 GLY 17 HA2 GLY 17 -2.997 6.527 2.704 122 HA3 GLY 17 HA1 GLY 17 -2.383 7.099 1.153 123 H HIS 18 HN HIS 18 -5.138 6.788 2.150 124 HA HIS 18 HA HIS 18 -6.163 5.465 -0.209 125 HB2 HIS 18 HB2 HIS 18 -6.921 3.563 0.720 126 HB3 HIS 18 HB1 HIS 18 -5.969 3.953 2.146 127 HD1 HIS 18 HD1 HIS 18 -7.319 5.292 4.066 128 HD2 HIS 18 HD2 HIS 18 -9.626 3.476 1.130 129 HE1 HIS 18 HE1 HIS 18 -9.658 5.210 4.994 130 HE2 HIS 18 HE2 HIS 18 -10.994 3.961 3.270 131 H ARG 19 HN ARG 19 -8.205 6.105 -0.751 132 HA ARG 19 HA ARG 19 -9.471 8.125 0.982 133 HB2 ARG 19 HB2 ARG 19 -9.415 8.140 -2.039 134 HB3 ARG 19 HB1 ARG 19 -10.160 9.338 -1.009 135 HG2 ARG 19 HG2 ARG 19 -8.010 10.037 -0.182 136 HG3 ARG 19 HG1 ARG 19 -7.214 8.762 -1.110 137 HD2 ARG 19 HD2 ARG 19 -6.998 10.802 -2.331 138 HD3 ARG 19 HD1 ARG 19 -8.158 9.765 -3.167 139 HE ARG 19 HE ARG 19 -9.856 11.199 -1.823 140 HH11 ARG 19 HH11 ARG 19 -6.863 12.332 -3.254 141 HH12 ARG 19 HH12 ARG 19 -7.473 13.930 -3.550 142 HH21 ARG 19 HH21 ARG 19 -10.644 13.298 -2.197 143 HH22 ARG 19 HH22 ARG 19 -9.619 14.488 -2.948 144 H ALA 20 HN ALA 20 -11.779 8.151 0.883 145 HA ALA 20 HA ALA 20 -12.985 5.939 -0.614 146 HB1 ALA 20 HB1 ALA 20 -12.987 4.848 1.379 147 HB2 ALA 20 HB2 ALA 20 -14.510 5.725 1.521 148 HB3 ALA 20 HB3 ALA 20 -13.063 6.336 2.324 149 H GLN 21 HN GLN 21 -14.905 6.340 -1.482 150 HA GLN 21 HA GLN 21 -16.387 8.748 -0.663 151 HB2 GLN 21 HB2 GLN 21 -16.856 9.307 -2.972 152 HB3 GLN 21 HB1 GLN 21 -15.116 9.198 -2.766 153 HG2 GLN 21 HG2 GLN 21 -14.908 7.476 -4.149 154 HG3 GLN 21 HG1 GLN 21 -16.408 6.720 -3.630 155 HE21 GLN 21 HE21 GLN 21 -18.325 7.265 -4.628 156 HE22 GLN 21 HE22 GLN 21 -18.375 8.121 -6.134 157 H VAL 22 HN VAL 22 -18.659 8.542 -0.878 158 HA VAL 22 HA VAL 22 -19.533 5.804 -1.470 159 HB VAL 22 HB VAL 22 -20.130 6.566 0.792 160 HG11 VAL 22 HG11 VAL 22 -21.707 8.324 1.170 161 HG12 VAL 22 HG12 VAL 22 -21.856 8.627 -0.559 162 HG13 VAL 22 HG13 VAL 22 -20.337 8.968 0.269 163 HG21 VAL 22 HG21 VAL 22 -22.427 5.885 0.733 164 HG22 VAL 22 HG22 VAL 22 -21.535 4.958 -0.465 165 HG23 VAL 22 HG23 VAL 22 -22.558 6.302 -0.971 166 H ARG 23 HN ARG 23 -20.948 5.392 -3.065 167 HA ARG 23 HA ARG 23 -21.977 7.677 -4.601 168 HB2 ARG 23 HB2 ARG 23 -22.706 5.645 -6.151 169 HB3 ARG 23 HB1 ARG 23 -21.071 6.293 -6.203 170 HG2 ARG 23 HG2 ARG 23 -20.155 4.455 -5.296 171 HG3 ARG 23 HG1 ARG 23 -21.537 4.145 -4.254 172 HD2 ARG 23 HD2 ARG 23 -21.300 2.384 -5.912 173 HD3 ARG 23 HD1 ARG 23 -22.786 3.291 -6.187 174 HE ARG 23 HE ARG 23 -21.688 4.375 -8.048 175 HH11 ARG 23 HH11 ARG 23 -20.073 1.571 -6.717 176 HH12 ARG 23 HH12 ARG 23 -19.194 1.224 -8.172 177 HH21 ARG 23 HH21 ARG 23 -20.514 3.915 -9.980 178 HH22 ARG 23 HH22 ARG 23 -19.443 2.543 -10.013 179 H LYS 24 HN LYS 24 -24.123 8.098 -4.681 180 HA LYS 24 HA LYS 24 -25.704 7.019 -2.559 181 HB2 LYS 24 HB2 LYS 24 -25.692 9.404 -3.560 182 HB3 LYS 24 HB1 LYS 24 -26.793 8.740 -4.757 183 HG2 LYS 24 HG2 LYS 24 -28.075 9.781 -3.035 184 HG3 LYS 24 HG1 LYS 24 -28.285 8.034 -2.904 185 HD2 LYS 24 HD2 LYS 24 -26.695 7.941 -1.083 186 HD3 LYS 24 HD1 LYS 24 -26.361 9.666 -1.252 187 HE2 LYS 24 HE2 LYS 24 -28.736 10.125 -0.730 188 HE3 LYS 24 HE1 LYS 24 -28.977 8.402 -0.451 189 HZ1 LYS 24 HZ1 LYS 24 -27.444 8.461 1.363 190 HZ2 LYS 24 HZ2 LYS 24 -28.591 9.687 1.601 191 HZ3 LYS 24 HZ3 LYS 24 -27.034 10.078 1.047 192 H LYS 25 HN LYS 25 -25.052 5.947 -5.629 193 HA LYS 25 HA LYS 25 -27.437 4.235 -5.566 194 HB2 LYS 25 HB2 LYS 25 -27.577 5.998 -7.361 195 HB3 LYS 25 HB1 LYS 25 -26.153 5.284 -8.104 196 HG2 LYS 25 HG2 LYS 25 -28.413 3.465 -7.551 197 HG3 LYS 25 HG1 LYS 25 -28.654 4.674 -8.810 198 HD2 LYS 25 HD2 LYS 25 -26.885 3.830 -10.099 199 HD3 LYS 25 HD1 LYS 25 -26.229 2.907 -8.741 200 HE2 LYS 25 HE2 LYS 25 -27.366 1.443 -10.327 201 HE3 LYS 25 HE1 LYS 25 -28.181 1.468 -8.763 202 HZ1 LYS 25 HZ1 LYS 25 -29.786 3.049 -9.689 203 HZ2 LYS 25 HZ2 LYS 25 -29.785 1.576 -10.522 204 HZ3 LYS 25 HZ3 LYS 25 -29.032 2.930 -11.206 205 HA PRO 26 HA PRO 26 -23.937 1.357 -5.199 206 HB2 PRO 26 HB2 PRO 26 -26.234 -0.482 -4.885 207 HB3 PRO 26 HB1 PRO 26 -24.808 -0.280 -3.869 208 HG2 PRO 26 HG2 PRO 26 -27.210 0.621 -3.108 209 HG3 PRO 26 HG1 PRO 26 -25.716 1.494 -2.714 210 HD2 PRO 26 HD2 PRO 26 -27.780 2.091 -4.790 211 HD3 PRO 26 HD1 PRO 26 -26.826 3.208 -3.793 212 H THR 27 HN THR 27 -23.250 -0.398 -6.459 213 HA THR 27 HA THR 27 -24.157 -0.273 -9.173 214 HB THR 27 HB THR 27 -21.786 -0.561 -8.753 215 HG1 THR 27 HG1 THR 27 -21.758 -2.930 -9.818 216 HG21 THR 27 HG21 THR 27 -21.714 -1.711 -6.677 217 HG22 THR 27 HG22 THR 27 -20.958 -2.773 -7.867 218 HG23 THR 27 HG23 THR 27 -22.611 -3.081 -7.336 219 H VAL 28 HN VAL 28 -24.285 -2.592 -10.291 220 HA VAL 28 HA VAL 28 -26.735 -3.688 -9.806 221 HB VAL 28 HB VAL 28 -25.657 -4.129 -11.844 222 HG11 VAL 28 HG11 VAL 28 -23.337 -4.055 -10.998 223 HG12 VAL 28 HG12 VAL 28 -23.619 -5.413 -12.094 224 HG13 VAL 28 HG13 VAL 28 -23.548 -5.685 -10.351 225 HG21 VAL 28 HG21 VAL 28 -25.913 -6.687 -10.281 226 HG22 VAL 28 HG22 VAL 28 -25.797 -6.595 -12.038 227 HG23 VAL 28 HG23 VAL 28 -27.176 -5.876 -11.207 228 H GLU 29 HN GLU 29 -23.683 -4.602 -8.324 229 HA GLU 29 HA GLU 29 -24.914 -6.892 -7.017 230 HB2 GLU 29 HB2 GLU 29 -22.054 -5.934 -6.948 231 HB3 GLU 29 HB1 GLU 29 -22.648 -7.491 -6.376 232 HG2 GLU 29 HG2 GLU 29 -23.338 -8.050 -8.682 233 HG3 GLU 29 HG1 GLU 29 -22.707 -6.497 -9.222 234 H GLY 30 HN GLY 30 -24.785 -3.698 -6.357 235 HA2 GLY 30 HA2 GLY 30 -25.665 -2.692 -4.473 236 HA3 GLY 30 HA1 GLY 30 -25.564 -4.229 -3.627 237 H PHE 31 HN PHE 31 -22.861 -2.685 -5.225 238 HA PHE 31 HA PHE 31 -21.527 -2.418 -2.654 239 HB2 PHE 31 HB2 PHE 31 -20.415 -1.866 -5.420 240 HB3 PHE 31 HB1 PHE 31 -19.499 -2.048 -3.924 241 HD1 PHE 31 HD1 PHE 31 -21.223 -4.498 -2.982 242 HD2 PHE 31 HD2 PHE 31 -19.174 -3.567 -6.580 243 HE1 PHE 31 HE1 PHE 31 -20.954 -6.893 -3.440 244 HE2 PHE 31 HE2 PHE 31 -18.904 -5.955 -7.053 245 HZ PHE 31 HZ PHE 31 -19.796 -7.628 -5.483 246 H THR 32 HN THR 32 -21.501 -0.542 -1.601 247 HA THR 32 HA THR 32 -22.774 1.751 -2.895 248 HB THR 32 HB THR 32 -23.180 2.548 -0.601 249 HG1 THR 32 HG1 THR 32 -22.785 0.483 0.896 250 HG21 THR 32 HG21 THR 32 -24.039 -0.228 -1.179 251 HG22 THR 32 HG22 THR 32 -24.877 1.238 -1.647 252 HG23 THR 32 HG23 THR 32 -24.763 0.783 0.056 253 H HIS 33 HN HIS 33 -19.801 0.822 -1.327 254 HA HIS 33 HA HIS 33 -18.936 3.642 -1.243 255 HB2 HIS 33 HB2 HIS 33 -18.364 1.286 0.518 256 HB3 HIS 33 HB1 HIS 33 -17.202 2.606 0.431 257 HD1 HIS 33 HD1 HIS 33 -20.770 1.895 1.486 258 HD2 HIS 33 HD2 HIS 33 -17.845 4.825 1.881 259 HE1 HIS 33 HE1 HIS 33 -21.635 3.493 3.228 260 HE2 HIS 33 HE2 HIS 33 -19.758 5.128 3.589 261 H ASP 34 HN ASP 34 -17.262 4.243 -2.459 262 HA ASP 34 HA ASP 34 -15.620 2.158 -3.749 263 HB2 ASP 34 HB2 ASP 34 -15.899 5.057 -4.581 264 HB3 ASP 34 HB1 ASP 34 -15.146 3.755 -5.493 265 H TRP 35 HN TRP 35 -13.372 2.342 -3.632 266 HA TRP 35 HA TRP 35 -12.282 4.636 -2.231 267 HB2 TRP 35 HB2 TRP 35 -10.994 3.189 -0.654 268 HB3 TRP 35 HB1 TRP 35 -12.722 3.245 -0.358 269 HD1 TRP 35 HD1 TRP 35 -14.022 0.948 -0.390 270 HE1 TRP 35 HE1 TRP 35 -13.263 -1.508 -0.658 271 HE3 TRP 35 HE3 TRP 35 -9.218 1.734 -1.974 272 HZ2 TRP 35 HZ2 TRP 35 -10.930 -2.913 -1.427 273 HZ3 TRP 35 HZ3 TRP 35 -7.792 -0.222 -2.445 274 HH2 TRP 35 HH2 TRP 35 -8.620 -2.488 -2.145 275 H MET 36 HN MET 36 -9.965 4.688 -2.194 276 HA MET 36 HA MET 36 -8.640 3.082 -4.256 277 HB2 MET 36 HB2 MET 36 -9.221 5.124 -5.400 278 HB3 MET 36 HB1 MET 36 -8.643 6.104 -4.057 279 HG2 MET 36 HG2 MET 36 -6.362 5.106 -4.500 280 HG3 MET 36 HG1 MET 36 -7.033 4.514 -6.021 281 HE1 MET 36 HE1 MET 36 -6.483 7.283 -3.694 282 HE2 MET 36 HE2 MET 36 -7.829 8.222 -4.350 283 HE3 MET 36 HE3 MET 36 -6.167 8.730 -4.658 284 H VAL 37 HN VAL 37 -6.625 2.471 -3.683 285 HA VAL 37 HA VAL 37 -5.382 3.725 -1.315 286 HB VAL 37 HB VAL 37 -3.981 1.494 -1.441 287 HG11 VAL 37 HG11 VAL 37 -6.780 1.501 -0.426 288 HG12 VAL 37 HG12 VAL 37 -5.420 2.221 0.416 289 HG13 VAL 37 HG13 VAL 37 -5.476 0.477 0.145 290 HG21 VAL 37 HG21 VAL 37 -4.927 0.637 -3.480 291 HG22 VAL 37 HG22 VAL 37 -6.557 0.764 -2.818 292 HG23 VAL 37 HG23 VAL 37 -5.418 -0.400 -2.141 293 H PHE 38 HN PHE 38 -3.186 4.340 -1.454 294 HA PHE 38 HA PHE 38 -1.783 3.701 -3.917 295 HB2 PHE 38 HB2 PHE 38 -1.233 6.029 -4.420 296 HB3 PHE 38 HB1 PHE 38 -2.981 5.900 -4.213 297 HD1 PHE 38 HD1 PHE 38 0.112 7.023 -2.605 298 HD2 PHE 38 HD2 PHE 38 -4.117 7.227 -2.661 299 HE1 PHE 38 HE1 PHE 38 0.210 8.953 -1.107 300 HE2 PHE 38 HE2 PHE 38 -4.053 9.156 -1.143 301 HZ PHE 38 HZ PHE 38 -1.898 10.035 -0.361 302 H VAL 39 HN VAL 39 0.222 3.136 -3.622 303 HA VAL 39 HA VAL 39 1.531 3.598 -1.012 304 HB VAL 39 HB VAL 39 2.732 1.387 -1.645 305 HG11 VAL 39 HG11 VAL 39 0.945 1.836 0.110 306 HG12 VAL 39 HG12 VAL 39 1.139 0.169 -0.426 307 HG13 VAL 39 HG13 VAL 39 -0.195 1.146 -1.042 308 HG21 VAL 39 HG21 VAL 39 2.196 0.655 -3.703 309 HG22 VAL 39 HG22 VAL 39 0.682 1.561 -3.735 310 HG23 VAL 39 HG23 VAL 39 0.767 0.016 -2.888 311 H ARG 40 HN ARG 40 3.361 4.823 -1.174 312 HA ARG 40 HA ARG 40 5.138 4.733 -3.445 313 HB2 ARG 40 HB2 ARG 40 3.790 7.427 -2.998 314 HB3 ARG 40 HB1 ARG 40 4.859 6.931 -4.303 315 HG2 ARG 40 HG2 ARG 40 2.795 5.200 -4.563 316 HG3 ARG 40 HG1 ARG 40 2.000 6.673 -3.972 317 HD2 ARG 40 HD2 ARG 40 2.116 6.759 -6.438 318 HD3 ARG 40 HD1 ARG 40 3.239 7.954 -5.768 319 HE ARG 40 HE ARG 40 4.335 5.342 -6.405 320 HH11 ARG 40 HH11 ARG 40 3.904 8.705 -7.293 321 HH12 ARG 40 HH12 ARG 40 5.246 8.714 -8.404 322 HH21 ARG 40 HH21 ARG 40 6.131 5.364 -7.833 323 HH22 ARG 40 HH22 ARG 40 6.502 6.819 -8.712 324 H GLY 41 HN GLY 41 6.922 6.435 -3.229 325 HA2 GLY 41 HA2 GLY 41 7.573 6.806 -0.422 326 HA3 GLY 41 HA1 GLY 41 8.620 7.117 -1.795 327 HA PRO 42 HA PRO 42 6.630 11.097 0.048 328 HB2 PRO 42 HB2 PRO 42 9.393 11.529 1.023 329 HB3 PRO 42 HB1 PRO 42 7.854 11.787 1.854 330 HG2 PRO 42 HG2 PRO 42 9.412 9.725 2.514 331 HG3 PRO 42 HG1 PRO 42 7.656 9.557 2.434 332 HD2 PRO 42 HD2 PRO 42 9.707 8.721 0.428 333 HD3 PRO 42 HD1 PRO 42 8.292 7.827 1.022 334 H GLU 43 HN GLU 43 7.528 13.326 -0.225 335 HA GLU 43 HA GLU 43 7.836 14.008 -2.826 336 HB2 GLU 43 HB2 GLU 43 9.167 15.513 -0.573 337 HB3 GLU 43 HB1 GLU 43 8.634 16.169 -2.112 338 HG2 GLU 43 HG2 GLU 43 6.993 16.859 -0.645 339 HG3 GLU 43 HG1 GLU 43 6.286 15.420 -1.376 340 H HIS 44 HN HIS 44 9.254 13.644 -4.288 341 HA HIS 44 HA HIS 44 11.162 13.748 -5.479 342 HB2 HIS 44 HB2 HIS 44 12.909 15.062 -4.808 343 HB3 HIS 44 HB1 HIS 44 11.830 15.489 -3.487 344 HD1 HIS 44 HD1 HIS 44 14.677 13.024 -4.176 345 HD2 HIS 44 HD2 HIS 44 12.923 15.116 -1.031 346 HE1 HIS 44 HE1 HIS 44 16.159 12.632 -2.187 347 HE2 HIS 44 HE2 HIS 44 15.136 13.979 -0.320 348 H SER 45 HN SER 45 10.836 11.711 -2.740 349 HA SER 45 HA SER 45 13.050 10.026 -3.570 350 HB2 SER 45 HB2 SER 45 12.350 8.551 -1.701 351 HB3 SER 45 HB1 SER 45 12.536 10.215 -1.151 352 HG SER 45 HG SER 45 10.028 9.810 -2.001 353 H ASN 46 HN ASN 46 12.794 8.819 -5.332 354 HA ASN 46 HA ASN 46 10.134 7.808 -6.025 355 HB2 ASN 46 HB2 ASN 46 12.655 8.265 -7.477 356 HB3 ASN 46 HB1 ASN 46 11.845 6.763 -7.902 357 HD21 ASN 46 HD21 ASN 46 11.719 10.210 -8.000 358 HD22 ASN 46 HD22 ASN 46 10.357 10.332 -9.065 359 H ILE 47 HN ILE 47 9.504 5.780 -5.540 360 HA ILE 47 HA ILE 47 11.416 4.202 -4.075 361 HB ILE 47 HB ILE 47 9.672 2.757 -3.423 362 HG12 ILE 47 HG12 ILE 47 7.813 4.267 -5.263 363 HG13 ILE 47 HG11 ILE 47 8.501 2.679 -5.615 364 HG21 ILE 47 HG21 ILE 47 9.859 4.814 -2.230 365 HG22 ILE 47 HG22 ILE 47 8.164 4.354 -2.341 366 HG23 ILE 47 HG23 ILE 47 8.805 5.626 -3.381 367 HD11 ILE 47 HD11 ILE 47 7.167 2.895 -3.025 368 HD12 ILE 47 HD12 ILE 47 7.081 1.625 -4.248 369 HD13 ILE 47 HD13 ILE 47 6.111 3.089 -4.424 370 H GLN 48 HN GLN 48 10.143 4.255 -7.261 371 HA GLN 48 HA GLN 48 10.278 1.560 -7.964 372 HB2 GLN 48 HB2 GLN 48 9.328 3.358 -9.398 373 HB3 GLN 48 HB1 GLN 48 10.957 3.943 -9.714 374 HG2 GLN 48 HG2 GLN 48 10.678 2.668 -11.578 375 HG3 GLN 48 HG1 GLN 48 11.303 1.442 -10.498 376 HE21 GLN 48 HE21 GLN 48 8.023 2.738 -10.279 377 HE22 GLN 48 HE22 GLN 48 7.242 1.271 -10.756 378 H HIS 49 HN HIS 49 12.767 3.626 -7.038 379 HA HIS 49 HA HIS 49 14.899 2.389 -8.503 380 HB2 HIS 49 HB2 HIS 49 14.738 4.371 -6.269 381 HB3 HIS 49 HB1 HIS 49 16.275 3.558 -6.577 382 HD1 HIS 49 HD1 HIS 49 16.602 3.607 -9.517 383 HD2 HIS 49 HD2 HIS 49 14.903 6.778 -7.438 384 HE1 HIS 49 HE1 HIS 49 16.745 5.590 -11.061 385 HE2 HIS 49 HE2 HIS 49 15.582 7.459 -9.840 386 H PHE 50 HN PHE 50 13.504 2.027 -5.256 387 HA PHE 50 HA PHE 50 15.270 -0.297 -4.909 388 HB2 PHE 50 HB2 PHE 50 15.022 0.013 -2.468 389 HB3 PHE 50 HB1 PHE 50 15.784 1.382 -3.274 390 HD1 PHE 50 HD1 PHE 50 12.684 0.235 -1.615 391 HD2 PHE 50 HD2 PHE 50 14.837 3.515 -3.255 392 HE1 PHE 50 HE1 PHE 50 11.130 1.783 -0.549 393 HE2 PHE 50 HE2 PHE 50 13.246 5.075 -2.202 394 HZ PHE 50 HZ PHE 50 11.391 4.208 -0.843 395 H VAL 51 HN VAL 51 12.231 0.530 -5.665 396 HA VAL 51 HA VAL 51 11.056 -1.908 -4.510 397 HB VAL 51 HB VAL 51 9.799 0.791 -5.068 398 HG11 VAL 51 HG11 VAL 51 7.742 -0.494 -4.057 399 HG12 VAL 51 HG12 VAL 51 8.534 -1.900 -4.775 400 HG13 VAL 51 HG13 VAL 51 8.065 -0.536 -5.793 401 HG21 VAL 51 HG21 VAL 51 9.073 0.417 -2.653 402 HG22 VAL 51 HG22 VAL 51 10.775 0.767 -2.938 403 HG23 VAL 51 HG23 VAL 51 10.255 -0.887 -2.618 404 H GLU 52 HN GLU 52 10.421 -3.368 -5.951 405 HA GLU 52 HA GLU 52 10.909 -2.730 -8.770 406 HB2 GLU 52 HB2 GLU 52 11.924 -4.763 -7.828 407 HB3 GLU 52 HB1 GLU 52 10.330 -5.392 -7.432 408 HG2 GLU 52 HG2 GLU 52 9.756 -5.413 -9.817 409 HG3 GLU 52 HG1 GLU 52 11.370 -4.816 -10.199 410 H LYS 53 HN LYS 53 8.407 -4.446 -6.884 411 HA LYS 53 HA LYS 53 6.346 -3.440 -8.698 412 HB2 LYS 53 HB2 LYS 53 5.333 -5.729 -8.741 413 HB3 LYS 53 HB1 LYS 53 6.891 -5.629 -9.550 414 HG2 LYS 53 HG2 LYS 53 7.968 -6.587 -7.568 415 HG3 LYS 53 HG1 LYS 53 6.400 -6.735 -6.790 416 HD2 LYS 53 HD2 LYS 53 7.243 -8.077 -9.363 417 HD3 LYS 53 HD1 LYS 53 7.192 -8.853 -7.784 418 HE2 LYS 53 HE2 LYS 53 4.802 -8.583 -7.673 419 HE3 LYS 53 HE1 LYS 53 4.821 -7.628 -9.155 420 HZ1 LYS 53 HZ1 LYS 53 5.692 -9.626 -10.306 421 HZ2 LYS 53 HZ2 LYS 53 4.138 -9.854 -9.666 422 HZ3 LYS 53 HZ3 LYS 53 5.488 -10.510 -8.876 423 H VAL 54 HN VAL 54 4.120 -4.132 -7.721 424 HA VAL 54 HA VAL 54 4.165 -4.057 -4.801 425 HB VAL 54 HB VAL 54 3.170 -1.875 -6.583 426 HG11 VAL 54 HG11 VAL 54 2.144 -1.767 -3.838 427 HG12 VAL 54 HG12 VAL 54 1.364 -2.967 -4.867 428 HG13 VAL 54 HG13 VAL 54 1.387 -1.270 -5.350 429 HG21 VAL 54 HG21 VAL 54 3.960 -0.843 -4.184 430 HG22 VAL 54 HG22 VAL 54 4.980 -1.017 -5.603 431 HG23 VAL 54 HG23 VAL 54 4.995 -2.254 -4.346 432 H VAL 55 HN VAL 55 2.135 -4.655 -3.839 433 HA VAL 55 HA VAL 55 0.165 -5.818 -5.653 434 HB VAL 55 HB VAL 55 2.203 -7.386 -4.486 435 HG11 VAL 55 HG11 VAL 55 -0.493 -7.944 -3.264 436 HG12 VAL 55 HG12 VAL 55 1.001 -7.537 -2.417 437 HG13 VAL 55 HG13 VAL 55 0.861 -9.077 -3.264 438 HG21 VAL 55 HG21 VAL 55 -0.339 -8.321 -5.793 439 HG22 VAL 55 HG22 VAL 55 1.211 -9.160 -5.730 440 HG23 VAL 55 HG23 VAL 55 1.051 -7.672 -6.661 441 H PHE 56 HN PHE 56 -1.834 -6.148 -4.724 442 HA PHE 56 HA PHE 56 -2.159 -5.282 -1.931 443 HB2 PHE 56 HB2 PHE 56 -3.767 -4.505 -4.367 444 HB3 PHE 56 HB1 PHE 56 -4.472 -4.454 -2.749 445 HD1 PHE 56 HD1 PHE 56 -1.631 -3.168 -4.777 446 HD2 PHE 56 HD2 PHE 56 -4.177 -2.588 -1.413 447 HE1 PHE 56 HE1 PHE 56 -0.685 -0.928 -4.460 448 HE2 PHE 56 HE2 PHE 56 -3.234 -0.337 -1.096 449 HZ PHE 56 HZ PHE 56 -1.481 0.484 -2.616 450 H HIS 57 HN HIS 57 -3.194 -6.771 -0.710 451 HA HIS 57 HA HIS 57 -4.693 -8.879 -2.136 452 HB2 HIS 57 HB2 HIS 57 -3.645 -8.862 0.714 453 HB3 HIS 57 HB1 HIS 57 -4.524 -10.187 -0.047 454 HD1 HIS 57 HD1 HIS 57 -3.168 -11.882 -1.277 455 HD2 HIS 57 HD2 HIS 57 -1.007 -8.410 -0.484 456 HE1 HIS 57 HE1 HIS 57 -0.776 -12.417 -1.849 457 HE2 HIS 57 HE2 HIS 57 0.535 -10.384 -1.122 458 H LEU 58 HN LEU 58 -6.546 -7.588 -2.432 459 HA LEU 58 HA LEU 58 -7.872 -6.273 -0.301 460 HB2 LEU 58 HB2 LEU 58 -9.343 -7.410 -2.665 461 HB3 LEU 58 HB1 LEU 58 -9.713 -5.962 -1.746 462 HG LEU 58 HG LEU 58 -7.376 -6.235 -3.630 463 HD11 LEU 58 HD11 LEU 58 -8.628 -5.071 -5.172 464 HD12 LEU 58 HD12 LEU 58 -9.912 -4.717 -4.033 465 HD13 LEU 58 HD13 LEU 58 -9.672 -6.365 -4.619 466 HD21 LEU 58 HD21 LEU 58 -7.287 -4.558 -1.670 467 HD22 LEU 58 HD22 LEU 58 -8.558 -3.710 -2.544 468 HD23 LEU 58 HD23 LEU 58 -6.987 -3.964 -3.301 469 H HIS 59 HN HIS 59 -10.377 -7.043 -0.014 470 HA HIS 59 HA HIS 59 -10.192 -9.489 1.495 471 HB2 HIS 59 HB2 HIS 59 -11.577 -7.450 2.127 472 HB3 HIS 59 HB1 HIS 59 -12.689 -7.908 0.845 473 HD1 HIS 59 HD1 HIS 59 -11.194 -9.501 3.971 474 HD2 HIS 59 HD2 HIS 59 -14.694 -9.494 1.716 475 HE1 HIS 59 HE1 HIS 59 -12.829 -10.938 5.240 476 HE2 HIS 59 HE2 HIS 59 -14.899 -11.021 3.798 477 H GLU 60 HN GLU 60 -11.241 -11.399 1.085 478 HA GLU 60 HA GLU 60 -11.027 -12.354 -1.506 479 HB2 GLU 60 HB2 GLU 60 -12.537 -13.492 0.835 480 HB3 GLU 60 HB1 GLU 60 -12.203 -14.378 -0.649 481 HG2 GLU 60 HG2 GLU 60 -9.794 -14.088 -0.254 482 HG3 GLU 60 HG1 GLU 60 -10.162 -13.269 1.263 483 H SER 61 HN SER 61 -13.810 -10.921 0.017 484 HA SER 61 HA SER 61 -15.797 -11.750 -1.759 485 HB2 SER 61 HB2 SER 61 -15.593 -9.057 -0.476 486 HB3 SER 61 HB1 SER 61 -17.062 -9.861 -1.007 487 HG SER 61 HG SER 61 -16.988 -11.181 0.687 488 H PHE 62 HN PHE 62 -13.195 -9.516 -2.115 489 HA PHE 62 HA PHE 62 -14.287 -8.195 -4.441 490 HB2 PHE 62 HB2 PHE 62 -11.542 -8.104 -3.159 491 HB3 PHE 62 HB1 PHE 62 -12.042 -7.107 -4.516 492 HD1 PHE 62 HD1 PHE 62 -13.089 -7.937 -1.033 493 HD2 PHE 62 HD2 PHE 62 -12.848 -5.002 -4.086 494 HE1 PHE 62 HE1 PHE 62 -13.950 -6.241 0.531 495 HE2 PHE 62 HE2 PHE 62 -13.710 -3.299 -2.541 496 HZ PHE 62 HZ PHE 62 -14.261 -3.917 -0.223 497 HA PRO 63 HA PRO 63 -13.017 -11.413 -7.207 498 HB2 PRO 63 HB2 PRO 63 -13.169 -9.325 -9.288 499 HB3 PRO 63 HB1 PRO 63 -14.080 -10.830 -9.139 500 HG2 PRO 63 HG2 PRO 63 -15.238 -8.461 -8.697 501 HG3 PRO 63 HG1 PRO 63 -15.661 -9.890 -7.735 502 HD2 PRO 63 HD2 PRO 63 -13.865 -7.595 -7.030 503 HD3 PRO 63 HD1 PRO 63 -15.082 -8.420 -6.032 504 H ARG 64 HN ARG 64 -11.026 -12.118 -7.621 505 HA ARG 64 HA ARG 64 -8.746 -12.148 -7.701 506 HB2 ARG 64 HB2 ARG 64 -9.223 -9.931 -9.704 507 HB3 ARG 64 HB1 ARG 64 -7.745 -10.869 -9.547 508 HG2 ARG 64 HG2 ARG 64 -9.003 -12.903 -10.131 509 HG3 ARG 64 HG1 ARG 64 -10.445 -11.915 -10.366 510 HD2 ARG 64 HD2 ARG 64 -7.873 -11.802 -11.915 511 HD3 ARG 64 HD1 ARG 64 -9.462 -12.292 -12.495 512 HE ARG 64 HE ARG 64 -9.131 -9.555 -11.519 513 HH11 ARG 64 HH11 ARG 64 -9.632 -11.755 -14.194 514 HH12 ARG 64 HH12 ARG 64 -10.014 -10.491 -15.327 515 HH21 ARG 64 HH21 ARG 64 -9.629 -7.900 -12.981 516 HH22 ARG 64 HH22 ARG 64 -10.011 -8.292 -14.636 517 HA PRO 65 HA PRO 65 -8.872 -8.432 -4.950 518 HB2 PRO 65 HB2 PRO 65 -7.846 -9.590 -2.709 519 HB3 PRO 65 HB1 PRO 65 -9.559 -9.634 -3.139 520 HG2 PRO 65 HG2 PRO 65 -7.458 -11.723 -3.493 521 HG3 PRO 65 HG1 PRO 65 -9.156 -11.902 -3.010 522 HD2 PRO 65 HD2 PRO 65 -8.261 -12.420 -5.528 523 HD3 PRO 65 HD1 PRO 65 -9.902 -11.856 -5.175 524 H LYS 66 HN LYS 66 -6.260 -10.551 -5.701 525 HA LYS 66 HA LYS 66 -4.244 -8.807 -4.668 526 HB2 LYS 66 HB2 LYS 66 -3.808 -11.193 -4.713 527 HB3 LYS 66 HB1 LYS 66 -4.029 -11.230 -6.455 528 HG2 LYS 66 HG2 LYS 66 -2.046 -9.936 -6.812 529 HG3 LYS 66 HG1 LYS 66 -1.877 -9.638 -5.082 530 HD2 LYS 66 HD2 LYS 66 -1.287 -11.841 -4.637 531 HD3 LYS 66 HD1 LYS 66 -1.885 -12.427 -6.190 532 HE2 LYS 66 HE2 LYS 66 -0.064 -11.235 -7.314 533 HE3 LYS 66 HE1 LYS 66 0.520 -10.658 -5.753 534 HZ1 LYS 66 HZ1 LYS 66 1.811 -12.542 -6.369 535 HZ2 LYS 66 HZ2 LYS 66 0.431 -13.466 -6.710 536 HZ3 LYS 66 HZ3 LYS 66 0.784 -13.033 -5.110 537 H ARG 67 HN ARG 67 -4.148 -6.897 -5.610 538 HA ARG 67 HA ARG 67 -4.138 -6.777 -8.549 539 HB2 ARG 67 HB2 ARG 67 -4.403 -4.435 -6.657 540 HB3 ARG 67 HB1 ARG 67 -4.788 -4.493 -8.373 541 HG2 ARG 67 HG2 ARG 67 -6.269 -5.883 -6.156 542 HG3 ARG 67 HG1 ARG 67 -6.818 -4.483 -7.080 543 HD2 ARG 67 HD2 ARG 67 -6.683 -5.912 -9.143 544 HD3 ARG 67 HD1 ARG 67 -6.371 -7.295 -8.081 545 HE ARG 67 HE ARG 67 -8.583 -7.381 -7.610 546 HH11 ARG 67 HH11 ARG 67 -7.910 -4.207 -8.947 547 HH12 ARG 67 HH12 ARG 67 -9.581 -3.720 -8.957 548 HH21 ARG 67 HH21 ARG 67 -10.772 -6.745 -7.638 549 HH22 ARG 67 HH22 ARG 67 -11.202 -5.144 -8.174 550 H VAL 68 HN VAL 68 -2.222 -6.548 -9.493 551 HA VAL 68 HA VAL 68 0.030 -5.754 -7.789 552 HB VAL 68 HB VAL 68 1.442 -7.078 -9.025 553 HG11 VAL 68 HG11 VAL 68 -0.196 -8.542 -7.977 554 HG12 VAL 68 HG12 VAL 68 0.359 -9.224 -9.509 555 HG13 VAL 68 HG13 VAL 68 -1.219 -8.442 -9.414 556 HG21 VAL 68 HG21 VAL 68 1.074 -6.029 -11.166 557 HG22 VAL 68 HG22 VAL 68 -0.449 -6.899 -11.366 558 HG23 VAL 68 HG23 VAL 68 1.080 -7.784 -11.345 559 H CYS 69 HN CYS 69 1.397 -4.110 -8.323 560 HA CYS 69 HA CYS 69 0.865 -2.671 -10.839 561 HB2 CYS 69 HB2 CYS 69 1.450 -1.474 -8.120 562 HB3 CYS 69 HB1 CYS 69 1.417 -0.559 -9.625 563 HG CYS 69 HG CYS 69 -1.352 -2.351 -9.002 564 H LYS 70 HN LYS 70 2.595 -2.779 -12.123 565 HA LYS 70 HA LYS 70 5.248 -3.271 -10.911 566 HB2 LYS 70 HB2 LYS 70 4.452 -3.657 -13.802 567 HB3 LYS 70 HB1 LYS 70 5.881 -4.279 -12.997 568 HG2 LYS 70 HG2 LYS 70 4.672 -5.950 -11.893 569 HG3 LYS 70 HG1 LYS 70 3.132 -5.141 -12.179 570 HD2 LYS 70 HD2 LYS 70 3.287 -5.606 -14.551 571 HD3 LYS 70 HD1 LYS 70 4.884 -6.323 -14.330 572 HE2 LYS 70 HE2 LYS 70 2.444 -7.375 -12.927 573 HE3 LYS 70 HE1 LYS 70 2.903 -7.914 -14.541 574 HZ1 LYS 70 HZ1 LYS 70 3.721 -9.303 -12.628 575 HZ2 LYS 70 HZ2 LYS 70 4.769 -8.026 -12.247 576 HZ3 LYS 70 HZ3 LYS 70 4.900 -8.813 -13.739 577 H ASP 71 HN ASP 71 3.546 -0.758 -11.780 578 HA ASP 71 HA ASP 71 5.606 0.554 -13.410 579 HB2 ASP 71 HB2 ASP 71 2.641 0.420 -13.637 580 HB3 ASP 71 HB1 ASP 71 3.405 1.937 -14.087 581 HA PRO 72 HA PRO 72 5.383 4.494 -10.890 582 HB2 PRO 72 HB2 PRO 72 3.413 5.224 -13.027 583 HB3 PRO 72 HB1 PRO 72 4.605 6.251 -12.234 584 HG2 PRO 72 HG2 PRO 72 5.101 5.218 -14.629 585 HG3 PRO 72 HG1 PRO 72 6.378 5.323 -13.402 586 HD2 PRO 72 HD2 PRO 72 4.993 2.963 -14.457 587 HD3 PRO 72 HD1 PRO 72 6.547 3.077 -13.624 588 HA PRO 73 HA PRO 73 2.258 5.503 -8.031 589 HB2 PRO 73 HB2 PRO 73 0.121 6.008 -10.067 590 HB3 PRO 73 HB1 PRO 73 0.378 6.792 -8.504 591 HG2 PRO 73 HG2 PRO 73 1.293 7.789 -10.903 592 HG3 PRO 73 HG1 PRO 73 2.011 8.167 -9.330 593 HD2 PRO 73 HD2 PRO 73 3.202 6.743 -11.483 594 HD3 PRO 73 HD1 PRO 73 3.881 7.018 -9.870 595 H TYR 74 HN TYR 74 1.917 3.723 -7.028 596 HA TYR 74 HA TYR 74 0.572 1.439 -8.200 597 HB2 TYR 74 HB2 TYR 74 1.671 1.724 -5.410 598 HB3 TYR 74 HB1 TYR 74 1.447 0.239 -6.310 599 HD1 TYR 74 HD2 TYR 74 3.470 3.332 -6.121 600 HD2 TYR 74 HD1 TYR 74 3.205 -0.609 -7.680 601 HE1 TYR 74 HE2 TYR 74 5.810 3.456 -6.823 602 HE2 TYR 74 HE1 TYR 74 5.567 -0.491 -8.385 603 HH TYR 74 HH TYR 74 7.271 1.092 -8.847 604 H LYS 75 HN LYS 75 -1.548 0.967 -7.797 605 HA LYS 75 HA LYS 75 -2.886 1.959 -5.440 606 HB2 LYS 75 HB2 LYS 75 -4.545 3.280 -6.785 607 HB3 LYS 75 HB1 LYS 75 -2.942 3.993 -6.683 608 HG2 LYS 75 HG2 LYS 75 -2.461 3.571 -8.887 609 HG3 LYS 75 HG1 LYS 75 -3.628 2.257 -9.009 610 HD2 LYS 75 HD2 LYS 75 -4.506 4.112 -10.223 611 HD3 LYS 75 HD1 LYS 75 -5.444 3.997 -8.742 612 HE2 LYS 75 HE2 LYS 75 -4.132 5.761 -7.766 613 HE3 LYS 75 HE1 LYS 75 -3.117 5.853 -9.197 614 HZ1 LYS 75 HZ1 LYS 75 -6.029 6.449 -9.080 615 HZ2 LYS 75 HZ2 LYS 75 -5.067 6.508 -10.475 616 HZ3 LYS 75 HZ3 LYS 75 -4.780 7.589 -9.204 617 H VAL 76 HN VAL 76 -5.046 1.375 -5.283 618 HA VAL 76 HA VAL 76 -6.127 -0.503 -7.248 619 HB VAL 76 HB VAL 76 -6.016 -0.905 -4.267 620 HG11 VAL 76 HG11 VAL 76 -8.338 -1.132 -5.153 621 HG12 VAL 76 HG12 VAL 76 -7.683 -2.604 -4.432 622 HG13 VAL 76 HG13 VAL 76 -7.760 -2.438 -6.188 623 HG21 VAL 76 HG21 VAL 76 -4.193 -1.894 -5.507 624 HG22 VAL 76 HG22 VAL 76 -5.322 -2.645 -6.628 625 HG23 VAL 76 HG23 VAL 76 -5.274 -3.165 -4.944 626 H GLU 77 HN GLU 77 -8.107 0.115 -7.888 627 HA GLU 77 HA GLU 77 -9.636 1.927 -6.132 628 HB2 GLU 77 HB2 GLU 77 -10.039 1.671 -9.105 629 HB3 GLU 77 HB1 GLU 77 -10.634 2.929 -8.045 630 HG2 GLU 77 HG2 GLU 77 -8.932 4.086 -8.925 631 HG3 GLU 77 HG1 GLU 77 -8.007 3.227 -7.696 632 H GLU 78 HN GLU 78 -11.284 0.924 -5.188 633 HA GLU 78 HA GLU 78 -12.652 -1.168 -6.733 634 HB2 GLU 78 HB2 GLU 78 -11.076 -1.564 -4.303 635 HB3 GLU 78 HB1 GLU 78 -12.714 -2.190 -4.163 636 HG2 GLU 78 HG2 GLU 78 -10.575 -2.970 -6.120 637 HG3 GLU 78 HG1 GLU 78 -11.429 -3.971 -4.945 638 H SER 79 HN SER 79 -14.546 -2.035 -5.339 639 HA SER 79 HA SER 79 -15.931 0.146 -3.988 640 HB2 SER 79 HB2 SER 79 -16.411 0.269 -6.468 641 HB3 SER 79 HB1 SER 79 -17.179 -1.315 -6.330 642 HG SER 79 HG SER 79 -18.037 1.188 -5.480 643 H GLY 80 HN GLY 80 -17.483 -0.549 -2.563 644 HA2 GLY 80 HA2 GLY 80 -18.322 -3.259 -2.286 645 HA3 GLY 80 HA1 GLY 80 -16.985 -2.895 -1.200 646 H TYR 81 HN TYR 81 -18.341 -3.111 0.682 647 HA TYR 81 HA TYR 81 -19.830 -0.661 1.187 648 HB2 TYR 81 HB2 TYR 81 -21.824 -1.890 2.052 649 HB3 TYR 81 HB1 TYR 81 -21.587 -2.041 0.313 650 HD1 TYR 81 HD2 TYR 81 -21.333 -3.840 3.530 651 HD2 TYR 81 HD1 TYR 81 -21.145 -4.157 -0.710 652 HE1 TYR 81 HE2 TYR 81 -21.398 -6.289 3.713 653 HE2 TYR 81 HE1 TYR 81 -21.213 -6.609 -0.533 654 HH TYR 81 HH TYR 81 -20.638 -8.349 1.159 655 H ALA 82 HN ALA 82 -17.402 -2.218 2.206 656 HA ALA 82 HA ALA 82 -17.774 -1.507 4.954 657 HB1 ALA 82 HB1 ALA 82 -18.798 -3.641 5.153 658 HB2 ALA 82 HB2 ALA 82 -17.168 -3.802 5.806 659 HB3 ALA 82 HB3 ALA 82 -17.537 -4.411 4.194 660 H GLY 83 HN GLY 83 -15.765 -1.795 6.206 661 HA2 GLY 83 HA2 GLY 83 -13.420 -1.552 4.457 662 HA3 GLY 83 HA1 GLY 83 -13.526 -0.997 6.122 663 H PHE 84 HN PHE 84 -11.332 -2.226 5.863 664 HA PHE 84 HA PHE 84 -11.335 -4.518 7.436 665 HB2 PHE 84 HB2 PHE 84 -10.710 -6.266 5.758 666 HB3 PHE 84 HB1 PHE 84 -12.375 -5.727 5.609 667 HD1 PHE 84 HD1 PHE 84 -12.908 -4.011 3.795 668 HD2 PHE 84 HD2 PHE 84 -9.274 -6.222 3.913 669 HE1 PHE 84 HE1 PHE 84 -12.558 -3.539 1.415 670 HE2 PHE 84 HE2 PHE 84 -8.904 -5.750 1.534 671 HZ PHE 84 HZ PHE 84 -10.546 -4.407 0.272 672 H ILE 85 HN ILE 85 -9.178 -5.334 7.801 673 HA ILE 85 HA ILE 85 -7.015 -3.608 7.199 674 HB ILE 85 HB ILE 85 -7.129 -6.445 8.216 675 HG12 ILE 85 HG12 ILE 85 -7.732 -4.619 9.767 676 HG13 ILE 85 HG11 ILE 85 -6.272 -5.468 10.264 677 HG21 ILE 85 HG21 ILE 85 -4.628 -4.836 7.707 678 HG22 ILE 85 HG22 ILE 85 -5.121 -6.300 6.854 679 HG23 ILE 85 HG23 ILE 85 -4.705 -6.375 8.566 680 HD11 ILE 85 HD11 ILE 85 -6.260 -2.862 8.777 681 HD12 ILE 85 HD12 ILE 85 -4.888 -3.681 9.520 682 HD13 ILE 85 HD13 ILE 85 -6.168 -3.007 10.530 683 H LEU 86 HN LEU 86 -5.921 -3.400 5.353 684 HA LEU 86 HA LEU 86 -6.152 -5.582 3.390 685 HB2 LEU 86 HB2 LEU 86 -7.059 -3.118 2.995 686 HB3 LEU 86 HB1 LEU 86 -5.375 -2.816 2.599 687 HG LEU 86 HG LEU 86 -6.721 -5.117 1.268 688 HD11 LEU 86 HD11 LEU 86 -7.019 -2.295 0.273 689 HD12 LEU 86 HD12 LEU 86 -8.285 -3.157 1.150 690 HD13 LEU 86 HD13 LEU 86 -7.715 -3.770 -0.402 691 HD21 LEU 86 HD21 LEU 86 -5.145 -3.248 -0.252 692 HD22 LEU 86 HD22 LEU 86 -5.001 -4.999 -0.133 693 HD23 LEU 86 HD23 LEU 86 -4.255 -3.961 1.088 694 HA PRO 87 HA PRO 87 -1.777 -5.902 4.306 695 HB2 PRO 87 HB2 PRO 87 -1.896 -8.321 2.691 696 HB3 PRO 87 HB1 PRO 87 -1.555 -8.150 4.413 697 HG2 PRO 87 HG2 PRO 87 -3.841 -9.268 3.460 698 HG3 PRO 87 HG1 PRO 87 -3.749 -8.417 5.012 699 HD2 PRO 87 HD2 PRO 87 -4.800 -7.458 2.380 700 HD3 PRO 87 HD1 PRO 87 -5.432 -7.180 4.018 701 H ILE 88 HN ILE 88 -0.995 -4.249 3.029 702 HA ILE 88 HA ILE 88 -0.913 -4.608 0.146 703 HB ILE 88 HB ILE 88 0.068 -2.248 1.767 704 HG12 ILE 88 HG12 ILE 88 -2.527 -2.359 0.241 705 HG13 ILE 88 HG11 ILE 88 -2.452 -2.925 1.908 706 HG21 ILE 88 HG21 ILE 88 0.996 -2.491 -0.504 707 HG22 ILE 88 HG22 ILE 88 -0.016 -1.057 -0.330 708 HG23 ILE 88 HG23 ILE 88 -0.645 -2.485 -1.151 709 HD11 ILE 88 HD11 ILE 88 -1.603 -0.182 1.053 710 HD12 ILE 88 HD12 ILE 88 -1.848 -0.773 2.692 711 HD13 ILE 88 HD13 ILE 88 -3.225 -0.577 1.606 712 H GLU 89 HN GLU 89 0.950 -4.920 -0.988 713 HA GLU 89 HA GLU 89 3.386 -5.264 0.621 714 HB2 GLU 89 HB2 GLU 89 2.372 -6.905 -1.680 715 HB3 GLU 89 HB1 GLU 89 4.060 -6.929 -1.179 716 HG2 GLU 89 HG2 GLU 89 3.308 -7.617 1.085 717 HG3 GLU 89 HG1 GLU 89 1.669 -7.737 0.454 718 H VAL 90 HN VAL 90 5.089 -4.192 0.047 719 HA VAL 90 HA VAL 90 5.185 -3.012 -2.642 720 HB VAL 90 HB VAL 90 6.693 -1.880 -0.292 721 HG11 VAL 90 HG11 VAL 90 7.524 -0.635 -1.963 722 HG12 VAL 90 HG12 VAL 90 5.951 0.159 -1.982 723 HG13 VAL 90 HG13 VAL 90 6.278 -1.177 -3.085 724 HG21 VAL 90 HG21 VAL 90 4.071 -2.065 -0.097 725 HG22 VAL 90 HG22 VAL 90 4.128 -0.644 -1.140 726 HG23 VAL 90 HG23 VAL 90 4.932 -0.620 0.431 727 H TYR 91 HN TYR 91 6.482 -4.299 -3.796 728 HA TYR 91 HA TYR 91 8.347 -6.084 -2.536 729 HB2 TYR 91 HB2 TYR 91 7.464 -5.562 -5.326 730 HB3 TYR 91 HB1 TYR 91 9.004 -6.375 -5.096 731 HD1 TYR 91 HD1 TYR 91 5.676 -6.659 -3.409 732 HD2 TYR 91 HD2 TYR 91 8.802 -8.613 -5.518 733 HE1 TYR 91 HE1 TYR 91 4.511 -8.810 -3.142 734 HE2 TYR 91 HE2 TYR 91 7.637 -10.763 -5.275 735 HH TYR 91 HH TYR 91 5.984 -11.808 -3.832 736 H PHE 92 HN PHE 92 10.487 -6.025 -2.480 737 HA PHE 92 HA PHE 92 11.706 -3.425 -3.143 738 HB2 PHE 92 HB2 PHE 92 12.322 -5.512 -1.034 739 HB3 PHE 92 HB1 PHE 92 13.392 -4.151 -1.379 740 HD1 PHE 92 HD1 PHE 92 11.068 -2.153 -1.849 741 HD2 PHE 92 HD2 PHE 92 11.929 -4.970 1.220 742 HE1 PHE 92 HE1 PHE 92 9.880 -0.744 -0.229 743 HE2 PHE 92 HE2 PHE 92 10.711 -3.571 2.840 744 HZ PHE 92 HZ PHE 92 9.699 -1.457 2.112 745 H LYS 93 HN LYS 93 13.853 -3.453 -4.080 746 HA LYS 93 HA LYS 93 14.576 -5.972 -5.376 747 HB2 LYS 93 HB2 LYS 93 15.843 -3.230 -5.620 748 HB3 LYS 93 HB1 LYS 93 16.249 -4.638 -6.591 749 HG2 LYS 93 HG2 LYS 93 14.018 -4.621 -7.564 750 HG3 LYS 93 HG1 LYS 93 13.592 -3.219 -6.577 751 HD2 LYS 93 HD2 LYS 93 15.299 -1.898 -7.670 752 HD3 LYS 93 HD1 LYS 93 15.839 -3.317 -8.596 753 HE2 LYS 93 HE2 LYS 93 14.359 -2.037 -10.085 754 HE3 LYS 93 HE1 LYS 93 13.409 -3.397 -9.495 755 HZ1 LYS 93 HZ1 LYS 93 12.120 -1.438 -9.386 756 HZ2 LYS 93 HZ2 LYS 93 13.323 -0.598 -8.545 757 HZ3 LYS 93 HZ3 LYS 93 12.507 -1.877 -7.798 758 H ASN 94 HN ASN 94 15.399 -7.194 -3.656 759 HA ASN 94 HA ASN 94 17.821 -6.090 -2.389 760 HB2 ASN 94 HB2 ASN 94 15.794 -7.934 -1.095 761 HB3 ASN 94 HB1 ASN 94 17.305 -7.405 -0.371 762 HD21 ASN 94 HD21 ASN 94 16.209 -6.553 1.382 763 HD22 ASN 94 HD22 ASN 94 15.324 -5.070 1.272 764 H LYS 95 HN LYS 95 19.557 -7.401 -2.268 765 HA LYS 95 HA LYS 95 19.313 -10.135 -3.327 766 HB2 LYS 95 HB2 LYS 95 20.956 -8.547 -4.375 767 HB3 LYS 95 HB1 LYS 95 21.787 -8.489 -2.829 768 HG2 LYS 95 HG2 LYS 95 21.755 -11.133 -3.201 769 HG3 LYS 95 HG1 LYS 95 21.752 -10.602 -4.886 770 HD2 LYS 95 HD2 LYS 95 24.031 -10.905 -4.163 771 HD3 LYS 95 HD1 LYS 95 23.717 -9.189 -4.414 772 HE2 LYS 95 HE2 LYS 95 25.015 -9.562 -2.378 773 HE3 LYS 95 HE1 LYS 95 23.435 -8.876 -2.006 774 HZ1 LYS 95 HZ1 LYS 95 24.017 -10.660 -0.487 775 HZ2 LYS 95 HZ2 LYS 95 24.169 -11.748 -1.782 776 HZ3 LYS 95 HZ3 LYS 95 22.656 -11.082 -1.406 777 H GLU 96 HN GLU 96 19.067 -8.572 -0.603 778 HA GLU 96 HA GLU 96 20.269 -10.660 1.054 779 HB2 GLU 96 HB2 GLU 96 20.771 -8.886 2.760 780 HB3 GLU 96 HB1 GLU 96 21.738 -8.761 1.296 781 HG2 GLU 96 HG2 GLU 96 20.445 -6.926 0.512 782 HG3 GLU 96 HG1 GLU 96 19.269 -7.133 1.817 783 H GLU 97 HN GLU 97 19.259 -9.166 3.432 784 HA GLU 97 HA GLU 97 17.096 -10.519 4.192 785 HB2 GLU 97 HB2 GLU 97 16.469 -8.539 5.610 786 HB3 GLU 97 HB1 GLU 97 18.139 -9.082 5.738 787 HG2 GLU 97 HG2 GLU 97 18.842 -7.256 4.286 788 HG3 GLU 97 HG1 GLU 97 17.164 -6.733 4.130 789 HA PRO 98 HA PRO 98 13.206 -10.454 2.783 790 HB2 PRO 98 HB2 PRO 98 11.876 -8.163 3.915 791 HB3 PRO 98 HB1 PRO 98 11.715 -9.861 4.376 792 HG2 PRO 98 HG2 PRO 98 13.447 -7.747 5.502 793 HG3 PRO 98 HG1 PRO 98 12.744 -9.171 6.298 794 HD2 PRO 98 HD2 PRO 98 15.337 -9.122 5.763 795 HD3 PRO 98 HD1 PRO 98 14.405 -10.604 5.431 796 H ARG 99 HN ARG 99 12.677 -10.110 0.805 797 HA ARG 99 HA ARG 99 13.390 -7.610 -0.493 798 HB2 ARG 99 HB2 ARG 99 12.516 -10.285 -1.583 799 HB3 ARG 99 HB1 ARG 99 12.945 -8.895 -2.580 800 HG2 ARG 99 HG2 ARG 99 15.169 -8.971 -1.963 801 HG3 ARG 99 HG1 ARG 99 14.827 -9.901 -0.523 802 HD2 ARG 99 HD2 ARG 99 14.703 -10.862 -3.327 803 HD3 ARG 99 HD1 ARG 99 15.933 -11.275 -2.164 804 HE ARG 99 HE ARG 99 13.577 -12.062 -1.004 805 HH11 ARG 99 HH11 ARG 99 15.250 -12.781 -3.997 806 HH12 ARG 99 HH12 ARG 99 14.626 -14.404 -4.104 807 HH21 ARG 99 HH21 ARG 99 12.756 -14.204 -1.145 808 HH22 ARG 99 HH22 ARG 99 13.220 -15.203 -2.488 809 H LYS 100 HN LYS 100 11.014 -8.115 1.295 810 HA LYS 100 HA LYS 100 9.147 -6.585 -0.323 811 HB2 LYS 100 HB2 LYS 100 7.218 -8.003 0.220 812 HB3 LYS 100 HB1 LYS 100 8.397 -8.872 -0.753 813 HG2 LYS 100 HG2 LYS 100 9.097 -10.182 1.044 814 HG3 LYS 100 HG1 LYS 100 8.418 -9.073 2.234 815 HD2 LYS 100 HD2 LYS 100 6.971 -10.918 2.249 816 HD3 LYS 100 HD1 LYS 100 6.137 -9.715 1.266 817 HE2 LYS 100 HE2 LYS 100 7.854 -11.871 0.058 818 HE3 LYS 100 HE1 LYS 100 6.147 -12.114 0.417 819 HZ1 LYS 100 HZ1 LYS 100 5.652 -10.190 -1.007 820 HZ2 LYS 100 HZ2 LYS 100 6.398 -11.462 -1.848 821 HZ3 LYS 100 HZ3 LYS 100 7.298 -10.093 -1.423 822 H VAL 101 HN VAL 101 7.661 -5.414 0.903 823 HA VAL 101 HA VAL 101 7.741 -5.839 3.807 824 HB VAL 101 HB VAL 101 8.883 -3.719 3.136 825 HG11 VAL 101 HG11 VAL 101 7.739 -2.988 1.228 826 HG12 VAL 101 HG12 VAL 101 7.320 -1.821 2.491 827 HG13 VAL 101 HG13 VAL 101 6.168 -3.078 2.036 828 HG21 VAL 101 HG21 VAL 101 7.816 -2.335 4.804 829 HG22 VAL 101 HG22 VAL 101 7.849 -4.017 5.344 830 HG23 VAL 101 HG23 VAL 101 6.353 -3.321 4.719 831 H ARG 102 HN ARG 102 5.733 -5.837 4.824 832 HA ARG 102 HA ARG 102 3.439 -5.659 2.985 833 HB2 ARG 102 HB2 ARG 102 4.106 -7.977 3.916 834 HB3 ARG 102 HB1 ARG 102 3.451 -7.396 5.445 835 HG2 ARG 102 HG2 ARG 102 1.323 -6.846 4.054 836 HG3 ARG 102 HG1 ARG 102 2.035 -7.894 2.836 837 HD2 ARG 102 HD2 ARG 102 0.533 -9.192 4.144 838 HD3 ARG 102 HD1 ARG 102 2.173 -9.670 4.550 839 HE ARG 102 HE ARG 102 0.632 -7.814 6.244 840 HH11 ARG 102 HH11 ARG 102 2.614 -10.682 5.851 841 HH12 ARG 102 HH12 ARG 102 2.678 -11.015 7.556 842 HH21 ARG 102 HH21 ARG 102 0.743 -8.236 8.475 843 HH22 ARG 102 HH22 ARG 102 1.608 -9.645 9.044 844 H PHE 103 HN PHE 103 2.467 -3.819 3.409 845 HA PHE 103 HA PHE 103 2.377 -2.833 6.161 846 HB2 PHE 103 HB2 PHE 103 1.636 -1.518 3.532 847 HB3 PHE 103 HB1 PHE 103 1.496 -0.742 5.102 848 HD1 PHE 103 HD1 PHE 103 3.989 -1.620 6.402 849 HD2 PHE 103 HD2 PHE 103 3.249 -0.316 2.423 850 HE1 PHE 103 HE1 PHE 103 6.306 -0.812 6.241 851 HE2 PHE 103 HE2 PHE 103 5.566 0.485 2.250 852 HZ PHE 103 HZ PHE 103 7.098 0.242 4.162 853 H ASP 104 HN ASP 104 0.803 -3.907 7.219 854 HA ASP 104 HA ASP 104 -1.718 -4.547 6.027 855 HB2 ASP 104 HB2 ASP 104 -0.930 -4.495 8.947 856 HB3 ASP 104 HB1 ASP 104 -2.422 -5.172 8.310 857 H TYR 105 HN TYR 105 -2.461 -2.621 5.185 858 HA TYR 105 HA TYR 105 -2.693 -0.358 6.994 859 HB2 TYR 105 HB2 TYR 105 -1.821 0.092 4.759 860 HB3 TYR 105 HB1 TYR 105 -3.281 -0.587 4.032 861 HD1 TYR 105 HD1 TYR 105 -2.341 2.020 6.549 862 HD2 TYR 105 HD2 TYR 105 -4.888 0.878 3.349 863 HE1 TYR 105 HE1 TYR 105 -3.461 4.205 6.667 864 HE2 TYR 105 HE2 TYR 105 -6.002 3.054 3.445 865 HH TYR 105 HH TYR 105 -6.322 4.831 5.535 866 H ASP 106 HN ASP 106 -4.445 0.187 7.990 867 HA ASP 106 HA ASP 106 -6.799 -1.403 7.856 868 HB2 ASP 106 HB2 ASP 106 -5.975 -0.336 9.929 869 HB3 ASP 106 HB1 ASP 106 -6.336 1.247 9.244 870 H LEU 107 HN LEU 107 -8.186 -1.261 6.201 871 HA LEU 107 HA LEU 107 -8.593 1.280 4.840 872 HB2 LEU 107 HB2 LEU 107 -8.831 -1.499 4.168 873 HB3 LEU 107 HB1 LEU 107 -10.365 -0.707 3.877 874 HG LEU 107 HG LEU 107 -9.066 0.988 2.486 875 HD11 LEU 107 HD11 LEU 107 -6.946 0.105 1.523 876 HD12 LEU 107 HD12 LEU 107 -6.937 -1.111 2.809 877 HD13 LEU 107 HD13 LEU 107 -6.831 0.602 3.216 878 HD21 LEU 107 HD21 LEU 107 -8.871 -0.677 0.577 879 HD22 LEU 107 HD22 LEU 107 -10.440 -0.537 1.375 880 HD23 LEU 107 HD23 LEU 107 -9.380 -1.895 1.749 881 H PHE 108 HN PHE 108 -9.993 2.626 5.962 882 HA PHE 108 HA PHE 108 -12.549 1.394 6.750 883 HB2 PHE 108 HB2 PHE 108 -12.862 2.975 8.488 884 HB3 PHE 108 HB1 PHE 108 -11.211 2.403 8.660 885 HD1 PHE 108 HD2 PHE 108 -13.347 5.240 7.795 886 HD2 PHE 108 HD1 PHE 108 -9.339 3.891 8.263 887 HE1 PHE 108 HE2 PHE 108 -12.567 7.571 7.797 888 HE2 PHE 108 HE1 PHE 108 -8.555 6.223 8.272 889 HZ PHE 108 HZ PHE 108 -10.167 8.065 8.037 890 H LEU 109 HN LEU 109 -14.464 2.534 6.293 891 HA LEU 109 HA LEU 109 -14.163 4.565 4.181 892 HB2 LEU 109 HB2 LEU 109 -16.420 2.572 4.466 893 HB3 LEU 109 HB1 LEU 109 -16.165 3.692 3.140 894 HG LEU 109 HG LEU 109 -14.431 1.310 3.813 895 HD11 LEU 109 HD11 LEU 109 -16.624 0.812 2.751 896 HD12 LEU 109 HD12 LEU 109 -15.230 0.353 1.778 897 HD13 LEU 109 HD13 LEU 109 -16.137 1.813 1.386 898 HD21 LEU 109 HD21 LEU 109 -14.167 3.414 1.678 899 HD22 LEU 109 HD22 LEU 109 -13.300 1.875 1.666 900 HD23 LEU 109 HD23 LEU 109 -13.019 3.035 2.965 901 H HIS 110 HN HIS 110 -15.836 6.226 4.168 902 HA HIS 110 HA HIS 110 -16.634 6.842 6.894 903 HB2 HIS 110 HB2 HIS 110 -17.106 9.087 6.122 904 HB3 HIS 110 HB1 HIS 110 -15.524 8.591 5.541 905 HD1 HIS 110 HD1 HIS 110 -19.065 9.106 4.293 906 HD2 HIS 110 HD2 HIS 110 -15.192 8.738 2.834 907 HE1 HIS 110 HE1 HIS 110 -19.207 9.670 1.853 908 HE2 HIS 110 HE2 HIS 110 -16.808 9.735 1.078 909 H LEU 111 HN LEU 111 -18.703 7.436 7.516 910 HA LEU 111 HA LEU 111 -20.829 5.913 6.585 911 HB2 LEU 111 HB2 LEU 111 -20.440 8.103 8.483 912 HB3 LEU 111 HB1 LEU 111 -22.040 8.087 7.774 913 HG LEU 111 HG LEU 111 -21.746 6.870 9.990 914 HD11 LEU 111 HD11 LEU 111 -22.787 5.046 7.849 915 HD12 LEU 111 HD12 LEU 111 -23.607 6.556 8.244 916 HD13 LEU 111 HD13 LEU 111 -23.400 5.317 9.481 917 HD21 LEU 111 HD21 LEU 111 -20.408 4.859 8.188 918 HD22 LEU 111 HD22 LEU 111 -20.883 4.589 9.867 919 HD23 LEU 111 HD23 LEU 111 -19.631 5.773 9.484 920 H GLU 112 HN GLU 112 -22.630 6.341 5.382 921 HA GLU 112 HA GLU 112 -22.432 7.948 3.087 922 HB2 GLU 112 HB2 GLU 112 -23.953 5.918 3.597 923 HB3 GLU 112 HB1 GLU 112 -25.029 7.079 4.353 924 HG2 GLU 112 HG2 GLU 112 -25.178 8.298 2.218 925 HG3 GLU 112 HG1 GLU 112 -24.176 7.056 1.467 926 H GLY 113 HN GLY 113 -22.230 10.141 3.262 927 HA2 GLY 113 HA2 GLY 113 -23.278 12.262 3.515 928 HA3 GLY 113 HA1 GLY 113 -24.305 11.574 4.767 929 H HIS 114 HN HIS 114 -20.848 11.103 4.590 930 HA HIS 114 HA HIS 114 -20.454 12.942 6.858 931 HB2 HIS 114 HB2 HIS 114 -20.780 10.600 7.724 932 HB3 HIS 114 HB1 HIS 114 -19.373 10.091 6.792 933 HD1 HIS 114 HD1 HIS 114 -20.377 11.841 9.923 934 HD2 HIS 114 HD2 HIS 114 -16.886 10.964 7.827 935 HE1 HIS 114 HE1 HIS 114 -18.485 12.319 11.513 936 HE2 HIS 114 HE2 HIS 114 -16.404 11.580 10.297 937 HA PRO 115 HA PRO 115 -16.884 14.852 4.913 938 HB2 PRO 115 HB2 PRO 115 -15.739 13.478 7.341 939 HB3 PRO 115 HB1 PRO 115 -15.285 15.046 6.663 940 HG2 PRO 115 HG2 PRO 115 -17.064 14.809 8.683 941 HG3 PRO 115 HG1 PRO 115 -17.171 16.091 7.465 942 HD2 PRO 115 HD2 PRO 115 -18.998 13.916 7.937 943 HD3 PRO 115 HD1 PRO 115 -19.141 15.231 6.758 944 HA PRO 116 HA PRO 116 -15.445 11.400 2.266 945 HB2 PRO 116 HB2 PRO 116 -13.572 13.686 1.767 946 HB3 PRO 116 HB1 PRO 116 -14.268 12.536 0.618 947 HG2 PRO 116 HG2 PRO 116 -15.294 14.977 0.894 948 HG3 PRO 116 HG1 PRO 116 -16.336 13.566 0.632 949 HD2 PRO 116 HD2 PRO 116 -15.953 15.192 3.057 950 HD3 PRO 116 HD1 PRO 116 -17.325 14.170 2.588 951 H VAL 117 HN VAL 117 -13.480 10.245 1.996 952 HA VAL 117 HA VAL 117 -11.917 10.239 4.479 953 HB VAL 117 HB VAL 117 -12.827 8.045 2.644 954 HG11 VAL 117 HG11 VAL 117 -10.501 7.879 4.545 955 HG12 VAL 117 HG12 VAL 117 -10.462 7.648 2.803 956 HG13 VAL 117 HG13 VAL 117 -11.310 6.492 3.829 957 HG21 VAL 117 HG21 VAL 117 -13.454 6.983 4.755 958 HG22 VAL 117 HG22 VAL 117 -14.197 8.574 4.577 959 HG23 VAL 117 HG23 VAL 117 -12.803 8.365 5.640 960 H ASN 118 HN ASN 118 -9.910 10.901 4.319 961 HA ASN 118 HA ASN 118 -8.284 9.983 2.069 962 HB2 ASN 118 HB2 ASN 118 -9.133 12.315 1.588 963 HB3 ASN 118 HB1 ASN 118 -8.226 12.864 2.996 964 HD21 ASN 118 HD21 ASN 118 -5.834 12.304 2.954 965 HD22 ASN 118 HD22 ASN 118 -5.039 12.416 1.421 966 H HIS 119 HN HIS 119 -7.039 8.650 3.367 967 HA HIS 119 HA HIS 119 -5.811 9.911 5.738 968 HB2 HIS 119 HB2 HIS 119 -7.482 8.112 6.262 969 HB3 HIS 119 HB1 HIS 119 -6.432 6.980 5.415 970 HD1 HIS 119 HD1 HIS 119 -4.714 5.849 6.773 971 HD2 HIS 119 HD2 HIS 119 -6.081 9.330 8.586 972 HE1 HIS 119 HE1 HIS 119 -3.580 5.931 9.017 973 HE2 HIS 119 HE2 HIS 119 -4.265 8.145 10.006 974 H LEU 120 HN LEU 120 -3.678 9.521 6.161 975 HA LEU 120 HA LEU 120 -2.139 7.858 4.320 976 HB2 LEU 120 HB2 LEU 120 -1.983 10.818 4.602 977 HB3 LEU 120 HB1 LEU 120 -0.502 9.921 4.318 978 HG LEU 120 HG LEU 120 -2.861 9.480 2.537 979 HD11 LEU 120 HD11 LEU 120 -0.993 11.306 1.404 980 HD12 LEU 120 HD12 LEU 120 -1.635 11.984 2.899 981 HD13 LEU 120 HD13 LEU 120 -2.732 11.490 1.608 982 HD21 LEU 120 HD21 LEU 120 -0.738 8.070 2.597 983 HD22 LEU 120 HD22 LEU 120 0.072 9.482 1.914 984 HD23 LEU 120 HD23 LEU 120 -1.244 8.707 1.031 985 H ARG 121 HN ARG 121 -0.129 7.222 5.073 986 HA ARG 121 HA ARG 121 0.901 8.216 7.564 987 HB2 ARG 121 HB2 ARG 121 0.972 5.917 8.601 988 HB3 ARG 121 HB1 ARG 121 -0.603 6.686 8.558 989 HG2 ARG 121 HG2 ARG 121 -1.238 4.646 7.850 990 HG3 ARG 121 HG1 ARG 121 -0.745 5.278 6.286 991 HD2 ARG 121 HD2 ARG 121 0.131 3.027 6.691 992 HD3 ARG 121 HD1 ARG 121 1.428 4.205 6.502 993 HE ARG 121 HE ARG 121 1.525 4.185 9.017 994 HH11 ARG 121 HH11 ARG 121 0.350 1.429 7.202 995 HH12 ARG 121 HH12 ARG 121 0.774 0.268 8.424 996 HH21 ARG 121 HH21 ARG 121 2.070 2.660 10.643 997 HH22 ARG 121 HH22 ARG 121 1.738 0.975 10.382 998 H CYS 122 HN CYS 122 3.046 8.063 7.650 999 HA CYS 122 HA CYS 122 4.383 6.827 5.370 1000 HB2 CYS 122 HB2 CYS 122 6.341 8.169 6.128 1001 HB3 CYS 122 HB1 CYS 122 4.922 9.139 5.766 1002 HG CYS 122 HG CYS 122 5.059 8.275 8.979 1003 H GLU 123 HN GLU 123 5.700 5.116 5.485 1004 HA GLU 123 HA GLU 123 6.295 3.992 8.143 1005 HB2 GLU 123 HB2 GLU 123 5.956 2.695 5.435 1006 HB3 GLU 123 HB1 GLU 123 6.564 1.842 6.852 1007 HG2 GLU 123 HG2 GLU 123 3.996 3.306 7.051 1008 HG3 GLU 123 HG1 GLU 123 4.019 1.756 6.196 1009 H LYS 124 HN LYS 124 8.389 3.273 8.575 1010 HA LYS 124 HA LYS 124 10.423 4.231 6.674 1011 HB2 LYS 124 HB2 LYS 124 10.231 5.548 8.800 1012 HB3 LYS 124 HB1 LYS 124 10.685 4.088 9.671 1013 HG2 LYS 124 HG2 LYS 124 12.796 4.066 8.289 1014 HG3 LYS 124 HG1 LYS 124 12.332 5.669 7.718 1015 HD2 LYS 124 HD2 LYS 124 12.972 4.825 10.511 1016 HD3 LYS 124 HD1 LYS 124 13.866 5.945 9.486 1017 HE2 LYS 124 HE2 LYS 124 11.650 7.223 9.359 1018 HE3 LYS 124 HE1 LYS 124 11.220 6.323 10.813 1019 HZ1 LYS 124 HZ1 LYS 124 13.679 7.966 10.559 1020 HZ2 LYS 124 HZ2 LYS 124 13.086 7.227 11.965 1021 HZ3 LYS 124 HZ3 LYS 124 12.240 8.519 11.262 1022 H LEU 125 HN LEU 125 11.828 2.782 5.979 1023 HA LEU 125 HA LEU 125 12.113 0.272 7.501 1024 HB2 LEU 125 HB2 LEU 125 12.627 0.665 4.559 1025 HB3 LEU 125 HB1 LEU 125 12.462 -0.850 5.419 1026 HG LEU 125 HG LEU 125 10.115 0.960 5.486 1027 HD11 LEU 125 HD11 LEU 125 10.715 1.212 3.157 1028 HD12 LEU 125 HD12 LEU 125 9.338 0.115 3.294 1029 HD13 LEU 125 HD13 LEU 125 10.951 -0.532 3.006 1030 HD21 LEU 125 HD21 LEU 125 8.960 -1.225 5.206 1031 HD22 LEU 125 HD22 LEU 125 10.008 -1.145 6.623 1032 HD23 LEU 125 HD23 LEU 125 10.542 -2.005 5.179 1033 H THR 126 HN THR 126 13.937 0.676 8.711 1034 HA THR 126 HA THR 126 16.223 1.995 7.462 1035 HB THR 126 HB THR 126 16.366 0.940 10.250 1036 HG1 THR 126 HG1 THR 126 14.304 1.925 10.202 1037 HG21 THR 126 HG21 THR 126 18.132 2.306 8.893 1038 HG22 THR 126 HG22 THR 126 17.844 2.677 10.593 1039 HG23 THR 126 HG23 THR 126 17.120 3.680 9.337 1040 H PHE 127 HN PHE 127 17.801 0.873 6.565 1041 HA PHE 127 HA PHE 127 18.156 -1.940 7.353 1042 HB2 PHE 127 HB2 PHE 127 18.898 -0.603 4.740 1043 HB3 PHE 127 HB1 PHE 127 19.063 -2.318 5.108 1044 HD1 PHE 127 HD1 PHE 127 17.074 -3.765 5.236 1045 HD2 PHE 127 HD2 PHE 127 16.779 0.372 4.260 1046 HE1 PHE 127 HE1 PHE 127 14.767 -4.102 4.455 1047 HE2 PHE 127 HE2 PHE 127 14.484 0.039 3.481 1048 HZ PHE 127 HZ PHE 127 13.467 -2.200 3.586 1049 H ASN 128 HN ASN 128 19.687 -1.896 8.878 1050 HA ASN 128 HA ASN 128 21.874 -0.070 8.838 1051 HB2 ASN 128 HB2 ASN 128 22.651 -1.144 10.827 1052 HB3 ASN 128 HB1 ASN 128 20.900 -1.041 10.934 1053 HD21 ASN 128 HD21 ASN 128 19.667 -2.929 10.776 1054 HD22 ASN 128 HD22 ASN 128 20.380 -4.501 10.989 1055 H ASN 129 HN ASN 129 23.522 -0.193 7.515 1056 HA ASN 129 HA ASN 129 25.295 -0.958 6.332 1057 HB2 ASN 129 HB2 ASN 129 25.140 -3.315 8.221 1058 HB3 ASN 129 HB1 ASN 129 26.537 -2.854 7.252 1059 HD21 ASN 129 HD21 ASN 129 24.639 -2.163 10.057 1060 HD22 ASN 129 HD22 ASN 129 25.698 -0.984 10.751 1061 HA PRO 130 HA PRO 130 22.932 -3.996 3.787 1062 HB2 PRO 130 HB2 PRO 130 22.087 -2.374 1.820 1063 HB3 PRO 130 HB1 PRO 130 21.210 -2.518 3.346 1064 HG2 PRO 130 HG2 PRO 130 22.933 -0.320 2.357 1065 HG3 PRO 130 HG1 PRO 130 21.549 -0.259 3.459 1066 HD2 PRO 130 HD2 PRO 130 24.297 -0.236 4.154 1067 HD3 PRO 130 HD1 PRO 130 22.916 -0.363 5.258 1068 H THR 131 HN THR 131 23.485 -4.780 1.653 1069 HA THR 131 HA THR 131 26.232 -4.469 0.994 1070 HB THR 131 HB THR 131 25.065 -6.583 0.551 1071 HG1 THR 131 HG1 THR 131 26.827 -6.319 -0.744 1072 HG21 THR 131 HG21 THR 131 22.863 -5.828 -0.059 1073 HG22 THR 131 HG22 THR 131 23.530 -6.743 -1.412 1074 HG23 THR 131 HG23 THR 131 23.496 -4.981 -1.472 1075 H GLU 132 HN GLU 132 27.053 -3.759 -1.186 1076 HA GLU 132 HA GLU 132 26.510 -1.055 -1.506 1077 HB2 GLU 132 HB2 GLU 132 28.570 -2.294 -2.312 1078 HB3 GLU 132 HB1 GLU 132 27.616 -2.752 -3.720 1079 HG2 GLU 132 HG2 GLU 132 28.839 -0.869 -4.373 1080 HG3 GLU 132 HG1 GLU 132 27.197 -0.296 -4.079 1081 H ASP 133 HN ASP 133 25.349 -3.773 -3.441 1082 HA ASP 133 HA ASP 133 24.008 -2.355 -5.438 1083 HB2 ASP 133 HB2 ASP 133 24.122 -4.626 -5.901 1084 HB3 ASP 133 HB1 ASP 133 23.590 -5.111 -4.293 1085 H PHE 134 HN PHE 134 22.740 -3.440 -2.289 1086 HA PHE 134 HA PHE 134 20.138 -2.363 -2.754 1087 HB2 PHE 134 HB2 PHE 134 20.798 -4.208 -1.031 1088 HB3 PHE 134 HB1 PHE 134 21.322 -2.863 -0.016 1089 HD1 PHE 134 HD1 PHE 134 18.450 -3.016 -2.305 1090 HD2 PHE 134 HD2 PHE 134 19.740 -2.842 1.735 1091 HE1 PHE 134 HE1 PHE 134 16.145 -2.668 -1.594 1092 HE2 PHE 134 HE2 PHE 134 17.418 -2.504 2.462 1093 HZ PHE 134 HZ PHE 134 15.618 -2.416 0.783 1094 H ARG 135 HN ARG 135 22.891 -1.313 -0.785 1095 HA ARG 135 HA ARG 135 22.084 1.136 0.132 1096 HB2 ARG 135 HB2 ARG 135 24.131 0.402 0.809 1097 HB3 ARG 135 HB1 ARG 135 24.682 0.084 -0.838 1098 HG2 ARG 135 HG2 ARG 135 25.779 2.070 -0.676 1099 HG3 ARG 135 HG1 ARG 135 24.204 2.805 -0.857 1100 HD2 ARG 135 HD2 ARG 135 23.996 2.756 1.619 1101 HD3 ARG 135 HD1 ARG 135 25.671 2.215 1.721 1102 HE ARG 135 HE ARG 135 25.891 4.454 0.266 1103 HH11 ARG 135 HH11 ARG 135 24.247 3.757 3.268 1104 HH12 ARG 135 HH12 ARG 135 24.423 5.361 3.903 1105 HH21 ARG 135 HH21 ARG 135 26.161 6.563 1.096 1106 HH22 ARG 135 HH22 ARG 135 25.515 6.963 2.662 1107 H ARG 136 HN ARG 136 23.507 0.444 -3.007 1108 HA ARG 136 HA ARG 136 23.650 2.903 -4.167 1109 HB2 ARG 136 HB2 ARG 136 23.790 0.229 -4.909 1110 HB3 ARG 136 HB1 ARG 136 22.652 0.993 -5.975 1111 HG2 ARG 136 HG2 ARG 136 24.322 2.658 -6.592 1112 HG3 ARG 136 HG1 ARG 136 25.482 1.842 -5.537 1113 HD2 ARG 136 HD2 ARG 136 25.867 1.065 -7.763 1114 HD3 ARG 136 HD1 ARG 136 25.094 -0.240 -6.853 1115 HE ARG 136 HE ARG 136 22.963 0.786 -7.968 1116 HH11 ARG 136 HH11 ARG 136 26.120 0.364 -9.429 1117 HH12 ARG 136 HH12 ARG 136 25.482 0.133 -11.032 1118 HH21 ARG 136 HH21 ARG 136 22.124 0.490 -10.058 1119 HH22 ARG 136 HH22 ARG 136 23.208 0.192 -11.387 1120 H LYS 137 HN LYS 137 20.902 0.673 -4.327 1121 HA LYS 137 HA LYS 137 19.306 2.351 -5.951 1122 HB2 LYS 137 HB2 LYS 137 18.511 0.087 -4.109 1123 HB3 LYS 137 HB1 LYS 137 17.452 0.833 -5.300 1124 HG2 LYS 137 HG2 LYS 137 18.794 0.029 -7.101 1125 HG3 LYS 137 HG1 LYS 137 20.052 -0.519 -5.990 1126 HD2 LYS 137 HD2 LYS 137 17.647 -1.735 -5.164 1127 HD3 LYS 137 HD1 LYS 137 17.745 -1.925 -6.918 1128 HE2 LYS 137 HE2 LYS 137 20.011 -2.822 -6.695 1129 HE3 LYS 137 HE1 LYS 137 19.914 -2.622 -4.945 1130 HZ1 LYS 137 HZ1 LYS 137 18.302 -4.450 -6.630 1131 HZ2 LYS 137 HZ2 LYS 137 18.032 -4.194 -4.973 1132 HZ3 LYS 137 HZ3 LYS 137 19.493 -4.874 -5.499 1133 H LEU 138 HN LEU 138 19.305 1.705 -2.488 1134 HA LEU 138 HA LEU 138 17.149 3.277 -1.714 1135 HB2 LEU 138 HB2 LEU 138 19.681 2.894 -0.137 1136 HB3 LEU 138 HB1 LEU 138 18.095 3.285 0.496 1137 HG LEU 138 HG LEU 138 19.032 0.673 -0.654 1138 HD11 LEU 138 HD11 LEU 138 19.520 1.150 1.711 1139 HD12 LEU 138 HD12 LEU 138 18.419 -0.212 1.497 1140 HD13 LEU 138 HD13 LEU 138 17.792 1.359 1.997 1141 HD21 LEU 138 HD21 LEU 138 16.217 1.485 -0.003 1142 HD22 LEU 138 HD22 LEU 138 16.747 -0.161 -0.322 1143 HD23 LEU 138 HD23 LEU 138 16.849 1.061 -1.588 1144 H LEU 139 HN LEU 139 20.416 4.221 -2.515 1145 HA LEU 139 HA LEU 139 20.225 6.879 -1.451 1146 HB2 LEU 139 HB2 LEU 139 22.170 5.769 -3.471 1147 HB3 LEU 139 HB1 LEU 139 22.370 7.234 -2.531 1148 HG LEU 139 HG LEU 139 22.159 4.496 -1.301 1149 HD11 LEU 139 HD11 LEU 139 24.446 4.266 -1.272 1150 HD12 LEU 139 HD12 LEU 139 24.727 5.992 -1.552 1151 HD13 LEU 139 HD13 LEU 139 24.170 4.966 -2.874 1152 HD21 LEU 139 HD21 LEU 139 21.563 6.421 0.099 1153 HD22 LEU 139 HD22 LEU 139 23.160 7.108 -0.194 1154 HD23 LEU 139 HD23 LEU 139 23.001 5.579 0.674 1155 H LYS 140 HN LYS 140 19.807 5.379 -4.592 1156 HA LYS 140 HA LYS 140 19.638 7.746 -6.122 1157 HB2 LYS 140 HB2 LYS 140 19.381 4.915 -6.557 1158 HB3 LYS 140 HB1 LYS 140 18.115 5.791 -7.393 1159 HG2 LYS 140 HG2 LYS 140 19.600 6.939 -8.737 1160 HG3 LYS 140 HG1 LYS 140 20.956 6.661 -7.640 1161 HD2 LYS 140 HD2 LYS 140 19.589 4.388 -9.041 1162 HD3 LYS 140 HD1 LYS 140 20.874 5.305 -9.818 1163 HE2 LYS 140 HE2 LYS 140 21.091 3.920 -7.156 1164 HE3 LYS 140 HE1 LYS 140 21.630 3.252 -8.692 1165 HZ1 LYS 140 HZ1 LYS 140 23.518 4.218 -7.670 1166 HZ2 LYS 140 HZ2 LYS 140 22.682 5.637 -7.279 1167 HZ3 LYS 140 HZ3 LYS 140 23.061 5.293 -8.897 1168 H ALA 141 HN ALA 141 17.407 6.040 -4.170 1169 HA ALA 141 HA ALA 141 14.937 6.598 -5.198 1170 HB1 ALA 141 HB1 ALA 141 14.077 6.105 -3.112 1171 HB2 ALA 141 HB2 ALA 141 15.437 6.841 -2.267 1172 HB3 ALA 141 HB3 ALA 141 15.644 5.299 -3.097 1173 H1 GLY 212 HT1 GLY 212 -19.939 10.128 14.295 1174 H2 GLY 212 HT2 GLY 212 -18.669 9.079 14.709 1175 H3 GLY 212 HT3 GLY 212 -20.165 8.950 15.493 1176 HA2 GLY 212 HA1 GLY 212 -19.866 7.197 13.844 1177 HA3 GLY 212 HA2 GLY 212 -21.239 8.239 13.488 1178 H GLY 213 HN GLY 213 -17.841 7.653 12.715 1179 HA2 GLY 213 HA2 GLY 213 -18.374 8.802 10.042 1180 HA3 GLY 213 HA1 GLY 213 -16.839 9.017 10.874 1181 H LYS 214 HN LYS 214 -17.006 6.248 11.924 1182 HA LYS 214 HA LYS 214 -15.685 4.984 9.678 1183 HB2 LYS 214 HB2 LYS 214 -14.675 4.889 11.903 1184 HB3 LYS 214 HB1 LYS 214 -16.108 4.103 12.541 1185 HG2 LYS 214 HG2 LYS 214 -15.658 2.178 11.044 1186 HG3 LYS 214 HG1 LYS 214 -14.153 2.964 10.557 1187 HD2 LYS 214 HD2 LYS 214 -13.368 2.931 12.863 1188 HD3 LYS 214 HD1 LYS 214 -14.888 2.203 13.386 1189 HE2 LYS 214 HE2 LYS 214 -14.399 0.251 11.955 1190 HE3 LYS 214 HE1 LYS 214 -12.848 0.974 11.537 1191 HZ1 LYS 214 HZ1 LYS 214 -12.547 -0.624 13.288 1192 HZ2 LYS 214 HZ2 LYS 214 -13.728 0.123 14.247 1193 HZ3 LYS 214 HZ3 LYS 214 -12.271 0.928 13.917 1194 H ALA 215 HN ALA 215 -16.869 3.935 8.238 1195 HA ALA 215 HA ALA 215 -19.467 2.884 8.719 1196 HB1 ALA 215 HB1 ALA 215 -19.214 1.880 6.470 1197 HB2 ALA 215 HB2 ALA 215 -17.521 2.374 6.463 1198 HB3 ALA 215 HB3 ALA 215 -18.795 3.593 6.497 1199 HA PRO 216 HA PRO 216 -18.679 -1.174 10.311 1200 HB2 PRO 216 HB2 PRO 216 -20.227 -2.751 8.652 1201 HB3 PRO 216 HB1 PRO 216 -20.839 -1.855 10.043 1202 HG2 PRO 216 HG2 PRO 216 -20.930 -1.158 7.146 1203 HG3 PRO 216 HG1 PRO 216 -22.152 -0.895 8.405 1204 HD2 PRO 216 HD2 PRO 216 -20.567 1.085 7.492 1205 HD3 PRO 216 HD1 PRO 216 -21.119 1.025 9.177 1206 H ARG 217 HN ARG 217 -17.632 -3.221 9.810 1207 HA ARG 217 HA ARG 217 -16.359 -3.279 7.176 1208 HB2 ARG 217 HB2 ARG 217 -14.148 -3.688 8.228 1209 HB3 ARG 217 HB1 ARG 217 -14.782 -2.077 8.518 1210 HG2 ARG 217 HG2 ARG 217 -15.413 -2.693 10.769 1211 HG3 ARG 217 HG1 ARG 217 -14.884 -4.354 10.485 1212 HD2 ARG 217 HD2 ARG 217 -13.236 -2.916 11.717 1213 HD3 ARG 217 HD1 ARG 217 -12.614 -3.679 10.254 1214 HE ARG 217 HE ARG 217 -13.645 -1.041 9.803 1215 HH11 ARG 217 HH11 ARG 217 -10.822 -2.844 10.848 1216 HH12 ARG 217 HH12 ARG 217 -9.703 -1.582 10.400 1217 HH21 ARG 217 HH21 ARG 217 -12.152 0.594 9.193 1218 HH22 ARG 217 HH22 ARG 217 -10.449 0.348 9.454 1219 H1 KCR 218 HN KCR 218 -15.224 -5.264 6.707 1220 H4 KCR 218 HA KCR 218 -16.664 -7.566 7.807 1221 H5 KCR 218 HB1 KCR 218 -15.933 -8.753 5.827 1222 H6 KCR 218 HB2 KCR 218 -14.837 -7.446 5.398 1223 H7 KCR 218 HG1 KCR 218 -16.775 -5.962 5.068 1224 H8 KCR 218 HG2 KCR 218 -17.845 -7.320 5.422 1225 H9 KCR 218 HD1 KCR 218 -17.133 -8.503 3.496 1226 H10 KCR 218 HD2 KCR 218 -15.795 -7.384 3.223 1227 H11 KCR 218 HE1 KCR 218 -17.395 -5.586 2.766 1228 H12 KCR 218 HE2 KCR 218 -18.730 -6.715 3.017 1229 H13 KCR 218 HZ1 KCR 218 -17.971 -7.918 1.063 1230 H14 KCR 218 HH1 KCR 218 -17.429 -7.760 -1.277 1231 H15 KCR 218 HJ1 KCR 218 -16.933 -4.798 -1.978 1232 H16 KCR 218 HF3 KCR 218 -17.104 -5.602 -4.258 1233 H17 KCR 218 HF1 KCR 218 -16.051 -6.887 -3.669 1234 H18 KCR 218 HF2 KCR 218 -17.799 -7.124 -3.699 1235 H GLN 219 HN GLN 219 -14.551 -6.174 9.194 1236 HA GLN 219 HA GLN 219 -12.892 -8.449 9.872 1237 HB2 GLN 219 HB2 GLN 219 -11.594 -7.213 8.143 1238 HB3 GLN 219 HB1 GLN 219 -11.695 -5.762 9.125 1239 HG2 GLN 219 HG2 GLN 219 -9.524 -6.846 9.327 1240 HG3 GLN 219 HG1 GLN 219 -10.379 -6.809 10.866 1241 HE21 GLN 219 HE21 GLN 219 -11.134 -9.042 8.284 1242 HE22 GLN 219 HE22 GLN 219 -10.591 -10.469 9.105 1243 H LEU 220 HN LEU 220 -14.817 -7.851 11.386 1244 HA LEU 220 HA LEU 220 -14.424 -5.583 13.112 1245 HB2 LEU 220 HB2 LEU 220 -16.622 -6.773 12.395 1246 HB3 LEU 220 HB1 LEU 220 -16.243 -7.906 13.674 1247 HG LEU 220 HG LEU 220 -16.549 -4.941 14.145 1248 HD11 LEU 220 HD11 LEU 220 -18.598 -7.130 14.456 1249 HD12 LEU 220 HD12 LEU 220 -18.628 -5.847 13.247 1250 HD13 LEU 220 HD13 LEU 220 -18.793 -5.451 14.958 1251 HD21 LEU 220 HD21 LEU 220 -16.615 -7.308 16.016 1252 HD22 LEU 220 HD22 LEU 220 -16.876 -5.623 16.470 1253 HD23 LEU 220 HD23 LEU 220 -15.300 -6.142 15.868 1254 H ALA 221 HN ALA 221 -12.951 -5.540 14.664 1255 HA ALA 221 HA ALA 221 -11.858 -7.994 15.752 1256 HB1 ALA 221 HB1 ALA 221 -10.367 -6.122 15.233 1257 HB2 ALA 221 HB2 ALA 221 -10.313 -6.531 16.949 1258 HB3 ALA 221 HB3 ALA 221 -11.220 -5.118 16.406 1259 H THR 222 HN THR 222 -13.697 -8.816 16.800 1260 HA THR 222 HA THR 222 -14.822 -7.231 18.987 1261 HB THR 222 HB THR 222 -16.359 -8.339 17.363 1262 HG1 THR 222 HG1 THR 222 -17.595 -8.175 19.060 1263 HG21 THR 222 HG21 THR 222 -15.100 -10.377 16.938 1264 HG22 THR 222 HG22 THR 222 -16.716 -10.765 17.528 1265 HG23 THR 222 HG23 THR 222 -15.330 -10.887 18.610 1266 H LYS 223 HN LYS 223 -12.151 -8.637 18.858 1267 HA LYS 223 HA LYS 223 -10.726 -9.643 20.288 1268 HB2 LYS 223 HB2 LYS 223 -12.974 -9.378 22.297 1269 HB3 LYS 223 HB1 LYS 223 -11.289 -9.719 22.673 1270 HG2 LYS 223 HG2 LYS 223 -12.354 -7.192 21.422 1271 HG3 LYS 223 HG1 LYS 223 -11.804 -7.386 23.088 1272 HD2 LYS 223 HD2 LYS 223 -10.053 -7.876 20.685 1273 HD3 LYS 223 HD1 LYS 223 -10.144 -6.327 21.523 1274 HE2 LYS 223 HE2 LYS 223 -9.431 -8.918 22.883 1275 HE3 LYS 223 HE1 LYS 223 -8.235 -7.814 22.206 1276 HZ1 LYS 223 HZ1 LYS 223 -10.217 -7.077 24.296 1277 HZ2 LYS 223 HZ2 LYS 223 -8.959 -6.105 23.702 1278 HZ3 LYS 223 HZ3 LYS 223 -8.604 -7.494 24.603 1279 H ALA 224 HN ALA 224 -12.206 -11.208 18.565 1280 HA ALA 224 HA ALA 224 -12.354 -13.714 20.105 1281 HB1 ALA 224 HB1 ALA 224 -14.569 -13.077 19.265 1282 HB2 ALA 224 HB2 ALA 224 -13.982 -14.546 18.487 1283 HB3 ALA 224 HB3 ALA 224 -13.926 -13.008 17.625 Start of MODEL 18 1 H1 GLY 1 HT1 GLY 1 30.588 10.143 5.180 2 H2 GLY 1 HT2 GLY 1 29.571 11.474 5.425 3 H3 GLY 1 HT3 GLY 1 31.231 11.601 5.754 4 HA2 GLY 1 HA1 GLY 1 30.000 11.220 3.084 5 HA3 GLY 1 HA2 GLY 1 30.746 12.697 3.681 6 H SER 2 HN SER 2 32.096 12.500 1.755 7 HA SER 2 HA SER 2 34.103 12.124 0.772 8 HB2 SER 2 HB2 SER 2 34.840 10.730 3.360 9 HB3 SER 2 HB1 SER 2 35.966 11.255 2.108 10 HG SER 2 HG SER 2 34.356 13.301 2.871 11 H HIS 3 HN HIS 3 33.198 10.827 -0.800 12 HA HIS 3 HA HIS 3 32.939 8.987 -2.095 13 HB2 HIS 3 HB2 HIS 3 35.062 7.860 -0.255 14 HB3 HIS 3 HB1 HIS 3 34.506 7.070 -1.726 15 HD1 HIS 3 HD1 HIS 3 37.055 9.306 -0.532 16 HD2 HIS 3 HD2 HIS 3 34.959 8.834 -4.094 17 HE1 HIS 3 HE1 HIS 3 38.400 10.513 -2.279 18 HE2 HIS 3 HE2 HIS 3 36.985 10.414 -4.361 19 H MET 4 HN MET 4 32.862 6.254 -1.583 20 HA MET 4 HA MET 4 30.503 6.122 0.144 21 HB2 MET 4 HB2 MET 4 30.593 5.159 -2.238 22 HB3 MET 4 HB1 MET 4 31.589 3.881 -1.555 23 HG2 MET 4 HG2 MET 4 29.311 3.140 -1.685 24 HG3 MET 4 HG1 MET 4 29.769 3.330 0.007 25 HE1 MET 4 HE1 MET 4 27.845 4.944 -3.021 26 HE2 MET 4 HE2 MET 4 28.943 6.227 -2.518 27 HE3 MET 4 HE3 MET 4 27.204 6.412 -2.283 28 H ALA 5 HN ALA 5 32.571 3.360 -0.411 29 HA ALA 5 HA ALA 5 33.874 2.069 0.904 30 HB1 ALA 5 HB1 ALA 5 35.313 3.107 2.539 31 HB2 ALA 5 HB2 ALA 5 34.313 4.559 2.538 32 HB3 ALA 5 HB3 ALA 5 35.219 4.111 1.092 33 H SER 6 HN SER 6 32.619 4.178 3.486 34 HA SER 6 HA SER 6 32.030 1.803 5.049 35 HB2 SER 6 HB2 SER 6 33.222 3.722 6.082 36 HB3 SER 6 HB1 SER 6 31.803 4.729 5.807 37 HG SER 6 HG SER 6 31.541 2.307 7.228 38 H SER 7 HN SER 7 30.109 0.873 4.933 39 HA SER 7 HA SER 7 27.796 2.319 3.982 40 HB2 SER 7 HB2 SER 7 28.292 -0.086 3.387 41 HB3 SER 7 HB1 SER 7 27.927 -0.514 5.058 42 HG SER 7 HG SER 7 26.168 -0.662 3.428 43 H CYS 8 HN CYS 8 25.743 2.185 5.227 44 HA CYS 8 HA CYS 8 25.982 2.160 8.116 45 HB2 CYS 8 HB2 CYS 8 25.141 4.668 6.632 46 HB3 CYS 8 HB1 CYS 8 25.138 4.452 8.378 47 HG CYS 8 HG CYS 8 28.147 3.761 7.518 48 H ALA 9 HN ALA 9 23.575 3.192 8.848 49 HA ALA 9 HA ALA 9 21.752 1.264 7.723 50 HB1 ALA 9 HB1 ALA 9 20.155 2.056 9.380 51 HB2 ALA 9 HB2 ALA 9 21.210 3.424 9.761 52 HB3 ALA 9 HB3 ALA 9 21.734 1.780 10.129 53 H VAL 10 HN VAL 10 20.894 1.639 5.799 54 HA VAL 10 HA VAL 10 20.167 4.385 5.065 55 HB VAL 10 HB VAL 10 20.114 1.970 3.252 56 HG11 VAL 10 HG11 VAL 10 18.855 3.632 2.246 57 HG12 VAL 10 HG12 VAL 10 20.457 3.896 1.555 58 HG13 VAL 10 HG13 VAL 10 19.880 4.926 2.865 59 HG21 VAL 10 HG21 VAL 10 22.372 2.036 3.773 60 HG22 VAL 10 HG22 VAL 10 22.388 3.791 3.943 61 HG23 VAL 10 HG23 VAL 10 22.277 3.060 2.342 62 H GLN 11 HN GLN 11 18.109 4.985 5.086 63 HA GLN 11 HA GLN 11 16.116 2.888 5.526 64 HB2 GLN 11 HB2 GLN 11 15.171 5.062 6.871 65 HB3 GLN 11 HB1 GLN 11 15.833 3.612 7.572 66 HG2 GLN 11 HG2 GLN 11 16.936 5.423 8.595 67 HG3 GLN 11 HG1 GLN 11 18.066 4.686 7.481 68 HE21 GLN 11 HE21 GLN 11 16.078 7.475 8.085 69 HE22 GLN 11 HE22 GLN 11 16.817 8.499 6.898 70 H VAL 12 HN VAL 12 14.418 2.884 4.396 71 HA VAL 12 HA VAL 12 13.960 5.101 2.537 72 HB VAL 12 HB VAL 12 12.746 3.325 1.204 73 HG11 VAL 12 HG11 VAL 12 15.199 3.934 0.876 74 HG12 VAL 12 HG12 VAL 12 14.720 2.338 0.308 75 HG13 VAL 12 HG13 VAL 12 15.577 2.507 1.839 76 HG21 VAL 12 HG21 VAL 12 12.255 1.881 3.106 77 HG22 VAL 12 HG22 VAL 12 13.962 1.455 3.208 78 HG23 VAL 12 HG23 VAL 12 13.025 1.019 1.777 79 H LYS 13 HN LYS 13 11.698 5.733 2.158 80 HA LYS 13 HA LYS 13 9.990 5.095 4.481 81 HB2 LYS 13 HB2 LYS 13 10.966 7.442 4.572 82 HB3 LYS 13 HB1 LYS 13 10.139 7.774 3.061 83 HG2 LYS 13 HG2 LYS 13 8.016 7.611 4.122 84 HG3 LYS 13 HG1 LYS 13 8.746 6.982 5.605 85 HD2 LYS 13 HD2 LYS 13 10.019 9.097 5.823 86 HD3 LYS 13 HD1 LYS 13 9.173 9.721 4.411 87 HE2 LYS 13 HE2 LYS 13 7.059 9.578 5.578 88 HE3 LYS 13 HE1 LYS 13 7.852 8.845 6.973 89 HZ1 LYS 13 HZ1 LYS 13 9.173 10.901 7.188 90 HZ2 LYS 13 HZ2 LYS 13 7.513 11.165 7.393 91 HZ3 LYS 13 HZ3 LYS 13 8.267 11.603 5.937 92 H LEU 14 HN LEU 14 8.154 4.131 3.890 93 HA LEU 14 HA LEU 14 7.137 4.680 1.186 94 HB2 LEU 14 HB2 LEU 14 6.858 2.205 2.879 95 HB3 LEU 14 HB1 LEU 14 5.982 2.468 1.385 96 HG LEU 14 HG LEU 14 8.996 2.320 1.609 97 HD11 LEU 14 HD11 LEU 14 6.994 0.305 0.627 98 HD12 LEU 14 HD12 LEU 14 7.986 0.171 2.078 99 HD13 LEU 14 HD13 LEU 14 8.744 0.157 0.485 100 HD21 LEU 14 HD21 LEU 14 7.318 2.194 -0.881 101 HD22 LEU 14 HD22 LEU 14 9.063 2.405 -0.736 102 HD23 LEU 14 HD23 LEU 14 7.976 3.707 -0.255 103 H GLU 15 HN GLU 15 4.917 4.936 0.946 104 HA GLU 15 HA GLU 15 3.639 5.984 3.383 105 HB2 GLU 15 HB2 GLU 15 4.497 7.733 1.871 106 HB3 GLU 15 HB1 GLU 15 3.545 7.067 0.557 107 HG2 GLU 15 HG2 GLU 15 1.499 7.657 1.687 108 HG3 GLU 15 HG1 GLU 15 2.406 8.219 3.091 109 H LEU 16 HN LEU 16 1.734 5.166 3.868 110 HA LEU 16 HA LEU 16 0.196 3.705 1.830 111 HB2 LEU 16 HB2 LEU 16 -0.100 3.832 4.817 112 HB3 LEU 16 HB1 LEU 16 -1.275 3.078 3.778 113 HG LEU 16 HG LEU 16 -0.016 1.337 4.704 114 HD11 LEU 16 HD11 LEU 16 1.526 1.414 2.224 115 HD12 LEU 16 HD12 LEU 16 -0.214 1.617 2.049 116 HD13 LEU 16 HD13 LEU 16 0.431 0.184 2.850 117 HD21 LEU 16 HD21 LEU 16 2.568 2.495 3.793 118 HD22 LEU 16 HD22 LEU 16 2.279 1.238 4.988 119 HD23 LEU 16 HD23 LEU 16 1.887 2.918 5.357 120 H GLY 17 HN GLY 17 -1.630 4.531 1.059 121 HA2 GLY 17 HA2 GLY 17 -3.081 6.537 2.603 122 HA3 GLY 17 HA1 GLY 17 -2.478 7.057 1.032 123 H HIS 18 HN HIS 18 -5.233 6.757 2.056 124 HA HIS 18 HA HIS 18 -6.262 5.436 -0.294 125 HB2 HIS 18 HB2 HIS 18 -7.019 3.524 0.612 126 HB3 HIS 18 HB1 HIS 18 -6.055 3.891 2.036 127 HD1 HIS 18 HD1 HIS 18 -7.378 5.191 3.999 128 HD2 HIS 18 HD2 HIS 18 -9.718 3.424 1.044 129 HE1 HIS 18 HE1 HIS 18 -9.735 5.177 4.903 130 HE2 HIS 18 HE2 HIS 18 -11.088 3.956 3.174 131 H ARG 19 HN ARG 19 -8.335 6.052 -0.798 132 HA ARG 19 HA ARG 19 -9.580 8.056 0.972 133 HB2 ARG 19 HB2 ARG 19 -9.603 8.032 -2.050 134 HB3 ARG 19 HB1 ARG 19 -10.377 9.213 -1.023 135 HG2 ARG 19 HG2 ARG 19 -8.236 10.007 -0.246 136 HG3 ARG 19 HG1 ARG 19 -7.409 8.776 -1.209 137 HD2 ARG 19 HD2 ARG 19 -7.398 10.900 -2.385 138 HD3 ARG 19 HD1 ARG 19 -8.398 9.717 -3.235 139 HE ARG 19 HE ARG 19 -10.065 11.163 -1.531 140 HH11 ARG 19 HH11 ARG 19 -8.075 11.764 -4.359 141 HH12 ARG 19 HH12 ARG 19 -9.116 13.020 -4.969 142 HH21 ARG 19 HH21 ARG 19 -11.418 12.794 -2.325 143 HH22 ARG 19 HH22 ARG 19 -11.017 13.613 -3.807 144 H ALA 20 HN ALA 20 -11.929 8.127 0.813 145 HA ALA 20 HA ALA 20 -13.188 5.940 -0.656 146 HB1 ALA 20 HB1 ALA 20 -13.104 4.781 1.322 147 HB2 ALA 20 HB2 ALA 20 -14.655 5.603 1.472 148 HB3 ALA 20 HB3 ALA 20 -13.237 6.236 2.307 149 H GLN 21 HN GLN 21 -15.103 6.462 -1.495 150 HA GLN 21 HA GLN 21 -16.665 8.647 -0.339 151 HB2 GLN 21 HB2 GLN 21 -16.998 9.751 -2.426 152 HB3 GLN 21 HB1 GLN 21 -15.264 9.504 -2.283 153 HG2 GLN 21 HG2 GLN 21 -15.163 8.187 -4.048 154 HG3 GLN 21 HG1 GLN 21 -16.650 7.339 -3.649 155 HE21 GLN 21 HE21 GLN 21 -18.624 8.190 -4.359 156 HE22 GLN 21 HE22 GLN 21 -18.716 9.336 -5.653 157 H VAL 22 HN VAL 22 -18.944 8.476 -0.938 158 HA VAL 22 HA VAL 22 -19.591 5.731 -1.765 159 HB VAL 22 HB VAL 22 -20.413 6.472 0.490 160 HG11 VAL 22 HG11 VAL 22 -22.352 7.906 0.636 161 HG12 VAL 22 HG12 VAL 22 -22.311 8.181 -1.107 162 HG13 VAL 22 HG13 VAL 22 -21.001 8.780 -0.088 163 HG21 VAL 22 HG21 VAL 22 -22.571 5.422 0.248 164 HG22 VAL 22 HG22 VAL 22 -21.393 4.601 -0.769 165 HG23 VAL 22 HG23 VAL 22 -22.554 5.716 -1.487 166 H ARG 23 HN ARG 23 -20.869 5.328 -3.477 167 HA ARG 23 HA ARG 23 -21.766 7.619 -5.072 168 HB2 ARG 23 HB2 ARG 23 -22.538 5.511 -6.566 169 HB3 ARG 23 HB1 ARG 23 -20.915 6.184 -6.635 170 HG2 ARG 23 HG2 ARG 23 -19.973 4.376 -5.719 171 HG3 ARG 23 HG1 ARG 23 -21.288 4.143 -4.570 172 HD2 ARG 23 HD2 ARG 23 -21.140 2.271 -6.099 173 HD3 ARG 23 HD1 ARG 23 -22.649 3.145 -6.338 174 HE ARG 23 HE ARG 23 -21.744 4.040 -8.374 175 HH11 ARG 23 HH11 ARG 23 -19.782 1.552 -6.891 176 HH12 ARG 23 HH12 ARG 23 -19.113 0.988 -8.394 177 HH21 ARG 23 HH21 ARG 23 -20.879 3.295 -10.371 178 HH22 ARG 23 HH22 ARG 23 -19.739 1.980 -10.376 179 H LYS 24 HN LYS 24 -23.875 8.128 -5.305 180 HA LYS 24 HA LYS 24 -25.578 7.472 -3.159 181 HB2 LYS 24 HB2 LYS 24 -25.565 9.604 -4.509 182 HB3 LYS 24 HB1 LYS 24 -26.431 8.726 -5.763 183 HG2 LYS 24 HG2 LYS 24 -28.042 9.910 -4.490 184 HG3 LYS 24 HG1 LYS 24 -28.182 8.202 -4.066 185 HD2 LYS 24 HD2 LYS 24 -26.827 8.605 -2.056 186 HD3 LYS 24 HD1 LYS 24 -26.750 10.319 -2.466 187 HE2 LYS 24 HE2 LYS 24 -29.211 10.424 -2.341 188 HE3 LYS 24 HE1 LYS 24 -29.239 8.733 -1.849 189 HZ1 LYS 24 HZ1 LYS 24 -27.949 10.956 -0.363 190 HZ2 LYS 24 HZ2 LYS 24 -27.940 9.327 0.111 191 HZ3 LYS 24 HZ3 LYS 24 -29.401 10.188 0.055 192 H LYS 25 HN LYS 25 -24.995 5.867 -6.073 193 HA LYS 25 HA LYS 25 -27.285 4.113 -5.556 194 HB2 LYS 25 HB2 LYS 25 -27.803 5.518 -7.520 195 HB3 LYS 25 HB1 LYS 25 -26.343 4.962 -8.311 196 HG2 LYS 25 HG2 LYS 25 -28.108 3.725 -9.229 197 HG3 LYS 25 HG1 LYS 25 -27.302 2.660 -8.088 198 HD2 LYS 25 HD2 LYS 25 -29.007 3.199 -6.398 199 HD3 LYS 25 HD1 LYS 25 -29.854 4.164 -7.612 200 HE2 LYS 25 HE2 LYS 25 -30.209 2.235 -8.985 201 HE3 LYS 25 HE1 LYS 25 -29.192 1.246 -7.938 202 HZ1 LYS 25 HZ1 LYS 25 -31.797 2.473 -7.192 203 HZ2 LYS 25 HZ2 LYS 25 -30.816 1.554 -6.158 204 HZ3 LYS 25 HZ3 LYS 25 -31.524 0.835 -7.519 205 HA PRO 26 HA PRO 26 -23.764 1.301 -5.301 206 HB2 PRO 26 HB2 PRO 26 -25.952 -0.683 -5.134 207 HB3 PRO 26 HB1 PRO 26 -24.598 -0.408 -4.039 208 HG2 PRO 26 HG2 PRO 26 -27.102 0.308 -3.400 209 HG3 PRO 26 HG1 PRO 26 -25.691 1.254 -2.888 210 HD2 PRO 26 HD2 PRO 26 -27.665 1.805 -5.058 211 HD3 PRO 26 HD1 PRO 26 -26.831 2.934 -3.974 212 H THR 27 HN THR 27 -22.987 -0.478 -6.566 213 HA THR 27 HA THR 27 -23.745 -0.239 -9.321 214 HB THR 27 HB THR 27 -21.391 -0.515 -8.763 215 HG1 THR 27 HG1 THR 27 -21.263 -2.798 -9.977 216 HG21 THR 27 HG21 THR 27 -21.406 -1.802 -6.775 217 HG22 THR 27 HG22 THR 27 -20.596 -2.789 -7.992 218 HG23 THR 27 HG23 THR 27 -22.273 -3.124 -7.560 219 H VAL 28 HN VAL 28 -23.742 -2.544 -10.524 220 HA VAL 28 HA VAL 28 -26.222 -3.650 -10.255 221 HB VAL 28 HB VAL 28 -25.030 -4.061 -12.222 222 HG11 VAL 28 HG11 VAL 28 -22.767 -3.956 -11.210 223 HG12 VAL 28 HG12 VAL 28 -22.952 -5.265 -12.384 224 HG13 VAL 28 HG13 VAL 28 -22.979 -5.621 -10.656 225 HG21 VAL 28 HG21 VAL 28 -25.338 -6.641 -10.704 226 HG22 VAL 28 HG22 VAL 28 -25.097 -6.536 -12.448 227 HG23 VAL 28 HG23 VAL 28 -26.545 -5.847 -11.714 228 H GLU 29 HN GLU 29 -23.259 -4.776 -8.672 229 HA GLU 29 HA GLU 29 -24.687 -6.983 -7.450 230 HB2 GLU 29 HB2 GLU 29 -21.797 -6.143 -7.227 231 HB3 GLU 29 HB1 GLU 29 -22.479 -7.610 -6.534 232 HG2 GLU 29 HG2 GLU 29 -23.138 -8.298 -8.858 233 HG3 GLU 29 HG1 GLU 29 -22.239 -6.902 -9.451 234 H GLY 30 HN GLY 30 -24.483 -3.803 -6.739 235 HA2 GLY 30 HA2 GLY 30 -25.561 -2.820 -4.933 236 HA3 GLY 30 HA1 GLY 30 -25.503 -4.357 -4.083 237 H PHE 31 HN PHE 31 -22.681 -2.803 -5.454 238 HA PHE 31 HA PHE 31 -21.563 -2.550 -2.782 239 HB2 PHE 31 HB2 PHE 31 -20.203 -1.987 -5.429 240 HB3 PHE 31 HB1 PHE 31 -19.432 -2.227 -3.865 241 HD1 PHE 31 HD1 PHE 31 -21.323 -4.665 -3.179 242 HD2 PHE 31 HD2 PHE 31 -18.853 -3.677 -6.490 243 HE1 PHE 31 HE1 PHE 31 -21.059 -7.055 -3.696 244 HE2 PHE 31 HE2 PHE 31 -18.587 -6.054 -7.014 245 HZ PHE 31 HZ PHE 31 -19.692 -7.753 -5.616 246 H THR 32 HN THR 32 -21.433 -0.646 -1.756 247 HA THR 32 HA THR 32 -22.716 1.619 -3.087 248 HB THR 32 HB THR 32 -23.122 2.464 -0.813 249 HG1 THR 32 HG1 THR 32 -22.695 0.501 0.772 250 HG21 THR 32 HG21 THR 32 -23.943 -0.336 -1.333 251 HG22 THR 32 HG22 THR 32 -24.815 1.115 -1.789 252 HG23 THR 32 HG23 THR 32 -24.659 0.669 -0.088 253 H HIS 33 HN HIS 33 -19.738 0.755 -1.468 254 HA HIS 33 HA HIS 33 -18.934 3.590 -1.423 255 HB2 HIS 33 HB2 HIS 33 -18.395 1.275 0.384 256 HB3 HIS 33 HB1 HIS 33 -17.211 2.572 0.298 257 HD1 HIS 33 HD1 HIS 33 -20.777 1.895 1.341 258 HD2 HIS 33 HD2 HIS 33 -17.893 4.880 1.616 259 HE1 HIS 33 HE1 HIS 33 -21.655 3.538 3.038 260 HE2 HIS 33 HE2 HIS 33 -19.804 5.219 3.320 261 H ASP 34 HN ASP 34 -17.324 4.216 -2.692 262 HA ASP 34 HA ASP 34 -15.608 2.153 -3.915 263 HB2 ASP 34 HB2 ASP 34 -16.492 4.870 -4.861 264 HB3 ASP 34 HB1 ASP 34 -15.054 4.108 -5.522 265 H TRP 35 HN TRP 35 -13.480 2.193 -3.548 266 HA TRP 35 HA TRP 35 -12.375 4.576 -2.275 267 HB2 TRP 35 HB2 TRP 35 -11.093 3.137 -0.689 268 HB3 TRP 35 HB1 TRP 35 -12.821 3.184 -0.403 269 HD1 TRP 35 HD1 TRP 35 -14.081 0.879 -0.346 270 HE1 TRP 35 HE1 TRP 35 -13.323 -1.573 -0.613 271 HE3 TRP 35 HE3 TRP 35 -9.332 1.662 -2.097 272 HZ2 TRP 35 HZ2 TRP 35 -11.022 -2.982 -1.437 273 HZ3 TRP 35 HZ3 TRP 35 -7.916 -0.296 -2.591 274 HH2 TRP 35 HH2 TRP 35 -8.734 -2.562 -2.240 275 H MET 36 HN MET 36 -10.067 4.648 -2.251 276 HA MET 36 HA MET 36 -8.730 3.037 -4.294 277 HB2 MET 36 HB2 MET 36 -9.319 5.025 -5.493 278 HB3 MET 36 HB1 MET 36 -8.813 6.055 -4.159 279 HG2 MET 36 HG2 MET 36 -6.487 5.097 -4.522 280 HG3 MET 36 HG1 MET 36 -7.096 4.494 -6.061 281 HE1 MET 36 HE1 MET 36 -6.523 7.285 -3.738 282 HE2 MET 36 HE2 MET 36 -7.986 8.097 -4.310 283 HE3 MET 36 HE3 MET 36 -6.398 8.760 -4.702 284 H VAL 37 HN VAL 37 -6.778 2.398 -3.666 285 HA VAL 37 HA VAL 37 -5.520 3.693 -1.336 286 HB VAL 37 HB VAL 37 -4.110 1.487 -1.431 287 HG11 VAL 37 HG11 VAL 37 -6.941 1.472 -0.502 288 HG12 VAL 37 HG12 VAL 37 -5.591 2.146 0.394 289 HG13 VAL 37 HG13 VAL 37 -5.667 0.411 0.074 290 HG21 VAL 37 HG21 VAL 37 -4.969 0.634 -3.510 291 HG22 VAL 37 HG22 VAL 37 -6.622 0.715 -2.901 292 HG23 VAL 37 HG23 VAL 37 -5.479 -0.430 -2.200 293 H PHE 38 HN PHE 38 -3.301 4.263 -1.471 294 HA PHE 38 HA PHE 38 -1.894 3.588 -3.906 295 HB2 PHE 38 HB2 PHE 38 -1.295 5.883 -4.472 296 HB3 PHE 38 HB1 PHE 38 -3.046 5.809 -4.264 297 HD1 PHE 38 HD1 PHE 38 0.088 6.935 -2.737 298 HD2 PHE 38 HD2 PHE 38 -4.149 7.155 -2.690 299 HE1 PHE 38 HE1 PHE 38 0.226 8.889 -1.263 300 HE2 PHE 38 HE2 PHE 38 -4.041 9.106 -1.202 301 HZ PHE 38 HZ PHE 38 -1.861 9.986 -0.483 302 H VAL 39 HN VAL 39 -0.019 2.837 -3.487 303 HA VAL 39 HA VAL 39 1.353 3.510 -0.963 304 HB VAL 39 HB VAL 39 2.660 1.362 -1.573 305 HG11 VAL 39 HG11 VAL 39 0.827 1.676 0.169 306 HG12 VAL 39 HG12 VAL 39 1.109 0.032 -0.401 307 HG13 VAL 39 HG13 VAL 39 -0.263 0.955 -1.015 308 HG21 VAL 39 HG21 VAL 39 1.876 -0.051 -3.165 309 HG22 VAL 39 HG22 VAL 39 1.518 1.493 -3.925 310 HG23 VAL 39 HG23 VAL 39 0.242 0.595 -3.102 311 H ARG 40 HN ARG 40 3.502 4.229 -1.072 312 HA ARG 40 HA ARG 40 5.067 4.326 -3.415 313 HB2 ARG 40 HB2 ARG 40 4.858 6.647 -4.061 314 HB3 ARG 40 HB1 ARG 40 3.263 5.909 -4.127 315 HG2 ARG 40 HG2 ARG 40 2.530 7.020 -2.218 316 HG3 ARG 40 HG1 ARG 40 4.173 7.385 -1.688 317 HD2 ARG 40 HD2 ARG 40 4.365 8.819 -3.781 318 HD3 ARG 40 HD1 ARG 40 2.610 8.644 -3.927 319 HE ARG 40 HE ARG 40 2.835 9.505 -1.407 320 HH11 ARG 40 HH11 ARG 40 4.277 10.646 -4.392 321 HH12 ARG 40 HH12 ARG 40 4.490 12.274 -3.816 322 HH21 ARG 40 HH21 ARG 40 3.125 11.620 -0.641 323 HH22 ARG 40 HH22 ARG 40 3.847 12.834 -1.660 324 H GLY 41 HN GLY 41 6.674 6.429 -3.093 325 HA2 GLY 41 HA2 GLY 41 7.555 6.320 -0.291 326 HA3 GLY 41 HA1 GLY 41 8.503 6.914 -1.650 327 HA PRO 42 HA PRO 42 6.286 10.462 0.421 328 HB2 PRO 42 HB2 PRO 42 8.201 11.524 2.016 329 HB3 PRO 42 HB1 PRO 42 7.149 10.207 2.547 330 HG2 PRO 42 HG2 PRO 42 9.986 10.135 1.808 331 HG3 PRO 42 HG1 PRO 42 9.085 9.029 2.837 332 HD2 PRO 42 HD2 PRO 42 9.844 8.673 0.105 333 HD3 PRO 42 HD1 PRO 42 8.872 7.615 1.129 334 H GLU 43 HN GLU 43 6.963 12.826 0.490 335 HA GLU 43 HA GLU 43 7.222 13.772 -1.996 336 HB2 GLU 43 HB2 GLU 43 8.190 15.088 0.531 337 HB3 GLU 43 HB1 GLU 43 7.950 15.927 -0.995 338 HG2 GLU 43 HG2 GLU 43 5.823 14.487 0.566 339 HG3 GLU 43 HG1 GLU 43 6.062 16.233 0.501 340 H HIS 44 HN HIS 44 8.635 13.658 -3.517 341 HA HIS 44 HA HIS 44 10.471 14.254 -4.705 342 HB2 HIS 44 HB2 HIS 44 11.683 14.903 -2.027 343 HB3 HIS 44 HB1 HIS 44 12.569 15.047 -3.541 344 HD1 HIS 44 HD1 HIS 44 10.828 16.485 -5.389 345 HD2 HIS 44 HD2 HIS 44 10.831 17.374 -1.330 346 HE1 HIS 44 HE1 HIS 44 9.861 18.797 -5.201 347 HE2 HIS 44 HE2 HIS 44 9.650 19.203 -2.724 348 H SER 45 HN SER 45 10.591 11.860 -2.230 349 HA SER 45 HA SER 45 12.960 10.648 -3.430 350 HB2 SER 45 HB2 SER 45 12.318 8.892 -1.519 351 HB3 SER 45 HB1 SER 45 13.261 10.352 -1.209 352 HG SER 45 HG SER 45 10.438 10.408 -1.063 353 H ASN 46 HN ASN 46 12.716 9.490 -5.119 354 HA ASN 46 HA ASN 46 10.412 8.094 -5.970 355 HB2 ASN 46 HB2 ASN 46 12.019 6.966 -7.544 356 HB3 ASN 46 HB1 ASN 46 12.287 8.699 -7.507 357 HD21 ASN 46 HD21 ASN 46 13.504 5.735 -5.916 358 HD22 ASN 46 HD22 ASN 46 15.120 6.327 -5.792 359 H ILE 47 HN ILE 47 9.732 5.971 -5.523 360 HA ILE 47 HA ILE 47 11.575 4.386 -3.906 361 HB ILE 47 HB ILE 47 9.844 2.782 -3.562 362 HG12 ILE 47 HG12 ILE 47 8.013 4.594 -5.132 363 HG13 ILE 47 HG11 ILE 47 8.679 3.069 -5.725 364 HG21 ILE 47 HG21 ILE 47 10.020 4.541 -2.014 365 HG22 ILE 47 HG22 ILE 47 8.307 4.234 -2.270 366 HG23 ILE 47 HG23 ILE 47 9.080 5.627 -3.029 367 HD11 ILE 47 HD11 ILE 47 7.355 2.906 -3.125 368 HD12 ILE 47 HD12 ILE 47 7.249 1.834 -4.525 369 HD13 ILE 47 HD13 ILE 47 6.295 3.318 -4.475 370 H GLN 48 HN GLN 48 10.301 4.557 -7.132 371 HA GLN 48 HA GLN 48 10.474 1.926 -7.968 372 HB2 GLN 48 HB2 GLN 48 9.410 3.662 -9.288 373 HB3 GLN 48 HB1 GLN 48 10.940 4.492 -9.501 374 HG2 GLN 48 HG2 GLN 48 10.378 3.373 -11.528 375 HG3 GLN 48 HG1 GLN 48 11.757 2.570 -10.812 376 HE21 GLN 48 HE21 GLN 48 8.466 2.161 -9.694 377 HE22 GLN 48 HE22 GLN 48 8.310 0.513 -10.197 378 H HIS 49 HN HIS 49 13.045 3.917 -7.053 379 HA HIS 49 HA HIS 49 15.036 2.613 -8.683 380 HB2 HIS 49 HB2 HIS 49 15.096 4.701 -6.551 381 HB3 HIS 49 HB1 HIS 49 16.578 3.802 -6.872 382 HD1 HIS 49 HD1 HIS 49 16.797 3.696 -9.826 383 HD2 HIS 49 HD2 HIS 49 15.251 7.039 -7.870 384 HE1 HIS 49 HE1 HIS 49 17.000 5.606 -11.457 385 HE2 HIS 49 HE2 HIS 49 16.104 7.624 -10.247 386 H PHE 50 HN PHE 50 13.739 2.291 -5.404 387 HA PHE 50 HA PHE 50 15.524 -0.013 -5.057 388 HB2 PHE 50 HB2 PHE 50 15.297 0.285 -2.619 389 HB3 PHE 50 HB1 PHE 50 16.051 1.661 -3.420 390 HD1 PHE 50 HD1 PHE 50 12.944 0.484 -1.779 391 HD2 PHE 50 HD2 PHE 50 15.126 3.802 -3.313 392 HE1 PHE 50 HE1 PHE 50 11.401 2.010 -0.664 393 HE2 PHE 50 HE2 PHE 50 13.553 5.339 -2.208 394 HZ PHE 50 HZ PHE 50 11.687 4.445 -0.878 395 H VAL 51 HN VAL 51 12.488 0.763 -5.829 396 HA VAL 51 HA VAL 51 11.327 -1.664 -4.634 397 HB VAL 51 HB VAL 51 10.069 1.042 -5.123 398 HG11 VAL 51 HG11 VAL 51 8.044 -0.370 -4.028 399 HG12 VAL 51 HG12 VAL 51 8.798 -1.631 -5.022 400 HG13 VAL 51 HG13 VAL 51 8.240 -0.135 -5.774 401 HG21 VAL 51 HG21 VAL 51 9.380 0.655 -2.703 402 HG22 VAL 51 HG22 VAL 51 11.092 0.942 -3.004 403 HG23 VAL 51 HG23 VAL 51 10.513 -0.696 -2.707 404 H GLU 52 HN GLU 52 10.268 -3.021 -6.017 405 HA GLU 52 HA GLU 52 10.691 -2.406 -8.864 406 HB2 GLU 52 HB2 GLU 52 11.888 -4.366 -8.013 407 HB3 GLU 52 HB1 GLU 52 10.369 -5.076 -7.485 408 HG2 GLU 52 HG2 GLU 52 9.611 -5.255 -9.766 409 HG3 GLU 52 HG1 GLU 52 11.060 -4.429 -10.341 410 H LYS 53 HN LYS 53 8.431 -4.401 -6.955 411 HA LYS 53 HA LYS 53 6.246 -3.365 -8.610 412 HB2 LYS 53 HB2 LYS 53 5.289 -5.661 -8.709 413 HB3 LYS 53 HB1 LYS 53 6.814 -5.501 -9.568 414 HG2 LYS 53 HG2 LYS 53 7.987 -6.569 -7.751 415 HG3 LYS 53 HG1 LYS 53 6.506 -6.675 -6.809 416 HD2 LYS 53 HD2 LYS 53 7.026 -8.006 -9.473 417 HD3 LYS 53 HD1 LYS 53 7.091 -8.810 -7.907 418 HE2 LYS 53 HE2 LYS 53 4.732 -8.421 -7.560 419 HE3 LYS 53 HE1 LYS 53 4.660 -7.448 -9.030 420 HZ1 LYS 53 HZ1 LYS 53 3.828 -9.731 -9.326 421 HZ2 LYS 53 HZ2 LYS 53 5.366 -10.330 -8.941 422 HZ3 LYS 53 HZ3 LYS 53 5.148 -9.390 -10.331 423 H VAL 54 HN VAL 54 4.094 -4.252 -7.598 424 HA VAL 54 HA VAL 54 4.182 -4.182 -4.687 425 HB VAL 54 HB VAL 54 3.194 -1.957 -6.417 426 HG11 VAL 54 HG11 VAL 54 2.163 -1.946 -3.665 427 HG12 VAL 54 HG12 VAL 54 1.356 -3.058 -4.768 428 HG13 VAL 54 HG13 VAL 54 1.434 -1.338 -5.148 429 HG21 VAL 54 HG21 VAL 54 3.962 -0.940 -4.037 430 HG22 VAL 54 HG22 VAL 54 5.033 -1.178 -5.411 431 HG23 VAL 54 HG23 VAL 54 4.963 -2.383 -4.124 432 H VAL 55 HN VAL 55 2.147 -4.808 -3.725 433 HA VAL 55 HA VAL 55 0.137 -5.861 -5.568 434 HB VAL 55 HB VAL 55 2.131 -7.521 -4.447 435 HG11 VAL 55 HG11 VAL 55 -0.585 -8.029 -3.257 436 HG12 VAL 55 HG12 VAL 55 0.916 -7.692 -2.387 437 HG13 VAL 55 HG13 VAL 55 0.734 -9.204 -3.281 438 HG21 VAL 55 HG21 VAL 55 -0.440 -8.295 -5.801 439 HG22 VAL 55 HG22 VAL 55 1.044 -9.246 -5.718 440 HG23 VAL 55 HG23 VAL 55 1.013 -7.736 -6.629 441 H PHE 56 HN PHE 56 -1.876 -6.138 -4.664 442 HA PHE 56 HA PHE 56 -2.207 -5.244 -1.876 443 HB2 PHE 56 HB2 PHE 56 -3.757 -4.503 -4.357 444 HB3 PHE 56 HB1 PHE 56 -4.529 -4.459 -2.769 445 HD1 PHE 56 HD1 PHE 56 -1.598 -3.177 -4.661 446 HD2 PHE 56 HD2 PHE 56 -4.312 -2.593 -1.431 447 HE1 PHE 56 HE1 PHE 56 -0.660 -0.945 -4.290 448 HE2 PHE 56 HE2 PHE 56 -3.376 -0.347 -1.061 449 HZ PHE 56 HZ PHE 56 -1.546 0.464 -2.489 450 H HIS 57 HN HIS 57 -3.436 -6.545 -0.603 451 HA HIS 57 HA HIS 57 -4.842 -8.779 -1.951 452 HB2 HIS 57 HB2 HIS 57 -3.806 -8.640 0.903 453 HB3 HIS 57 HB1 HIS 57 -4.642 -10.009 0.175 454 HD1 HIS 57 HD1 HIS 57 -3.168 -11.775 -0.711 455 HD2 HIS 57 HD2 HIS 57 -1.219 -8.102 -0.502 456 HE1 HIS 57 HE1 HIS 57 -0.777 -12.231 -1.341 457 HE2 HIS 57 HE2 HIS 57 0.425 -10.061 -0.902 458 H LEU 58 HN LEU 58 -6.699 -7.471 -2.285 459 HA LEU 58 HA LEU 58 -8.031 -6.177 -0.122 460 HB2 LEU 58 HB2 LEU 58 -9.578 -7.118 -2.495 461 HB3 LEU 58 HB1 LEU 58 -9.707 -5.604 -1.618 462 HG LEU 58 HG LEU 58 -7.649 -6.351 -3.679 463 HD11 LEU 58 HD11 LEU 58 -8.692 -4.935 -5.057 464 HD12 LEU 58 HD12 LEU 58 -9.398 -3.971 -3.768 465 HD13 LEU 58 HD13 LEU 58 -10.071 -5.556 -4.164 466 HD21 LEU 58 HD21 LEU 58 -7.721 -4.027 -1.775 467 HD22 LEU 58 HD22 LEU 58 -6.922 -3.928 -3.343 468 HD23 LEU 58 HD23 LEU 58 -6.380 -5.109 -2.152 469 H HIS 59 HN HIS 59 -10.586 -6.950 0.028 470 HA HIS 59 HA HIS 59 -10.381 -9.413 1.500 471 HB2 HIS 59 HB2 HIS 59 -12.087 -7.187 1.536 472 HB3 HIS 59 HB1 HIS 59 -13.106 -8.544 1.064 473 HD1 HIS 59 HD1 HIS 59 -14.326 -9.145 3.136 474 HD2 HIS 59 HD2 HIS 59 -10.268 -8.550 3.827 475 HE1 HIS 59 HE1 HIS 59 -13.956 -9.721 5.557 476 HE2 HIS 59 HE2 HIS 59 -11.465 -9.552 5.888 477 H GLU 60 HN GLU 60 -11.573 -11.281 1.146 478 HA GLU 60 HA GLU 60 -11.029 -12.337 -1.363 479 HB2 GLU 60 HB2 GLU 60 -12.775 -13.441 0.832 480 HB3 GLU 60 HB1 GLU 60 -12.227 -14.362 -0.562 481 HG2 GLU 60 HG2 GLU 60 -10.482 -13.123 1.552 482 HG3 GLU 60 HG1 GLU 60 -10.866 -14.836 1.380 483 H SER 61 HN SER 61 -14.031 -10.999 -0.159 484 HA SER 61 HA SER 61 -15.731 -12.095 -2.136 485 HB2 SER 61 HB2 SER 61 -16.576 -11.076 -0.049 486 HB3 SER 61 HB1 SER 61 -16.037 -9.496 -0.609 487 HG SER 61 HG SER 61 -18.367 -10.337 -0.968 488 H PHE 62 HN PHE 62 -13.495 -9.445 -2.128 489 HA PHE 62 HA PHE 62 -14.524 -8.083 -4.416 490 HB2 PHE 62 HB2 PHE 62 -11.786 -8.074 -3.118 491 HB3 PHE 62 HB1 PHE 62 -12.238 -7.026 -4.453 492 HD1 PHE 62 HD1 PHE 62 -13.325 -7.935 -1.004 493 HD2 PHE 62 HD2 PHE 62 -13.070 -4.929 -3.993 494 HE1 PHE 62 HE1 PHE 62 -14.184 -6.274 0.595 495 HE2 PHE 62 HE2 PHE 62 -13.932 -3.261 -2.408 496 HZ PHE 62 HZ PHE 62 -14.490 -3.934 -0.106 497 HA PRO 63 HA PRO 63 -13.349 -11.045 -7.484 498 HB2 PRO 63 HB2 PRO 63 -13.159 -8.692 -9.279 499 HB3 PRO 63 HB1 PRO 63 -14.146 -10.148 -9.437 500 HG2 PRO 63 HG2 PRO 63 -15.238 -7.804 -8.765 501 HG3 PRO 63 HG1 PRO 63 -15.815 -9.327 -8.059 502 HD2 PRO 63 HD2 PRO 63 -14.053 -7.225 -6.865 503 HD3 PRO 63 HD1 PRO 63 -15.337 -8.187 -6.104 504 H ARG 64 HN ARG 64 -11.357 -11.868 -7.504 505 HA ARG 64 HA ARG 64 -9.082 -12.050 -7.460 506 HB2 ARG 64 HB2 ARG 64 -9.405 -9.892 -9.547 507 HB3 ARG 64 HB1 ARG 64 -7.881 -10.697 -9.208 508 HG2 ARG 64 HG2 ARG 64 -8.862 -12.836 -9.857 509 HG3 ARG 64 HG1 ARG 64 -10.394 -12.032 -10.198 510 HD2 ARG 64 HD2 ARG 64 -9.081 -12.406 -12.221 511 HD3 ARG 64 HD1 ARG 64 -9.354 -10.693 -11.914 512 HE ARG 64 HE ARG 64 -6.820 -12.072 -11.289 513 HH11 ARG 64 HH11 ARG 64 -8.596 -9.310 -12.501 514 HH12 ARG 64 HH12 ARG 64 -7.176 -8.332 -12.729 515 HH21 ARG 64 HH21 ARG 64 -4.957 -10.805 -11.575 516 HH22 ARG 64 HH22 ARG 64 -5.095 -9.186 -12.197 517 HA PRO 65 HA PRO 65 -9.055 -8.385 -4.637 518 HB2 PRO 65 HB2 PRO 65 -7.988 -9.647 -2.466 519 HB3 PRO 65 HB1 PRO 65 -9.714 -9.628 -2.842 520 HG2 PRO 65 HG2 PRO 65 -7.683 -11.757 -3.356 521 HG3 PRO 65 HG1 PRO 65 -9.360 -11.913 -2.798 522 HD2 PRO 65 HD2 PRO 65 -8.630 -12.374 -5.365 523 HD3 PRO 65 HD1 PRO 65 -10.212 -11.717 -4.924 524 H LYS 66 HN LYS 66 -6.488 -10.518 -5.522 525 HA LYS 66 HA LYS 66 -4.461 -8.769 -4.486 526 HB2 LYS 66 HB2 LYS 66 -4.069 -11.174 -4.411 527 HB3 LYS 66 HB1 LYS 66 -4.190 -11.259 -6.162 528 HG2 LYS 66 HG2 LYS 66 -2.190 -9.995 -6.449 529 HG3 LYS 66 HG1 LYS 66 -2.131 -9.601 -4.732 530 HD2 LYS 66 HD2 LYS 66 -1.215 -11.571 -4.176 531 HD3 LYS 66 HD1 LYS 66 -2.187 -12.476 -5.339 532 HE2 LYS 66 HE2 LYS 66 0.131 -10.725 -6.123 533 HE3 LYS 66 HE1 LYS 66 0.302 -12.441 -5.758 534 HZ1 LYS 66 HZ1 LYS 66 0.044 -11.904 -8.162 535 HZ2 LYS 66 HZ2 LYS 66 -1.542 -11.393 -7.838 536 HZ3 LYS 66 HZ3 LYS 66 -1.096 -13.004 -7.563 537 H ARG 67 HN ARG 67 -4.263 -6.919 -5.495 538 HA ARG 67 HA ARG 67 -4.208 -6.896 -8.436 539 HB2 ARG 67 HB2 ARG 67 -4.364 -4.483 -6.609 540 HB3 ARG 67 HB1 ARG 67 -4.727 -4.568 -8.331 541 HG2 ARG 67 HG2 ARG 67 -6.310 -5.802 -6.093 542 HG3 ARG 67 HG1 ARG 67 -6.779 -4.429 -7.102 543 HD2 ARG 67 HD2 ARG 67 -6.714 -5.935 -9.081 544 HD3 ARG 67 HD1 ARG 67 -6.375 -7.289 -7.988 545 HE ARG 67 HE ARG 67 -8.568 -7.370 -7.462 546 HH11 ARG 67 HH11 ARG 67 -7.950 -4.223 -8.886 547 HH12 ARG 67 HH12 ARG 67 -9.632 -3.787 -8.951 548 HH21 ARG 67 HH21 ARG 67 -10.763 -6.808 -7.556 549 HH22 ARG 67 HH22 ARG 67 -11.235 -5.243 -8.158 550 H VAL 68 HN VAL 68 -2.375 -6.181 -9.512 551 HA VAL 68 HA VAL 68 -0.053 -5.737 -7.759 552 HB VAL 68 HB VAL 68 1.316 -7.093 -9.004 553 HG11 VAL 68 HG11 VAL 68 -0.350 -8.526 -7.983 554 HG12 VAL 68 HG12 VAL 68 0.153 -9.195 -9.538 555 HG13 VAL 68 HG13 VAL 68 -1.392 -8.357 -9.399 556 HG21 VAL 68 HG21 VAL 68 0.992 -6.002 -11.133 557 HG22 VAL 68 HG22 VAL 68 -0.551 -6.832 -11.355 558 HG23 VAL 68 HG23 VAL 68 0.954 -7.755 -11.333 559 H CYS 69 HN CYS 69 1.331 -4.105 -8.233 560 HA CYS 69 HA CYS 69 0.822 -2.583 -10.701 561 HB2 CYS 69 HB2 CYS 69 1.466 -1.532 -7.941 562 HB3 CYS 69 HB1 CYS 69 1.547 -0.550 -9.401 563 HG CYS 69 HG CYS 69 -1.330 -1.603 -9.778 564 H LYS 70 HN LYS 70 2.511 -2.675 -12.027 565 HA LYS 70 HA LYS 70 5.164 -3.321 -10.917 566 HB2 LYS 70 HB2 LYS 70 4.296 -3.438 -13.813 567 HB3 LYS 70 HB1 LYS 70 5.731 -4.159 -13.099 568 HG2 LYS 70 HG2 LYS 70 4.522 -5.895 -12.119 569 HG3 LYS 70 HG1 LYS 70 2.998 -5.014 -12.237 570 HD2 LYS 70 HD2 LYS 70 3.070 -5.224 -14.675 571 HD3 LYS 70 HD1 LYS 70 4.589 -6.111 -14.553 572 HE2 LYS 70 HE2 LYS 70 2.075 -7.037 -13.192 573 HE3 LYS 70 HE1 LYS 70 2.454 -7.472 -14.857 574 HZ1 LYS 70 HZ1 LYS 70 3.135 -9.101 -13.082 575 HZ2 LYS 70 HZ2 LYS 70 4.333 -7.989 -12.626 576 HZ3 LYS 70 HZ3 LYS 70 4.341 -8.656 -14.184 577 H ASP 71 HN ASP 71 3.579 -0.658 -11.487 578 HA ASP 71 HA ASP 71 5.773 0.742 -12.844 579 HB2 ASP 71 HB2 ASP 71 2.853 0.702 -13.478 580 HB3 ASP 71 HB1 ASP 71 3.745 2.192 -13.761 581 HA PRO 72 HA PRO 72 5.402 4.461 -10.107 582 HB2 PRO 72 HB2 PRO 72 3.821 5.423 -12.484 583 HB3 PRO 72 HB1 PRO 72 4.893 6.349 -11.425 584 HG2 PRO 72 HG2 PRO 72 5.818 5.449 -13.724 585 HG3 PRO 72 HG1 PRO 72 6.817 5.318 -12.262 586 HD2 PRO 72 HD2 PRO 72 5.420 3.207 -13.778 587 HD3 PRO 72 HD1 PRO 72 6.842 3.091 -12.730 588 HA PRO 73 HA PRO 73 2.255 5.458 -7.462 589 HB2 PRO 73 HB2 PRO 73 0.169 6.114 -9.506 590 HB3 PRO 73 HB1 PRO 73 0.403 6.800 -7.892 591 HG2 PRO 73 HG2 PRO 73 1.384 7.931 -10.207 592 HG3 PRO 73 HG1 PRO 73 2.072 8.201 -8.601 593 HD2 PRO 73 HD2 PRO 73 3.295 6.893 -10.812 594 HD3 PRO 73 HD1 PRO 73 3.941 7.056 -9.169 595 H TYR 74 HN TYR 74 1.895 3.605 -6.601 596 HA TYR 74 HA TYR 74 0.628 1.414 -8.016 597 HB2 TYR 74 HB2 TYR 74 1.686 1.475 -5.200 598 HB3 TYR 74 HB1 TYR 74 1.471 0.061 -6.206 599 HD1 TYR 74 HD2 TYR 74 3.465 3.171 -5.854 600 HD2 TYR 74 HD1 TYR 74 3.256 -0.717 -7.546 601 HE1 TYR 74 HE2 TYR 74 5.807 3.356 -6.536 602 HE2 TYR 74 HE1 TYR 74 5.614 -0.548 -8.239 603 HH TYR 74 HH TYR 74 7.300 1.033 -8.628 604 H LYS 75 HN LYS 75 -1.510 0.966 -7.763 605 HA LYS 75 HA LYS 75 -2.899 1.789 -5.360 606 HB2 LYS 75 HB2 LYS 75 -4.455 3.250 -6.691 607 HB3 LYS 75 HB1 LYS 75 -2.820 3.883 -6.499 608 HG2 LYS 75 HG2 LYS 75 -2.225 3.240 -8.701 609 HG3 LYS 75 HG1 LYS 75 -3.734 2.371 -8.918 610 HD2 LYS 75 HD2 LYS 75 -3.174 5.275 -8.958 611 HD3 LYS 75 HD1 LYS 75 -4.238 4.337 -9.988 612 HE2 LYS 75 HE2 LYS 75 -5.804 4.137 -8.092 613 HE3 LYS 75 HE1 LYS 75 -4.739 5.203 -7.179 614 HZ1 LYS 75 HZ1 LYS 75 -6.175 5.884 -9.682 615 HZ2 LYS 75 HZ2 LYS 75 -5.058 6.898 -8.906 616 HZ3 LYS 75 HZ3 LYS 75 -6.507 6.486 -8.132 617 H VAL 76 HN VAL 76 -5.189 1.508 -5.555 618 HA VAL 76 HA VAL 76 -6.132 -0.537 -7.403 619 HB VAL 76 HB VAL 76 -6.120 -0.783 -4.406 620 HG11 VAL 76 HG11 VAL 76 -8.411 -1.084 -5.329 621 HG12 VAL 76 HG12 VAL 76 -7.762 -2.513 -4.529 622 HG13 VAL 76 HG13 VAL 76 -7.798 -2.427 -6.293 623 HG21 VAL 76 HG21 VAL 76 -4.252 -1.844 -5.496 624 HG22 VAL 76 HG22 VAL 76 -5.323 -2.631 -6.650 625 HG23 VAL 76 HG23 VAL 76 -5.368 -3.091 -4.949 626 H GLU 77 HN GLU 77 -8.149 -0.016 -8.110 627 HA GLU 77 HA GLU 77 -9.686 1.953 -6.529 628 HB2 GLU 77 HB2 GLU 77 -10.079 1.383 -9.461 629 HB3 GLU 77 HB1 GLU 77 -10.724 2.721 -8.539 630 HG2 GLU 77 HG2 GLU 77 -9.053 3.758 -9.668 631 HG3 GLU 77 HG1 GLU 77 -8.205 3.272 -8.205 632 H GLU 78 HN GLU 78 -11.301 0.975 -5.451 633 HA GLU 78 HA GLU 78 -12.756 -1.138 -6.873 634 HB2 GLU 78 HB2 GLU 78 -11.093 -1.527 -4.494 635 HB3 GLU 78 HB1 GLU 78 -12.727 -2.155 -4.315 636 HG2 GLU 78 HG2 GLU 78 -10.626 -2.937 -6.311 637 HG3 GLU 78 HG1 GLU 78 -11.473 -3.938 -5.133 638 H SER 79 HN SER 79 -14.596 -1.954 -5.434 639 HA SER 79 HA SER 79 -15.876 0.204 -3.956 640 HB2 SER 79 HB2 SER 79 -16.522 0.446 -6.371 641 HB3 SER 79 HB1 SER 79 -17.252 -1.160 -6.282 642 HG SER 79 HG SER 79 -18.143 1.267 -5.300 643 H GLY 80 HN GLY 80 -17.393 -0.515 -2.493 644 HA2 GLY 80 HA2 GLY 80 -18.209 -3.256 -2.305 645 HA3 GLY 80 HA1 GLY 80 -16.922 -2.862 -1.170 646 H TYR 81 HN TYR 81 -18.353 -3.153 0.652 647 HA TYR 81 HA TYR 81 -19.918 -0.740 1.114 648 HB2 TYR 81 HB2 TYR 81 -21.892 -2.064 1.930 649 HB3 TYR 81 HB1 TYR 81 -21.623 -2.128 0.194 650 HD1 TYR 81 HD2 TYR 81 -21.427 -4.055 3.326 651 HD2 TYR 81 HD1 TYR 81 -21.051 -4.184 -0.907 652 HE1 TYR 81 HE2 TYR 81 -21.432 -6.510 3.408 653 HE2 TYR 81 HE1 TYR 81 -21.057 -6.639 -0.833 654 HH TYR 81 HH TYR 81 -21.894 -8.404 1.984 655 H ALA 82 HN ALA 82 -17.489 -2.289 2.219 656 HA ALA 82 HA ALA 82 -17.995 -1.579 4.957 657 HB1 ALA 82 HB1 ALA 82 -18.905 -3.737 5.177 658 HB2 ALA 82 HB2 ALA 82 -17.254 -3.882 5.775 659 HB3 ALA 82 HB3 ALA 82 -17.661 -4.457 4.158 660 H GLY 83 HN GLY 83 -16.037 -1.966 6.324 661 HA2 GLY 83 HA2 GLY 83 -13.619 -1.504 4.705 662 HA3 GLY 83 HA1 GLY 83 -13.860 -0.942 6.354 663 H PHE 84 HN PHE 84 -11.552 -2.158 5.936 664 HA PHE 84 HA PHE 84 -11.481 -4.408 7.601 665 HB2 PHE 84 HB2 PHE 84 -10.897 -6.170 5.933 666 HB3 PHE 84 HB1 PHE 84 -12.565 -5.632 5.804 667 HD1 PHE 84 HD1 PHE 84 -13.158 -3.988 3.964 668 HD2 PHE 84 HD2 PHE 84 -9.459 -6.090 4.079 669 HE1 PHE 84 HE1 PHE 84 -12.839 -3.539 1.572 670 HE2 PHE 84 HE2 PHE 84 -9.120 -5.640 1.694 671 HZ PHE 84 HZ PHE 84 -10.806 -4.364 0.423 672 H ILE 85 HN ILE 85 -9.325 -5.156 7.961 673 HA ILE 85 HA ILE 85 -7.189 -3.430 7.267 674 HB ILE 85 HB ILE 85 -7.257 -6.231 8.379 675 HG12 ILE 85 HG12 ILE 85 -7.888 -4.367 9.875 676 HG13 ILE 85 HG11 ILE 85 -6.413 -5.176 10.394 677 HG21 ILE 85 HG21 ILE 85 -4.793 -4.593 7.807 678 HG22 ILE 85 HG22 ILE 85 -5.253 -6.098 7.014 679 HG23 ILE 85 HG23 ILE 85 -4.832 -6.097 8.726 680 HD11 ILE 85 HD11 ILE 85 -6.449 -2.615 8.830 681 HD12 ILE 85 HD12 ILE 85 -5.060 -3.391 9.584 682 HD13 ILE 85 HD13 ILE 85 -6.342 -2.709 10.586 683 H LEU 86 HN LEU 86 -6.054 -3.296 5.437 684 HA LEU 86 HA LEU 86 -6.274 -5.534 3.530 685 HB2 LEU 86 HB2 LEU 86 -7.210 -3.115 3.027 686 HB3 LEU 86 HB1 LEU 86 -5.521 -2.777 2.681 687 HG LEU 86 HG LEU 86 -6.704 -5.166 1.380 688 HD11 LEU 86 HD11 LEU 86 -7.173 -2.426 0.240 689 HD12 LEU 86 HD12 LEU 86 -8.388 -3.278 1.197 690 HD13 LEU 86 HD13 LEU 86 -7.809 -3.978 -0.313 691 HD21 LEU 86 HD21 LEU 86 -5.299 -3.366 -0.288 692 HD22 LEU 86 HD22 LEU 86 -4.863 -5.008 0.177 693 HD23 LEU 86 HD23 LEU 86 -4.366 -3.640 1.179 694 HA PRO 87 HA PRO 87 -1.892 -5.760 4.485 695 HB2 PRO 87 HB2 PRO 87 -2.008 -8.255 2.977 696 HB3 PRO 87 HB1 PRO 87 -1.619 -8.001 4.679 697 HG2 PRO 87 HG2 PRO 87 -3.913 -9.192 3.865 698 HG3 PRO 87 HG1 PRO 87 -3.800 -8.234 5.353 699 HD2 PRO 87 HD2 PRO 87 -4.906 -7.466 2.679 700 HD3 PRO 87 HD1 PRO 87 -5.524 -7.098 4.304 701 H ILE 88 HN ILE 88 -1.023 -4.232 3.169 702 HA ILE 88 HA ILE 88 -0.947 -4.694 0.295 703 HB ILE 88 HB ILE 88 0.050 -2.270 1.805 704 HG12 ILE 88 HG12 ILE 88 -2.569 -2.389 0.337 705 HG13 ILE 88 HG11 ILE 88 -2.480 -2.967 2.000 706 HG21 ILE 88 HG21 ILE 88 0.939 -2.566 -0.458 707 HG22 ILE 88 HG22 ILE 88 -0.137 -1.171 -0.359 708 HG23 ILE 88 HG23 ILE 88 -0.705 -2.673 -1.086 709 HD11 ILE 88 HD11 ILE 88 -1.667 -0.213 1.122 710 HD12 ILE 88 HD12 ILE 88 -1.804 -0.808 2.771 711 HD13 ILE 88 HD13 ILE 88 -3.247 -0.630 1.774 712 H GLU 89 HN GLU 89 0.974 -4.893 -0.835 713 HA GLU 89 HA GLU 89 3.383 -5.274 0.815 714 HB2 GLU 89 HB2 GLU 89 2.387 -6.960 -1.471 715 HB3 GLU 89 HB1 GLU 89 4.042 -7.030 -0.878 716 HG2 GLU 89 HG2 GLU 89 3.128 -7.627 1.361 717 HG3 GLU 89 HG1 GLU 89 1.532 -7.731 0.616 718 H VAL 90 HN VAL 90 5.139 -4.250 0.167 719 HA VAL 90 HA VAL 90 5.248 -3.283 -2.610 720 HB VAL 90 HB VAL 90 6.819 -2.116 -0.328 721 HG11 VAL 90 HG11 VAL 90 7.453 -0.478 -1.904 722 HG12 VAL 90 HG12 VAL 90 6.304 -1.063 -3.087 723 HG13 VAL 90 HG13 VAL 90 7.712 -2.034 -2.665 724 HG21 VAL 90 HG21 VAL 90 4.266 -1.808 -0.277 725 HG22 VAL 90 HG22 VAL 90 4.498 -0.804 -1.707 726 HG23 VAL 90 HG23 VAL 90 5.271 -0.364 -0.183 727 H TYR 91 HN TYR 91 6.673 -4.282 -3.855 728 HA TYR 91 HA TYR 91 8.570 -6.130 -2.629 729 HB2 TYR 91 HB2 TYR 91 7.687 -5.597 -5.432 730 HB3 TYR 91 HB1 TYR 91 9.166 -6.498 -5.138 731 HD1 TYR 91 HD1 TYR 91 5.890 -6.573 -3.353 732 HD2 TYR 91 HD2 TYR 91 8.731 -8.691 -5.697 733 HE1 TYR 91 HE1 TYR 91 4.588 -8.632 -3.070 734 HE2 TYR 91 HE2 TYR 91 7.421 -10.755 -5.431 735 HH TYR 91 HH TYR 91 5.766 -11.714 -3.916 736 H PHE 92 HN PHE 92 10.678 -5.914 -2.518 737 HA PHE 92 HA PHE 92 11.818 -3.308 -3.276 738 HB2 PHE 92 HB2 PHE 92 12.633 -5.395 -1.235 739 HB3 PHE 92 HB1 PHE 92 13.597 -3.961 -1.599 740 HD1 PHE 92 HD1 PHE 92 11.337 -1.989 -1.880 741 HD2 PHE 92 HD2 PHE 92 12.085 -5.026 1.001 742 HE1 PHE 92 HE1 PHE 92 10.118 -0.683 -0.205 743 HE2 PHE 92 HE2 PHE 92 10.837 -3.718 2.681 744 HZ PHE 92 HZ PHE 92 9.869 -1.549 2.075 745 H LYS 93 HN LYS 93 14.027 -3.292 -4.168 746 HA LYS 93 HA LYS 93 14.592 -5.687 -5.777 747 HB2 LYS 93 HB2 LYS 93 15.726 -2.888 -5.989 748 HB3 LYS 93 HB1 LYS 93 16.101 -4.225 -7.066 749 HG2 LYS 93 HG2 LYS 93 13.832 -4.251 -7.870 750 HG3 LYS 93 HG1 LYS 93 13.391 -2.966 -6.743 751 HD2 LYS 93 HD2 LYS 93 14.761 -1.365 -7.797 752 HD3 LYS 93 HD1 LYS 93 15.664 -2.584 -8.700 753 HE2 LYS 93 HE2 LYS 93 13.883 -2.799 -10.339 754 HE3 LYS 93 HE1 LYS 93 12.659 -2.224 -9.201 755 HZ1 LYS 93 HZ1 LYS 93 14.816 -0.512 -10.323 756 HZ2 LYS 93 HZ2 LYS 93 13.442 -0.006 -9.463 757 HZ3 LYS 93 HZ3 LYS 93 13.277 -0.666 -11.016 758 H ASN 94 HN ASN 94 15.679 -6.946 -4.164 759 HA ASN 94 HA ASN 94 18.472 -6.291 -4.098 760 HB2 ASN 94 HB2 ASN 94 18.755 -6.458 -1.672 761 HB3 ASN 94 HB1 ASN 94 17.733 -5.095 -2.107 762 HD21 ASN 94 HD21 ASN 94 17.950 -6.426 0.405 763 HD22 ASN 94 HD22 ASN 94 16.389 -7.078 0.782 764 H LYS 95 HN LYS 95 19.767 -8.044 -3.047 765 HA LYS 95 HA LYS 95 18.545 -10.680 -3.583 766 HB2 LYS 95 HB2 LYS 95 21.447 -9.897 -3.410 767 HB3 LYS 95 HB1 LYS 95 20.833 -11.484 -3.846 768 HG2 LYS 95 HG2 LYS 95 19.864 -10.610 -5.856 769 HG3 LYS 95 HG1 LYS 95 20.326 -8.965 -5.405 770 HD2 LYS 95 HD2 LYS 95 22.675 -9.560 -5.520 771 HD3 LYS 95 HD1 LYS 95 22.257 -11.235 -5.881 772 HE2 LYS 95 HE2 LYS 95 21.274 -10.580 -7.984 773 HE3 LYS 95 HE1 LYS 95 21.529 -8.875 -7.610 774 HZ1 LYS 95 HZ1 LYS 95 23.215 -9.788 -9.125 775 HZ2 LYS 95 HZ2 LYS 95 23.699 -10.877 -7.918 776 HZ3 LYS 95 HZ3 LYS 95 23.892 -9.212 -7.680 777 H GLU 96 HN GLU 96 19.126 -8.623 -1.226 778 HA GLU 96 HA GLU 96 20.113 -10.503 0.775 779 HB2 GLU 96 HB2 GLU 96 20.058 -8.036 2.012 780 HB3 GLU 96 HB1 GLU 96 21.478 -8.709 1.229 781 HG2 GLU 96 HG2 GLU 96 19.480 -6.952 -0.170 782 HG3 GLU 96 HG1 GLU 96 20.927 -6.346 0.634 783 H GLU 97 HN GLU 97 18.993 -8.644 2.872 784 HA GLU 97 HA GLU 97 16.985 -10.149 3.845 785 HB2 GLU 97 HB2 GLU 97 16.152 -8.083 5.034 786 HB3 GLU 97 HB1 GLU 97 17.853 -8.482 5.250 787 HG2 GLU 97 HG2 GLU 97 17.264 -6.623 3.050 788 HG3 GLU 97 HG1 GLU 97 16.913 -6.019 4.668 789 HA PRO 98 HA PRO 98 13.044 -10.462 2.361 790 HB2 PRO 98 HB2 PRO 98 11.653 -8.234 3.559 791 HB3 PRO 98 HB1 PRO 98 11.565 -9.944 3.993 792 HG2 PRO 98 HG2 PRO 98 13.255 -7.784 5.131 793 HG3 PRO 98 HG1 PRO 98 12.629 -9.257 5.907 794 HD2 PRO 98 HD2 PRO 98 15.200 -9.082 5.299 795 HD3 PRO 98 HD1 PRO 98 14.319 -10.596 4.958 796 H ARG 99 HN ARG 99 12.562 -10.120 0.331 797 HA ARG 99 HA ARG 99 13.010 -7.588 -0.972 798 HB2 ARG 99 HB2 ARG 99 12.148 -10.304 -1.887 799 HB3 ARG 99 HB1 ARG 99 12.015 -8.916 -2.960 800 HG2 ARG 99 HG2 ARG 99 14.332 -8.506 -2.856 801 HG3 ARG 99 HG1 ARG 99 14.537 -9.715 -1.587 802 HD2 ARG 99 HD2 ARG 99 15.170 -10.402 -3.944 803 HD3 ARG 99 HD1 ARG 99 14.081 -11.508 -3.127 804 HE ARG 99 HE ARG 99 12.616 -9.613 -4.634 805 HH11 ARG 99 HH11 ARG 99 14.709 -12.384 -5.049 806 HH12 ARG 99 HH12 ARG 99 14.014 -12.845 -6.576 807 HH21 ARG 99 HH21 ARG 99 11.686 -10.218 -6.642 808 HH22 ARG 99 HH22 ARG 99 12.282 -11.627 -7.472 809 H LYS 100 HN LYS 100 10.801 -8.041 1.040 810 HA LYS 100 HA LYS 100 8.767 -6.595 -0.423 811 HB2 LYS 100 HB2 LYS 100 6.942 -8.109 0.271 812 HB3 LYS 100 HB1 LYS 100 8.060 -8.879 -0.849 813 HG2 LYS 100 HG2 LYS 100 8.998 -10.214 0.824 814 HG3 LYS 100 HG1 LYS 100 8.365 -9.196 2.118 815 HD2 LYS 100 HD2 LYS 100 7.031 -11.130 2.154 816 HD3 LYS 100 HD1 LYS 100 6.052 -9.916 1.332 817 HE2 LYS 100 HE2 LYS 100 7.746 -11.867 -0.198 818 HE3 LYS 100 HE1 LYS 100 6.122 -12.279 0.348 819 HZ1 LYS 100 HZ1 LYS 100 5.306 -10.307 -0.855 820 HZ2 LYS 100 HZ2 LYS 100 6.018 -11.467 -1.874 821 HZ3 LYS 100 HZ3 LYS 100 6.872 -10.063 -1.469 822 H VAL 101 HN VAL 101 7.462 -5.391 0.888 823 HA VAL 101 HA VAL 101 7.754 -5.765 3.783 824 HB VAL 101 HB VAL 101 8.965 -3.757 3.025 825 HG11 VAL 101 HG11 VAL 101 7.908 -2.992 1.105 826 HG12 VAL 101 HG12 VAL 101 7.464 -1.788 2.326 827 HG13 VAL 101 HG13 VAL 101 6.308 -3.036 1.862 828 HG21 VAL 101 HG21 VAL 101 7.949 -2.179 4.589 829 HG22 VAL 101 HG22 VAL 101 8.023 -3.812 5.254 830 HG23 VAL 101 HG23 VAL 101 6.495 -3.176 4.642 831 H ARG 102 HN ARG 102 5.839 -5.689 4.948 832 HA ARG 102 HA ARG 102 3.421 -5.522 3.281 833 HB2 ARG 102 HB2 ARG 102 3.929 -7.739 4.415 834 HB3 ARG 102 HB1 ARG 102 3.637 -6.912 5.944 835 HG2 ARG 102 HG2 ARG 102 1.381 -6.276 5.143 836 HG3 ARG 102 HG1 ARG 102 1.635 -7.249 3.701 837 HD2 ARG 102 HD2 ARG 102 0.452 -8.679 5.096 838 HD3 ARG 102 HD1 ARG 102 2.121 -9.162 5.401 839 HE ARG 102 HE ARG 102 1.935 -7.554 7.379 840 HH11 ARG 102 HH11 ARG 102 -0.720 -9.467 6.138 841 HH12 ARG 102 HH12 ARG 102 -1.627 -9.413 7.620 842 HH21 ARG 102 HH21 ARG 102 0.762 -7.492 9.333 843 HH22 ARG 102 HH22 ARG 102 -0.785 -8.285 9.443 844 H PHE 103 HN PHE 103 2.119 -3.891 3.635 845 HA PHE 103 HA PHE 103 2.209 -2.623 6.289 846 HB2 PHE 103 HB2 PHE 103 1.425 -1.385 3.645 847 HB3 PHE 103 HB1 PHE 103 1.449 -0.563 5.195 848 HD1 PHE 103 HD1 PHE 103 3.978 -1.462 6.347 849 HD2 PHE 103 HD2 PHE 103 3.027 -0.365 2.348 850 HE1 PHE 103 HE1 PHE 103 6.314 -0.789 5.979 851 HE2 PHE 103 HE2 PHE 103 5.360 0.295 1.977 852 HZ PHE 103 HZ PHE 103 7.006 0.090 3.789 853 H ASP 104 HN ASP 104 0.654 -3.748 7.316 854 HA ASP 104 HA ASP 104 -1.889 -4.324 6.172 855 HB2 ASP 104 HB2 ASP 104 -2.527 -4.797 8.591 856 HB3 ASP 104 HB1 ASP 104 -1.210 -5.760 7.933 857 H TYR 105 HN TYR 105 -2.635 -2.431 5.321 858 HA TYR 105 HA TYR 105 -2.861 -0.099 7.048 859 HB2 TYR 105 HB2 TYR 105 -2.002 0.250 4.791 860 HB3 TYR 105 HB1 TYR 105 -3.440 -0.500 4.097 861 HD1 TYR 105 HD1 TYR 105 -2.560 2.317 6.409 862 HD2 TYR 105 HD2 TYR 105 -5.067 0.885 3.299 863 HE1 TYR 105 HE1 TYR 105 -3.660 4.516 6.286 864 HE2 TYR 105 HE2 TYR 105 -6.168 3.064 3.169 865 HH TYR 105 HH TYR 105 -4.921 5.845 4.548 866 H ASP 106 HN ASP 106 -4.702 0.625 7.893 867 HA ASP 106 HA ASP 106 -6.947 -1.161 7.891 868 HB2 ASP 106 HB2 ASP 106 -6.162 -0.050 9.934 869 HB3 ASP 106 HB1 ASP 106 -6.562 1.519 9.239 870 H LEU 107 HN LEU 107 -8.145 -1.148 6.079 871 HA LEU 107 HA LEU 107 -8.690 1.286 4.644 872 HB2 LEU 107 HB2 LEU 107 -8.805 -1.508 4.114 873 HB3 LEU 107 HB1 LEU 107 -10.393 -0.829 3.809 874 HG LEU 107 HG LEU 107 -9.192 0.901 2.357 875 HD11 LEU 107 HD11 LEU 107 -7.061 0.046 1.380 876 HD12 LEU 107 HD12 LEU 107 -6.996 -1.122 2.704 877 HD13 LEU 107 HD13 LEU 107 -6.937 0.606 3.051 878 HD21 LEU 107 HD21 LEU 107 -9.011 -0.775 0.479 879 HD22 LEU 107 HD22 LEU 107 -10.550 -0.725 1.344 880 HD23 LEU 107 HD23 LEU 107 -9.391 -2.011 1.681 881 H PHE 108 HN PHE 108 -10.024 2.636 5.820 882 HA PHE 108 HA PHE 108 -12.559 1.467 6.739 883 HB2 PHE 108 HB2 PHE 108 -12.795 3.343 8.272 884 HB3 PHE 108 HB1 PHE 108 -11.262 2.531 8.545 885 HD1 PHE 108 HD2 PHE 108 -12.877 5.572 7.289 886 HD2 PHE 108 HD1 PHE 108 -9.174 3.653 8.141 887 HE1 PHE 108 HE2 PHE 108 -11.719 7.732 7.098 888 HE2 PHE 108 HE1 PHE 108 -8.012 5.812 7.957 889 HZ PHE 108 HZ PHE 108 -9.282 7.852 7.431 890 H LEU 109 HN LEU 109 -14.483 2.309 6.099 891 HA LEU 109 HA LEU 109 -14.384 4.515 4.140 892 HB2 LEU 109 HB2 LEU 109 -16.575 2.447 4.376 893 HB3 LEU 109 HB1 LEU 109 -16.296 3.574 3.061 894 HG LEU 109 HG LEU 109 -14.588 1.179 3.748 895 HD11 LEU 109 HD11 LEU 109 -16.779 0.709 2.661 896 HD12 LEU 109 HD12 LEU 109 -15.376 0.228 1.710 897 HD13 LEU 109 HD13 LEU 109 -16.257 1.701 1.301 898 HD21 LEU 109 HD21 LEU 109 -14.259 3.326 1.666 899 HD22 LEU 109 HD22 LEU 109 -13.451 1.758 1.583 900 HD23 LEU 109 HD23 LEU 109 -13.123 2.848 2.930 901 H HIS 110 HN HIS 110 -16.108 6.116 4.372 902 HA HIS 110 HA HIS 110 -17.049 6.257 7.145 903 HB2 HIS 110 HB2 HIS 110 -15.785 8.165 5.832 904 HB3 HIS 110 HB1 HIS 110 -17.392 8.514 5.206 905 HD1 HIS 110 HD1 HIS 110 -18.844 9.975 6.646 906 HD2 HIS 110 HD2 HIS 110 -15.654 8.317 8.746 907 HE1 HIS 110 HE1 HIS 110 -18.909 11.026 8.931 908 HE2 HIS 110 HE2 HIS 110 -16.861 10.149 10.111 909 H LEU 111 HN LEU 111 -19.264 6.982 7.559 910 HA LEU 111 HA LEU 111 -21.091 5.228 6.520 911 HB2 LEU 111 HB2 LEU 111 -21.120 7.428 8.342 912 HB3 LEU 111 HB1 LEU 111 -22.573 7.469 7.359 913 HG LEU 111 HG LEU 111 -22.866 6.212 9.473 914 HD11 LEU 111 HD11 LEU 111 -23.770 4.118 8.398 915 HD12 LEU 111 HD12 LEU 111 -23.114 4.718 6.875 916 HD13 LEU 111 HD13 LEU 111 -24.354 5.640 7.725 917 HD21 LEU 111 HD21 LEU 111 -20.828 4.378 8.234 918 HD22 LEU 111 HD22 LEU 111 -21.812 3.985 9.647 919 HD23 LEU 111 HD23 LEU 111 -20.646 5.309 9.724 920 H GLU 112 HN GLU 112 -22.639 5.164 5.065 921 HA GLU 112 HA GLU 112 -22.540 6.390 2.626 922 HB2 GLU 112 HB2 GLU 112 -23.875 4.382 3.143 923 HB3 GLU 112 HB1 GLU 112 -24.999 5.367 4.066 924 HG2 GLU 112 HG2 GLU 112 -25.406 6.648 1.911 925 HG3 GLU 112 HG1 GLU 112 -24.552 5.337 1.104 926 H GLY 113 HN GLY 113 -23.502 8.133 1.651 927 HA2 GLY 113 HA2 GLY 113 -24.945 9.988 1.518 928 HA3 GLY 113 HA1 GLY 113 -25.195 9.888 3.255 929 H HIS 114 HN HIS 114 -22.550 9.839 4.138 930 HA HIS 114 HA HIS 114 -21.369 12.288 3.086 931 HB2 HIS 114 HB2 HIS 114 -21.227 13.253 5.415 932 HB3 HIS 114 HB1 HIS 114 -22.838 13.227 4.712 933 HD1 HIS 114 HD1 HIS 114 -20.925 12.146 7.643 934 HD2 HIS 114 HD2 HIS 114 -24.541 11.151 5.840 935 HE1 HIS 114 HE1 HIS 114 -22.219 10.856 9.376 936 HE2 HIS 114 HE2 HIS 114 -24.348 10.152 8.223 937 HA PRO 115 HA PRO 115 -17.905 9.845 4.672 938 HB2 PRO 115 HB2 PRO 115 -17.178 8.473 2.477 939 HB3 PRO 115 HB1 PRO 115 -18.476 7.916 3.537 940 HG2 PRO 115 HG2 PRO 115 -18.646 8.939 0.812 941 HG3 PRO 115 HG1 PRO 115 -19.889 8.127 1.776 942 HD2 PRO 115 HD2 PRO 115 -19.447 11.011 1.343 943 HD3 PRO 115 HD1 PRO 115 -20.902 10.168 1.927 944 HA PRO 116 HA PRO 116 -14.942 12.427 2.416 945 HB2 PRO 116 HB2 PRO 116 -14.052 13.910 4.466 946 HB3 PRO 116 HB1 PRO 116 -15.537 14.331 3.607 947 HG2 PRO 116 HG2 PRO 116 -15.191 13.205 6.310 948 HG3 PRO 116 HG1 PRO 116 -16.544 14.129 5.642 949 HD2 PRO 116 HD2 PRO 116 -16.304 11.270 5.946 950 HD3 PRO 116 HD1 PRO 116 -17.682 12.203 5.325 951 H VAL 117 HN VAL 117 -13.627 10.528 2.152 952 HA VAL 117 HA VAL 117 -11.959 9.962 4.519 953 HB VAL 117 HB VAL 117 -12.969 8.039 2.435 954 HG11 VAL 117 HG11 VAL 117 -10.822 7.674 4.503 955 HG12 VAL 117 HG12 VAL 117 -10.688 7.456 2.764 956 HG13 VAL 117 HG13 VAL 117 -11.653 6.335 3.724 957 HG21 VAL 117 HG21 VAL 117 -13.821 6.850 4.435 958 HG22 VAL 117 HG22 VAL 117 -14.531 8.449 4.221 959 HG23 VAL 117 HG23 VAL 117 -13.272 8.198 5.430 960 H ASN 118 HN ASN 118 -10.051 10.818 4.251 961 HA ASN 118 HA ASN 118 -8.462 9.882 1.988 962 HB2 ASN 118 HB2 ASN 118 -9.283 12.194 1.423 963 HB3 ASN 118 HB1 ASN 118 -8.437 12.793 2.843 964 HD21 ASN 118 HD21 ASN 118 -6.055 12.395 2.881 965 HD22 ASN 118 HD22 ASN 118 -5.208 12.418 1.375 966 H HIS 119 HN HIS 119 -7.172 8.581 3.284 967 HA HIS 119 HA HIS 119 -5.952 9.888 5.637 968 HB2 HIS 119 HB2 HIS 119 -7.619 8.057 6.154 969 HB3 HIS 119 HB1 HIS 119 -6.497 6.937 5.383 970 HD1 HIS 119 HD1 HIS 119 -5.547 5.618 7.276 971 HD2 HIS 119 HD2 HIS 119 -5.624 9.702 8.075 972 HE1 HIS 119 HE1 HIS 119 -4.276 5.918 9.425 973 HE2 HIS 119 HE2 HIS 119 -4.465 8.372 9.964 974 H LEU 120 HN LEU 120 -3.826 9.611 6.026 975 HA LEU 120 HA LEU 120 -2.246 7.918 4.232 976 HB2 LEU 120 HB2 LEU 120 -2.119 10.878 4.532 977 HB3 LEU 120 HB1 LEU 120 -0.620 10.007 4.283 978 HG LEU 120 HG LEU 120 -2.936 9.625 2.428 979 HD11 LEU 120 HD11 LEU 120 -1.169 11.272 1.164 980 HD12 LEU 120 HD12 LEU 120 -1.239 11.971 2.777 981 HD13 LEU 120 HD13 LEU 120 -2.717 11.770 1.831 982 HD21 LEU 120 HD21 LEU 120 -0.856 8.118 2.587 983 HD22 LEU 120 HD22 LEU 120 0.005 9.482 1.873 984 HD23 LEU 120 HD23 LEU 120 -1.328 8.727 1.000 985 H ARG 121 HN ARG 121 -0.394 7.104 5.107 986 HA ARG 121 HA ARG 121 0.674 8.163 7.578 987 HB2 ARG 121 HB2 ARG 121 0.687 5.887 8.653 988 HB3 ARG 121 HB1 ARG 121 -0.885 6.663 8.563 989 HG2 ARG 121 HG2 ARG 121 -1.500 4.603 7.873 990 HG3 ARG 121 HG1 ARG 121 -0.990 5.230 6.311 991 HD2 ARG 121 HD2 ARG 121 -0.094 3.002 6.684 992 HD3 ARG 121 HD1 ARG 121 1.217 4.182 6.604 993 HE ARG 121 HE ARG 121 1.176 4.078 9.123 994 HH11 ARG 121 HH11 ARG 121 0.086 1.386 7.159 995 HH12 ARG 121 HH12 ARG 121 0.416 0.192 8.378 996 HH21 ARG 121 HH21 ARG 121 1.606 2.502 10.726 997 HH22 ARG 121 HH22 ARG 121 1.273 0.830 10.398 998 H CYS 122 HN CYS 122 2.833 7.485 7.968 999 HA CYS 122 HA CYS 122 4.080 6.487 5.500 1000 HB2 CYS 122 HB2 CYS 122 5.997 7.952 6.116 1001 HB3 CYS 122 HB1 CYS 122 4.507 8.826 5.786 1002 HG CYS 122 HG CYS 122 4.753 10.238 7.903 1003 H GLU 123 HN GLU 123 5.457 4.850 5.595 1004 HA GLU 123 HA GLU 123 6.215 3.792 8.236 1005 HB2 GLU 123 HB2 GLU 123 5.888 2.436 5.551 1006 HB3 GLU 123 HB1 GLU 123 6.482 1.632 7.006 1007 HG2 GLU 123 HG2 GLU 123 3.910 3.065 7.204 1008 HG3 GLU 123 HG1 GLU 123 3.918 1.567 6.266 1009 H LYS 124 HN LYS 124 8.355 2.989 8.507 1010 HA LYS 124 HA LYS 124 10.313 4.079 6.592 1011 HB2 LYS 124 HB2 LYS 124 10.156 5.594 8.482 1012 HB3 LYS 124 HB1 LYS 124 10.367 4.257 9.603 1013 HG2 LYS 124 HG2 LYS 124 12.639 3.911 8.467 1014 HG3 LYS 124 HG1 LYS 124 12.395 5.517 7.790 1015 HD2 LYS 124 HD2 LYS 124 13.658 5.807 9.738 1016 HD3 LYS 124 HD1 LYS 124 12.020 6.328 10.136 1017 HE2 LYS 124 HE2 LYS 124 12.848 3.509 10.622 1018 HE3 LYS 124 HE1 LYS 124 13.322 4.762 11.773 1019 HZ1 LYS 124 HZ1 LYS 124 10.523 4.158 10.948 1020 HZ2 LYS 124 HZ2 LYS 124 10.997 5.304 12.099 1021 HZ3 LYS 124 HZ3 LYS 124 11.243 3.654 12.396 1022 H LEU 125 HN LEU 125 11.988 2.780 6.100 1023 HA LEU 125 HA LEU 125 12.268 0.268 7.636 1024 HB2 LEU 125 HB2 LEU 125 12.726 0.588 4.672 1025 HB3 LEU 125 HB1 LEU 125 12.643 -0.907 5.579 1026 HG LEU 125 HG LEU 125 10.207 0.767 5.659 1027 HD11 LEU 125 HD11 LEU 125 10.827 1.054 3.308 1028 HD12 LEU 125 HD12 LEU 125 9.440 -0.028 3.473 1029 HD13 LEU 125 HD13 LEU 125 11.039 -0.694 3.156 1030 HD21 LEU 125 HD21 LEU 125 9.203 -1.505 5.299 1031 HD22 LEU 125 HD22 LEU 125 10.171 -1.331 6.764 1032 HD23 LEU 125 HD23 LEU 125 10.842 -2.157 5.357 1033 H THR 126 HN THR 126 14.145 0.611 8.774 1034 HA THR 126 HA THR 126 16.402 1.921 7.422 1035 HB THR 126 HB THR 126 16.562 1.005 10.268 1036 HG1 THR 126 HG1 THR 126 14.528 2.085 10.108 1037 HG21 THR 126 HG21 THR 126 18.357 2.244 8.782 1038 HG22 THR 126 HG22 THR 126 18.150 2.641 10.486 1039 HG23 THR 126 HG23 THR 126 17.422 3.664 9.250 1040 H PHE 127 HN PHE 127 17.835 0.675 6.417 1041 HA PHE 127 HA PHE 127 18.165 -2.110 7.285 1042 HB2 PHE 127 HB2 PHE 127 18.989 -0.781 4.693 1043 HB3 PHE 127 HB1 PHE 127 19.104 -2.500 5.055 1044 HD1 PHE 127 HD1 PHE 127 17.077 -3.886 5.186 1045 HD2 PHE 127 HD2 PHE 127 16.918 0.236 4.131 1046 HE1 PHE 127 HE1 PHE 127 14.797 -4.189 4.347 1047 HE2 PHE 127 HE2 PHE 127 14.638 -0.056 3.291 1048 HZ PHE 127 HZ PHE 127 13.567 -2.272 3.401 1049 H ASN 128 HN ASN 128 19.776 -2.324 8.687 1050 HA ASN 128 HA ASN 128 21.905 -0.441 8.881 1051 HB2 ASN 128 HB2 ASN 128 21.505 -3.135 10.183 1052 HB3 ASN 128 HB1 ASN 128 22.846 -2.052 10.543 1053 HD21 ASN 128 HD21 ASN 128 19.448 -2.634 10.908 1054 HD22 ASN 128 HD22 ASN 128 19.166 -1.404 12.096 1055 H ASN 129 HN ASN 129 23.545 -0.337 7.541 1056 HA ASN 129 HA ASN 129 25.261 -0.860 6.158 1057 HB2 ASN 129 HB2 ASN 129 25.400 -3.245 8.009 1058 HB3 ASN 129 HB1 ASN 129 26.665 -2.780 6.861 1059 HD21 ASN 129 HD21 ASN 129 26.272 -2.818 9.989 1060 HD22 ASN 129 HD22 ASN 129 26.949 -1.284 10.439 1061 HA PRO 130 HA PRO 130 23.134 -3.937 3.489 1062 HB2 PRO 130 HB2 PRO 130 22.296 -2.294 1.541 1063 HB3 PRO 130 HB1 PRO 130 21.376 -2.501 3.036 1064 HG2 PRO 130 HG2 PRO 130 23.119 -0.250 2.180 1065 HG3 PRO 130 HG1 PRO 130 21.644 -0.221 3.158 1066 HD2 PRO 130 HD2 PRO 130 24.281 -0.116 4.113 1067 HD3 PRO 130 HD1 PRO 130 22.828 -0.419 5.080 1068 H THR 131 HN THR 131 23.841 -4.691 1.420 1069 HA THR 131 HA THR 131 26.577 -4.263 0.851 1070 HB THR 131 HB THR 131 25.506 -6.397 0.279 1071 HG1 THR 131 HG1 THR 131 26.353 -6.561 -1.883 1072 HG21 THR 131 HG21 THR 131 23.305 -5.669 -0.368 1073 HG22 THR 131 HG22 THR 131 24.040 -6.502 -1.741 1074 HG23 THR 131 HG23 THR 131 23.963 -4.740 -1.718 1075 H GLU 132 HN GLU 132 27.353 -3.654 -1.425 1076 HA GLU 132 HA GLU 132 26.903 -0.913 -1.698 1077 HB2 GLU 132 HB2 GLU 132 28.895 -2.319 -2.576 1078 HB3 GLU 132 HB1 GLU 132 27.894 -2.544 -4.007 1079 HG2 GLU 132 HG2 GLU 132 29.345 -0.720 -4.431 1080 HG3 GLU 132 HG1 GLU 132 27.727 -0.063 -4.180 1081 H ASP 133 HN ASP 133 25.600 -3.611 -3.584 1082 HA ASP 133 HA ASP 133 24.269 -2.187 -5.569 1083 HB2 ASP 133 HB2 ASP 133 23.603 -4.841 -4.300 1084 HB3 ASP 133 HB1 ASP 133 22.692 -4.179 -5.644 1085 H PHE 134 HN PHE 134 22.930 -3.374 -2.484 1086 HA PHE 134 HA PHE 134 20.377 -2.242 -2.882 1087 HB2 PHE 134 HB2 PHE 134 21.093 -4.079 -1.181 1088 HB3 PHE 134 HB1 PHE 134 21.545 -2.723 -0.148 1089 HD1 PHE 134 HD1 PHE 134 18.720 -2.685 -2.483 1090 HD2 PHE 134 HD2 PHE 134 19.912 -3.064 1.580 1091 HE1 PHE 134 HE1 PHE 134 16.395 -2.438 -1.787 1092 HE2 PHE 134 HE2 PHE 134 17.570 -2.815 2.288 1093 HZ PHE 134 HZ PHE 134 15.802 -2.501 0.597 1094 H ARG 135 HN ARG 135 23.151 -1.221 -0.964 1095 HA ARG 135 HA ARG 135 22.370 1.212 0.016 1096 HB2 ARG 135 HB2 ARG 135 24.405 0.389 0.665 1097 HB3 ARG 135 HB1 ARG 135 24.948 0.143 -0.995 1098 HG2 ARG 135 HG2 ARG 135 26.083 2.089 -0.730 1099 HG3 ARG 135 HG1 ARG 135 24.525 2.861 -0.901 1100 HD2 ARG 135 HD2 ARG 135 24.290 2.794 1.561 1101 HD3 ARG 135 HD1 ARG 135 25.924 2.134 1.685 1102 HE ARG 135 HE ARG 135 26.348 4.356 0.275 1103 HH11 ARG 135 HH11 ARG 135 24.525 3.815 3.208 1104 HH12 ARG 135 HH12 ARG 135 24.848 5.393 3.865 1105 HH21 ARG 135 HH21 ARG 135 26.780 6.428 1.119 1106 HH22 ARG 135 HH22 ARG 135 26.128 6.887 2.664 1107 H ARG 136 HN ARG 136 23.786 0.577 -3.138 1108 HA ARG 136 HA ARG 136 24.002 3.059 -4.231 1109 HB2 ARG 136 HB2 ARG 136 24.014 0.381 -5.034 1110 HB3 ARG 136 HB1 ARG 136 22.966 1.252 -6.109 1111 HG2 ARG 136 HG2 ARG 136 24.707 2.716 -6.783 1112 HG3 ARG 136 HG1 ARG 136 25.781 2.066 -5.536 1113 HD2 ARG 136 HD2 ARG 136 26.332 1.093 -7.693 1114 HD3 ARG 136 HD1 ARG 136 25.676 -0.134 -6.607 1115 HE ARG 136 HE ARG 136 23.874 1.156 -8.530 1116 HH11 ARG 136 HH11 ARG 136 25.639 -1.691 -7.489 1117 HH12 ARG 136 HH12 ARG 136 24.759 -2.772 -8.532 1118 HH21 ARG 136 HH21 ARG 136 22.681 -0.273 -9.861 1119 HH22 ARG 136 HH22 ARG 136 23.056 -1.969 -9.855 1120 H LYS 137 HN LYS 137 21.218 0.893 -4.574 1121 HA LYS 137 HA LYS 137 19.698 2.766 -6.070 1122 HB2 LYS 137 HB2 LYS 137 18.978 0.182 -4.682 1123 HB3 LYS 137 HB1 LYS 137 17.779 1.147 -5.545 1124 HG2 LYS 137 HG2 LYS 137 19.042 0.903 -7.618 1125 HG3 LYS 137 HG1 LYS 137 20.300 0.001 -6.770 1126 HD2 LYS 137 HD2 LYS 137 17.540 -1.042 -6.532 1127 HD3 LYS 137 HD1 LYS 137 18.306 -1.176 -8.114 1128 HE2 LYS 137 HE2 LYS 137 20.133 -2.390 -7.228 1129 HE3 LYS 137 HE1 LYS 137 19.638 -2.080 -5.568 1130 HZ1 LYS 137 HZ1 LYS 137 19.150 -4.343 -6.382 1131 HZ2 LYS 137 HZ2 LYS 137 18.082 -3.688 -7.522 1132 HZ3 LYS 137 HZ3 LYS 137 17.771 -3.511 -5.863 1133 H LEU 138 HN LEU 138 19.613 1.768 -2.681 1134 HA LEU 138 HA LEU 138 17.456 3.287 -1.793 1135 HB2 LEU 138 HB2 LEU 138 20.004 2.730 -0.288 1136 HB3 LEU 138 HB1 LEU 138 18.480 3.222 0.419 1137 HG LEU 138 HG LEU 138 19.170 0.579 -0.835 1138 HD11 LEU 138 HD11 LEU 138 19.731 0.997 1.546 1139 HD12 LEU 138 HD12 LEU 138 18.588 -0.322 1.299 1140 HD13 LEU 138 HD13 LEU 138 18.014 1.249 1.858 1141 HD21 LEU 138 HD21 LEU 138 16.441 1.536 -0.032 1142 HD22 LEU 138 HD22 LEU 138 16.859 -0.096 -0.535 1143 HD23 LEU 138 HD23 LEU 138 16.983 1.240 -1.680 1144 H LEU 139 HN LEU 139 20.754 4.273 -2.487 1145 HA LEU 139 HA LEU 139 20.533 6.870 -1.285 1146 HB2 LEU 139 HB2 LEU 139 22.523 5.878 -3.320 1147 HB3 LEU 139 HB1 LEU 139 22.686 7.311 -2.326 1148 HG LEU 139 HG LEU 139 22.541 4.512 -1.230 1149 HD11 LEU 139 HD11 LEU 139 24.803 4.329 -1.271 1150 HD12 LEU 139 HD12 LEU 139 25.055 6.081 -1.233 1151 HD13 LEU 139 HD13 LEU 139 24.568 5.294 -2.734 1152 HD21 LEU 139 HD21 LEU 139 21.823 6.329 0.261 1153 HD22 LEU 139 HD22 LEU 139 23.395 7.101 0.049 1154 HD23 LEU 139 HD23 LEU 139 23.284 5.519 0.825 1155 H LYS 140 HN LYS 140 20.133 5.558 -4.510 1156 HA LYS 140 HA LYS 140 20.119 7.985 -5.921 1157 HB2 LYS 140 HB2 LYS 140 19.637 5.220 -6.514 1158 HB3 LYS 140 HB1 LYS 140 18.433 6.233 -7.286 1159 HG2 LYS 140 HG2 LYS 140 20.002 7.383 -8.545 1160 HG3 LYS 140 HG1 LYS 140 21.334 6.905 -7.493 1161 HD2 LYS 140 HD2 LYS 140 19.784 4.899 -9.099 1162 HD3 LYS 140 HD1 LYS 140 21.169 5.761 -9.764 1163 HE2 LYS 140 HE2 LYS 140 21.219 4.146 -7.230 1164 HE3 LYS 140 HE1 LYS 140 21.676 3.531 -8.813 1165 HZ1 LYS 140 HZ1 LYS 140 23.680 4.191 -7.858 1166 HZ2 LYS 140 HZ2 LYS 140 23.018 5.594 -7.179 1167 HZ3 LYS 140 HZ3 LYS 140 23.282 5.505 -8.849 1168 H ALA 141 HN ALA 141 17.695 6.350 -4.081 1169 HA ALA 141 HA ALA 141 15.406 7.726 -4.960 1170 HB1 ALA 141 HB1 ALA 141 14.484 6.454 -3.398 1171 HB2 ALA 141 HB2 ALA 141 15.300 7.364 -2.125 1172 HB3 ALA 141 HB3 ALA 141 16.089 5.964 -2.855 1173 H1 GLY 212 HT1 GLY 212 -15.284 8.223 16.218 1174 H2 GLY 212 HT2 GLY 212 -16.099 6.755 15.995 1175 H3 GLY 212 HT3 GLY 212 -16.961 8.211 15.987 1176 HA2 GLY 212 HA1 GLY 212 -15.787 8.911 13.980 1177 HA3 GLY 212 HA2 GLY 212 -14.953 7.362 13.976 1178 H GLY 213 HN GLY 213 -17.275 8.940 12.436 1179 HA2 GLY 213 HA2 GLY 213 -19.382 6.953 12.473 1180 HA3 GLY 213 HA1 GLY 213 -19.325 8.398 11.475 1181 H LYS 214 HN LYS 214 -17.366 5.453 11.840 1182 HA LYS 214 HA LYS 214 -16.971 5.403 8.960 1183 HB2 LYS 214 HB2 LYS 214 -15.334 3.636 9.412 1184 HB3 LYS 214 HB1 LYS 214 -15.018 5.064 10.385 1185 HG2 LYS 214 HG2 LYS 214 -16.054 3.975 12.315 1186 HG3 LYS 214 HG1 LYS 214 -16.352 2.537 11.334 1187 HD2 LYS 214 HD2 LYS 214 -13.932 2.306 10.966 1188 HD3 LYS 214 HD1 LYS 214 -13.652 3.723 11.980 1189 HE2 LYS 214 HE2 LYS 214 -14.910 1.123 12.850 1190 HE3 LYS 214 HE1 LYS 214 -13.278 1.671 13.233 1191 HZ1 LYS 214 HZ1 LYS 214 -15.845 2.830 14.161 1192 HZ2 LYS 214 HZ2 LYS 214 -14.357 3.629 14.336 1193 HZ3 LYS 214 HZ3 LYS 214 -14.613 2.136 15.102 1194 H ALA 215 HN ALA 215 -17.530 3.723 7.646 1195 HA ALA 215 HA ALA 215 -20.032 2.512 8.130 1196 HB1 ALA 215 HB1 ALA 215 -19.600 1.355 5.986 1197 HB2 ALA 215 HB2 ALA 215 -17.947 1.963 6.014 1198 HB3 ALA 215 HB3 ALA 215 -19.300 3.089 5.894 1199 HA PRO 216 HA PRO 216 -19.165 -1.281 10.207 1200 HB2 PRO 216 HB2 PRO 216 -20.643 -3.042 8.650 1201 HB3 PRO 216 HB1 PRO 216 -21.279 -2.071 9.979 1202 HG2 PRO 216 HG2 PRO 216 -21.402 -1.583 7.047 1203 HG3 PRO 216 HG1 PRO 216 -22.612 -1.242 8.295 1204 HD2 PRO 216 HD2 PRO 216 -21.086 0.688 7.213 1205 HD3 PRO 216 HD1 PRO 216 -21.591 0.734 8.915 1206 H ARG 217 HN ARG 217 -18.372 -3.553 9.826 1207 HA ARG 217 HA ARG 217 -16.646 -3.645 7.446 1208 HB2 ARG 217 HB2 ARG 217 -15.773 -4.073 10.309 1209 HB3 ARG 217 HB1 ARG 217 -14.777 -4.413 8.899 1210 HG2 ARG 217 HG2 ARG 217 -14.933 -2.040 8.259 1211 HG3 ARG 217 HG1 ARG 217 -15.840 -1.730 9.741 1212 HD2 ARG 217 HD2 ARG 217 -13.968 -2.398 11.084 1213 HD3 ARG 217 HD1 ARG 217 -13.069 -2.902 9.651 1214 HE ARG 217 HE ARG 217 -13.902 -0.119 9.751 1215 HH11 ARG 217 HH11 ARG 217 -11.352 -2.476 10.229 1216 HH12 ARG 217 HH12 ARG 217 -10.075 -1.286 10.151 1217 HH21 ARG 217 HH21 ARG 217 -12.233 1.423 9.658 1218 HH22 ARG 217 HH22 ARG 217 -10.575 0.921 9.822 1219 H1 KCR 218 HN KCR 218 -15.474 -5.797 7.333 1220 H4 KCR 218 HA KCR 218 -17.380 -7.946 8.004 1221 H5 KCR 218 HB1 KCR 218 -16.706 -9.088 6.004 1222 H6 KCR 218 HB2 KCR 218 -15.398 -7.948 5.727 1223 H7 KCR 218 HG1 KCR 218 -17.052 -6.175 5.319 1224 H8 KCR 218 HG2 KCR 218 -18.344 -7.363 5.528 1225 H9 KCR 218 HD1 KCR 218 -17.602 -8.613 3.641 1226 H10 KCR 218 HD2 KCR 218 -16.130 -7.650 3.511 1227 H11 KCR 218 HE1 KCR 218 -17.462 -5.680 2.949 1228 H12 KCR 218 HE2 KCR 218 -18.937 -6.645 3.068 1229 H13 KCR 218 HZ1 KCR 218 -17.847 -8.031 1.234 1230 H14 KCR 218 HH1 KCR 218 -17.389 -7.846 -1.109 1231 H15 KCR 218 HJ1 KCR 218 -17.352 -4.863 -1.889 1232 H16 KCR 218 HF3 KCR 218 -17.583 -5.898 -4.107 1233 H17 KCR 218 HF1 KCR 218 -15.987 -6.487 -3.647 1234 H18 KCR 218 HF2 KCR 218 -17.404 -7.511 -3.414 1235 H GLN 219 HN GLN 219 -16.246 -8.188 10.048 1236 HA GLN 219 HA GLN 219 -13.761 -9.720 9.718 1237 HB2 GLN 219 HB2 GLN 219 -13.307 -7.416 10.604 1238 HB3 GLN 219 HB1 GLN 219 -14.311 -7.804 11.995 1239 HG2 GLN 219 HG2 GLN 219 -12.000 -8.067 12.579 1240 HG3 GLN 219 HG1 GLN 219 -12.777 -9.649 12.554 1241 HE21 GLN 219 HE21 GLN 219 -10.873 -10.762 12.241 1242 HE22 GLN 219 HE22 GLN 219 -9.999 -10.707 10.744 1243 H LEU 220 HN LEU 220 -13.681 -11.598 10.848 1244 HA LEU 220 HA LEU 220 -16.099 -12.512 12.095 1245 HB2 LEU 220 HB2 LEU 220 -14.635 -13.958 10.683 1246 HB3 LEU 220 HB1 LEU 220 -13.411 -13.880 11.937 1247 HG LEU 220 HG LEU 220 -14.985 -14.978 13.505 1248 HD11 LEU 220 HD11 LEU 220 -17.005 -16.031 12.616 1249 HD12 LEU 220 HD12 LEU 220 -16.724 -15.253 11.058 1250 HD13 LEU 220 HD13 LEU 220 -17.077 -14.273 12.481 1251 HD21 LEU 220 HD21 LEU 220 -14.485 -16.481 10.939 1252 HD22 LEU 220 HD22 LEU 220 -14.830 -17.203 12.510 1253 HD23 LEU 220 HD23 LEU 220 -13.341 -16.291 12.267 1254 H ALA 221 HN ALA 221 -16.115 -10.885 13.774 1255 HA ALA 221 HA ALA 221 -14.669 -11.818 16.149 1256 HB1 ALA 221 HB1 ALA 221 -13.466 -9.849 15.325 1257 HB2 ALA 221 HB2 ALA 221 -14.258 -9.516 16.865 1258 HB3 ALA 221 HB3 ALA 221 -14.964 -8.916 15.364 1259 H THR 222 HN THR 222 -16.202 -12.507 17.466 1260 HA THR 222 HA THR 222 -18.938 -11.788 17.190 1261 HB THR 222 HB THR 222 -17.747 -13.130 19.614 1262 HG1 THR 222 HG1 THR 222 -17.962 -14.044 16.963 1263 HG21 THR 222 HG21 THR 222 -20.377 -13.462 18.164 1264 HG22 THR 222 HG22 THR 222 -20.138 -12.600 19.684 1265 HG23 THR 222 HG23 THR 222 -19.876 -14.343 19.608 1266 H LYS 223 HN LYS 223 -16.412 -10.936 19.514 1267 HA LYS 223 HA LYS 223 -18.023 -8.605 20.273 1268 HB2 LYS 223 HB2 LYS 223 -18.260 -10.185 22.096 1269 HB3 LYS 223 HB1 LYS 223 -16.521 -10.426 22.164 1270 HG2 LYS 223 HG2 LYS 223 -16.158 -8.267 23.043 1271 HG3 LYS 223 HG1 LYS 223 -17.806 -7.759 22.671 1272 HD2 LYS 223 HD2 LYS 223 -17.502 -8.223 25.065 1273 HD3 LYS 223 HD1 LYS 223 -18.685 -9.301 24.325 1274 HE2 LYS 223 HE2 LYS 223 -17.257 -10.551 25.823 1275 HE3 LYS 223 HE1 LYS 223 -16.958 -11.046 24.160 1276 HZ1 LYS 223 HZ1 LYS 223 -15.276 -9.042 25.555 1277 HZ2 LYS 223 HZ2 LYS 223 -14.928 -9.883 24.119 1278 HZ3 LYS 223 HZ3 LYS 223 -14.948 -10.704 25.598 1279 H ALA 224 HN ALA 224 -14.794 -10.059 20.698 1280 HA ALA 224 HA ALA 224 -13.517 -7.912 19.312 1281 HB1 ALA 224 HB1 ALA 224 -13.063 -8.081 22.292 1282 HB2 ALA 224 HB2 ALA 224 -13.914 -6.785 21.453 1283 HB3 ALA 224 HB3 ALA 224 -12.193 -7.038 21.167 Start of MODEL 19 1 H1 GLY 1 HT1 GLY 1 33.093 -5.507 4.668 2 H2 GLY 1 HT2 GLY 1 32.922 -6.842 3.635 3 H3 GLY 1 HT3 GLY 1 32.159 -6.842 5.148 4 HA2 GLY 1 HA1 GLY 1 30.566 -6.406 3.392 5 HA3 GLY 1 HA2 GLY 1 30.726 -5.035 4.482 6 H SER 2 HN SER 2 29.855 -3.746 2.751 7 HA SER 2 HA SER 2 31.306 -3.410 0.312 8 HB2 SER 2 HB2 SER 2 29.816 -1.329 0.145 9 HB3 SER 2 HB1 SER 2 29.000 -2.892 0.217 10 HG SER 2 HG SER 2 28.414 -2.515 2.290 11 H HIS 3 HN HIS 3 32.280 -1.303 -0.336 12 HA HIS 3 HA HIS 3 33.724 -0.124 1.949 13 HB2 HIS 3 HB2 HIS 3 35.763 -0.049 0.529 14 HB3 HIS 3 HB1 HIS 3 35.225 -1.686 0.876 15 HD1 HIS 3 HD1 HIS 3 34.609 -3.163 -1.085 16 HD2 HIS 3 HD2 HIS 3 35.383 0.773 -2.187 17 HE1 HIS 3 HE1 HIS 3 34.707 -3.167 -3.599 18 HE2 HIS 3 HE2 HIS 3 34.987 -0.748 -4.245 19 H MET 4 HN MET 4 31.398 0.824 0.344 20 HA MET 4 HA MET 4 32.614 3.226 -0.833 21 HB2 MET 4 HB2 MET 4 29.879 2.019 -1.230 22 HB3 MET 4 HB1 MET 4 30.331 3.607 -1.831 23 HG2 MET 4 HG2 MET 4 32.225 2.441 -3.050 24 HG3 MET 4 HG1 MET 4 31.405 0.931 -2.653 25 HE1 MET 4 HE1 MET 4 31.175 4.348 -4.544 26 HE2 MET 4 HE2 MET 4 29.771 4.414 -3.479 27 HE3 MET 4 HE3 MET 4 29.550 4.281 -5.225 28 H ALA 5 HN ALA 5 32.831 4.747 0.626 29 HA ALA 5 HA ALA 5 32.321 6.393 2.095 30 HB1 ALA 5 HB1 ALA 5 30.021 7.180 2.244 31 HB2 ALA 5 HB2 ALA 5 29.456 5.712 1.445 32 HB3 ALA 5 HB3 ALA 5 30.469 6.859 0.568 33 H SER 6 HN SER 6 30.284 6.643 4.001 34 HA SER 6 HA SER 6 31.192 4.691 5.916 35 HB2 SER 6 HB2 SER 6 29.150 6.903 6.252 36 HB3 SER 6 HB1 SER 6 29.965 6.017 7.538 37 HG SER 6 HG SER 6 31.009 7.979 7.215 38 H SER 7 HN SER 7 30.142 2.926 6.578 39 HA SER 7 HA SER 7 27.629 2.245 5.322 40 HB2 SER 7 HB2 SER 7 29.397 0.733 7.266 41 HB3 SER 7 HB1 SER 7 27.907 0.087 6.573 42 HG SER 7 HG SER 7 30.325 0.775 5.258 43 H CYS 8 HN CYS 8 25.744 2.699 6.126 44 HA CYS 8 HA CYS 8 25.345 2.928 9.014 45 HB2 CYS 8 HB2 CYS 8 24.419 5.033 7.041 46 HB3 CYS 8 HB1 CYS 8 24.215 5.067 8.789 47 HG CYS 8 HG CYS 8 27.123 5.116 9.122 48 H ALA 9 HN ALA 9 22.846 3.286 9.367 49 HA ALA 9 HA ALA 9 21.478 1.293 7.786 50 HB1 ALA 9 HB1 ALA 9 19.571 1.687 9.281 51 HB2 ALA 9 HB2 ALA 9 20.419 3.070 9.988 52 HB3 ALA 9 HB3 ALA 9 21.062 1.443 10.202 53 H VAL 10 HN VAL 10 20.525 1.726 5.930 54 HA VAL 10 HA VAL 10 19.943 4.517 5.270 55 HB VAL 10 HB VAL 10 19.914 2.112 3.438 56 HG11 VAL 10 HG11 VAL 10 18.598 3.743 2.435 57 HG12 VAL 10 HG12 VAL 10 20.189 3.991 1.713 58 HG13 VAL 10 HG13 VAL 10 19.626 5.061 2.999 59 HG21 VAL 10 HG21 VAL 10 22.156 2.244 3.966 60 HG22 VAL 10 HG22 VAL 10 22.107 3.992 4.195 61 HG23 VAL 10 HG23 VAL 10 22.054 3.314 2.568 62 H GLN 11 HN GLN 11 17.961 5.238 5.446 63 HA GLN 11 HA GLN 11 15.823 3.272 5.853 64 HB2 GLN 11 HB2 GLN 11 15.718 6.200 6.575 65 HB3 GLN 11 HB1 GLN 11 14.714 4.893 7.189 66 HG2 GLN 11 HG2 GLN 11 16.119 4.519 8.866 67 HG3 GLN 11 HG1 GLN 11 17.476 4.368 7.753 68 HE21 GLN 11 HE21 GLN 11 15.561 7.270 7.980 69 HE22 GLN 11 HE22 GLN 11 16.781 8.251 8.727 70 H VAL 12 HN VAL 12 14.234 3.091 4.445 71 HA VAL 12 HA VAL 12 13.884 5.237 2.473 72 HB VAL 12 HB VAL 12 12.829 3.469 1.046 73 HG11 VAL 12 HG11 VAL 12 15.358 4.128 1.077 74 HG12 VAL 12 HG12 VAL 12 14.853 2.696 0.187 75 HG13 VAL 12 HG13 VAL 12 15.580 2.530 1.785 76 HG21 VAL 12 HG21 VAL 12 12.230 1.982 2.878 77 HG22 VAL 12 HG22 VAL 12 13.929 1.573 3.097 78 HG23 VAL 12 HG23 VAL 12 13.100 1.154 1.594 79 H LYS 13 HN LYS 13 11.790 6.024 2.105 80 HA LYS 13 HA LYS 13 9.856 5.197 4.151 81 HB2 LYS 13 HB2 LYS 13 10.348 7.855 2.843 82 HB3 LYS 13 HB1 LYS 13 8.837 7.502 3.668 83 HG2 LYS 13 HG2 LYS 13 10.158 6.921 5.680 84 HG3 LYS 13 HG1 LYS 13 11.593 7.536 4.850 85 HD2 LYS 13 HD2 LYS 13 10.195 9.676 4.486 86 HD3 LYS 13 HD1 LYS 13 9.153 9.034 5.757 87 HE2 LYS 13 HE2 LYS 13 10.732 10.517 6.769 88 HE3 LYS 13 HE1 LYS 13 11.166 8.866 7.219 89 HZ1 LYS 13 HZ1 LYS 13 12.429 10.401 5.011 90 HZ2 LYS 13 HZ2 LYS 13 12.895 8.869 5.564 91 HZ3 LYS 13 HZ3 LYS 13 13.090 10.225 6.563 92 H LEU 14 HN LEU 14 8.106 4.260 3.562 93 HA LEU 14 HA LEU 14 7.104 4.686 0.824 94 HB2 LEU 14 HB2 LEU 14 6.760 2.275 2.596 95 HB3 LEU 14 HB1 LEU 14 5.973 2.492 1.050 96 HG LEU 14 HG LEU 14 8.970 2.350 1.421 97 HD11 LEU 14 HD11 LEU 14 7.015 0.268 0.483 98 HD12 LEU 14 HD12 LEU 14 7.939 0.228 1.984 99 HD13 LEU 14 HD13 LEU 14 8.770 0.119 0.431 100 HD21 LEU 14 HD21 LEU 14 7.293 2.180 -1.078 101 HD22 LEU 14 HD22 LEU 14 9.054 2.163 -0.972 102 HD23 LEU 14 HD23 LEU 14 8.160 3.623 -0.550 103 H GLU 15 HN GLU 15 4.931 5.054 0.579 104 HA GLU 15 HA GLU 15 3.636 6.043 3.027 105 HB2 GLU 15 HB2 GLU 15 4.370 7.791 1.447 106 HB3 GLU 15 HB1 GLU 15 3.397 7.054 0.184 107 HG2 GLU 15 HG2 GLU 15 1.373 7.573 1.384 108 HG3 GLU 15 HG1 GLU 15 2.304 8.206 2.740 109 H LEU 16 HN LEU 16 1.859 5.056 3.615 110 HA LEU 16 HA LEU 16 0.306 3.475 1.691 111 HB2 LEU 16 HB2 LEU 16 0.209 3.704 4.684 112 HB3 LEU 16 HB1 LEU 16 -1.074 2.935 3.787 113 HG LEU 16 HG LEU 16 0.193 1.170 4.576 114 HD11 LEU 16 HD11 LEU 16 1.800 1.224 2.178 115 HD12 LEU 16 HD12 LEU 16 0.100 1.580 1.880 116 HD13 LEU 16 HD13 LEU 16 0.562 0.078 2.685 117 HD21 LEU 16 HD21 LEU 16 2.686 2.575 3.745 118 HD22 LEU 16 HD22 LEU 16 2.575 1.076 4.650 119 HD23 LEU 16 HD23 LEU 16 2.045 2.596 5.377 120 H GLY 17 HN GLY 17 -1.793 3.979 1.228 121 HA2 GLY 17 HA2 GLY 17 -3.036 6.245 2.565 122 HA3 GLY 17 HA1 GLY 17 -2.622 6.492 0.872 123 H HIS 18 HN HIS 18 -5.182 6.719 1.760 124 HA HIS 18 HA HIS 18 -6.444 5.165 -0.201 125 HB2 HIS 18 HB2 HIS 18 -7.263 3.356 0.865 126 HB3 HIS 18 HB1 HIS 18 -6.168 3.732 2.187 127 HD1 HIS 18 HD1 HIS 18 -7.242 5.164 4.189 128 HD2 HIS 18 HD2 HIS 18 -9.921 3.486 1.484 129 HE1 HIS 18 HE1 HIS 18 -9.506 5.314 5.284 130 HE2 HIS 18 HE2 HIS 18 -11.069 4.137 3.711 131 H ARG 19 HN ARG 19 -8.340 6.013 -0.766 132 HA ARG 19 HA ARG 19 -9.543 8.038 1.006 133 HB2 ARG 19 HB2 ARG 19 -9.612 7.942 -2.019 134 HB3 ARG 19 HB1 ARG 19 -10.386 9.148 -1.018 135 HG2 ARG 19 HG2 ARG 19 -8.246 9.955 -0.256 136 HG3 ARG 19 HG1 ARG 19 -7.424 8.685 -1.167 137 HD2 ARG 19 HD2 ARG 19 -7.301 10.700 -2.441 138 HD3 ARG 19 HD1 ARG 19 -8.431 9.606 -3.238 139 HE ARG 19 HE ARG 19 -10.152 11.046 -1.883 140 HH11 ARG 19 HH11 ARG 19 -7.248 12.136 -3.502 141 HH12 ARG 19 HH12 ARG 19 -7.893 13.702 -3.889 142 HH21 ARG 19 HH21 ARG 19 -11.011 13.115 -2.405 143 HH22 ARG 19 HH22 ARG 19 -10.021 14.262 -3.263 144 H ALA 20 HN ALA 20 -11.934 8.198 0.723 145 HA ALA 20 HA ALA 20 -13.208 5.904 -0.509 146 HB1 ALA 20 HB1 ALA 20 -13.069 4.777 1.456 147 HB2 ALA 20 HB2 ALA 20 -14.554 5.683 1.756 148 HB3 ALA 20 HB3 ALA 20 -13.025 6.250 2.429 149 H GLN 21 HN GLN 21 -15.166 6.352 -1.248 150 HA GLN 21 HA GLN 21 -16.715 8.569 -0.188 151 HB2 GLN 21 HB2 GLN 21 -16.932 9.735 -2.253 152 HB3 GLN 21 HB1 GLN 21 -15.219 9.477 -1.994 153 HG2 GLN 21 HG2 GLN 21 -15.131 8.755 -4.062 154 HG3 GLN 21 HG1 GLN 21 -15.949 7.306 -3.512 155 HE21 GLN 21 HE21 GLN 21 -18.114 6.998 -3.998 156 HE22 GLN 21 HE22 GLN 21 -18.958 7.994 -5.139 157 H VAL 22 HN VAL 22 -18.901 8.227 -0.392 158 HA VAL 22 HA VAL 22 -19.618 5.646 -1.598 159 HB VAL 22 HB VAL 22 -20.057 6.031 0.883 160 HG11 VAL 22 HG11 VAL 22 -22.075 7.232 1.486 161 HG12 VAL 22 HG12 VAL 22 -22.306 7.720 -0.193 162 HG13 VAL 22 HG13 VAL 22 -20.914 8.312 0.716 163 HG21 VAL 22 HG21 VAL 22 -22.159 4.822 0.825 164 HG22 VAL 22 HG22 VAL 22 -21.069 4.219 -0.419 165 HG23 VAL 22 HG23 VAL 22 -22.403 5.287 -0.856 166 H ARG 23 HN ARG 23 -21.309 5.453 -2.975 167 HA ARG 23 HA ARG 23 -22.554 7.947 -3.954 168 HB2 ARG 23 HB2 ARG 23 -23.460 6.118 -5.700 169 HB3 ARG 23 HB1 ARG 23 -21.870 6.857 -5.892 170 HG2 ARG 23 HG2 ARG 23 -20.732 4.981 -5.165 171 HG3 ARG 23 HG1 ARG 23 -22.115 4.354 -4.295 172 HD2 ARG 23 HD2 ARG 23 -23.157 3.938 -6.613 173 HD3 ARG 23 HD1 ARG 23 -21.534 4.196 -7.265 174 HE ARG 23 HE ARG 23 -22.209 2.080 -5.356 175 HH11 ARG 23 HH11 ARG 23 -20.399 3.397 -8.035 176 HH12 ARG 23 HH12 ARG 23 -19.345 2.023 -8.179 177 HH21 ARG 23 HH21 ARG 23 -20.831 0.250 -5.561 178 HH22 ARG 23 HH22 ARG 23 -19.580 0.247 -6.763 179 H LYS 24 HN LYS 24 -24.853 8.025 -4.163 180 HA LYS 24 HA LYS 24 -26.109 6.806 -1.873 181 HB2 LYS 24 HB2 LYS 24 -26.471 9.191 -2.515 182 HB3 LYS 24 HB1 LYS 24 -27.304 8.647 -3.961 183 HG2 LYS 24 HG2 LYS 24 -29.096 9.036 -2.641 184 HG3 LYS 24 HG1 LYS 24 -28.780 7.370 -2.160 185 HD2 LYS 24 HD2 LYS 24 -27.482 8.215 -0.224 186 HD3 LYS 24 HD1 LYS 24 -27.885 9.861 -0.707 187 HE2 LYS 24 HE2 LYS 24 -30.269 9.336 -0.446 188 HE3 LYS 24 HE1 LYS 24 -29.844 7.706 0.075 189 HZ1 LYS 24 HZ1 LYS 24 -28.709 8.626 1.982 190 HZ2 LYS 24 HZ2 LYS 24 -30.307 9.195 1.942 191 HZ3 LYS 24 HZ3 LYS 24 -29.035 10.207 1.462 192 H LYS 25 HN LYS 25 -25.661 5.889 -5.025 193 HA LYS 25 HA LYS 25 -27.836 3.926 -4.781 194 HB2 LYS 25 HB2 LYS 25 -28.379 5.554 -6.555 195 HB3 LYS 25 HB1 LYS 25 -26.868 5.193 -7.362 196 HG2 LYS 25 HG2 LYS 25 -28.535 4.009 -8.504 197 HG3 LYS 25 HG1 LYS 25 -27.694 2.836 -7.505 198 HD2 LYS 25 HD2 LYS 25 -29.474 3.027 -5.812 199 HD3 LYS 25 HD1 LYS 25 -30.346 4.108 -6.906 200 HE2 LYS 25 HE2 LYS 25 -29.500 1.313 -7.624 201 HE3 LYS 25 HE1 LYS 25 -31.093 1.714 -6.973 202 HZ1 LYS 25 HZ1 LYS 25 -29.920 2.709 -9.519 203 HZ2 LYS 25 HZ2 LYS 25 -31.416 3.194 -8.888 204 HZ3 LYS 25 HZ3 LYS 25 -31.178 1.584 -9.361 205 HA PRO 26 HA PRO 26 -24.204 1.251 -4.924 206 HB2 PRO 26 HB2 PRO 26 -26.276 -0.836 -5.071 207 HB3 PRO 26 HB1 PRO 26 -24.941 -0.652 -3.937 208 HG2 PRO 26 HG2 PRO 26 -27.491 -0.182 -3.221 209 HG3 PRO 26 HG1 PRO 26 -26.141 0.756 -2.556 210 HD2 PRO 26 HD2 PRO 26 -28.122 1.511 -4.658 211 HD3 PRO 26 HD1 PRO 26 -27.377 2.509 -3.393 212 H THR 27 HN THR 27 -23.266 -0.038 -6.481 213 HA THR 27 HA THR 27 -24.099 0.341 -9.166 214 HB THR 27 HB THR 27 -21.729 0.045 -8.591 215 HG1 THR 27 HG1 THR 27 -21.559 -2.021 -10.137 216 HG21 THR 27 HG21 THR 27 -21.614 -1.502 -6.854 217 HG22 THR 27 HG22 THR 27 -20.990 -2.407 -8.236 218 HG23 THR 27 HG23 THR 27 -22.650 -2.657 -7.694 219 H VAL 28 HN VAL 28 -24.074 -1.791 -10.620 220 HA VAL 28 HA VAL 28 -26.481 -3.058 -10.449 221 HB VAL 28 HB VAL 28 -25.301 -3.193 -12.460 222 HG11 VAL 28 HG11 VAL 28 -23.033 -3.039 -11.486 223 HG12 VAL 28 HG12 VAL 28 -23.153 -4.257 -12.760 224 HG13 VAL 28 HG13 VAL 28 -23.128 -4.751 -11.067 225 HG21 VAL 28 HG21 VAL 28 -25.400 -5.934 -11.222 226 HG22 VAL 28 HG22 VAL 28 -25.208 -5.625 -12.950 227 HG23 VAL 28 HG23 VAL 28 -26.683 -5.125 -12.123 228 H GLU 29 HN GLU 29 -23.437 -4.190 -9.034 229 HA GLU 29 HA GLU 29 -24.686 -6.613 -8.058 230 HB2 GLU 29 HB2 GLU 29 -21.882 -5.559 -7.708 231 HB3 GLU 29 HB1 GLU 29 -22.437 -7.153 -7.208 232 HG2 GLU 29 HG2 GLU 29 -23.004 -7.621 -9.605 233 HG3 GLU 29 HG1 GLU 29 -22.254 -6.078 -10.016 234 H GLY 30 HN GLY 30 -24.660 -3.514 -6.996 235 HA2 GLY 30 HA2 GLY 30 -25.668 -2.737 -5.067 236 HA3 GLY 30 HA1 GLY 30 -25.611 -4.366 -4.406 237 H PHE 31 HN PHE 31 -22.802 -2.693 -5.634 238 HA PHE 31 HA PHE 31 -21.668 -2.630 -2.955 239 HB2 PHE 31 HB2 PHE 31 -20.333 -1.828 -5.555 240 HB3 PHE 31 HB1 PHE 31 -19.551 -2.181 -4.017 241 HD1 PHE 31 HD1 PHE 31 -21.237 -4.731 -3.455 242 HD2 PHE 31 HD2 PHE 31 -19.078 -3.362 -6.842 243 HE1 PHE 31 HE1 PHE 31 -20.896 -7.054 -4.177 244 HE2 PHE 31 HE2 PHE 31 -18.738 -5.671 -7.575 245 HZ PHE 31 HZ PHE 31 -19.647 -7.529 -6.240 246 H THR 32 HN THR 32 -21.214 -0.699 -1.916 247 HA THR 32 HA THR 32 -22.549 1.636 -3.118 248 HB THR 32 HB THR 32 -23.053 2.357 -0.831 249 HG1 THR 32 HG1 THR 32 -22.507 1.101 0.925 250 HG21 THR 32 HG21 THR 32 -23.850 -0.420 -1.498 251 HG22 THR 32 HG22 THR 32 -24.712 1.051 -1.911 252 HG23 THR 32 HG23 THR 32 -24.606 0.525 -0.229 253 H HIS 33 HN HIS 33 -19.641 0.640 -1.381 254 HA HIS 33 HA HIS 33 -18.779 3.450 -1.227 255 HB2 HIS 33 HB2 HIS 33 -18.194 1.020 0.425 256 HB3 HIS 33 HB1 HIS 33 -17.018 2.330 0.388 257 HD1 HIS 33 HD1 HIS 33 -20.425 1.440 1.683 258 HD2 HIS 33 HD2 HIS 33 -17.777 4.647 1.737 259 HE1 HIS 33 HE1 HIS 33 -21.268 2.988 3.474 260 HE2 HIS 33 HE2 HIS 33 -19.521 4.791 3.641 261 H ASP 34 HN ASP 34 -17.252 4.111 -2.553 262 HA ASP 34 HA ASP 34 -15.511 2.132 -3.869 263 HB2 ASP 34 HB2 ASP 34 -16.030 5.031 -4.606 264 HB3 ASP 34 HB1 ASP 34 -15.064 3.884 -5.525 265 H TRP 35 HN TRP 35 -13.324 2.252 -3.605 266 HA TRP 35 HA TRP 35 -12.236 4.555 -2.198 267 HB2 TRP 35 HB2 TRP 35 -10.991 3.095 -0.605 268 HB3 TRP 35 HB1 TRP 35 -12.723 3.159 -0.339 269 HD1 TRP 35 HD1 TRP 35 -14.022 0.878 -0.365 270 HE1 TRP 35 HE1 TRP 35 -13.285 -1.586 -0.611 271 HE3 TRP 35 HE3 TRP 35 -9.205 1.604 -1.939 272 HZ2 TRP 35 HZ2 TRP 35 -10.973 -3.018 -1.357 273 HZ3 TRP 35 HZ3 TRP 35 -7.798 -0.369 -2.392 274 HH2 TRP 35 HH2 TRP 35 -8.650 -2.623 -2.077 275 H MET 36 HN MET 36 -9.882 4.510 -2.075 276 HA MET 36 HA MET 36 -8.551 2.920 -4.140 277 HB2 MET 36 HB2 MET 36 -9.063 4.898 -5.365 278 HB3 MET 36 HB1 MET 36 -8.639 5.933 -4.008 279 HG2 MET 36 HG2 MET 36 -6.280 5.072 -4.248 280 HG3 MET 36 HG1 MET 36 -6.794 4.379 -5.789 281 HE1 MET 36 HE1 MET 36 -6.495 7.273 -3.562 282 HE2 MET 36 HE2 MET 36 -7.978 7.944 -4.257 283 HE3 MET 36 HE3 MET 36 -6.425 8.724 -4.572 284 H VAL 37 HN VAL 37 -6.555 2.286 -3.512 285 HA VAL 37 HA VAL 37 -5.528 3.387 -0.985 286 HB VAL 37 HB VAL 37 -4.028 1.206 -1.257 287 HG11 VAL 37 HG11 VAL 37 -6.843 1.222 -0.295 288 HG12 VAL 37 HG12 VAL 37 -5.451 1.748 0.633 289 HG13 VAL 37 HG13 VAL 37 -5.623 0.051 0.172 290 HG21 VAL 37 HG21 VAL 37 -4.918 0.498 -3.367 291 HG22 VAL 37 HG22 VAL 37 -6.567 0.593 -2.748 292 HG23 VAL 37 HG23 VAL 37 -5.458 -0.628 -2.122 293 H PHE 38 HN PHE 38 -3.257 3.528 -0.695 294 HA PHE 38 HA PHE 38 -1.762 4.285 -3.129 295 HB2 PHE 38 HB2 PHE 38 -2.305 5.749 -0.594 296 HB3 PHE 38 HB1 PHE 38 -0.684 5.886 -1.251 297 HD1 PHE 38 HD2 PHE 38 -4.221 6.755 -1.729 298 HD2 PHE 38 HD1 PHE 38 -0.257 7.069 -3.250 299 HE1 PHE 38 HE2 PHE 38 -4.932 8.589 -3.199 300 HE2 PHE 38 HE1 PHE 38 -0.952 8.918 -4.706 301 HZ PHE 38 HZ PHE 38 -3.313 9.680 -4.689 302 H VAL 39 HN VAL 39 0.101 3.156 -3.324 303 HA VAL 39 HA VAL 39 1.795 3.145 -0.944 304 HB VAL 39 HB VAL 39 2.877 1.013 -1.846 305 HG11 VAL 39 HG11 VAL 39 1.162 1.369 0.091 306 HG12 VAL 39 HG12 VAL 39 1.624 -0.255 -0.417 307 HG13 VAL 39 HG13 VAL 39 0.099 0.444 -0.966 308 HG21 VAL 39 HG21 VAL 39 2.040 0.650 -3.963 309 HG22 VAL 39 HG22 VAL 39 0.403 1.116 -3.502 310 HG23 VAL 39 HG23 VAL 39 1.055 -0.440 -2.988 311 H ARG 40 HN ARG 40 3.451 4.426 -1.326 312 HA ARG 40 HA ARG 40 4.975 4.352 -3.758 313 HB2 ARG 40 HB2 ARG 40 4.560 6.624 -4.506 314 HB3 ARG 40 HB1 ARG 40 3.034 5.747 -4.489 315 HG2 ARG 40 HG2 ARG 40 2.200 6.941 -2.722 316 HG3 ARG 40 HG1 ARG 40 3.796 7.303 -2.070 317 HD2 ARG 40 HD2 ARG 40 4.131 8.799 -4.097 318 HD3 ARG 40 HD1 ARG 40 2.396 8.601 -4.401 319 HE ARG 40 HE ARG 40 2.356 9.386 -1.862 320 HH11 ARG 40 HH11 ARG 40 4.173 10.669 -4.586 321 HH12 ARG 40 HH12 ARG 40 4.260 12.271 -3.908 322 HH21 ARG 40 HH21 ARG 40 2.475 11.468 -1.006 323 HH22 ARG 40 HH22 ARG 40 3.305 12.728 -1.881 324 H GLY 41 HN GLY 41 6.420 6.539 -3.696 325 HA2 GLY 41 HA2 GLY 41 7.381 6.772 -0.926 326 HA3 GLY 41 HA1 GLY 41 8.330 7.118 -2.366 327 HA PRO 42 HA PRO 42 6.003 10.901 -0.403 328 HB2 PRO 42 HB2 PRO 42 8.705 11.598 0.577 329 HB3 PRO 42 HB1 PRO 42 7.148 11.704 1.406 330 HG2 PRO 42 HG2 PRO 42 8.935 9.810 2.033 331 HG3 PRO 42 HG1 PRO 42 7.198 9.498 2.050 332 HD2 PRO 42 HD2 PRO 42 9.236 8.706 0.029 333 HD3 PRO 42 HD1 PRO 42 7.826 7.806 0.622 334 H GLU 43 HN GLU 43 6.610 13.193 -0.757 335 HA GLU 43 HA GLU 43 7.143 13.740 -3.402 336 HB2 GLU 43 HB2 GLU 43 7.129 15.359 -0.901 337 HB3 GLU 43 HB1 GLU 43 7.770 16.091 -2.364 338 HG2 GLU 43 HG2 GLU 43 5.357 16.544 -1.898 339 HG3 GLU 43 HG1 GLU 43 5.709 15.878 -3.490 340 H HIS 44 HN HIS 44 8.870 13.504 -4.531 341 HA HIS 44 HA HIS 44 10.915 13.994 -5.362 342 HB2 HIS 44 HB2 HIS 44 11.906 15.840 -4.534 343 HB3 HIS 44 HB1 HIS 44 10.777 15.786 -3.190 344 HD1 HIS 44 HD1 HIS 44 14.330 15.038 -4.108 345 HD2 HIS 44 HD2 HIS 44 11.882 15.019 -0.743 346 HE1 HIS 44 HE1 HIS 44 15.887 14.871 -2.135 347 HE2 HIS 44 HE2 HIS 44 14.397 14.978 -0.106 348 H SER 45 HN SER 45 10.314 11.928 -2.770 349 HA SER 45 HA SER 45 12.879 10.567 -3.160 350 HB2 SER 45 HB2 SER 45 11.758 8.914 -1.466 351 HB3 SER 45 HB1 SER 45 12.388 10.451 -0.882 352 HG SER 45 HG SER 45 9.695 10.073 -1.669 353 H ASN 46 HN ASN 46 13.008 9.323 -4.849 354 HA ASN 46 HA ASN 46 10.735 8.075 -6.090 355 HB2 ASN 46 HB2 ASN 46 12.467 7.031 -7.577 356 HB3 ASN 46 HB1 ASN 46 12.698 8.762 -7.457 357 HD21 ASN 46 HD21 ASN 46 13.881 5.751 -5.962 358 HD22 ASN 46 HD22 ASN 46 15.469 6.374 -5.694 359 H ILE 47 HN ILE 47 9.931 6.039 -5.646 360 HA ILE 47 HA ILE 47 11.613 4.341 -3.979 361 HB ILE 47 HB ILE 47 9.801 2.890 -3.611 362 HG12 ILE 47 HG12 ILE 47 8.093 4.624 -5.385 363 HG13 ILE 47 HG11 ILE 47 8.818 3.093 -5.889 364 HG21 ILE 47 HG21 ILE 47 9.939 4.794 -2.203 365 HG22 ILE 47 HG22 ILE 47 8.244 4.422 -2.493 366 HG23 ILE 47 HG23 ILE 47 9.012 5.768 -3.338 367 HD11 ILE 47 HD11 ILE 47 7.302 3.000 -3.383 368 HD12 ILE 47 HD12 ILE 47 7.330 1.868 -4.738 369 HD13 ILE 47 HD13 ILE 47 6.348 3.330 -4.830 370 H GLN 48 HN GLN 48 10.479 4.595 -7.253 371 HA GLN 48 HA GLN 48 10.564 1.931 -8.071 372 HB2 GLN 48 HB2 GLN 48 9.597 3.786 -9.384 373 HB3 GLN 48 HB1 GLN 48 11.206 4.429 -9.665 374 HG2 GLN 48 HG2 GLN 48 10.703 3.342 -11.639 375 HG3 GLN 48 HG1 GLN 48 11.690 2.181 -10.788 376 HE21 GLN 48 HE21 GLN 48 8.327 2.868 -10.092 377 HE22 GLN 48 HE22 GLN 48 7.724 1.323 -10.566 378 H HIS 49 HN HIS 49 13.110 3.856 -7.047 379 HA HIS 49 HA HIS 49 15.171 2.551 -8.599 380 HB2 HIS 49 HB2 HIS 49 15.101 4.679 -6.526 381 HB3 HIS 49 HB1 HIS 49 16.594 3.752 -6.648 382 HD1 HIS 49 HD1 HIS 49 16.859 3.471 -9.687 383 HD2 HIS 49 HD2 HIS 49 15.660 6.989 -7.794 384 HE1 HIS 49 HE1 HIS 49 17.387 5.328 -11.301 385 HE2 HIS 49 HE2 HIS 49 16.526 7.428 -10.199 386 H PHE 50 HN PHE 50 13.700 2.207 -5.407 387 HA PHE 50 HA PHE 50 15.470 -0.098 -4.992 388 HB2 PHE 50 HB2 PHE 50 15.198 0.214 -2.562 389 HB3 PHE 50 HB1 PHE 50 15.963 1.593 -3.348 390 HD1 PHE 50 HD1 PHE 50 12.804 0.414 -1.809 391 HD2 PHE 50 HD2 PHE 50 15.070 3.723 -3.224 392 HE1 PHE 50 HE1 PHE 50 11.247 1.937 -0.720 393 HE2 PHE 50 HE2 PHE 50 13.478 5.264 -2.148 394 HZ PHE 50 HZ PHE 50 11.562 4.371 -0.888 395 H VAL 51 HN VAL 51 12.481 0.689 -5.890 396 HA VAL 51 HA VAL 51 11.249 -1.720 -4.731 397 HB VAL 51 HB VAL 51 10.020 1.000 -5.253 398 HG11 VAL 51 HG11 VAL 51 7.972 -0.381 -4.172 399 HG12 VAL 51 HG12 VAL 51 8.736 -1.667 -5.125 400 HG13 VAL 51 HG13 VAL 51 8.199 -0.185 -5.919 401 HG21 VAL 51 HG21 VAL 51 9.290 0.643 -2.844 402 HG22 VAL 51 HG22 VAL 51 11.009 0.924 -3.117 403 HG23 VAL 51 HG23 VAL 51 10.419 -0.709 -2.810 404 H GLU 52 HN GLU 52 10.110 -3.012 -6.146 405 HA GLU 52 HA GLU 52 10.686 -2.436 -8.981 406 HB2 GLU 52 HB2 GLU 52 11.790 -4.420 -7.946 407 HB3 GLU 52 HB1 GLU 52 10.202 -5.110 -7.646 408 HG2 GLU 52 HG2 GLU 52 11.195 -6.111 -9.594 409 HG3 GLU 52 HG1 GLU 52 9.779 -5.172 -10.063 410 H LYS 53 HN LYS 53 8.333 -4.390 -7.150 411 HA LYS 53 HA LYS 53 6.198 -3.275 -8.817 412 HB2 LYS 53 HB2 LYS 53 5.164 -5.532 -8.964 413 HB3 LYS 53 HB1 LYS 53 6.711 -5.425 -9.791 414 HG2 LYS 53 HG2 LYS 53 7.810 -6.583 -8.016 415 HG3 LYS 53 HG1 LYS 53 6.356 -6.572 -7.032 416 HD2 LYS 53 HD2 LYS 53 6.668 -7.964 -9.697 417 HD3 LYS 53 HD1 LYS 53 6.792 -8.755 -8.129 418 HE2 LYS 53 HE2 LYS 53 4.488 -8.274 -7.640 419 HE3 LYS 53 HE1 LYS 53 4.363 -7.273 -9.087 420 HZ1 LYS 53 HZ1 LYS 53 4.825 -10.208 -9.007 421 HZ2 LYS 53 HZ2 LYS 53 4.776 -9.272 -10.418 422 HZ3 LYS 53 HZ3 LYS 53 3.385 -9.439 -9.469 423 H VAL 54 HN VAL 54 4.007 -4.144 -7.826 424 HA VAL 54 HA VAL 54 4.093 -4.089 -4.916 425 HB VAL 54 HB VAL 54 3.181 -1.842 -6.633 426 HG11 VAL 54 HG11 VAL 54 2.020 -1.778 -3.963 427 HG12 VAL 54 HG12 VAL 54 1.288 -2.983 -5.019 428 HG13 VAL 54 HG13 VAL 54 1.326 -1.288 -5.507 429 HG21 VAL 54 HG21 VAL 54 3.856 -0.823 -4.263 430 HG22 VAL 54 HG22 VAL 54 5.027 -1.183 -5.522 431 HG23 VAL 54 HG23 VAL 54 4.771 -2.322 -4.200 432 H VAL 55 HN VAL 55 2.048 -4.686 -3.952 433 HA VAL 55 HA VAL 55 0.035 -5.732 -5.771 434 HB VAL 55 HB VAL 55 2.074 -7.401 -4.887 435 HG11 VAL 55 HG11 VAL 55 -0.448 -7.954 -3.347 436 HG12 VAL 55 HG12 VAL 55 1.150 -7.591 -2.682 437 HG13 VAL 55 HG13 VAL 55 0.878 -9.104 -3.548 438 HG21 VAL 55 HG21 VAL 55 -0.638 -8.206 -5.905 439 HG22 VAL 55 HG22 VAL 55 0.857 -9.135 -6.012 440 HG23 VAL 55 HG23 VAL 55 0.695 -7.623 -6.903 441 H PHE 56 HN PHE 56 -1.933 -6.170 -4.760 442 HA PHE 56 HA PHE 56 -2.141 -5.334 -1.947 443 HB2 PHE 56 HB2 PHE 56 -3.799 -4.491 -4.324 444 HB3 PHE 56 HB1 PHE 56 -4.476 -4.469 -2.695 445 HD1 PHE 56 HD1 PHE 56 -1.658 -3.168 -4.740 446 HD2 PHE 56 HD2 PHE 56 -4.142 -2.639 -1.324 447 HE1 PHE 56 HE1 PHE 56 -0.696 -0.937 -4.397 448 HE2 PHE 56 HE2 PHE 56 -3.184 -0.397 -0.977 449 HZ PHE 56 HZ PHE 56 -1.448 0.452 -2.511 450 H HIS 57 HN HIS 57 -2.894 -7.004 -0.772 451 HA HIS 57 HA HIS 57 -4.473 -9.074 -2.141 452 HB2 HIS 57 HB2 HIS 57 -3.389 -9.109 0.696 453 HB3 HIS 57 HB1 HIS 57 -4.126 -10.457 -0.164 454 HD1 HIS 57 HD1 HIS 57 -2.562 -12.011 -1.290 455 HD2 HIS 57 HD2 HIS 57 -0.793 -8.321 -0.532 456 HE1 HIS 57 HE1 HIS 57 -0.122 -12.294 -1.840 457 HE2 HIS 57 HE2 HIS 57 0.960 -10.109 -1.191 458 H LEU 58 HN LEU 58 -6.317 -7.709 -2.347 459 HA LEU 58 HA LEU 58 -7.528 -6.414 -0.149 460 HB2 LEU 58 HB2 LEU 58 -9.058 -7.355 -2.560 461 HB3 LEU 58 HB1 LEU 58 -9.359 -5.945 -1.556 462 HG LEU 58 HG LEU 58 -7.166 -6.308 -3.592 463 HD11 LEU 58 HD11 LEU 58 -8.826 -5.598 -4.876 464 HD12 LEU 58 HD12 LEU 58 -8.394 -4.019 -4.219 465 HD13 LEU 58 HD13 LEU 58 -9.742 -4.924 -3.529 466 HD21 LEU 58 HD21 LEU 58 -7.546 -4.103 -1.587 467 HD22 LEU 58 HD22 LEU 58 -6.548 -3.959 -3.033 468 HD23 LEU 58 HD23 LEU 58 -6.141 -5.147 -1.796 469 H HIS 59 HN HIS 59 -10.094 -7.062 0.087 470 HA HIS 59 HA HIS 59 -9.955 -9.459 1.678 471 HB2 HIS 59 HB2 HIS 59 -11.321 -7.220 2.023 472 HB3 HIS 59 HB1 HIS 59 -12.523 -8.048 1.042 473 HD1 HIS 59 HD1 HIS 59 -10.584 -8.590 4.282 474 HD2 HIS 59 HD2 HIS 59 -14.159 -9.684 2.448 475 HE1 HIS 59 HE1 HIS 59 -11.893 -9.841 6.025 476 HE2 HIS 59 HE2 HIS 59 -13.971 -10.640 4.844 477 H GLU 60 HN GLU 60 -10.941 -11.402 1.293 478 HA GLU 60 HA GLU 60 -10.864 -12.296 -1.359 479 HB2 GLU 60 HB2 GLU 60 -12.133 -13.601 1.042 480 HB3 GLU 60 HB1 GLU 60 -11.796 -14.411 -0.482 481 HG2 GLU 60 HG2 GLU 60 -9.386 -13.872 -0.151 482 HG3 GLU 60 HG1 GLU 60 -9.799 -13.266 1.453 483 H SER 61 HN SER 61 -13.509 -11.030 0.466 484 HA SER 61 HA SER 61 -15.670 -11.909 -1.072 485 HB2 SER 61 HB2 SER 61 -15.818 -10.681 1.106 486 HB3 SER 61 HB1 SER 61 -15.368 -9.203 0.257 487 HG SER 61 HG SER 61 -17.615 -10.797 -0.444 488 H PHE 62 HN PHE 62 -13.100 -9.831 -1.876 489 HA PHE 62 HA PHE 62 -14.487 -8.547 -4.092 490 HB2 PHE 62 HB2 PHE 62 -11.642 -8.351 -3.066 491 HB3 PHE 62 HB1 PHE 62 -12.246 -7.470 -4.458 492 HD1 PHE 62 HD1 PHE 62 -13.385 -8.066 -0.943 493 HD2 PHE 62 HD2 PHE 62 -12.649 -5.264 -4.050 494 HE1 PHE 62 HE1 PHE 62 -14.122 -6.240 0.535 495 HE2 PHE 62 HE2 PHE 62 -13.391 -3.433 -2.585 496 HZ PHE 62 HZ PHE 62 -14.127 -3.921 -0.287 497 HA PRO 63 HA PRO 63 -13.273 -11.805 -6.882 498 HB2 PRO 63 HB2 PRO 63 -13.654 -9.833 -9.028 499 HB3 PRO 63 HB1 PRO 63 -14.540 -11.328 -8.713 500 HG2 PRO 63 HG2 PRO 63 -15.653 -8.915 -8.320 501 HG3 PRO 63 HG1 PRO 63 -16.028 -10.301 -7.279 502 HD2 PRO 63 HD2 PRO 63 -14.174 -7.999 -6.773 503 HD3 PRO 63 HD1 PRO 63 -15.335 -8.772 -5.671 504 H ARG 64 HN ARG 64 -11.214 -12.360 -7.138 505 HA ARG 64 HA ARG 64 -8.975 -12.293 -7.523 506 HB2 ARG 64 HB2 ARG 64 -9.909 -10.315 -9.604 507 HB3 ARG 64 HB1 ARG 64 -8.238 -10.846 -9.471 508 HG2 ARG 64 HG2 ARG 64 -8.859 -13.112 -9.949 509 HG3 ARG 64 HG1 ARG 64 -10.571 -12.693 -9.913 510 HD2 ARG 64 HD2 ARG 64 -9.702 -12.902 -12.187 511 HD3 ARG 64 HD1 ARG 64 -10.316 -11.287 -11.846 512 HE ARG 64 HE ARG 64 -7.515 -11.455 -11.352 513 HH11 ARG 64 HH11 ARG 64 -9.860 -11.248 -13.940 514 HH12 ARG 64 HH12 ARG 64 -8.795 -10.390 -15.012 515 HH21 ARG 64 HH21 ARG 64 -6.101 -10.345 -12.762 516 HH22 ARG 64 HH22 ARG 64 -6.652 -9.872 -14.341 517 HA PRO 65 HA PRO 65 -9.066 -8.449 -4.919 518 HB2 PRO 65 HB2 PRO 65 -7.926 -9.509 -2.681 519 HB3 PRO 65 HB1 PRO 65 -9.657 -9.577 -3.026 520 HG2 PRO 65 HG2 PRO 65 -7.566 -11.674 -3.376 521 HG3 PRO 65 HG1 PRO 65 -9.242 -11.836 -2.821 522 HD2 PRO 65 HD2 PRO 65 -8.430 -12.454 -5.349 523 HD3 PRO 65 HD1 PRO 65 -10.066 -11.906 -4.957 524 H LYS 66 HN LYS 66 -6.418 -10.647 -5.545 525 HA LYS 66 HA LYS 66 -4.411 -8.835 -4.656 526 HB2 LYS 66 HB2 LYS 66 -3.944 -11.219 -4.669 527 HB3 LYS 66 HB1 LYS 66 -4.161 -11.271 -6.413 528 HG2 LYS 66 HG2 LYS 66 -2.213 -9.908 -6.763 529 HG3 LYS 66 HG1 LYS 66 -2.055 -9.629 -5.029 530 HD2 LYS 66 HD2 LYS 66 -1.256 -11.723 -4.615 531 HD3 LYS 66 HD1 LYS 66 -2.051 -12.437 -6.020 532 HE2 LYS 66 HE2 LYS 66 -0.435 -11.362 -7.486 533 HE3 LYS 66 HE1 LYS 66 0.323 -10.576 -6.101 534 HZ1 LYS 66 HZ1 LYS 66 0.161 -13.515 -6.501 535 HZ2 LYS 66 HZ2 LYS 66 0.969 -12.714 -5.245 536 HZ3 LYS 66 HZ3 LYS 66 1.524 -12.564 -6.843 537 H ARG 67 HN ARG 67 -4.494 -6.929 -5.594 538 HA ARG 67 HA ARG 67 -4.444 -6.777 -8.518 539 HB2 ARG 67 HB2 ARG 67 -4.506 -4.451 -6.583 540 HB3 ARG 67 HB1 ARG 67 -4.924 -4.452 -8.295 541 HG2 ARG 67 HG2 ARG 67 -6.455 -5.674 -6.027 542 HG3 ARG 67 HG1 ARG 67 -6.936 -4.320 -7.054 543 HD2 ARG 67 HD2 ARG 67 -6.634 -6.098 -8.970 544 HD3 ARG 67 HD1 ARG 67 -6.889 -7.246 -7.647 545 HE ARG 67 HE ARG 67 -8.912 -5.383 -7.442 546 HH11 ARG 67 HH11 ARG 67 -7.809 -7.678 -9.845 547 HH12 ARG 67 HH12 ARG 67 -9.384 -7.871 -10.562 548 HH21 ARG 67 HH21 ARG 67 -10.970 -5.608 -8.392 549 HH22 ARG 67 HH22 ARG 67 -11.181 -6.706 -9.725 550 H VAL 68 HN VAL 68 -2.618 -6.139 -9.606 551 HA VAL 68 HA VAL 68 -0.276 -5.642 -7.897 552 HB VAL 68 HB VAL 68 1.087 -6.933 -9.213 553 HG11 VAL 68 HG11 VAL 68 -0.567 -8.392 -8.161 554 HG12 VAL 68 HG12 VAL 68 -0.037 -9.045 -9.716 555 HG13 VAL 68 HG13 VAL 68 -1.602 -8.244 -9.588 556 HG21 VAL 68 HG21 VAL 68 0.732 -5.838 -11.316 557 HG22 VAL 68 HG22 VAL 68 -0.856 -6.595 -11.489 558 HG23 VAL 68 HG23 VAL 68 0.605 -7.586 -11.548 559 H CYS 69 HN CYS 69 1.121 -4.021 -8.402 560 HA CYS 69 HA CYS 69 0.554 -2.421 -10.798 561 HB2 CYS 69 HB2 CYS 69 1.114 -1.336 -8.020 562 HB3 CYS 69 HB1 CYS 69 0.974 -0.364 -9.482 563 HG CYS 69 HG CYS 69 -1.707 -2.221 -9.196 564 H LYS 70 HN LYS 70 2.290 -2.416 -12.034 565 HA LYS 70 HA LYS 70 4.919 -2.924 -10.784 566 HB2 LYS 70 HB2 LYS 70 4.547 -3.172 -13.727 567 HB3 LYS 70 HB1 LYS 70 5.531 -4.136 -12.637 568 HG2 LYS 70 HG2 LYS 70 3.936 -5.677 -13.177 569 HG3 LYS 70 HG1 LYS 70 3.169 -4.931 -11.775 570 HD2 LYS 70 HD2 LYS 70 1.679 -3.707 -13.077 571 HD3 LYS 70 HD1 LYS 70 2.656 -3.884 -14.531 572 HE2 LYS 70 HE2 LYS 70 1.300 -6.201 -13.176 573 HE3 LYS 70 HE1 LYS 70 0.534 -5.248 -14.445 574 HZ1 LYS 70 HZ1 LYS 70 3.085 -6.755 -14.723 575 HZ2 LYS 70 HZ2 LYS 70 2.330 -5.850 -15.941 576 HZ3 LYS 70 HZ3 LYS 70 1.576 -7.242 -15.331 577 H ASP 71 HN ASP 71 3.180 -0.425 -11.677 578 HA ASP 71 HA ASP 71 5.272 0.969 -13.197 579 HB2 ASP 71 HB2 ASP 71 2.266 1.265 -13.153 580 HB3 ASP 71 HB1 ASP 71 3.310 2.475 -13.884 581 HA PRO 72 HA PRO 72 5.580 4.514 -10.266 582 HB2 PRO 72 HB2 PRO 72 3.978 5.858 -12.435 583 HB3 PRO 72 HB1 PRO 72 5.286 6.526 -11.448 584 HG2 PRO 72 HG2 PRO 72 5.851 5.682 -13.864 585 HG3 PRO 72 HG1 PRO 72 6.923 5.219 -12.521 586 HD2 PRO 72 HD2 PRO 72 4.920 3.588 -13.994 587 HD3 PRO 72 HD1 PRO 72 6.463 3.100 -13.271 588 HA PRO 73 HA PRO 73 2.738 5.729 -7.355 589 HB2 PRO 73 HB2 PRO 73 0.637 6.764 -9.219 590 HB3 PRO 73 HB1 PRO 73 1.052 7.315 -7.590 591 HG2 PRO 73 HG2 PRO 73 2.029 8.457 -9.900 592 HG3 PRO 73 HG1 PRO 73 2.842 8.536 -8.330 593 HD2 PRO 73 HD2 PRO 73 3.750 7.228 -10.689 594 HD3 PRO 73 HD1 PRO 73 4.512 7.211 -9.088 595 H TYR 74 HN TYR 74 2.188 3.872 -6.571 596 HA TYR 74 HA TYR 74 0.590 1.966 -8.056 597 HB2 TYR 74 HB2 TYR 74 1.782 1.644 -5.301 598 HB3 TYR 74 HB1 TYR 74 1.321 0.364 -6.411 599 HD1 TYR 74 HD2 TYR 74 3.699 3.220 -6.083 600 HD2 TYR 74 HD1 TYR 74 2.972 -0.622 -7.738 601 HE1 TYR 74 HE2 TYR 74 6.017 3.122 -6.854 602 HE2 TYR 74 HE1 TYR 74 5.306 -0.729 -8.521 603 HH TYR 74 HH TYR 74 7.166 0.559 -8.926 604 H LYS 75 HN LYS 75 -1.486 1.527 -7.641 605 HA LYS 75 HA LYS 75 -2.754 2.231 -5.135 606 HB2 LYS 75 HB2 LYS 75 -4.464 3.685 -6.384 607 HB3 LYS 75 HB1 LYS 75 -2.910 4.409 -6.008 608 HG2 LYS 75 HG2 LYS 75 -2.210 4.372 -8.210 609 HG3 LYS 75 HG1 LYS 75 -3.363 3.124 -8.669 610 HD2 LYS 75 HD2 LYS 75 -4.123 5.186 -9.588 611 HD3 LYS 75 HD1 LYS 75 -5.193 4.809 -8.249 612 HE2 LYS 75 HE2 LYS 75 -3.942 6.339 -6.840 613 HE3 LYS 75 HE1 LYS 75 -2.861 6.715 -8.173 614 HZ1 LYS 75 HZ1 LYS 75 -4.508 8.427 -7.989 615 HZ2 LYS 75 HZ2 LYS 75 -5.769 7.296 -8.025 616 HZ3 LYS 75 HZ3 LYS 75 -4.816 7.542 -9.405 617 H VAL 76 HN VAL 76 -4.763 1.369 -4.898 618 HA VAL 76 HA VAL 76 -5.793 -0.242 -7.140 619 HB VAL 76 HB VAL 76 -5.727 -0.943 -4.225 620 HG11 VAL 76 HG11 VAL 76 -8.074 -1.025 -5.169 621 HG12 VAL 76 HG12 VAL 76 -7.456 -2.524 -4.473 622 HG13 VAL 76 HG13 VAL 76 -7.501 -2.316 -6.225 623 HG21 VAL 76 HG21 VAL 76 -3.954 -1.879 -5.523 624 HG22 VAL 76 HG22 VAL 76 -5.066 -2.379 -6.786 625 HG23 VAL 76 HG23 VAL 76 -5.111 -3.163 -5.208 626 H GLU 77 HN GLU 77 -7.717 0.324 -7.838 627 HA GLU 77 HA GLU 77 -9.433 1.920 -6.061 628 HB2 GLU 77 HB2 GLU 77 -9.307 1.876 -9.076 629 HB3 GLU 77 HB1 GLU 77 -10.481 2.767 -8.141 630 HG2 GLU 77 HG2 GLU 77 -8.873 4.186 -7.229 631 HG3 GLU 77 HG1 GLU 77 -7.579 3.151 -7.788 632 H GLU 78 HN GLU 78 -11.129 0.975 -5.341 633 HA GLU 78 HA GLU 78 -12.364 -1.193 -6.866 634 HB2 GLU 78 HB2 GLU 78 -10.833 -1.523 -4.383 635 HB3 GLU 78 HB1 GLU 78 -12.444 -2.222 -4.310 636 HG2 GLU 78 HG2 GLU 78 -10.204 -2.901 -6.195 637 HG3 GLU 78 HG1 GLU 78 -11.002 -3.929 -5.008 638 H SER 79 HN SER 79 -14.231 -2.098 -5.405 639 HA SER 79 HA SER 79 -15.642 0.047 -4.051 640 HB2 SER 79 HB2 SER 79 -16.086 0.296 -6.519 641 HB3 SER 79 HB1 SER 79 -16.862 -1.291 -6.474 642 HG SER 79 HG SER 79 -17.747 1.162 -5.566 643 H GLY 80 HN GLY 80 -17.300 -0.683 -2.739 644 HA2 GLY 80 HA2 GLY 80 -18.155 -3.395 -2.614 645 HA3 GLY 80 HA1 GLY 80 -16.870 -3.091 -1.449 646 H TYR 81 HN TYR 81 -18.317 -3.406 0.329 647 HA TYR 81 HA TYR 81 -19.777 -0.961 0.922 648 HB2 TYR 81 HB2 TYR 81 -21.802 -2.233 1.687 649 HB3 TYR 81 HB1 TYR 81 -21.551 -2.221 -0.055 650 HD1 TYR 81 HD2 TYR 81 -21.502 -4.308 2.968 651 HD2 TYR 81 HD1 TYR 81 -21.008 -4.244 -1.257 652 HE1 TYR 81 HE2 TYR 81 -21.636 -6.763 2.920 653 HE2 TYR 81 HE1 TYR 81 -21.145 -6.698 -1.311 654 HH TYR 81 HH TYR 81 -22.264 -8.537 1.253 655 H ALA 82 HN ALA 82 -17.359 -2.337 1.950 656 HA ALA 82 HA ALA 82 -17.871 -1.783 4.686 657 HB1 ALA 82 HB1 ALA 82 -18.786 -3.917 4.935 658 HB2 ALA 82 HB2 ALA 82 -17.115 -4.111 5.465 659 HB3 ALA 82 HB3 ALA 82 -17.598 -4.652 3.858 660 H GLY 83 HN GLY 83 -15.942 -1.929 6.022 661 HA2 GLY 83 HA2 GLY 83 -13.500 -1.664 4.407 662 HA3 GLY 83 HA1 GLY 83 -13.749 -0.991 6.013 663 H PHE 84 HN PHE 84 -11.470 -2.209 5.834 664 HA PHE 84 HA PHE 84 -11.464 -4.455 7.502 665 HB2 PHE 84 HB2 PHE 84 -10.801 -6.222 5.873 666 HB3 PHE 84 HB1 PHE 84 -12.456 -5.680 5.644 667 HD1 PHE 84 HD1 PHE 84 -12.920 -4.013 3.777 668 HD2 PHE 84 HD2 PHE 84 -9.271 -6.179 4.095 669 HE1 PHE 84 HE1 PHE 84 -12.462 -3.572 1.407 670 HE2 PHE 84 HE2 PHE 84 -8.793 -5.738 1.733 671 HZ PHE 84 HZ PHE 84 -10.383 -4.435 0.372 672 H ILE 85 HN ILE 85 -9.285 -5.211 7.937 673 HA ILE 85 HA ILE 85 -7.159 -3.439 7.317 674 HB ILE 85 HB ILE 85 -7.211 -6.245 8.416 675 HG12 ILE 85 HG12 ILE 85 -7.861 -4.399 9.914 676 HG13 ILE 85 HG11 ILE 85 -6.373 -5.181 10.434 677 HG21 ILE 85 HG21 ILE 85 -4.737 -4.609 7.854 678 HG22 ILE 85 HG22 ILE 85 -5.197 -6.121 7.069 679 HG23 ILE 85 HG23 ILE 85 -4.786 -6.107 8.784 680 HD11 ILE 85 HD11 ILE 85 -6.422 -2.637 8.848 681 HD12 ILE 85 HD12 ILE 85 -5.050 -3.373 9.673 682 HD13 ILE 85 HD13 ILE 85 -6.382 -2.696 10.608 683 H LEU 86 HN LEU 86 -5.964 -3.282 5.513 684 HA LEU 86 HA LEU 86 -6.182 -5.498 3.587 685 HB2 LEU 86 HB2 LEU 86 -7.055 -3.043 3.110 686 HB3 LEU 86 HB1 LEU 86 -5.358 -2.763 2.755 687 HG LEU 86 HG LEU 86 -6.647 -5.101 1.455 688 HD11 LEU 86 HD11 LEU 86 -6.977 -2.344 0.313 689 HD12 LEU 86 HD12 LEU 86 -8.227 -3.120 1.286 690 HD13 LEU 86 HD13 LEU 86 -7.701 -3.859 -0.225 691 HD21 LEU 86 HD21 LEU 86 -5.137 -3.366 -0.201 692 HD22 LEU 86 HD22 LEU 86 -4.799 -5.035 0.249 693 HD23 LEU 86 HD23 LEU 86 -4.229 -3.708 1.266 694 HA PRO 87 HA PRO 87 -1.796 -5.912 4.562 695 HB2 PRO 87 HB2 PRO 87 -1.621 -8.264 3.138 696 HB3 PRO 87 HB1 PRO 87 -2.077 -8.165 4.840 697 HG2 PRO 87 HG2 PRO 87 -3.816 -8.420 2.421 698 HG3 PRO 87 HG1 PRO 87 -3.967 -9.215 4.000 699 HD2 PRO 87 HD2 PRO 87 -5.496 -7.105 3.334 700 HD3 PRO 87 HD1 PRO 87 -4.913 -7.353 4.991 701 H ILE 88 HN ILE 88 -0.943 -4.287 3.273 702 HA ILE 88 HA ILE 88 -0.897 -4.716 0.388 703 HB ILE 88 HB ILE 88 0.139 -2.278 1.848 704 HG12 ILE 88 HG12 ILE 88 -2.559 -2.442 0.511 705 HG13 ILE 88 HG11 ILE 88 -2.381 -2.930 2.197 706 HG21 ILE 88 HG21 ILE 88 0.883 -2.686 -0.475 707 HG22 ILE 88 HG22 ILE 88 -0.101 -1.228 -0.317 708 HG23 ILE 88 HG23 ILE 88 -0.806 -2.699 -0.986 709 HD11 ILE 88 HD11 ILE 88 -1.662 -0.225 1.105 710 HD12 ILE 88 HD12 ILE 88 -1.627 -0.724 2.790 711 HD13 ILE 88 HD13 ILE 88 -3.163 -0.621 1.931 712 H GLU 89 HN GLU 89 1.027 -4.904 -0.741 713 HA GLU 89 HA GLU 89 3.440 -5.205 0.901 714 HB2 GLU 89 HB2 GLU 89 2.520 -7.102 -1.260 715 HB3 GLU 89 HB1 GLU 89 4.078 -7.169 -0.442 716 HG2 GLU 89 HG2 GLU 89 2.995 -7.628 1.660 717 HG3 GLU 89 HG1 GLU 89 1.412 -7.437 0.919 718 H VAL 90 HN VAL 90 5.148 -4.205 0.140 719 HA VAL 90 HA VAL 90 5.117 -3.302 -2.659 720 HB VAL 90 HB VAL 90 6.821 -2.137 -0.472 721 HG11 VAL 90 HG11 VAL 90 7.341 -0.486 -2.074 722 HG12 VAL 90 HG12 VAL 90 6.114 -1.062 -3.180 723 HG13 VAL 90 HG13 VAL 90 7.553 -2.032 -2.869 724 HG21 VAL 90 HG21 VAL 90 4.274 -1.852 -0.251 725 HG22 VAL 90 HG22 VAL 90 4.404 -0.837 -1.686 726 HG23 VAL 90 HG23 VAL 90 5.271 -0.399 -0.214 727 H TYR 91 HN TYR 91 6.522 -4.233 -3.996 728 HA TYR 91 HA TYR 91 8.405 -6.140 -2.857 729 HB2 TYR 91 HB2 TYR 91 7.477 -5.552 -5.629 730 HB3 TYR 91 HB1 TYR 91 8.968 -6.451 -5.392 731 HD1 TYR 91 HD1 TYR 91 5.631 -6.535 -3.712 732 HD2 TYR 91 HD2 TYR 91 8.631 -8.688 -5.809 733 HE1 TYR 91 HE1 TYR 91 4.338 -8.600 -3.442 734 HE2 TYR 91 HE2 TYR 91 7.340 -10.767 -5.539 735 HH TYR 91 HH TYR 91 5.623 -11.664 -3.957 736 H PHE 92 HN PHE 92 10.476 -5.927 -2.685 737 HA PHE 92 HA PHE 92 11.661 -3.343 -3.404 738 HB2 PHE 92 HB2 PHE 92 12.400 -5.474 -1.375 739 HB3 PHE 92 HB1 PHE 92 13.437 -4.093 -1.737 740 HD1 PHE 92 HD1 PHE 92 11.149 -2.055 -2.009 741 HD2 PHE 92 HD2 PHE 92 12.013 -5.021 0.918 742 HE1 PHE 92 HE1 PHE 92 10.026 -0.696 -0.309 743 HE2 PHE 92 HE2 PHE 92 10.856 -3.659 2.624 744 HZ PHE 92 HZ PHE 92 9.886 -1.489 2.005 745 H LYS 93 HN LYS 93 13.969 -3.446 -4.140 746 HA LYS 93 HA LYS 93 14.328 -5.709 -5.983 747 HB2 LYS 93 HB2 LYS 93 15.744 -3.037 -5.866 748 HB3 LYS 93 HB1 LYS 93 15.994 -4.275 -7.092 749 HG2 LYS 93 HG2 LYS 93 13.788 -3.968 -7.946 750 HG3 LYS 93 HG1 LYS 93 13.371 -2.890 -6.611 751 HD2 LYS 93 HD2 LYS 93 14.896 -1.219 -7.385 752 HD3 LYS 93 HD1 LYS 93 15.610 -2.324 -8.564 753 HE2 LYS 93 HE2 LYS 93 13.189 -2.419 -9.528 754 HE3 LYS 93 HE1 LYS 93 12.950 -0.925 -8.621 755 HZ1 LYS 93 HZ1 LYS 93 13.647 -0.630 -10.970 756 HZ2 LYS 93 HZ2 LYS 93 15.153 -1.295 -10.566 757 HZ3 LYS 93 HZ3 LYS 93 14.639 0.146 -9.839 758 H ASN 94 HN ASN 94 15.289 -7.311 -4.701 759 HA ASN 94 HA ASN 94 17.970 -6.748 -3.722 760 HB2 ASN 94 HB2 ASN 94 15.884 -6.461 -1.984 761 HB3 ASN 94 HB1 ASN 94 16.335 -8.137 -1.716 762 HD21 ASN 94 HD21 ASN 94 17.074 -7.698 0.363 763 HD22 ASN 94 HD22 ASN 94 18.563 -6.858 0.639 764 H LYS 95 HN LYS 95 19.193 -8.636 -3.269 765 HA LYS 95 HA LYS 95 18.006 -11.161 -4.235 766 HB2 LYS 95 HB2 LYS 95 20.884 -10.284 -4.111 767 HB3 LYS 95 HB1 LYS 95 20.353 -11.880 -4.610 768 HG2 LYS 95 HG2 LYS 95 19.135 -10.853 -6.488 769 HG3 LYS 95 HG1 LYS 95 19.749 -9.274 -5.997 770 HD2 LYS 95 HD2 LYS 95 21.246 -9.889 -7.651 771 HD3 LYS 95 HD1 LYS 95 22.078 -10.401 -6.185 772 HE2 LYS 95 HE2 LYS 95 20.477 -12.163 -8.043 773 HE3 LYS 95 HE1 LYS 95 22.231 -12.106 -7.919 774 HZ1 LYS 95 HZ1 LYS 95 22.010 -12.866 -5.596 775 HZ2 LYS 95 HZ2 LYS 95 21.415 -13.988 -6.718 776 HZ3 LYS 95 HZ3 LYS 95 20.341 -13.034 -5.826 777 H GLU 96 HN GLU 96 19.284 -9.447 -1.657 778 HA GLU 96 HA GLU 96 19.795 -11.801 -0.002 779 HB2 GLU 96 HB2 GLU 96 20.654 -9.860 1.598 780 HB3 GLU 96 HB1 GLU 96 21.676 -10.432 0.288 781 HG2 GLU 96 HG2 GLU 96 19.851 -8.081 -0.043 782 HG3 GLU 96 HG1 GLU 96 21.468 -7.924 0.643 783 H GLU 97 HN GLU 97 19.406 -10.111 2.410 784 HA GLU 97 HA GLU 97 17.159 -10.888 3.540 785 HB2 GLU 97 HB2 GLU 97 18.395 -8.152 3.690 786 HB3 GLU 97 HB1 GLU 97 17.072 -8.650 4.740 787 HG2 GLU 97 HG2 GLU 97 19.766 -9.983 4.538 788 HG3 GLU 97 HG1 GLU 97 19.239 -8.903 5.831 789 HA PRO 98 HA PRO 98 13.131 -10.130 2.609 790 HB2 PRO 98 HB2 PRO 98 13.011 -7.392 3.776 791 HB3 PRO 98 HB1 PRO 98 11.913 -8.762 3.984 792 HG2 PRO 98 HG2 PRO 98 13.977 -7.991 5.698 793 HG3 PRO 98 HG1 PRO 98 13.087 -9.514 5.762 794 HD2 PRO 98 HD2 PRO 98 15.834 -9.209 5.192 795 HD3 PRO 98 HD1 PRO 98 14.855 -10.668 4.922 796 H ARG 99 HN ARG 99 12.464 -9.846 0.678 797 HA ARG 99 HA ARG 99 13.449 -7.577 -0.889 798 HB2 ARG 99 HB2 ARG 99 12.287 -10.211 -1.768 799 HB3 ARG 99 HB1 ARG 99 12.925 -8.969 -2.839 800 HG2 ARG 99 HG2 ARG 99 15.111 -9.273 -2.142 801 HG3 ARG 99 HG1 ARG 99 14.622 -10.088 -0.663 802 HD2 ARG 99 HD2 ARG 99 15.649 -11.575 -2.384 803 HD3 ARG 99 HD1 ARG 99 14.055 -12.091 -1.904 804 HE ARG 99 HE ARG 99 14.194 -10.398 -4.262 805 HH11 ARG 99 HH11 ARG 99 13.990 -13.646 -2.971 806 HH12 ARG 99 HH12 ARG 99 13.453 -14.343 -4.472 807 HH21 ARG 99 HH21 ARG 99 13.477 -11.291 -6.221 808 HH22 ARG 99 HH22 ARG 99 13.173 -13.004 -6.337 809 H LYS 100 HN LYS 100 11.024 -8.071 0.993 810 HA LYS 100 HA LYS 100 9.278 -6.305 -0.431 811 HB2 LYS 100 HB2 LYS 100 7.268 -7.838 -0.165 812 HB3 LYS 100 HB1 LYS 100 8.382 -8.207 -1.470 813 HG2 LYS 100 HG2 LYS 100 9.400 -9.973 -0.116 814 HG3 LYS 100 HG1 LYS 100 8.274 -9.607 1.204 815 HD2 LYS 100 HD2 LYS 100 7.533 -10.556 -1.582 816 HD3 LYS 100 HD1 LYS 100 7.496 -11.527 -0.115 817 HE2 LYS 100 HE2 LYS 100 5.736 -10.059 0.813 818 HE3 LYS 100 HE1 LYS 100 5.728 -9.100 -0.688 819 HZ1 LYS 100 HZ1 LYS 100 4.889 -11.920 -0.318 820 HZ2 LYS 100 HZ2 LYS 100 5.217 -11.272 -1.845 821 HZ3 LYS 100 HZ3 LYS 100 3.978 -10.609 -0.897 822 H VAL 101 HN VAL 101 7.714 -5.367 0.848 823 HA VAL 101 HA VAL 101 7.948 -5.937 3.726 824 HB VAL 101 HB VAL 101 9.084 -3.838 3.076 825 HG11 VAL 101 HG11 VAL 101 7.930 -3.034 1.205 826 HG12 VAL 101 HG12 VAL 101 7.532 -1.890 2.497 827 HG13 VAL 101 HG13 VAL 101 6.367 -3.129 2.028 828 HG21 VAL 101 HG21 VAL 101 8.044 -2.415 4.760 829 HG22 VAL 101 HG22 VAL 101 8.159 -4.086 5.309 830 HG23 VAL 101 HG23 VAL 101 6.613 -3.445 4.752 831 H ARG 102 HN ARG 102 6.049 -5.767 4.948 832 HA ARG 102 HA ARG 102 3.590 -5.660 3.341 833 HB2 ARG 102 HB2 ARG 102 4.116 -7.853 4.418 834 HB3 ARG 102 HB1 ARG 102 4.015 -7.054 5.982 835 HG2 ARG 102 HG2 ARG 102 1.691 -6.438 5.540 836 HG3 ARG 102 HG1 ARG 102 1.753 -7.274 3.991 837 HD2 ARG 102 HD2 ARG 102 0.735 -8.770 5.504 838 HD3 ARG 102 HD1 ARG 102 2.389 -9.347 5.304 839 HE ARG 102 HE ARG 102 2.496 -7.691 7.483 840 HH11 ARG 102 HH11 ARG 102 0.644 -10.533 6.608 841 HH12 ARG 102 HH12 ARG 102 0.436 -11.059 8.257 842 HH21 ARG 102 HH21 ARG 102 2.238 -8.369 9.631 843 HH22 ARG 102 HH22 ARG 102 1.337 -9.817 9.985 844 H PHE 103 HN PHE 103 2.323 -3.987 3.702 845 HA PHE 103 HA PHE 103 2.425 -2.725 6.355 846 HB2 PHE 103 HB2 PHE 103 1.698 -1.518 3.682 847 HB3 PHE 103 HB1 PHE 103 1.631 -0.670 5.221 848 HD1 PHE 103 HD1 PHE 103 4.142 -1.594 6.481 849 HD2 PHE 103 HD2 PHE 103 3.319 -0.401 2.484 850 HE1 PHE 103 HE1 PHE 103 6.479 -0.879 6.220 851 HE2 PHE 103 HE2 PHE 103 5.661 0.301 2.209 852 HZ PHE 103 HZ PHE 103 7.246 0.063 4.079 853 H ASP 104 HN ASP 104 0.847 -3.845 7.381 854 HA ASP 104 HA ASP 104 -1.707 -4.427 6.278 855 HB2 ASP 104 HB2 ASP 104 -2.316 -4.743 8.753 856 HB3 ASP 104 HB1 ASP 104 -1.071 -5.793 8.087 857 H TYR 105 HN TYR 105 -2.462 -2.516 5.361 858 HA TYR 105 HA TYR 105 -2.688 -0.172 7.078 859 HB2 TYR 105 HB2 TYR 105 -1.824 0.139 4.804 860 HB3 TYR 105 HB1 TYR 105 -3.311 -0.536 4.134 861 HD1 TYR 105 HD1 TYR 105 -2.149 2.241 6.353 862 HD2 TYR 105 HD2 TYR 105 -4.995 0.886 3.513 863 HE1 TYR 105 HE1 TYR 105 -3.147 4.492 6.303 864 HE2 TYR 105 HE2 TYR 105 -6.010 3.107 3.443 865 HH TYR 105 HH TYR 105 -4.523 5.851 4.661 866 H ASP 106 HN ASP 106 -4.508 0.560 7.933 867 HA ASP 106 HA ASP 106 -6.823 -1.132 7.897 868 HB2 ASP 106 HB2 ASP 106 -6.202 -0.107 9.974 869 HB3 ASP 106 HB1 ASP 106 -6.233 1.500 9.254 870 H LEU 107 HN LEU 107 -8.147 -1.095 6.190 871 HA LEU 107 HA LEU 107 -8.663 1.367 4.759 872 HB2 LEU 107 HB2 LEU 107 -9.004 -1.462 4.275 873 HB3 LEU 107 HB1 LEU 107 -10.473 -0.580 3.901 874 HG LEU 107 HG LEU 107 -9.055 0.932 2.451 875 HD11 LEU 107 HD11 LEU 107 -6.935 -0.098 1.659 876 HD12 LEU 107 HD12 LEU 107 -7.034 -1.216 3.019 877 HD13 LEU 107 HD13 LEU 107 -6.881 0.517 3.312 878 HD21 LEU 107 HD21 LEU 107 -8.868 -0.827 0.648 879 HD22 LEU 107 HD22 LEU 107 -10.454 -0.637 1.403 880 HD23 LEU 107 HD23 LEU 107 -9.414 -1.985 1.864 881 H PHE 108 HN PHE 108 -9.836 2.708 6.107 882 HA PHE 108 HA PHE 108 -12.325 1.603 7.206 883 HB2 PHE 108 HB2 PHE 108 -12.371 3.559 8.711 884 HB3 PHE 108 HB1 PHE 108 -10.875 2.656 8.903 885 HD1 PHE 108 HD2 PHE 108 -8.751 3.613 8.107 886 HD2 PHE 108 HD1 PHE 108 -12.403 5.757 7.825 887 HE1 PHE 108 HE2 PHE 108 -7.498 5.694 7.708 888 HE2 PHE 108 HE1 PHE 108 -11.167 7.843 7.438 889 HZ PHE 108 HZ PHE 108 -8.710 7.812 7.362 890 H LEU 109 HN LEU 109 -14.203 2.162 6.286 891 HA LEU 109 HA LEU 109 -14.186 4.434 4.408 892 HB2 LEU 109 HB2 LEU 109 -16.286 2.267 4.657 893 HB3 LEU 109 HB1 LEU 109 -16.113 3.441 3.366 894 HG LEU 109 HG LEU 109 -14.273 1.112 3.931 895 HD11 LEU 109 HD11 LEU 109 -16.460 0.634 2.828 896 HD12 LEU 109 HD12 LEU 109 -15.041 0.220 1.871 897 HD13 LEU 109 HD13 LEU 109 -15.953 1.684 1.507 898 HD21 LEU 109 HD21 LEU 109 -14.062 3.288 1.859 899 HD22 LEU 109 HD22 LEU 109 -13.095 1.811 1.885 900 HD23 LEU 109 HD23 LEU 109 -12.946 2.987 3.193 901 H HIS 110 HN HIS 110 -15.849 6.035 4.644 902 HA HIS 110 HA HIS 110 -16.865 6.161 7.375 903 HB2 HIS 110 HB2 HIS 110 -16.208 8.197 5.324 904 HB3 HIS 110 HB1 HIS 110 -17.529 8.575 6.424 905 HD1 HIS 110 HD1 HIS 110 -16.777 9.827 8.406 906 HD2 HIS 110 HD2 HIS 110 -13.823 7.250 7.011 907 HE1 HIS 110 HE1 HIS 110 -14.795 10.191 9.907 908 HE2 HIS 110 HE2 HIS 110 -13.078 8.506 9.153 909 H LEU 111 HN LEU 111 -19.058 7.551 7.415 910 HA LEU 111 HA LEU 111 -20.864 5.464 6.796 911 HB2 LEU 111 HB2 LEU 111 -20.813 7.760 8.466 912 HB3 LEU 111 HB1 LEU 111 -22.303 7.787 7.539 913 HG LEU 111 HG LEU 111 -22.519 6.648 9.742 914 HD11 LEU 111 HD11 LEU 111 -23.557 4.541 8.812 915 HD12 LEU 111 HD12 LEU 111 -22.985 5.068 7.229 916 HD13 LEU 111 HD13 LEU 111 -24.135 6.060 8.126 917 HD21 LEU 111 HD21 LEU 111 -20.774 4.526 8.505 918 HD22 LEU 111 HD22 LEU 111 -21.509 4.508 10.112 919 HD23 LEU 111 HD23 LEU 111 -20.236 5.671 9.738 920 H GLU 112 HN GLU 112 -22.440 5.245 5.424 921 HA GLU 112 HA GLU 112 -22.486 6.333 2.904 922 HB2 GLU 112 HB2 GLU 112 -23.640 4.253 3.691 923 HB3 GLU 112 HB1 GLU 112 -24.862 5.267 4.438 924 HG2 GLU 112 HG2 GLU 112 -25.446 6.169 2.229 925 HG3 GLU 112 HG1 GLU 112 -24.259 5.090 1.495 926 H GLY 113 HN GLY 113 -23.073 8.217 2.104 927 HA2 GLY 113 HA2 GLY 113 -24.850 9.890 1.890 928 HA3 GLY 113 HA1 GLY 113 -24.931 9.906 3.646 929 H HIS 114 HN HIS 114 -22.329 10.073 4.407 930 HA HIS 114 HA HIS 114 -21.136 12.295 2.944 931 HB2 HIS 114 HB2 HIS 114 -22.646 13.432 4.494 932 HB3 HIS 114 HB1 HIS 114 -21.963 12.545 5.850 933 HD1 HIS 114 HD1 HIS 114 -20.176 13.712 7.095 934 HD2 HIS 114 HD2 HIS 114 -20.585 15.182 3.223 935 HE1 HIS 114 HE1 HIS 114 -18.610 15.675 6.944 936 HE2 HIS 114 HE2 HIS 114 -18.750 16.444 4.548 937 HA PRO 115 HA PRO 115 -17.730 10.015 4.891 938 HB2 PRO 115 HB2 PRO 115 -16.992 8.371 2.919 939 HB3 PRO 115 HB1 PRO 115 -18.360 7.982 3.966 940 HG2 PRO 115 HG2 PRO 115 -18.346 8.780 1.140 941 HG3 PRO 115 HG1 PRO 115 -19.617 7.973 2.071 942 HD2 PRO 115 HD2 PRO 115 -19.328 10.806 1.430 943 HD3 PRO 115 HD1 PRO 115 -20.717 9.960 2.147 944 HA PRO 116 HA PRO 116 -14.819 12.379 2.322 945 HB2 PRO 116 HB2 PRO 116 -13.896 14.060 4.194 946 HB3 PRO 116 HB1 PRO 116 -15.423 14.370 3.361 947 HG2 PRO 116 HG2 PRO 116 -14.944 13.471 6.136 948 HG3 PRO 116 HG1 PRO 116 -16.328 14.343 5.460 949 HD2 PRO 116 HD2 PRO 116 -16.092 11.527 5.988 950 HD3 PRO 116 HD1 PRO 116 -17.475 12.406 5.301 951 H VAL 117 HN VAL 117 -13.476 10.477 2.189 952 HA VAL 117 HA VAL 117 -11.695 10.191 4.532 953 HB VAL 117 HB VAL 117 -12.238 7.978 2.574 954 HG11 VAL 117 HG11 VAL 117 -10.345 7.405 3.713 955 HG12 VAL 117 HG12 VAL 117 -11.569 6.710 4.757 956 HG13 VAL 117 HG13 VAL 117 -10.821 8.252 5.174 957 HG21 VAL 117 HG21 VAL 117 -13.605 7.036 4.476 958 HG22 VAL 117 HG22 VAL 117 -14.359 8.284 3.484 959 HG23 VAL 117 HG23 VAL 117 -13.716 8.689 5.080 960 H ASN 118 HN ASN 118 -9.771 10.993 4.144 961 HA ASN 118 HA ASN 118 -8.320 10.028 1.800 962 HB2 ASN 118 HB2 ASN 118 -9.264 12.387 1.371 963 HB3 ASN 118 HB1 ASN 118 -8.136 12.936 2.599 964 HD21 ASN 118 HD21 ASN 118 -6.023 11.053 1.799 965 HD22 ASN 118 HD22 ASN 118 -5.402 11.649 0.296 966 H HIS 119 HN HIS 119 -6.982 8.753 3.017 967 HA HIS 119 HA HIS 119 -5.522 10.071 5.222 968 HB2 HIS 119 HB2 HIS 119 -7.278 8.302 5.856 969 HB3 HIS 119 HB1 HIS 119 -6.176 7.137 5.132 970 HD1 HIS 119 HD1 HIS 119 -5.419 5.887 7.182 971 HD2 HIS 119 HD2 HIS 119 -5.083 10.014 7.594 972 HE1 HIS 119 HE1 HIS 119 -4.175 6.257 9.331 973 HE2 HIS 119 HE2 HIS 119 -4.189 8.756 9.665 974 H LEU 120 HN LEU 120 -3.374 9.878 5.225 975 HA LEU 120 HA LEU 120 -2.033 7.873 3.590 976 HB2 LEU 120 HB2 LEU 120 -1.981 10.814 3.098 977 HB3 LEU 120 HB1 LEU 120 -0.487 9.923 2.893 978 HG LEU 120 HG LEU 120 -2.998 9.067 1.482 979 HD11 LEU 120 HD11 LEU 120 -1.250 10.417 -0.280 980 HD12 LEU 120 HD12 LEU 120 -1.574 11.502 1.076 981 HD13 LEU 120 HD13 LEU 120 -2.913 10.837 0.139 982 HD21 LEU 120 HD21 LEU 120 -0.832 7.665 1.747 983 HD22 LEU 120 HD22 LEU 120 -0.165 8.793 0.562 984 HD23 LEU 120 HD23 LEU 120 -1.573 7.812 0.151 985 H ARG 121 HN ARG 121 -0.164 7.166 4.508 986 HA ARG 121 HA ARG 121 1.073 8.794 6.580 987 HB2 ARG 121 HB2 ARG 121 1.113 6.886 8.176 988 HB3 ARG 121 HB1 ARG 121 -0.464 7.571 7.893 989 HG2 ARG 121 HG2 ARG 121 -0.821 5.269 7.949 990 HG3 ARG 121 HG1 ARG 121 -0.901 5.689 6.265 991 HD2 ARG 121 HD2 ARG 121 1.240 4.690 5.889 992 HD3 ARG 121 HD1 ARG 121 1.530 4.486 7.602 993 HE ARG 121 HE ARG 121 -0.464 2.988 6.067 994 HH11 ARG 121 HH11 ARG 121 1.568 3.400 8.876 995 HH12 ARG 121 HH12 ARG 121 1.330 1.778 9.455 996 HH21 ARG 121 HH21 ARG 121 -0.796 0.836 6.834 997 HH22 ARG 121 HH22 ARG 121 0.008 0.315 8.280 998 H CYS 122 HN CYS 122 3.222 8.260 7.066 999 HA CYS 122 HA CYS 122 4.485 6.802 4.858 1000 HB2 CYS 122 HB2 CYS 122 6.496 8.177 5.418 1001 HB3 CYS 122 HB1 CYS 122 5.108 9.108 4.873 1002 HG CYS 122 HG CYS 122 4.782 9.020 8.063 1003 H GLU 123 HN GLU 123 5.665 5.074 5.197 1004 HA GLU 123 HA GLU 123 6.227 4.239 7.955 1005 HB2 GLU 123 HB2 GLU 123 6.036 2.700 5.361 1006 HB3 GLU 123 HB1 GLU 123 6.540 1.982 6.888 1007 HG2 GLU 123 HG2 GLU 123 3.950 3.437 6.656 1008 HG3 GLU 123 HG1 GLU 123 4.080 1.750 6.157 1009 H LYS 124 HN LYS 124 8.280 3.079 8.293 1010 HA LYS 124 HA LYS 124 10.435 4.161 6.599 1011 HB2 LYS 124 HB2 LYS 124 10.354 5.483 8.610 1012 HB3 LYS 124 HB1 LYS 124 10.306 4.033 9.608 1013 HG2 LYS 124 HG2 LYS 124 12.570 3.474 8.540 1014 HG3 LYS 124 HG1 LYS 124 12.601 5.166 8.054 1015 HD2 LYS 124 HD2 LYS 124 13.762 5.089 10.066 1016 HD3 LYS 124 HD1 LYS 124 12.169 5.711 10.493 1017 HE2 LYS 124 HE2 LYS 124 12.666 2.782 10.601 1018 HE3 LYS 124 HE1 LYS 124 13.295 3.794 11.901 1019 HZ1 LYS 124 HZ1 LYS 124 11.028 4.622 12.257 1020 HZ2 LYS 124 HZ2 LYS 124 11.131 2.944 12.478 1021 HZ3 LYS 124 HZ3 LYS 124 10.451 3.572 11.061 1022 H LEU 125 HN LEU 125 11.576 2.561 5.721 1023 HA LEU 125 HA LEU 125 11.926 0.057 7.213 1024 HB2 LEU 125 HB2 LEU 125 12.698 0.675 4.379 1025 HB3 LEU 125 HB1 LEU 125 12.770 -0.884 5.157 1026 HG LEU 125 HG LEU 125 10.911 -1.023 3.833 1027 HD11 LEU 125 HD11 LEU 125 9.152 -1.460 5.229 1028 HD12 LEU 125 HD12 LEU 125 9.533 -0.103 6.294 1029 HD13 LEU 125 HD13 LEU 125 10.554 -1.543 6.298 1030 HD21 LEU 125 HD21 LEU 125 10.712 1.250 3.084 1031 HD22 LEU 125 HD22 LEU 125 10.125 1.745 4.678 1032 HD23 LEU 125 HD23 LEU 125 9.139 0.688 3.668 1033 H THR 126 HN THR 126 13.819 -0.148 8.353 1034 HA THR 126 HA THR 126 16.075 1.564 7.518 1035 HB THR 126 HB THR 126 16.078 0.287 10.205 1036 HG1 THR 126 HG1 THR 126 14.401 1.413 10.882 1037 HG21 THR 126 HG21 THR 126 17.896 1.736 9.148 1038 HG22 THR 126 HG22 THR 126 17.383 2.138 10.790 1039 HG23 THR 126 HG23 THR 126 16.798 3.091 9.425 1040 H PHE 127 HN PHE 127 17.823 0.618 6.742 1041 HA PHE 127 HA PHE 127 18.229 -2.251 7.283 1042 HB2 PHE 127 HB2 PHE 127 18.953 -0.729 4.771 1043 HB3 PHE 127 HB1 PHE 127 19.130 -2.465 5.028 1044 HD1 PHE 127 HD1 PHE 127 17.172 -3.919 5.083 1045 HD2 PHE 127 HD2 PHE 127 16.819 0.250 4.329 1046 HE1 PHE 127 HE1 PHE 127 14.864 -4.255 4.305 1047 HE2 PHE 127 HE2 PHE 127 14.524 -0.068 3.549 1048 HZ PHE 127 HZ PHE 127 13.535 -2.326 3.545 1049 H ASN 128 HN ASN 128 19.819 -2.331 8.758 1050 HA ASN 128 HA ASN 128 21.772 -0.276 8.991 1051 HB2 ASN 128 HB2 ASN 128 22.770 -1.669 10.760 1052 HB3 ASN 128 HB1 ASN 128 21.049 -1.400 10.988 1053 HD21 ASN 128 HD21 ASN 128 19.631 -3.119 10.827 1054 HD22 ASN 128 HD22 ASN 128 20.171 -4.768 10.822 1055 H ASN 129 HN ASN 129 23.421 0.001 7.753 1056 HA ASN 129 HA ASN 129 25.189 -0.313 6.377 1057 HB2 ASN 129 HB2 ASN 129 25.692 -2.800 8.012 1058 HB3 ASN 129 HB1 ASN 129 26.880 -1.825 7.153 1059 HD21 ASN 129 HD21 ASN 129 25.069 -2.225 10.017 1060 HD22 ASN 129 HD22 ASN 129 25.691 -0.857 10.881 1061 HA PRO 130 HA PRO 130 23.018 -3.575 3.909 1062 HB2 PRO 130 HB2 PRO 130 22.149 -2.027 1.888 1063 HB3 PRO 130 HB1 PRO 130 21.274 -2.146 3.419 1064 HG2 PRO 130 HG2 PRO 130 23.072 0.017 2.425 1065 HG3 PRO 130 HG1 PRO 130 21.574 0.141 3.364 1066 HD2 PRO 130 HD2 PRO 130 24.128 0.309 4.419 1067 HD3 PRO 130 HD1 PRO 130 22.673 -0.099 5.347 1068 H THR 131 HN THR 131 23.677 -4.570 2.004 1069 HA THR 131 HA THR 131 26.353 -4.268 1.229 1070 HB THR 131 HB THR 131 25.301 -6.403 0.908 1071 HG1 THR 131 HG1 THR 131 25.619 -6.640 -1.473 1072 HG21 THR 131 HG21 THR 131 23.454 -6.795 -0.602 1073 HG22 THR 131 HG22 THR 131 23.447 -5.099 -1.088 1074 HG23 THR 131 HG23 THR 131 22.996 -5.547 0.557 1075 H GLU 132 HN GLU 132 27.198 -3.643 -0.907 1076 HA GLU 132 HA GLU 132 26.700 -0.990 -1.479 1077 HB2 GLU 132 HB2 GLU 132 28.703 -2.305 -2.226 1078 HB3 GLU 132 HB1 GLU 132 27.705 -2.985 -3.506 1079 HG2 GLU 132 HG2 GLU 132 27.293 -0.693 -4.333 1080 HG3 GLU 132 HG1 GLU 132 28.448 -0.104 -3.140 1081 H ASP 133 HN ASP 133 25.389 -3.826 -3.222 1082 HA ASP 133 HA ASP 133 24.175 -2.468 -5.331 1083 HB2 ASP 133 HB2 ASP 133 23.170 -4.999 -4.009 1084 HB3 ASP 133 HB1 ASP 133 22.783 -4.447 -5.631 1085 H PHE 134 HN PHE 134 22.754 -3.515 -2.248 1086 HA PHE 134 HA PHE 134 20.210 -2.371 -2.756 1087 HB2 PHE 134 HB2 PHE 134 20.830 -4.214 -1.040 1088 HB3 PHE 134 HB1 PHE 134 21.337 -2.880 -0.006 1089 HD1 PHE 134 HD1 PHE 134 18.487 -2.882 -2.349 1090 HD2 PHE 134 HD2 PHE 134 19.731 -2.982 1.717 1091 HE1 PHE 134 HE1 PHE 134 16.189 -2.506 -1.646 1092 HE2 PHE 134 HE2 PHE 134 17.407 -2.613 2.428 1093 HZ PHE 134 HZ PHE 134 15.638 -2.365 0.736 1094 H ARG 135 HN ARG 135 22.945 -1.415 -0.770 1095 HA ARG 135 HA ARG 135 22.225 1.034 0.207 1096 HB2 ARG 135 HB2 ARG 135 24.213 0.199 0.923 1097 HB3 ARG 135 HB1 ARG 135 24.772 -0.154 -0.714 1098 HG2 ARG 135 HG2 ARG 135 25.905 1.790 -0.699 1099 HG3 ARG 135 HG1 ARG 135 24.386 2.643 -0.486 1100 HD2 ARG 135 HD2 ARG 135 26.261 2.952 1.277 1101 HD3 ARG 135 HD1 ARG 135 24.605 2.694 1.825 1102 HE ARG 135 HE ARG 135 25.344 0.259 2.012 1103 HH11 ARG 135 HH11 ARG 135 27.531 2.953 2.443 1104 HH12 ARG 135 HH12 ARG 135 28.572 2.095 3.528 1105 HH21 ARG 135 HH21 ARG 135 26.701 -0.869 3.436 1106 HH22 ARG 135 HH22 ARG 135 28.105 -0.081 4.099 1107 H ARG 136 HN ARG 136 23.657 0.399 -2.962 1108 HA ARG 136 HA ARG 136 23.853 2.951 -3.948 1109 HB2 ARG 136 HB2 ARG 136 23.663 0.225 -5.017 1110 HB3 ARG 136 HB1 ARG 136 23.309 1.527 -6.109 1111 HG2 ARG 136 HG2 ARG 136 25.442 2.307 -6.144 1112 HG3 ARG 136 HG1 ARG 136 25.777 1.736 -4.506 1113 HD2 ARG 136 HD2 ARG 136 27.024 0.453 -6.170 1114 HD3 ARG 136 HD1 ARG 136 25.867 -0.550 -5.297 1115 HE ARG 136 HE ARG 136 24.673 0.368 -7.671 1116 HH11 ARG 136 HH11 ARG 136 27.305 -1.726 -6.667 1117 HH12 ARG 136 HH12 ARG 136 27.068 -2.857 -7.969 1118 HH21 ARG 136 HH21 ARG 136 24.357 -1.137 -9.387 1119 HH22 ARG 136 HH22 ARG 136 25.391 -2.529 -9.495 1120 H LYS 137 HN LYS 137 21.126 0.687 -4.287 1121 HA LYS 137 HA LYS 137 19.582 2.445 -5.883 1122 HB2 LYS 137 HB2 LYS 137 18.688 0.133 -4.153 1123 HB3 LYS 137 HB1 LYS 137 17.679 0.958 -5.337 1124 HG2 LYS 137 HG2 LYS 137 19.166 0.247 -7.125 1125 HG3 LYS 137 HG1 LYS 137 20.230 -0.530 -5.952 1126 HD2 LYS 137 HD2 LYS 137 18.423 -2.064 -5.331 1127 HD3 LYS 137 HD1 LYS 137 17.354 -1.274 -6.498 1128 HE2 LYS 137 HE2 LYS 137 18.750 -1.966 -8.326 1129 HE3 LYS 137 HE1 LYS 137 19.957 -2.605 -7.218 1130 HZ1 LYS 137 HZ1 LYS 137 17.238 -3.671 -7.083 1131 HZ2 LYS 137 HZ2 LYS 137 18.710 -4.442 -6.758 1132 HZ3 LYS 137 HZ3 LYS 137 18.229 -4.160 -8.360 1133 H LEU 138 HN LEU 138 19.517 1.683 -2.446 1134 HA LEU 138 HA LEU 138 17.396 3.316 -1.666 1135 HB2 LEU 138 HB2 LEU 138 19.859 2.750 -0.043 1136 HB3 LEU 138 HB1 LEU 138 18.285 3.216 0.564 1137 HG LEU 138 HG LEU 138 19.092 0.584 -0.639 1138 HD11 LEU 138 HD11 LEU 138 19.560 1.084 1.764 1139 HD12 LEU 138 HD12 LEU 138 18.521 -0.316 1.480 1140 HD13 LEU 138 HD13 LEU 138 17.816 1.213 2.006 1141 HD21 LEU 138 HD21 LEU 138 16.317 1.560 -0.009 1142 HD22 LEU 138 HD22 LEU 138 16.749 -0.118 -0.323 1143 HD23 LEU 138 HD23 LEU 138 16.946 1.096 -1.587 1144 H LEU 139 HN LEU 139 20.823 4.079 -2.056 1145 HA LEU 139 HA LEU 139 20.607 6.728 -1.023 1146 HB2 LEU 139 HB2 LEU 139 22.734 5.439 -2.728 1147 HB3 LEU 139 HB1 LEU 139 22.883 7.016 -1.976 1148 HG LEU 139 HG LEU 139 22.510 4.423 -0.481 1149 HD11 LEU 139 HD11 LEU 139 24.666 4.128 -1.069 1150 HD12 LEU 139 HD12 LEU 139 24.945 5.282 0.244 1151 HD13 LEU 139 HD13 LEU 139 24.911 5.845 -1.426 1152 HD21 LEU 139 HD21 LEU 139 21.593 6.403 0.625 1153 HD22 LEU 139 HD22 LEU 139 23.174 7.183 0.522 1154 HD23 LEU 139 HD23 LEU 139 22.970 5.725 1.495 1155 H LYS 140 HN LYS 140 20.335 5.309 -4.208 1156 HA LYS 140 HA LYS 140 20.376 7.711 -5.695 1157 HB2 LYS 140 HB2 LYS 140 19.906 4.929 -6.218 1158 HB3 LYS 140 HB1 LYS 140 18.705 5.916 -7.021 1159 HG2 LYS 140 HG2 LYS 140 20.212 6.914 -8.398 1160 HG3 LYS 140 HG1 LYS 140 21.539 6.745 -7.250 1161 HD2 LYS 140 HD2 LYS 140 20.329 4.334 -8.555 1162 HD3 LYS 140 HD1 LYS 140 21.554 5.293 -9.385 1163 HE2 LYS 140 HE2 LYS 140 21.905 4.174 -6.618 1164 HE3 LYS 140 HE1 LYS 140 22.381 3.316 -8.077 1165 HZ1 LYS 140 HZ1 LYS 140 24.186 4.617 -6.955 1166 HZ2 LYS 140 HZ2 LYS 140 23.373 6.033 -7.417 1167 HZ3 LYS 140 HZ3 LYS 140 23.962 4.971 -8.597 1168 H ALA 141 HN ALA 141 17.984 6.165 -3.786 1169 HA ALA 141 HA ALA 141 15.685 7.451 -4.844 1170 HB1 ALA 141 HB1 ALA 141 14.534 6.506 -3.077 1171 HB2 ALA 141 HB2 ALA 141 15.899 6.647 -1.967 1172 HB3 ALA 141 HB3 ALA 141 15.915 5.418 -3.231 1173 H1 GLY 212 HT1 GLY 212 -23.369 8.114 12.782 1174 H2 GLY 212 HT2 GLY 212 -23.539 6.937 13.993 1175 H3 GLY 212 HT3 GLY 212 -23.198 6.468 12.402 1176 HA2 GLY 212 HA1 GLY 212 -21.405 7.989 14.210 1177 HA3 GLY 212 HA2 GLY 212 -21.217 6.306 13.736 1178 H GLY 213 HN GLY 213 -19.072 7.068 13.047 1179 HA2 GLY 213 HA2 GLY 213 -19.214 8.324 10.370 1180 HA3 GLY 213 HA1 GLY 213 -17.874 8.566 11.480 1181 H LYS 214 HN LYS 214 -18.298 5.560 12.148 1182 HA LYS 214 HA LYS 214 -16.497 4.624 10.048 1183 HB2 LYS 214 HB2 LYS 214 -17.188 3.540 12.777 1184 HB3 LYS 214 HB1 LYS 214 -16.215 2.645 11.618 1185 HG2 LYS 214 HG2 LYS 214 -14.569 4.447 11.601 1186 HG3 LYS 214 HG1 LYS 214 -15.548 5.351 12.757 1187 HD2 LYS 214 HD2 LYS 214 -15.220 3.682 14.441 1188 HD3 LYS 214 HD1 LYS 214 -14.444 2.596 13.286 1189 HE2 LYS 214 HE2 LYS 214 -13.375 5.288 14.131 1190 HE3 LYS 214 HE1 LYS 214 -12.831 3.737 14.769 1191 HZ1 LYS 214 HZ1 LYS 214 -12.624 4.631 11.940 1192 HZ2 LYS 214 HZ2 LYS 214 -12.142 3.114 12.522 1193 HZ3 LYS 214 HZ3 LYS 214 -11.346 4.519 13.048 1194 H ALA 215 HN ALA 215 -17.320 3.609 8.393 1195 HA ALA 215 HA ALA 215 -19.991 2.630 8.297 1196 HB1 ALA 215 HB1 ALA 215 -19.365 1.880 6.029 1197 HB2 ALA 215 HB2 ALA 215 -17.684 2.281 6.375 1198 HB3 ALA 215 HB3 ALA 215 -18.904 3.555 6.331 1199 HA PRO 216 HA PRO 216 -19.702 -1.654 9.391 1200 HB2 PRO 216 HB2 PRO 216 -20.551 -2.995 7.134 1201 HB3 PRO 216 HB1 PRO 216 -21.620 -2.247 8.317 1202 HG2 PRO 216 HG2 PRO 216 -20.680 -1.186 5.686 1203 HG3 PRO 216 HG1 PRO 216 -22.292 -1.099 6.419 1204 HD2 PRO 216 HD2 PRO 216 -20.637 1.004 6.447 1205 HD3 PRO 216 HD1 PRO 216 -21.693 0.652 7.831 1206 H ARG 217 HN ARG 217 -18.518 -3.631 9.078 1207 HA ARG 217 HA ARG 217 -16.417 -3.541 7.042 1208 HB2 ARG 217 HB2 ARG 217 -15.889 -3.779 10.018 1209 HB3 ARG 217 HB1 ARG 217 -14.680 -4.030 8.763 1210 HG2 ARG 217 HG2 ARG 217 -14.932 -1.717 8.040 1211 HG3 ARG 217 HG1 ARG 217 -16.170 -1.460 9.268 1212 HD2 ARG 217 HD2 ARG 217 -14.080 -0.564 10.049 1213 HD3 ARG 217 HD1 ARG 217 -14.496 -1.981 11.009 1214 HE ARG 217 HE ARG 217 -12.871 -3.207 9.545 1215 HH11 ARG 217 HH11 ARG 217 -12.587 0.256 10.031 1216 HH12 ARG 217 HH12 ARG 217 -10.865 0.268 9.799 1217 HH21 ARG 217 HH21 ARG 217 -10.610 -3.180 9.267 1218 HH22 ARG 217 HH22 ARG 217 -9.741 -1.670 9.396 1219 H1 KCR 218 HN KCR 218 -15.494 -5.557 6.551 1220 H4 KCR 218 HA KCR 218 -17.245 -7.793 7.266 1221 H5 KCR 218 HB1 KCR 218 -16.214 -8.956 5.359 1222 H6 KCR 218 HB2 KCR 218 -15.133 -7.593 5.112 1223 H7 KCR 218 HG1 KCR 218 -17.031 -6.162 4.603 1224 H8 KCR 218 HG2 KCR 218 -18.130 -7.516 4.872 1225 H9 KCR 218 HD1 KCR 218 -17.226 -8.712 3.007 1226 H10 KCR 218 HD2 KCR 218 -15.932 -7.528 2.811 1227 H11 KCR 218 HE1 KCR 218 -17.610 -5.809 2.288 1228 H12 KCR 218 HE2 KCR 218 -18.881 -7.025 2.428 1229 H13 KCR 218 HZ1 KCR 218 -17.756 -8.174 0.525 1230 H14 KCR 218 HH1 KCR 218 -17.290 -7.896 -1.811 1231 H15 KCR 218 HJ1 KCR 218 -17.164 -4.888 -2.466 1232 H16 KCR 218 HF3 KCR 218 -17.797 -6.449 -4.554 1233 H17 KCR 218 HF1 KCR 218 -16.141 -5.846 -4.547 1234 H18 KCR 218 HF2 KCR 218 -16.484 -7.482 -3.985 1235 H GLN 219 HN GLN 219 -14.622 -6.535 8.585 1236 HA GLN 219 HA GLN 219 -13.635 -9.138 9.471 1237 HB2 GLN 219 HB2 GLN 219 -12.097 -8.424 7.707 1238 HB3 GLN 219 HB1 GLN 219 -11.865 -6.880 8.513 1239 HG2 GLN 219 HG2 GLN 219 -10.824 -8.001 10.400 1240 HG3 GLN 219 HG1 GLN 219 -11.094 -9.565 9.632 1241 HE21 GLN 219 HE21 GLN 219 -8.902 -10.027 9.618 1242 HE22 GLN 219 HE22 GLN 219 -7.809 -9.254 8.518 1243 H LEU 220 HN LEU 220 -13.228 -9.235 11.585 1244 HA LEU 220 HA LEU 220 -13.209 -8.690 13.779 1245 HB2 LEU 220 HB2 LEU 220 -12.057 -6.097 12.756 1246 HB3 LEU 220 HB1 LEU 220 -12.049 -6.611 14.433 1247 HG LEU 220 HG LEU 220 -10.620 -7.988 12.156 1248 HD11 LEU 220 HD11 LEU 220 -9.595 -5.872 12.798 1249 HD12 LEU 220 HD12 LEU 220 -8.593 -7.239 13.284 1250 HD13 LEU 220 HD13 LEU 220 -9.567 -6.390 14.484 1251 HD21 LEU 220 HD21 LEU 220 -9.640 -9.399 13.892 1252 HD22 LEU 220 HD22 LEU 220 -11.394 -9.581 13.837 1253 HD23 LEU 220 HD23 LEU 220 -10.648 -8.611 15.107 1254 H ALA 221 HN ALA 221 -15.580 -8.114 12.201 1255 HA ALA 221 HA ALA 221 -16.803 -6.136 14.007 1256 HB1 ALA 221 HB1 ALA 221 -16.503 -5.116 11.803 1257 HB2 ALA 221 HB2 ALA 221 -18.211 -5.344 12.180 1258 HB3 ALA 221 HB3 ALA 221 -17.400 -6.444 11.065 1259 H THR 222 HN THR 222 -16.621 -9.039 14.117 1260 HA THR 222 HA THR 222 -19.503 -9.636 14.103 1261 HB THR 222 HB THR 222 -17.304 -11.649 13.569 1262 HG1 THR 222 HG1 THR 222 -19.115 -10.312 11.807 1263 HG21 THR 222 HG21 THR 222 -19.298 -12.600 14.630 1264 HG22 THR 222 HG22 THR 222 -19.159 -13.135 12.956 1265 HG23 THR 222 HG23 THR 222 -20.314 -11.874 13.384 1266 H LYS 223 HN LYS 223 -19.969 -9.385 16.208 1267 HA LYS 223 HA LYS 223 -18.110 -10.084 18.282 1268 HB2 LYS 223 HB2 LYS 223 -21.029 -9.337 18.505 1269 HB3 LYS 223 HB1 LYS 223 -19.855 -9.350 19.812 1270 HG2 LYS 223 HG2 LYS 223 -19.665 -7.569 17.393 1271 HG3 LYS 223 HG1 LYS 223 -20.400 -7.092 18.920 1272 HD2 LYS 223 HD2 LYS 223 -18.245 -6.231 19.071 1273 HD3 LYS 223 HD1 LYS 223 -18.133 -7.745 19.965 1274 HE2 LYS 223 HE2 LYS 223 -17.125 -8.836 18.048 1275 HE3 LYS 223 HE1 LYS 223 -17.323 -7.375 17.081 1276 HZ1 LYS 223 HZ1 LYS 223 -15.055 -7.680 17.979 1277 HZ2 LYS 223 HZ2 LYS 223 -15.675 -7.529 19.549 1278 HZ3 LYS 223 HZ3 LYS 223 -15.774 -6.225 18.469 1279 H ALA 224 HN ALA 224 -18.851 -11.465 20.141 1280 HA ALA 224 HA ALA 224 -19.685 -14.038 19.051 1281 HB1 ALA 224 HB1 ALA 224 -18.833 -14.973 21.141 1282 HB2 ALA 224 HB2 ALA 224 -18.532 -13.345 21.751 1283 HB3 ALA 224 HB3 ALA 224 -17.626 -13.948 20.362 Start of MODEL 20 1 H1 GLY 1 HT1 GLY 1 28.051 -7.409 -5.678 2 H2 GLY 1 HT2 GLY 1 27.087 -6.122 -5.124 3 H3 GLY 1 HT3 GLY 1 26.934 -7.661 -4.429 4 HA2 GLY 1 HA1 GLY 1 28.183 -6.100 -3.017 5 HA3 GLY 1 HA2 GLY 1 29.079 -7.550 -3.450 6 H SER 2 HN SER 2 29.692 -4.547 -2.849 7 HA SER 2 HA SER 2 31.768 -4.363 -4.906 8 HB2 SER 2 HB2 SER 2 29.990 -2.026 -4.167 9 HB3 SER 2 HB1 SER 2 31.311 -2.012 -5.336 10 HG SER 2 HG SER 2 29.962 -2.715 -6.773 11 H HIS 3 HN HIS 3 30.552 -3.634 -1.743 12 HA HIS 3 HA HIS 3 31.422 -2.565 0.076 13 HB2 HIS 3 HB2 HIS 3 33.371 -3.745 0.997 14 HB3 HIS 3 HB1 HIS 3 32.173 -4.850 0.350 15 HD1 HIS 3 HD1 HIS 3 35.721 -3.981 0.183 16 HD2 HIS 3 HD2 HIS 3 33.000 -6.099 -2.147 17 HE1 HIS 3 HE1 HIS 3 37.109 -5.374 -1.391 18 HE2 HIS 3 HE2 HIS 3 35.442 -6.774 -2.664 19 H MET 4 HN MET 4 31.584 -0.512 -1.129 20 HA MET 4 HA MET 4 34.088 0.310 -2.196 21 HB2 MET 4 HB2 MET 4 31.619 1.828 -1.386 22 HB3 MET 4 HB1 MET 4 33.051 2.636 -2.008 23 HG2 MET 4 HG2 MET 4 32.881 1.299 -4.067 24 HG3 MET 4 HG1 MET 4 31.405 0.565 -3.442 25 HE1 MET 4 HE1 MET 4 31.767 5.095 -4.259 26 HE2 MET 4 HE2 MET 4 33.108 3.971 -4.485 27 HE3 MET 4 HE3 MET 4 32.479 4.279 -2.866 28 H ALA 5 HN ALA 5 32.407 1.526 0.724 29 HA ALA 5 HA ALA 5 34.780 1.485 2.304 30 HB1 ALA 5 HB1 ALA 5 35.158 3.404 0.687 31 HB2 ALA 5 HB2 ALA 5 35.354 3.754 2.400 32 HB3 ALA 5 HB3 ALA 5 33.884 4.249 1.557 33 H SER 6 HN SER 6 32.080 3.743 1.981 34 HA SER 6 HA SER 6 31.677 3.922 4.777 35 HB2 SER 6 HB2 SER 6 31.184 5.813 3.418 36 HB3 SER 6 HB1 SER 6 30.114 4.874 2.383 37 HG SER 6 HG SER 6 29.690 5.579 5.112 38 H SER 7 HN SER 7 30.525 2.715 6.088 39 HA SER 7 HA SER 7 28.376 1.035 4.972 40 HB2 SER 7 HB2 SER 7 30.160 0.391 7.343 41 HB3 SER 7 HB1 SER 7 28.893 -0.642 6.677 42 HG SER 7 HG SER 7 30.434 -0.061 4.655 43 H CYS 8 HN CYS 8 26.420 1.546 5.750 44 HA CYS 8 HA CYS 8 26.037 2.465 8.453 45 HB2 CYS 8 HB2 CYS 8 26.778 4.489 7.150 46 HB3 CYS 8 HB1 CYS 8 25.336 4.313 6.164 47 HG CYS 8 HG CYS 8 24.751 4.464 9.465 48 H ALA 9 HN ALA 9 23.684 2.868 8.874 49 HA ALA 9 HA ALA 9 22.010 1.037 7.394 50 HB1 ALA 9 HB1 ALA 9 20.263 1.639 9.008 51 HB2 ALA 9 HB2 ALA 9 21.293 2.931 9.639 52 HB3 ALA 9 HB3 ALA 9 21.778 1.247 9.833 53 H VAL 10 HN VAL 10 20.946 1.572 5.611 54 HA VAL 10 HA VAL 10 20.440 4.412 5.057 55 HB VAL 10 HB VAL 10 20.176 2.062 3.170 56 HG11 VAL 10 HG11 VAL 10 18.797 3.729 2.321 57 HG12 VAL 10 HG12 VAL 10 20.329 4.022 1.492 58 HG13 VAL 10 HG13 VAL 10 19.864 5.026 2.865 59 HG21 VAL 10 HG21 VAL 10 22.501 2.263 3.648 60 HG22 VAL 10 HG22 VAL 10 22.428 4.022 3.585 61 HG23 VAL 10 HG23 VAL 10 22.237 3.079 2.108 62 H GLN 11 HN GLN 11 18.391 5.213 4.870 63 HA GLN 11 HA GLN 11 16.257 3.336 5.655 64 HB2 GLN 11 HB2 GLN 11 16.190 6.278 6.268 65 HB3 GLN 11 HB1 GLN 11 15.294 4.974 7.036 66 HG2 GLN 11 HG2 GLN 11 16.812 5.019 8.653 67 HG3 GLN 11 HG1 GLN 11 17.948 4.338 7.493 68 HE21 GLN 11 HE21 GLN 11 16.913 7.227 9.124 69 HE22 GLN 11 HE22 GLN 11 18.276 8.202 8.669 70 H VAL 12 HN VAL 12 14.526 3.209 4.400 71 HA VAL 12 HA VAL 12 14.202 5.263 2.324 72 HB VAL 12 HB VAL 12 12.999 3.477 1.039 73 HG11 VAL 12 HG11 VAL 12 15.532 4.052 0.879 74 HG12 VAL 12 HG12 VAL 12 14.956 2.563 0.135 75 HG13 VAL 12 HG13 VAL 12 15.764 2.510 1.701 76 HG21 VAL 12 HG21 VAL 12 12.459 2.107 2.985 77 HG22 VAL 12 HG22 VAL 12 14.154 1.639 3.110 78 HG23 VAL 12 HG23 VAL 12 13.212 1.186 1.686 79 H LYS 13 HN LYS 13 12.215 6.231 2.099 80 HA LYS 13 HA LYS 13 10.188 5.421 4.053 81 HB2 LYS 13 HB2 LYS 13 10.917 8.055 2.867 82 HB3 LYS 13 HB1 LYS 13 9.254 7.780 3.368 83 HG2 LYS 13 HG2 LYS 13 10.068 7.167 5.608 84 HG3 LYS 13 HG1 LYS 13 11.705 7.580 5.093 85 HD2 LYS 13 HD2 LYS 13 11.077 9.864 4.717 86 HD3 LYS 13 HD1 LYS 13 9.378 9.492 5.011 87 HE2 LYS 13 HE2 LYS 13 9.885 8.930 7.322 88 HE3 LYS 13 HE1 LYS 13 11.596 9.242 7.036 89 HZ1 LYS 13 HZ1 LYS 13 10.360 11.089 8.123 90 HZ2 LYS 13 HZ2 LYS 13 9.485 11.296 6.684 91 HZ3 LYS 13 HZ3 LYS 13 11.164 11.529 6.699 92 H LEU 14 HN LEU 14 8.487 4.480 3.399 93 HA LEU 14 HA LEU 14 7.596 4.794 0.615 94 HB2 LEU 14 HB2 LEU 14 6.999 2.701 2.707 95 HB3 LEU 14 HB1 LEU 14 6.150 2.795 1.169 96 HG LEU 14 HG LEU 14 9.128 2.335 1.482 97 HD11 LEU 14 HD11 LEU 14 7.003 0.417 0.592 98 HD12 LEU 14 HD12 LEU 14 7.663 0.457 2.225 99 HD13 LEU 14 HD13 LEU 14 8.711 0.076 0.857 100 HD21 LEU 14 HD21 LEU 14 7.463 2.034 -1.000 101 HD22 LEU 14 HD22 LEU 14 9.221 2.040 -0.849 102 HD23 LEU 14 HD23 LEU 14 8.310 3.528 -0.598 103 H GLU 15 HN GLU 15 5.040 4.685 0.538 104 HA GLU 15 HA GLU 15 3.902 6.265 2.732 105 HB2 GLU 15 HB2 GLU 15 4.664 7.820 1.003 106 HB3 GLU 15 HB1 GLU 15 3.743 6.938 -0.206 107 HG2 GLU 15 HG2 GLU 15 1.681 7.627 0.739 108 HG3 GLU 15 HG1 GLU 15 2.478 8.264 2.176 109 H LEU 16 HN LEU 16 2.024 5.472 3.409 110 HA LEU 16 HA LEU 16 0.418 3.807 1.579 111 HB2 LEU 16 HB2 LEU 16 0.665 3.912 4.528 112 HB3 LEU 16 HB1 LEU 16 -0.934 3.643 3.901 113 HG LEU 16 HG LEU 16 -0.411 1.486 4.014 114 HD11 LEU 16 HD11 LEU 16 1.538 1.130 2.071 115 HD12 LEU 16 HD12 LEU 16 0.495 2.442 1.506 116 HD13 LEU 16 HD13 LEU 16 -0.201 0.871 1.920 117 HD21 LEU 16 HD21 LEU 16 2.491 2.172 3.872 118 HD22 LEU 16 HD22 LEU 16 1.783 0.605 4.322 119 HD23 LEU 16 HD23 LEU 16 1.549 2.011 5.367 120 H GLY 17 HN GLY 17 -1.717 4.267 1.277 121 HA2 GLY 17 HA2 GLY 17 -2.957 6.502 2.611 122 HA3 GLY 17 HA1 GLY 17 -2.562 6.819 0.923 123 H HIS 18 HN HIS 18 -5.132 6.934 1.760 124 HA HIS 18 HA HIS 18 -6.320 5.331 -0.202 125 HB2 HIS 18 HB2 HIS 18 -7.023 3.473 0.846 126 HB3 HIS 18 HB1 HIS 18 -6.013 3.922 2.209 127 HD1 HIS 18 HD1 HIS 18 -7.252 5.258 4.169 128 HD2 HIS 18 HD2 HIS 18 -9.715 3.474 1.329 129 HE1 HIS 18 HE1 HIS 18 -9.570 5.283 5.158 130 HE2 HIS 18 HE2 HIS 18 -11.010 4.078 3.487 131 H ARG 19 HN ARG 19 -8.278 6.102 -0.754 132 HA ARG 19 HA ARG 19 -9.510 8.106 1.026 133 HB2 ARG 19 HB2 ARG 19 -9.580 8.010 -1.993 134 HB3 ARG 19 HB1 ARG 19 -10.416 9.173 -0.997 135 HG2 ARG 19 HG2 ARG 19 -8.307 10.073 -0.222 136 HG3 ARG 19 HG1 ARG 19 -7.440 8.889 -1.212 137 HD2 ARG 19 HD2 ARG 19 -7.626 11.086 -2.321 138 HD3 ARG 19 HD1 ARG 19 -8.417 9.785 -3.214 139 HE ARG 19 HE ARG 19 -10.398 10.877 -1.668 140 HH11 ARG 19 HH11 ARG 19 -8.183 12.091 -4.098 141 HH12 ARG 19 HH12 ARG 19 -9.302 13.280 -4.700 142 HH21 ARG 19 HH21 ARG 19 -11.867 12.446 -2.458 143 HH22 ARG 19 HH22 ARG 19 -11.373 13.516 -3.737 144 H ALA 20 HN ALA 20 -11.871 8.202 0.853 145 HA ALA 20 HA ALA 20 -13.153 6.012 -0.577 146 HB1 ALA 20 HB1 ALA 20 -13.043 4.845 1.396 147 HB2 ALA 20 HB2 ALA 20 -14.592 5.668 1.568 148 HB3 ALA 20 HB3 ALA 20 -13.164 6.297 2.388 149 H GLN 21 HN GLN 21 -15.121 6.547 -1.364 150 HA GLN 21 HA GLN 21 -16.659 8.626 -0.045 151 HB2 GLN 21 HB2 GLN 21 -16.672 10.100 -1.756 152 HB3 GLN 21 HB1 GLN 21 -15.239 9.277 -2.320 153 HG2 GLN 21 HG2 GLN 21 -18.004 8.608 -3.172 154 HG3 GLN 21 HG1 GLN 21 -16.903 9.664 -4.031 155 HE21 GLN 21 HE21 GLN 21 -18.221 7.141 -4.773 156 HE22 GLN 21 HE22 GLN 21 -16.951 6.085 -5.276 157 H VAL 22 HN VAL 22 -18.957 8.424 -0.603 158 HA VAL 22 HA VAL 22 -19.567 5.754 -1.644 159 HB VAL 22 HB VAL 22 -21.478 7.505 -0.140 160 HG11 VAL 22 HG11 VAL 22 -22.414 5.162 0.331 161 HG12 VAL 22 HG12 VAL 22 -21.442 4.662 -1.044 162 HG13 VAL 22 HG13 VAL 22 -22.698 5.883 -1.245 163 HG21 VAL 22 HG21 VAL 22 -20.952 6.245 1.851 164 HG22 VAL 22 HG22 VAL 22 -19.509 7.058 1.254 165 HG23 VAL 22 HG23 VAL 22 -19.727 5.329 0.979 166 H ARG 23 HN ARG 23 -20.549 5.541 -3.522 167 HA ARG 23 HA ARG 23 -21.437 7.894 -4.981 168 HB2 ARG 23 HB2 ARG 23 -22.291 5.810 -6.518 169 HB3 ARG 23 HB1 ARG 23 -20.672 6.494 -6.597 170 HG2 ARG 23 HG2 ARG 23 -19.706 4.723 -5.568 171 HG3 ARG 23 HG1 ARG 23 -21.136 4.354 -4.610 172 HD2 ARG 23 HD2 ARG 23 -20.636 2.637 -6.315 173 HD3 ARG 23 HD1 ARG 23 -22.221 3.377 -6.527 174 HE ARG 23 HE ARG 23 -21.376 4.564 -8.408 175 HH11 ARG 23 HH11 ARG 23 -19.077 2.303 -7.056 176 HH12 ARG 23 HH12 ARG 23 -18.260 2.020 -8.565 177 HH21 ARG 23 HH21 ARG 23 -20.289 4.229 -10.399 178 HH22 ARG 23 HH22 ARG 23 -18.926 3.149 -10.454 179 H LYS 24 HN LYS 24 -23.544 8.428 -5.454 180 HA LYS 24 HA LYS 24 -25.426 7.780 -3.423 181 HB2 LYS 24 HB2 LYS 24 -25.178 9.973 -4.711 182 HB3 LYS 24 HB1 LYS 24 -26.079 9.186 -6.000 183 HG2 LYS 24 HG2 LYS 24 -27.632 10.444 -4.726 184 HG3 LYS 24 HG1 LYS 24 -27.894 8.743 -4.334 185 HD2 LYS 24 HD2 LYS 24 -26.529 9.023 -2.303 186 HD3 LYS 24 HD1 LYS 24 -26.344 10.736 -2.683 187 HE2 LYS 24 HE2 LYS 24 -28.823 10.954 -2.603 188 HE3 LYS 24 HE1 LYS 24 -28.907 9.278 -2.057 189 HZ1 LYS 24 HZ1 LYS 24 -27.555 9.898 -0.127 190 HZ2 LYS 24 HZ2 LYS 24 -29.004 10.780 -0.188 191 HZ3 LYS 24 HZ3 LYS 24 -27.549 11.514 -0.649 192 H LYS 25 HN LYS 25 -24.570 6.144 -6.177 193 HA LYS 25 HA LYS 25 -26.938 4.458 -5.910 194 HB2 LYS 25 HB2 LYS 25 -27.426 5.847 -7.844 195 HB3 LYS 25 HB1 LYS 25 -25.864 5.457 -8.554 196 HG2 LYS 25 HG2 LYS 25 -26.482 3.244 -8.984 197 HG3 LYS 25 HG1 LYS 25 -27.883 3.336 -7.919 198 HD2 LYS 25 HD2 LYS 25 -28.897 4.970 -9.446 199 HD3 LYS 25 HD1 LYS 25 -27.526 4.762 -10.544 200 HE2 LYS 25 HE2 LYS 25 -28.049 2.435 -10.836 201 HE3 LYS 25 HE1 LYS 25 -29.309 2.527 -9.606 202 HZ1 LYS 25 HZ1 LYS 25 -29.334 3.965 -12.211 203 HZ2 LYS 25 HZ2 LYS 25 -30.559 4.009 -11.039 204 HZ3 LYS 25 HZ3 LYS 25 -30.216 2.559 -11.852 205 HA PRO 26 HA PRO 26 -23.515 1.540 -5.565 206 HB2 PRO 26 HB2 PRO 26 -25.797 -0.345 -5.643 207 HB3 PRO 26 HB1 PRO 26 -24.476 -0.218 -4.484 208 HG2 PRO 26 HG2 PRO 26 -26.955 0.593 -3.877 209 HG3 PRO 26 HG1 PRO 26 -25.518 1.437 -3.268 210 HD2 PRO 26 HD2 PRO 26 -27.394 2.213 -5.460 211 HD3 PRO 26 HD1 PRO 26 -26.533 3.236 -4.291 212 H THR 27 HN THR 27 -22.627 -0.019 -6.933 213 HA THR 27 HA THR 27 -23.216 0.486 -9.682 214 HB THR 27 HB THR 27 -20.900 0.156 -8.936 215 HG1 THR 27 HG1 THR 27 -20.684 -1.893 -10.523 216 HG21 THR 27 HG21 THR 27 -21.012 -1.466 -7.228 217 HG22 THR 27 HG22 THR 27 -20.165 -2.258 -8.555 218 HG23 THR 27 HG23 THR 27 -21.867 -2.609 -8.262 219 H VAL 28 HN VAL 28 -22.978 -1.691 -11.115 220 HA VAL 28 HA VAL 28 -25.440 -2.856 -11.284 221 HB VAL 28 HB VAL 28 -23.977 -3.041 -13.109 222 HG11 VAL 28 HG11 VAL 28 -21.870 -3.025 -11.834 223 HG12 VAL 28 HG12 VAL 28 -21.884 -4.257 -13.099 224 HG13 VAL 28 HG13 VAL 28 -22.134 -4.719 -11.414 225 HG21 VAL 28 HG21 VAL 28 -24.435 -5.767 -11.922 226 HG22 VAL 28 HG22 VAL 28 -23.957 -5.479 -13.595 227 HG23 VAL 28 HG23 VAL 28 -25.508 -4.882 -13.004 228 H GLU 29 HN GLU 29 -22.681 -4.027 -9.419 229 HA GLU 29 HA GLU 29 -24.199 -6.372 -8.592 230 HB2 GLU 29 HB2 GLU 29 -21.326 -5.597 -8.107 231 HB3 GLU 29 HB1 GLU 29 -22.061 -7.096 -7.549 232 HG2 GLU 29 HG2 GLU 29 -22.578 -7.651 -9.929 233 HG3 GLU 29 HG1 GLU 29 -21.689 -6.205 -10.403 234 H GLY 30 HN GLY 30 -24.097 -3.292 -7.566 235 HA2 GLY 30 HA2 GLY 30 -25.301 -2.504 -5.741 236 HA3 GLY 30 HA1 GLY 30 -25.305 -4.126 -5.068 237 H PHE 31 HN PHE 31 -22.422 -2.395 -6.038 238 HA PHE 31 HA PHE 31 -21.518 -2.431 -3.268 239 HB2 PHE 31 HB2 PHE 31 -19.946 -1.778 -5.775 240 HB3 PHE 31 HB1 PHE 31 -19.290 -2.062 -4.166 241 HD1 PHE 31 HD1 PHE 31 -21.192 -4.461 -3.588 242 HD2 PHE 31 HD2 PHE 31 -18.643 -3.492 -6.840 243 HE1 PHE 31 HE1 PHE 31 -20.951 -6.848 -4.099 244 HE2 PHE 31 HE2 PHE 31 -18.399 -5.869 -7.365 245 HZ PHE 31 HZ PHE 31 -19.556 -7.557 -5.998 246 H THR 32 HN THR 32 -21.313 -0.609 -2.099 247 HA THR 32 HA THR 32 -22.465 1.796 -3.309 248 HB THR 32 HB THR 32 -23.035 2.453 -1.025 249 HG1 THR 32 HG1 THR 32 -22.734 0.773 0.630 250 HG21 THR 32 HG21 THR 32 -23.839 -0.298 -1.781 251 HG22 THR 32 HG22 THR 32 -24.659 1.189 -2.215 252 HG23 THR 32 HG23 THR 32 -24.635 0.644 -0.536 253 H HIS 33 HN HIS 33 -19.635 0.706 -1.563 254 HA HIS 33 HA HIS 33 -18.746 3.491 -1.200 255 HB2 HIS 33 HB2 HIS 33 -18.212 0.949 0.305 256 HB3 HIS 33 HB1 HIS 33 -17.077 2.290 0.414 257 HD1 HIS 33 HD1 HIS 33 -20.819 1.686 1.009 258 HD2 HIS 33 HD2 HIS 33 -17.650 4.016 2.376 259 HE1 HIS 33 HE1 HIS 33 -21.702 2.951 3.016 260 HE2 HIS 33 HE2 HIS 33 -19.800 4.429 3.746 261 H ASP 34 HN ASP 34 -17.200 4.190 -2.510 262 HA ASP 34 HA ASP 34 -15.429 2.211 -3.788 263 HB2 ASP 34 HB2 ASP 34 -16.390 4.926 -4.672 264 HB3 ASP 34 HB1 ASP 34 -14.939 4.202 -5.358 265 H TRP 35 HN TRP 35 -13.276 2.402 -3.618 266 HA TRP 35 HA TRP 35 -12.206 4.699 -2.199 267 HB2 TRP 35 HB2 TRP 35 -10.930 3.202 -0.647 268 HB3 TRP 35 HB1 TRP 35 -12.659 3.263 -0.361 269 HD1 TRP 35 HD1 TRP 35 -13.974 0.978 -0.453 270 HE1 TRP 35 HE1 TRP 35 -13.240 -1.477 -0.797 271 HE3 TRP 35 HE3 TRP 35 -9.159 1.764 -1.989 272 HZ2 TRP 35 HZ2 TRP 35 -10.910 -2.884 -1.602 273 HZ3 TRP 35 HZ3 TRP 35 -7.748 -0.185 -2.509 274 HH2 TRP 35 HH2 TRP 35 -8.593 -2.453 -2.286 275 H MET 36 HN MET 36 -9.832 4.622 -2.075 276 HA MET 36 HA MET 36 -8.527 3.090 -4.193 277 HB2 MET 36 HB2 MET 36 -9.006 5.126 -5.343 278 HB3 MET 36 HB1 MET 36 -8.552 6.098 -3.950 279 HG2 MET 36 HG2 MET 36 -6.219 5.203 -4.229 280 HG3 MET 36 HG1 MET 36 -6.749 4.550 -5.779 281 HE1 MET 36 HE1 MET 36 -6.385 7.413 -3.511 282 HE2 MET 36 HE2 MET 36 -7.848 8.132 -4.197 283 HE3 MET 36 HE3 MET 36 -6.273 8.870 -4.503 284 H VAL 37 HN VAL 37 -6.543 2.413 -3.581 285 HA VAL 37 HA VAL 37 -5.510 3.441 -1.026 286 HB VAL 37 HB VAL 37 -4.053 1.227 -1.351 287 HG11 VAL 37 HG11 VAL 37 -6.836 1.369 -0.310 288 HG12 VAL 37 HG12 VAL 37 -5.379 1.756 0.589 289 HG13 VAL 37 HG13 VAL 37 -5.695 0.094 0.078 290 HG21 VAL 37 HG21 VAL 37 -5.069 0.629 -3.476 291 HG22 VAL 37 HG22 VAL 37 -6.667 0.650 -2.729 292 HG23 VAL 37 HG23 VAL 37 -5.479 -0.558 -2.238 293 H PHE 38 HN PHE 38 -3.277 3.604 -0.721 294 HA PHE 38 HA PHE 38 -1.759 4.377 -3.137 295 HB2 PHE 38 HB2 PHE 38 -2.348 5.778 -0.591 296 HB3 PHE 38 HB1 PHE 38 -0.691 5.888 -1.149 297 HD1 PHE 38 HD1 PHE 38 -0.133 7.067 -3.129 298 HD2 PHE 38 HD2 PHE 38 -4.153 6.910 -1.747 299 HE1 PHE 38 HE1 PHE 38 -0.693 8.986 -4.565 300 HE2 PHE 38 HE2 PHE 38 -4.733 8.808 -3.195 301 HZ PHE 38 HZ PHE 38 -3.016 9.856 -4.608 302 H VAL 39 HN VAL 39 0.020 3.106 -3.357 303 HA VAL 39 HA VAL 39 1.735 3.023 -0.984 304 HB VAL 39 HB VAL 39 2.726 0.861 -1.831 305 HG11 VAL 39 HG11 VAL 39 0.942 1.193 0.001 306 HG12 VAL 39 HG12 VAL 39 1.271 -0.434 -0.594 307 HG13 VAL 39 HG13 VAL 39 -0.151 0.444 -1.162 308 HG21 VAL 39 HG21 VAL 39 2.070 0.448 -3.971 309 HG22 VAL 39 HG22 VAL 39 0.470 1.145 -3.727 310 HG23 VAL 39 HG23 VAL 39 0.834 -0.466 -3.111 311 H ARG 40 HN ARG 40 3.504 4.175 -1.361 312 HA ARG 40 HA ARG 40 5.029 3.992 -3.775 313 HB2 ARG 40 HB2 ARG 40 4.677 6.190 -4.714 314 HB3 ARG 40 HB1 ARG 40 3.124 5.365 -4.631 315 HG2 ARG 40 HG2 ARG 40 2.341 6.709 -2.933 316 HG3 ARG 40 HG1 ARG 40 3.961 7.145 -2.391 317 HD2 ARG 40 HD2 ARG 40 4.213 8.396 -4.585 318 HD3 ARG 40 HD1 ARG 40 2.469 8.157 -4.803 319 HE ARG 40 HE ARG 40 2.558 9.219 -2.349 320 HH11 ARG 40 HH11 ARG 40 4.091 10.212 -5.346 321 HH12 ARG 40 HH12 ARG 40 4.160 11.890 -4.885 322 HH21 ARG 40 HH21 ARG 40 2.650 11.383 -1.754 323 HH22 ARG 40 HH22 ARG 40 3.349 12.565 -2.829 324 H GLY 41 HN GLY 41 6.507 6.182 -3.840 325 HA2 GLY 41 HA2 GLY 41 7.424 6.600 -1.075 326 HA3 GLY 41 HA1 GLY 41 8.358 6.936 -2.528 327 HA PRO 42 HA PRO 42 5.780 10.661 -1.091 328 HB2 PRO 42 HB2 PRO 42 7.688 11.863 0.593 329 HB3 PRO 42 HB1 PRO 42 6.209 11.050 1.102 330 HG2 PRO 42 HG2 PRO 42 8.896 10.195 1.476 331 HG3 PRO 42 HG1 PRO 42 7.431 9.325 1.936 332 HD2 PRO 42 HD2 PRO 42 9.250 8.906 -0.322 333 HD3 PRO 42 HD1 PRO 42 8.033 7.819 0.362 334 H GLU 43 HN GLU 43 6.423 13.032 -1.167 335 HA GLU 43 HA GLU 43 7.158 13.706 -3.666 336 HB2 GLU 43 HB2 GLU 43 7.410 15.247 -1.104 337 HB3 GLU 43 HB1 GLU 43 7.845 15.968 -2.644 338 HG2 GLU 43 HG2 GLU 43 5.580 16.550 -1.938 339 HG3 GLU 43 HG1 GLU 43 5.604 15.684 -3.468 340 H HIS 44 HN HIS 44 8.863 13.554 -4.840 341 HA HIS 44 HA HIS 44 10.930 14.071 -5.632 342 HB2 HIS 44 HB2 HIS 44 11.653 14.745 -2.782 343 HB3 HIS 44 HB1 HIS 44 12.730 14.935 -4.159 344 HD1 HIS 44 HD1 HIS 44 11.087 16.324 -6.204 345 HD2 HIS 44 HD2 HIS 44 10.802 17.236 -2.153 346 HE1 HIS 44 HE1 HIS 44 10.107 18.637 -6.093 347 HE2 HIS 44 HE2 HIS 44 9.774 19.091 -3.638 348 H SER 45 HN SER 45 10.425 11.822 -3.077 349 HA SER 45 HA SER 45 12.824 10.332 -3.859 350 HB2 SER 45 HB2 SER 45 11.936 8.793 -1.942 351 HB3 SER 45 HB1 SER 45 12.704 10.327 -1.536 352 HG SER 45 HG SER 45 9.910 10.148 -1.918 353 H ASN 46 HN ASN 46 12.640 8.964 -5.494 354 HA ASN 46 HA ASN 46 10.015 7.789 -6.094 355 HB2 ASN 46 HB2 ASN 46 12.418 8.423 -7.682 356 HB3 ASN 46 HB1 ASN 46 11.671 6.880 -8.075 357 HD21 ASN 46 HD21 ASN 46 11.375 10.309 -8.171 358 HD22 ASN 46 HD22 ASN 46 9.946 10.362 -9.156 359 H ILE 47 HN ILE 47 9.578 5.693 -5.697 360 HA ILE 47 HA ILE 47 11.608 4.262 -4.217 361 HB ILE 47 HB ILE 47 9.941 2.681 -3.595 362 HG12 ILE 47 HG12 ILE 47 8.016 4.183 -5.372 363 HG13 ILE 47 HG11 ILE 47 8.765 2.636 -5.779 364 HG21 ILE 47 HG21 ILE 47 10.067 4.694 -2.333 365 HG22 ILE 47 HG22 ILE 47 8.386 4.181 -2.440 366 HG23 ILE 47 HG23 ILE 47 8.971 5.514 -3.439 367 HD11 ILE 47 HD11 ILE 47 7.384 2.770 -3.191 368 HD12 ILE 47 HD12 ILE 47 7.433 1.474 -4.387 369 HD13 ILE 47 HD13 ILE 47 6.362 2.857 -4.626 370 H GLN 48 HN GLN 48 10.291 4.234 -7.380 371 HA GLN 48 HA GLN 48 10.546 1.578 -8.143 372 HB2 GLN 48 HB2 GLN 48 9.540 3.358 -9.525 373 HB3 GLN 48 HB1 GLN 48 11.134 4.050 -9.793 374 HG2 GLN 48 HG2 GLN 48 10.877 2.858 -11.730 375 HG3 GLN 48 HG1 GLN 48 11.675 1.670 -10.726 376 HE21 GLN 48 HE21 GLN 48 8.291 2.529 -10.291 377 HE22 GLN 48 HE22 GLN 48 7.663 1.022 -10.848 378 H HIS 49 HN HIS 49 12.971 3.646 -7.117 379 HA HIS 49 HA HIS 49 15.157 2.496 -8.591 380 HB2 HIS 49 HB2 HIS 49 14.889 4.487 -6.382 381 HB3 HIS 49 HB1 HIS 49 16.454 3.677 -6.586 382 HD1 HIS 49 HD1 HIS 49 16.889 3.667 -9.526 383 HD2 HIS 49 HD2 HIS 49 15.190 6.892 -7.533 384 HE1 HIS 49 HE1 HIS 49 17.217 5.649 -11.038 385 HE2 HIS 49 HE2 HIS 49 16.406 7.618 -9.697 386 H PHE 50 HN PHE 50 13.655 2.000 -5.430 387 HA PHE 50 HA PHE 50 15.461 -0.283 -5.041 388 HB2 PHE 50 HB2 PHE 50 15.230 0.028 -2.605 389 HB3 PHE 50 HB1 PHE 50 15.976 1.410 -3.405 390 HD1 PHE 50 HD1 PHE 50 12.886 0.222 -1.748 391 HD2 PHE 50 HD2 PHE 50 15.022 3.534 -3.346 392 HE1 PHE 50 HE1 PHE 50 11.325 1.758 -0.655 393 HE2 PHE 50 HE2 PHE 50 13.432 5.070 -2.267 394 HZ PHE 50 HZ PHE 50 11.584 4.183 -0.916 395 H VAL 51 HN VAL 51 12.418 0.463 -5.847 396 HA VAL 51 HA VAL 51 11.250 -1.873 -4.494 397 HB VAL 51 HB VAL 51 9.980 0.763 -5.266 398 HG11 VAL 51 HG11 VAL 51 7.969 -0.566 -4.023 399 HG12 VAL 51 HG12 VAL 51 8.719 -1.892 -4.929 400 HG13 VAL 51 HG13 VAL 51 8.141 -0.459 -5.782 401 HG21 VAL 51 HG21 VAL 51 9.283 0.563 -2.805 402 HG22 VAL 51 HG22 VAL 51 10.973 0.913 -3.155 403 HG23 VAL 51 HG23 VAL 51 10.485 -0.719 -2.703 404 H GLU 52 HN GLU 52 10.289 -3.374 -5.693 405 HA GLU 52 HA GLU 52 10.997 -3.333 -8.536 406 HB2 GLU 52 HB2 GLU 52 11.798 -5.225 -7.294 407 HB3 GLU 52 HB1 GLU 52 10.210 -5.525 -6.608 408 HG2 GLU 52 HG2 GLU 52 9.465 -5.959 -9.031 409 HG3 GLU 52 HG1 GLU 52 11.190 -6.067 -9.384 410 H LYS 53 HN LYS 53 8.285 -4.725 -6.707 411 HA LYS 53 HA LYS 53 6.434 -3.521 -8.606 412 HB2 LYS 53 HB2 LYS 53 5.190 -5.654 -8.759 413 HB3 LYS 53 HB1 LYS 53 6.807 -5.730 -9.450 414 HG2 LYS 53 HG2 LYS 53 7.625 -6.986 -7.558 415 HG3 LYS 53 HG1 LYS 53 6.123 -6.735 -6.674 416 HD2 LYS 53 HD2 LYS 53 5.008 -8.058 -8.567 417 HD3 LYS 53 HD1 LYS 53 6.634 -8.502 -9.085 418 HE2 LYS 53 HE2 LYS 53 5.312 -9.148 -6.476 419 HE3 LYS 53 HE1 LYS 53 5.832 -10.241 -7.739 420 HZ1 LYS 53 HZ1 LYS 53 7.659 -8.589 -6.097 421 HZ2 LYS 53 HZ2 LYS 53 8.124 -9.667 -7.312 422 HZ3 LYS 53 HZ3 LYS 53 7.388 -10.249 -5.900 423 H VAL 54 HN VAL 54 4.103 -4.216 -7.715 424 HA VAL 54 HA VAL 54 4.106 -4.082 -4.801 425 HB VAL 54 HB VAL 54 3.177 -1.950 -6.642 426 HG11 VAL 54 HG11 VAL 54 1.842 -2.019 -4.013 427 HG12 VAL 54 HG12 VAL 54 1.182 -3.073 -5.261 428 HG13 VAL 54 HG13 VAL 54 1.290 -1.335 -5.540 429 HG21 VAL 54 HG21 VAL 54 3.640 -0.897 -4.186 430 HG22 VAL 54 HG22 VAL 54 4.855 -1.079 -5.445 431 HG23 VAL 54 HG23 VAL 54 4.707 -2.295 -4.173 432 H VAL 55 HN VAL 55 2.351 -5.022 -3.852 433 HA VAL 55 HA VAL 55 0.206 -5.958 -5.629 434 HB VAL 55 HB VAL 55 2.172 -7.655 -4.277 435 HG11 VAL 55 HG11 VAL 55 -0.764 -8.033 -3.617 436 HG12 VAL 55 HG12 VAL 55 0.618 -8.007 -2.523 437 HG13 VAL 55 HG13 VAL 55 0.391 -9.366 -3.622 438 HG21 VAL 55 HG21 VAL 55 -0.089 -8.599 -5.996 439 HG22 VAL 55 HG22 VAL 55 1.595 -9.128 -5.949 440 HG23 VAL 55 HG23 VAL 55 1.175 -7.584 -6.693 441 H PHE 56 HN PHE 56 -1.774 -5.988 -4.802 442 HA PHE 56 HA PHE 56 -2.115 -5.197 -1.983 443 HB2 PHE 56 HB2 PHE 56 -3.701 -4.483 -4.453 444 HB3 PHE 56 HB1 PHE 56 -4.438 -4.422 -2.851 445 HD1 PHE 56 HD1 PHE 56 -1.629 -3.086 -4.886 446 HD2 PHE 56 HD2 PHE 56 -4.151 -2.561 -1.494 447 HE1 PHE 56 HE1 PHE 56 -0.730 -0.836 -4.582 448 HE2 PHE 56 HE2 PHE 56 -3.257 -0.289 -1.193 449 HZ PHE 56 HZ PHE 56 -1.543 0.577 -2.736 450 H HIS 57 HN HIS 57 -3.195 -6.635 -0.727 451 HA HIS 57 HA HIS 57 -4.669 -8.795 -2.109 452 HB2 HIS 57 HB2 HIS 57 -3.664 -8.693 0.758 453 HB3 HIS 57 HB1 HIS 57 -4.510 -10.045 0.008 454 HD1 HIS 57 HD1 HIS 57 -3.032 -11.833 -0.807 455 HD2 HIS 57 HD2 HIS 57 -1.084 -8.158 -0.735 456 HE1 HIS 57 HE1 HIS 57 -0.643 -12.314 -1.431 457 HE2 HIS 57 HE2 HIS 57 0.564 -10.118 -1.118 458 H LEU 58 HN LEU 58 -6.527 -7.539 -2.458 459 HA LEU 58 HA LEU 58 -7.903 -6.174 -0.377 460 HB2 LEU 58 HB2 LEU 58 -9.337 -7.396 -2.716 461 HB3 LEU 58 HB1 LEU 58 -9.717 -5.916 -1.850 462 HG LEU 58 HG LEU 58 -7.360 -6.249 -3.698 463 HD11 LEU 58 HD11 LEU 58 -8.575 -5.177 -5.301 464 HD12 LEU 58 HD12 LEU 58 -9.857 -4.708 -4.200 465 HD13 LEU 58 HD13 LEU 58 -9.674 -6.397 -4.686 466 HD21 LEU 58 HD21 LEU 58 -7.267 -4.517 -1.805 467 HD22 LEU 58 HD22 LEU 58 -8.552 -3.697 -2.686 468 HD23 LEU 58 HD23 LEU 58 -6.987 -3.961 -3.452 469 H HIS 59 HN HIS 59 -10.357 -6.979 0.004 470 HA HIS 59 HA HIS 59 -10.085 -9.304 1.633 471 HB2 HIS 59 HB2 HIS 59 -11.693 -7.243 1.858 472 HB3 HIS 59 HB1 HIS 59 -12.744 -8.177 0.803 473 HD1 HIS 59 HD1 HIS 59 -10.881 -8.708 4.091 474 HD2 HIS 59 HD2 HIS 59 -14.411 -9.803 2.172 475 HE1 HIS 59 HE1 HIS 59 -12.206 -10.015 5.787 476 HE2 HIS 59 HE2 HIS 59 -14.248 -10.822 4.549 477 H GLU 60 HN GLU 60 -10.952 -11.322 1.355 478 HA GLU 60 HA GLU 60 -10.549 -12.489 -1.125 479 HB2 GLU 60 HB2 GLU 60 -12.107 -13.510 1.240 480 HB3 GLU 60 HB1 GLU 60 -11.635 -14.504 -0.132 481 HG2 GLU 60 HG2 GLU 60 -9.729 -13.061 1.695 482 HG3 GLU 60 HG1 GLU 60 -10.151 -14.767 1.808 483 H SER 61 HN SER 61 -13.444 -11.081 0.122 484 HA SER 61 HA SER 61 -15.280 -12.313 -1.649 485 HB2 SER 61 HB2 SER 61 -15.986 -11.200 0.431 486 HB3 SER 61 HB1 SER 61 -15.472 -9.646 -0.226 487 HG SER 61 HG SER 61 -17.768 -10.133 -0.429 488 H PHE 62 HN PHE 62 -12.872 -9.947 -2.136 489 HA PHE 62 HA PHE 62 -14.204 -8.681 -4.385 490 HB2 PHE 62 HB2 PHE 62 -11.421 -8.389 -3.236 491 HB3 PHE 62 HB1 PHE 62 -11.994 -7.502 -4.637 492 HD1 PHE 62 HD1 PHE 62 -13.081 -8.196 -1.132 493 HD2 PHE 62 HD2 PHE 62 -12.718 -5.369 -4.281 494 HE1 PHE 62 HE1 PHE 62 -13.966 -6.437 0.347 495 HE2 PHE 62 HE2 PHE 62 -13.605 -3.605 -2.818 496 HZ PHE 62 HZ PHE 62 -14.231 -4.139 -0.496 497 HA PRO 63 HA PRO 63 -12.878 -11.883 -7.212 498 HB2 PRO 63 HB2 PRO 63 -13.438 -9.800 -9.239 499 HB3 PRO 63 HB1 PRO 63 -14.113 -11.425 -9.081 500 HG2 PRO 63 HG2 PRO 63 -15.575 -9.272 -8.499 501 HG3 PRO 63 HG1 PRO 63 -15.704 -10.757 -7.536 502 HD2 PRO 63 HD2 PRO 63 -14.247 -8.214 -6.915 503 HD3 PRO 63 HD1 PRO 63 -15.225 -9.243 -5.846 504 H ARG 64 HN ARG 64 -10.808 -12.322 -7.653 505 HA ARG 64 HA ARG 64 -8.555 -12.033 -7.899 506 HB2 ARG 64 HB2 ARG 64 -9.527 -9.802 -9.691 507 HB3 ARG 64 HB1 ARG 64 -7.841 -10.280 -9.564 508 HG2 ARG 64 HG2 ARG 64 -8.284 -12.409 -10.511 509 HG3 ARG 64 HG1 ARG 64 -10.027 -12.168 -10.395 510 HD2 ARG 64 HD2 ARG 64 -9.198 -11.842 -12.670 511 HD3 ARG 64 HD1 ARG 64 -9.931 -10.384 -12.011 512 HE ARG 64 HE ARG 64 -7.012 -10.818 -12.229 513 HH11 ARG 64 HH11 ARG 64 -9.820 -8.708 -12.190 514 HH12 ARG 64 HH12 ARG 64 -8.916 -7.287 -12.623 515 HH21 ARG 64 HH21 ARG 64 -5.824 -8.948 -12.778 516 HH22 ARG 64 HH22 ARG 64 -6.637 -7.420 -12.950 517 HA PRO 65 HA PRO 65 -8.854 -8.579 -4.838 518 HB2 PRO 65 HB2 PRO 65 -7.854 -9.889 -2.673 519 HB3 PRO 65 HB1 PRO 65 -9.562 -9.909 -3.124 520 HG2 PRO 65 HG2 PRO 65 -7.465 -11.978 -3.539 521 HG3 PRO 65 HG1 PRO 65 -9.190 -12.173 -3.179 522 HD2 PRO 65 HD2 PRO 65 -8.068 -12.475 -5.681 523 HD3 PRO 65 HD1 PRO 65 -9.772 -12.091 -5.380 524 H LYS 66 HN LYS 66 -6.224 -10.680 -5.643 525 HA LYS 66 HA LYS 66 -4.217 -8.931 -4.617 526 HB2 LYS 66 HB2 LYS 66 -3.749 -11.309 -4.723 527 HB3 LYS 66 HB1 LYS 66 -4.034 -11.320 -6.457 528 HG2 LYS 66 HG2 LYS 66 -2.070 -9.997 -6.853 529 HG3 LYS 66 HG1 LYS 66 -1.830 -9.763 -5.121 530 HD2 LYS 66 HD2 LYS 66 -1.244 -11.993 -4.781 531 HD3 LYS 66 HD1 LYS 66 -1.897 -12.506 -6.338 532 HE2 LYS 66 HE2 LYS 66 -0.105 -11.286 -7.474 533 HE3 LYS 66 HE1 LYS 66 0.531 -10.766 -5.913 534 HZ1 LYS 66 HZ1 LYS 66 0.887 -13.103 -5.344 535 HZ2 LYS 66 HZ2 LYS 66 1.757 -12.668 -6.733 536 HZ3 LYS 66 HZ3 LYS 66 0.331 -13.571 -6.874 537 H ARG 67 HN ARG 67 -3.988 -7.035 -5.515 538 HA ARG 67 HA ARG 67 -4.267 -6.785 -8.435 539 HB2 ARG 67 HB2 ARG 67 -4.292 -4.438 -6.546 540 HB3 ARG 67 HB1 ARG 67 -5.035 -4.591 -8.133 541 HG2 ARG 67 HG2 ARG 67 -5.974 -5.968 -5.626 542 HG3 ARG 67 HG1 ARG 67 -6.690 -4.525 -6.340 543 HD2 ARG 67 HD2 ARG 67 -6.496 -7.222 -7.689 544 HD3 ARG 67 HD1 ARG 67 -7.930 -6.583 -6.882 545 HE ARG 67 HE ARG 67 -6.752 -5.053 -9.097 546 HH11 ARG 67 HH11 ARG 67 -9.347 -7.096 -7.919 547 HH12 ARG 67 HH12 ARG 67 -10.503 -6.508 -9.079 548 HH21 ARG 67 HH21 ARG 67 -8.258 -4.287 -10.612 549 HH22 ARG 67 HH22 ARG 67 -9.884 -4.898 -10.607 550 H VAL 68 HN VAL 68 -2.343 -6.716 -9.423 551 HA VAL 68 HA VAL 68 -0.033 -5.894 -7.842 552 HB VAL 68 HB VAL 68 1.319 -7.149 -9.192 553 HG11 VAL 68 HG11 VAL 68 -0.259 -8.678 -8.171 554 HG12 VAL 68 HG12 VAL 68 0.210 -9.266 -9.768 555 HG13 VAL 68 HG13 VAL 68 -1.358 -8.491 -9.540 556 HG21 VAL 68 HG21 VAL 68 0.904 -5.990 -11.252 557 HG22 VAL 68 HG22 VAL 68 -0.643 -6.819 -11.454 558 HG23 VAL 68 HG23 VAL 68 0.866 -7.732 -11.536 559 H CYS 69 HN CYS 69 1.264 -4.206 -8.328 560 HA CYS 69 HA CYS 69 0.660 -2.615 -10.723 561 HB2 CYS 69 HB2 CYS 69 1.133 -1.539 -7.924 562 HB3 CYS 69 HB1 CYS 69 1.006 -0.556 -9.379 563 HG CYS 69 HG CYS 69 -1.670 -1.620 -9.858 564 H LYS 70 HN LYS 70 2.442 -2.652 -11.944 565 HA LYS 70 HA LYS 70 5.071 -2.959 -10.616 566 HB2 LYS 70 HB2 LYS 70 4.461 -3.513 -13.523 567 HB3 LYS 70 HB1 LYS 70 5.848 -4.049 -12.591 568 HG2 LYS 70 HG2 LYS 70 4.534 -5.648 -11.403 569 HG3 LYS 70 HG1 LYS 70 3.040 -4.977 -12.057 570 HD2 LYS 70 HD2 LYS 70 3.684 -5.672 -14.293 571 HD3 LYS 70 HD1 LYS 70 5.219 -6.287 -13.675 572 HE2 LYS 70 HE2 LYS 70 2.476 -7.291 -12.925 573 HE3 LYS 70 HE1 LYS 70 3.604 -8.089 -14.022 574 HZ1 LYS 70 HZ1 LYS 70 5.181 -8.228 -12.142 575 HZ2 LYS 70 HZ2 LYS 70 3.752 -9.102 -11.883 576 HZ3 LYS 70 HZ3 LYS 70 3.983 -7.610 -11.116 577 H ASP 71 HN ASP 71 3.284 -0.565 -11.608 578 HA ASP 71 HA ASP 71 5.253 0.770 -13.337 579 HB2 ASP 71 HB2 ASP 71 2.265 1.043 -13.018 580 HB3 ASP 71 HB1 ASP 71 3.210 2.279 -13.833 581 HA PRO 72 HA PRO 72 5.608 4.585 -10.636 582 HB2 PRO 72 HB2 PRO 72 3.613 5.539 -12.675 583 HB3 PRO 72 HB1 PRO 72 4.914 6.446 -11.899 584 HG2 PRO 72 HG2 PRO 72 5.264 5.450 -14.326 585 HG3 PRO 72 HG1 PRO 72 6.571 5.373 -13.129 586 HD2 PRO 72 HD2 PRO 72 4.893 3.208 -14.212 587 HD3 PRO 72 HD1 PRO 72 6.496 3.127 -13.464 588 HA PRO 73 HA PRO 73 2.744 5.624 -7.523 589 HB2 PRO 73 HB2 PRO 73 0.674 6.631 -9.439 590 HB3 PRO 73 HB1 PRO 73 1.055 7.204 -7.811 591 HG2 PRO 73 HG2 PRO 73 2.082 8.315 -10.108 592 HG3 PRO 73 HG1 PRO 73 2.878 8.397 -8.531 593 HD2 PRO 73 HD2 PRO 73 3.790 7.055 -10.874 594 HD3 PRO 73 HD1 PRO 73 4.543 7.055 -9.268 595 H TYR 74 HN TYR 74 2.172 3.793 -6.683 596 HA TYR 74 HA TYR 74 0.593 1.834 -8.124 597 HB2 TYR 74 HB2 TYR 74 1.759 1.602 -5.348 598 HB3 TYR 74 HB1 TYR 74 1.341 0.285 -6.434 599 HD1 TYR 74 HD2 TYR 74 3.674 3.186 -6.114 600 HD2 TYR 74 HD1 TYR 74 3.028 -0.692 -7.725 601 HE1 TYR 74 HE2 TYR 74 6.010 3.110 -6.850 602 HE2 TYR 74 HE1 TYR 74 5.372 -0.774 -8.467 603 HH TYR 74 HH TYR 74 7.206 0.669 -8.946 604 H LYS 75 HN LYS 75 -1.496 1.332 -7.647 605 HA LYS 75 HA LYS 75 -2.743 2.146 -5.163 606 HB2 LYS 75 HB2 LYS 75 -4.423 3.575 -6.210 607 HB3 LYS 75 HB1 LYS 75 -2.817 4.242 -6.456 608 HG2 LYS 75 HG2 LYS 75 -2.778 3.444 -8.710 609 HG3 LYS 75 HG1 LYS 75 -4.294 2.588 -8.482 610 HD2 LYS 75 HD2 LYS 75 -4.495 4.740 -9.722 611 HD3 LYS 75 HD1 LYS 75 -5.511 4.627 -8.288 612 HE2 LYS 75 HE2 LYS 75 -3.928 5.972 -7.034 613 HE3 LYS 75 HE1 LYS 75 -2.842 6.011 -8.418 614 HZ1 LYS 75 HZ1 LYS 75 -5.590 7.136 -8.415 615 HZ2 LYS 75 HZ2 LYS 75 -4.443 7.269 -9.656 616 HZ3 LYS 75 HZ3 LYS 75 -4.178 8.048 -8.171 617 H VAL 76 HN VAL 76 -4.918 1.521 -5.048 618 HA VAL 76 HA VAL 76 -5.936 -0.207 -7.189 619 HB VAL 76 HB VAL 76 -5.933 -0.862 -4.258 620 HG11 VAL 76 HG11 VAL 76 -8.244 -0.932 -5.251 621 HG12 VAL 76 HG12 VAL 76 -7.663 -2.450 -4.564 622 HG13 VAL 76 HG13 VAL 76 -7.664 -2.213 -6.315 623 HG21 VAL 76 HG21 VAL 76 -4.122 -1.811 -5.538 624 HG22 VAL 76 HG22 VAL 76 -5.245 -2.394 -6.758 625 HG23 VAL 76 HG23 VAL 76 -5.268 -3.086 -5.137 626 H GLU 77 HN GLU 77 -7.819 0.457 -7.899 627 HA GLU 77 HA GLU 77 -9.476 2.169 -6.162 628 HB2 GLU 77 HB2 GLU 77 -9.403 2.051 -9.176 629 HB3 GLU 77 HB1 GLU 77 -10.411 3.100 -8.214 630 HG2 GLU 77 HG2 GLU 77 -8.714 4.469 -7.615 631 HG3 GLU 77 HG1 GLU 77 -7.510 3.210 -7.832 632 H GLU 78 HN GLU 78 -11.080 1.059 -5.360 633 HA GLU 78 HA GLU 78 -12.445 -0.894 -7.070 634 HB2 GLU 78 HB2 GLU 78 -10.941 -1.494 -4.595 635 HB3 GLU 78 HB1 GLU 78 -12.527 -2.246 -4.711 636 HG2 GLU 78 HG2 GLU 78 -10.143 -2.599 -6.491 637 HG3 GLU 78 HG1 GLU 78 -11.045 -3.805 -5.578 638 H SER 79 HN SER 79 -14.310 -1.900 -5.638 639 HA SER 79 HA SER 79 -15.639 0.202 -4.119 640 HB2 SER 79 HB2 SER 79 -16.245 0.554 -6.510 641 HB3 SER 79 HB1 SER 79 -16.931 -1.075 -6.543 642 HG SER 79 HG SER 79 -17.908 1.265 -5.408 643 H GLY 80 HN GLY 80 -17.203 -0.543 -2.724 644 HA2 GLY 80 HA2 GLY 80 -18.020 -3.291 -2.600 645 HA3 GLY 80 HA1 GLY 80 -16.779 -2.900 -1.412 646 H TYR 81 HN TYR 81 -18.281 -3.187 0.365 647 HA TYR 81 HA TYR 81 -19.843 -0.761 0.768 648 HB2 TYR 81 HB2 TYR 81 -21.851 -2.053 1.538 649 HB3 TYR 81 HB1 TYR 81 -21.526 -2.150 -0.191 650 HD1 TYR 81 HD2 TYR 81 -21.470 -4.033 2.974 651 HD2 TYR 81 HD1 TYR 81 -20.914 -4.230 -1.236 652 HE1 TYR 81 HE2 TYR 81 -21.509 -6.485 3.093 653 HE2 TYR 81 HE1 TYR 81 -20.956 -6.686 -1.131 654 HH TYR 81 HH TYR 81 -22.098 -8.398 1.447 655 H ALA 82 HN ALA 82 -17.476 -2.384 1.951 656 HA ALA 82 HA ALA 82 -18.011 -1.617 4.664 657 HB1 ALA 82 HB1 ALA 82 -19.026 -3.733 4.870 658 HB2 ALA 82 HB2 ALA 82 -17.411 -3.927 5.543 659 HB3 ALA 82 HB3 ALA 82 -17.769 -4.520 3.921 660 H GLY 83 HN GLY 83 -16.084 -1.857 6.033 661 HA2 GLY 83 HA2 GLY 83 -13.643 -1.591 4.429 662 HA3 GLY 83 HA1 GLY 83 -13.864 -1.009 6.073 663 H PHE 84 HN PHE 84 -11.599 -2.282 5.678 664 HA PHE 84 HA PHE 84 -11.614 -4.564 7.317 665 HB2 PHE 84 HB2 PHE 84 -10.991 -6.286 5.621 666 HB3 PHE 84 HB1 PHE 84 -12.648 -5.725 5.446 667 HD1 PHE 84 HD1 PHE 84 -13.156 -4.027 3.633 668 HD2 PHE 84 HD2 PHE 84 -9.481 -6.161 3.829 669 HE1 PHE 84 HE1 PHE 84 -12.736 -3.503 1.271 670 HE2 PHE 84 HE2 PHE 84 -9.040 -5.637 1.478 671 HZ PHE 84 HZ PHE 84 -10.663 -4.309 0.181 672 H ILE 85 HN ILE 85 -9.459 -5.350 7.722 673 HA ILE 85 HA ILE 85 -7.305 -3.612 7.125 674 HB ILE 85 HB ILE 85 -7.382 -6.462 8.114 675 HG12 ILE 85 HG12 ILE 85 -8.067 -4.677 9.679 676 HG13 ILE 85 HG11 ILE 85 -6.593 -5.492 10.194 677 HG21 ILE 85 HG21 ILE 85 -4.914 -4.777 7.702 678 HG22 ILE 85 HG22 ILE 85 -5.352 -6.217 6.782 679 HG23 ILE 85 HG23 ILE 85 -4.974 -6.348 8.500 680 HD11 ILE 85 HD11 ILE 85 -6.629 -2.862 8.745 681 HD12 ILE 85 HD12 ILE 85 -5.249 -3.655 9.501 682 HD13 ILE 85 HD13 ILE 85 -6.563 -3.034 10.498 683 H LEU 86 HN LEU 86 -6.107 -3.430 5.342 684 HA LEU 86 HA LEU 86 -6.312 -5.590 3.348 685 HB2 LEU 86 HB2 LEU 86 -7.170 -3.117 2.912 686 HB3 LEU 86 HB1 LEU 86 -5.465 -2.832 2.600 687 HG LEU 86 HG LEU 86 -6.741 -5.130 1.211 688 HD11 LEU 86 HD11 LEU 86 -7.025 -2.331 0.158 689 HD12 LEU 86 HD12 LEU 86 -8.314 -3.164 1.030 690 HD13 LEU 86 HD13 LEU 86 -7.709 -3.823 -0.489 691 HD21 LEU 86 HD21 LEU 86 -5.154 -3.299 -0.310 692 HD22 LEU 86 HD22 LEU 86 -4.928 -5.027 -0.050 693 HD23 LEU 86 HD23 LEU 86 -4.293 -3.863 1.118 694 HA PRO 87 HA PRO 87 -1.976 -5.899 4.450 695 HB2 PRO 87 HB2 PRO 87 -2.022 -8.403 2.989 696 HB3 PRO 87 HB1 PRO 87 -1.801 -8.139 4.717 697 HG2 PRO 87 HG2 PRO 87 -4.025 -9.302 3.634 698 HG3 PRO 87 HG1 PRO 87 -4.018 -8.430 5.176 699 HD2 PRO 87 HD2 PRO 87 -4.946 -7.522 2.486 700 HD3 PRO 87 HD1 PRO 87 -5.633 -7.191 4.091 701 H ILE 88 HN ILE 88 -1.115 -4.352 3.118 702 HA ILE 88 HA ILE 88 -0.942 -4.939 0.260 703 HB ILE 88 HB ILE 88 -0.037 -2.387 1.591 704 HG12 ILE 88 HG12 ILE 88 -2.713 -2.773 0.262 705 HG13 ILE 88 HG11 ILE 88 -2.523 -2.980 1.999 706 HG21 ILE 88 HG21 ILE 88 0.777 -2.885 -0.676 707 HG22 ILE 88 HG22 ILE 88 -0.276 -1.470 -0.639 708 HG23 ILE 88 HG23 ILE 88 -0.893 -3.012 -1.231 709 HD11 ILE 88 HD11 ILE 88 -1.639 -0.673 2.018 710 HD12 ILE 88 HD12 ILE 88 -3.331 -0.807 1.599 711 HD13 ILE 88 HD13 ILE 88 -2.122 -0.514 0.345 712 H GLU 89 HN GLU 89 1.095 -4.871 -0.805 713 HA GLU 89 HA GLU 89 3.411 -5.019 0.984 714 HB2 GLU 89 HB2 GLU 89 3.000 -6.984 -1.280 715 HB3 GLU 89 HB1 GLU 89 4.274 -6.976 -0.065 716 HG2 GLU 89 HG2 GLU 89 2.672 -7.479 1.675 717 HG3 GLU 89 HG1 GLU 89 1.352 -7.408 0.513 718 H VAL 90 HN VAL 90 5.054 -3.884 0.333 719 HA VAL 90 HA VAL 90 5.102 -2.917 -2.446 720 HB VAL 90 HB VAL 90 6.535 -1.649 -0.110 721 HG11 VAL 90 HG11 VAL 90 7.586 -0.710 -1.893 722 HG12 VAL 90 HG12 VAL 90 6.170 0.337 -1.860 723 HG13 VAL 90 HG13 VAL 90 6.237 -1.020 -2.984 724 HG21 VAL 90 HG21 VAL 90 3.949 -1.749 -0.041 725 HG22 VAL 90 HG22 VAL 90 4.037 -0.532 -1.313 726 HG23 VAL 90 HG23 VAL 90 4.757 -0.213 0.266 727 H TYR 91 HN TYR 91 6.452 -4.066 -3.617 728 HA TYR 91 HA TYR 91 8.294 -5.831 -2.307 729 HB2 TYR 91 HB2 TYR 91 7.643 -5.474 -5.229 730 HB3 TYR 91 HB1 TYR 91 8.523 -6.824 -4.514 731 HD1 TYR 91 HD2 TYR 91 5.138 -5.136 -4.363 732 HD2 TYR 91 HD1 TYR 91 7.429 -8.595 -3.648 733 HE1 TYR 91 HE2 TYR 91 3.115 -6.401 -3.813 734 HE2 TYR 91 HE1 TYR 91 5.405 -9.805 -3.139 735 HH TYR 91 HH TYR 91 3.097 -9.167 -2.149 736 H PHE 92 HN PHE 92 10.471 -5.997 -2.553 737 HA PHE 92 HA PHE 92 11.762 -3.431 -3.235 738 HB2 PHE 92 HB2 PHE 92 12.398 -5.532 -1.150 739 HB3 PHE 92 HB1 PHE 92 13.466 -4.175 -1.519 740 HD1 PHE 92 HD1 PHE 92 11.212 -2.141 -1.933 741 HD2 PHE 92 HD2 PHE 92 11.967 -5.000 1.119 742 HE1 PHE 92 HE1 PHE 92 10.053 -0.704 -0.313 743 HE2 PHE 92 HE2 PHE 92 10.776 -3.567 2.741 744 HZ PHE 92 HZ PHE 92 9.842 -1.416 2.022 745 H LYS 93 HN LYS 93 13.978 -3.533 -4.037 746 HA LYS 93 HA LYS 93 14.566 -5.977 -5.575 747 HB2 LYS 93 HB2 LYS 93 15.810 -3.236 -5.865 748 HB3 LYS 93 HB1 LYS 93 15.994 -4.593 -6.965 749 HG2 LYS 93 HG2 LYS 93 13.753 -4.382 -7.719 750 HG3 LYS 93 HG1 LYS 93 13.379 -3.210 -6.445 751 HD2 LYS 93 HD2 LYS 93 14.881 -1.597 -7.418 752 HD3 LYS 93 HD1 LYS 93 15.471 -2.780 -8.584 753 HE2 LYS 93 HE2 LYS 93 12.975 -2.870 -9.334 754 HE3 LYS 93 HE1 LYS 93 12.859 -1.310 -8.514 755 HZ1 LYS 93 HZ1 LYS 93 13.361 -1.033 -10.851 756 HZ2 LYS 93 HZ2 LYS 93 14.758 -1.979 -10.695 757 HZ3 LYS 93 HZ3 LYS 93 14.656 -0.484 -9.903 758 H ASN 94 HN ASN 94 15.688 -7.207 -3.959 759 HA ASN 94 HA ASN 94 18.439 -6.386 -3.703 760 HB2 ASN 94 HB2 ASN 94 18.609 -6.563 -1.286 761 HB3 ASN 94 HB1 ASN 94 17.455 -5.311 -1.717 762 HD21 ASN 94 HD21 ASN 94 16.354 -5.337 0.183 763 HD22 ASN 94 HD22 ASN 94 15.404 -6.677 0.727 764 H LYS 95 HN LYS 95 19.784 -8.081 -2.647 765 HA LYS 95 HA LYS 95 18.684 -10.769 -3.161 766 HB2 LYS 95 HB2 LYS 95 20.623 -9.986 -4.559 767 HB3 LYS 95 HB1 LYS 95 21.572 -9.907 -3.087 768 HG2 LYS 95 HG2 LYS 95 21.341 -12.296 -2.774 769 HG3 LYS 95 HG1 LYS 95 20.317 -12.399 -4.211 770 HD2 LYS 95 HD2 LYS 95 22.184 -11.545 -5.573 771 HD3 LYS 95 HD1 LYS 95 23.202 -11.512 -4.133 772 HE2 LYS 95 HE2 LYS 95 21.948 -13.947 -5.400 773 HE3 LYS 95 HE1 LYS 95 23.653 -13.501 -5.445 774 HZ1 LYS 95 HZ1 LYS 95 23.574 -13.630 -2.941 775 HZ2 LYS 95 HZ2 LYS 95 23.455 -15.106 -3.770 776 HZ3 LYS 95 HZ3 LYS 95 22.065 -14.392 -3.109 777 H GLU 96 HN GLU 96 19.304 -8.664 -0.800 778 HA GLU 96 HA GLU 96 20.239 -10.614 1.163 779 HB2 GLU 96 HB2 GLU 96 20.524 -8.579 2.645 780 HB3 GLU 96 HB1 GLU 96 21.593 -8.642 1.251 781 HG2 GLU 96 HG2 GLU 96 20.290 -7.016 0.097 782 HG3 GLU 96 HG1 GLU 96 19.047 -7.057 1.351 783 H GLU 97 HN GLU 97 19.039 -8.866 3.305 784 HA GLU 97 HA GLU 97 16.946 -10.407 4.068 785 HB2 GLU 97 HB2 GLU 97 16.192 -8.503 5.480 786 HB3 GLU 97 HB1 GLU 97 17.912 -8.857 5.599 787 HG2 GLU 97 HG2 GLU 97 18.418 -6.959 4.177 788 HG3 GLU 97 HG1 GLU 97 16.694 -6.634 3.977 789 HA PRO 98 HA PRO 98 13.053 -10.427 2.496 790 HB2 PRO 98 HB2 PRO 98 11.674 -8.161 3.610 791 HB3 PRO 98 HB1 PRO 98 11.543 -9.859 4.083 792 HG2 PRO 98 HG2 PRO 98 13.270 -7.706 5.198 793 HG3 PRO 98 HG1 PRO 98 12.528 -9.102 6.015 794 HD2 PRO 98 HD2 PRO 98 15.114 -9.131 5.535 795 HD3 PRO 98 HD1 PRO 98 14.157 -10.590 5.162 796 H ARG 99 HN ARG 99 12.457 -10.063 0.504 797 HA ARG 99 HA ARG 99 13.094 -7.558 -0.846 798 HB2 ARG 99 HB2 ARG 99 12.277 -10.291 -1.733 799 HB3 ARG 99 HB1 ARG 99 12.056 -8.927 -2.823 800 HG2 ARG 99 HG2 ARG 99 14.361 -8.414 -2.765 801 HG3 ARG 99 HG1 ARG 99 14.641 -9.631 -1.519 802 HD2 ARG 99 HD2 ARG 99 15.251 -10.278 -3.889 803 HD3 ARG 99 HD1 ARG 99 14.188 -11.420 -3.076 804 HE ARG 99 HE ARG 99 12.613 -9.564 -4.477 805 HH11 ARG 99 HH11 ARG 99 14.895 -12.136 -5.144 806 HH12 ARG 99 HH12 ARG 99 14.205 -12.519 -6.695 807 HH21 ARG 99 HH21 ARG 99 11.694 -10.064 -6.494 808 HH22 ARG 99 HH22 ARG 99 12.358 -11.355 -7.458 809 H LYS 100 HN LYS 100 10.835 -8.027 1.115 810 HA LYS 100 HA LYS 100 8.829 -6.577 -0.352 811 HB2 LYS 100 HB2 LYS 100 7.021 -8.217 0.226 812 HB3 LYS 100 HB1 LYS 100 8.150 -8.781 -0.999 813 HG2 LYS 100 HG2 LYS 100 9.368 -10.012 0.797 814 HG3 LYS 100 HG1 LYS 100 8.071 -9.566 1.904 815 HD2 LYS 100 HD2 LYS 100 7.673 -11.123 -0.650 816 HD3 LYS 100 HD1 LYS 100 7.864 -11.858 0.938 817 HE2 LYS 100 HE2 LYS 100 5.577 -11.817 0.720 818 HE3 LYS 100 HE1 LYS 100 5.869 -10.319 1.600 819 HZ1 LYS 100 HZ1 LYS 100 5.761 -9.146 -0.561 820 HZ2 LYS 100 HZ2 LYS 100 4.316 -9.932 -0.164 821 HZ3 LYS 100 HZ3 LYS 100 5.357 -10.607 -1.324 822 H VAL 101 HN VAL 101 7.546 -5.386 0.927 823 HA VAL 101 HA VAL 101 7.786 -5.805 3.834 824 HB VAL 101 HB VAL 101 8.962 -3.748 3.109 825 HG11 VAL 101 HG11 VAL 101 7.893 -2.956 1.212 826 HG12 VAL 101 HG12 VAL 101 7.411 -1.798 2.463 827 HG13 VAL 101 HG13 VAL 101 6.292 -3.065 1.958 828 HG21 VAL 101 HG21 VAL 101 7.973 -2.238 4.724 829 HG22 VAL 101 HG22 VAL 101 7.985 -3.895 5.340 830 HG23 VAL 101 HG23 VAL 101 6.487 -3.194 4.726 831 H ARG 102 HN ARG 102 5.893 -5.835 4.995 832 HA ARG 102 HA ARG 102 3.449 -5.754 3.367 833 HB2 ARG 102 HB2 ARG 102 4.023 -7.945 4.392 834 HB3 ARG 102 HB1 ARG 102 3.932 -7.192 5.977 835 HG2 ARG 102 HG2 ARG 102 1.594 -6.729 5.711 836 HG3 ARG 102 HG1 ARG 102 1.615 -7.301 4.044 837 HD2 ARG 102 HD2 ARG 102 0.679 -9.023 5.408 838 HD3 ARG 102 HD1 ARG 102 2.286 -9.547 4.911 839 HE ARG 102 HE ARG 102 2.324 -8.227 7.445 840 HH11 ARG 102 HH11 ARG 102 1.563 -11.277 5.882 841 HH12 ARG 102 HH12 ARG 102 1.881 -12.230 7.304 842 HH21 ARG 102 HH21 ARG 102 2.720 -9.484 9.323 843 HH22 ARG 102 HH22 ARG 102 2.532 -11.213 9.256 844 H PHE 103 HN PHE 103 2.225 -4.053 3.671 845 HA PHE 103 HA PHE 103 2.240 -2.773 6.309 846 HB2 PHE 103 HB2 PHE 103 1.501 -1.671 3.591 847 HB3 PHE 103 HB1 PHE 103 1.383 -0.779 5.103 848 HD1 PHE 103 HD1 PHE 103 3.928 -1.620 6.412 849 HD2 PHE 103 HD2 PHE 103 3.093 -0.497 2.395 850 HE1 PHE 103 HE1 PHE 103 6.242 -0.812 6.158 851 HE2 PHE 103 HE2 PHE 103 5.403 0.298 2.133 852 HZ PHE 103 HZ PHE 103 6.976 0.147 4.017 853 H ASP 104 HN ASP 104 0.687 -3.893 7.379 854 HA ASP 104 HA ASP 104 -1.859 -4.527 6.250 855 HB2 ASP 104 HB2 ASP 104 -2.481 -4.958 8.693 856 HB3 ASP 104 HB1 ASP 104 -1.180 -5.935 8.031 857 H TYR 105 HN TYR 105 -2.732 -2.689 5.407 858 HA TYR 105 HA TYR 105 -2.944 -0.340 7.127 859 HB2 TYR 105 HB2 TYR 105 -2.078 -0.093 4.830 860 HB3 TYR 105 HB1 TYR 105 -3.609 -0.701 4.199 861 HD1 TYR 105 HD1 TYR 105 -2.333 1.993 6.448 862 HD2 TYR 105 HD2 TYR 105 -5.169 0.818 3.534 863 HE1 TYR 105 HE1 TYR 105 -3.172 4.310 6.371 864 HE2 TYR 105 HE2 TYR 105 -6.055 3.093 3.447 865 HH TYR 105 HH TYR 105 -4.428 5.752 4.738 866 H ASP 106 HN ASP 106 -4.805 0.418 7.920 867 HA ASP 106 HA ASP 106 -7.087 -1.352 7.824 868 HB2 ASP 106 HB2 ASP 106 -6.336 -0.361 9.949 869 HB3 ASP 106 HB1 ASP 106 -6.698 1.247 9.323 870 H LEU 107 HN LEU 107 -8.292 -1.207 6.032 871 HA LEU 107 HA LEU 107 -8.758 1.300 4.690 872 HB2 LEU 107 HB2 LEU 107 -9.100 -1.506 4.132 873 HB3 LEU 107 HB1 LEU 107 -10.571 -0.634 3.757 874 HG LEU 107 HG LEU 107 -9.159 0.915 2.339 875 HD11 LEU 107 HD11 LEU 107 -7.015 -0.032 1.561 876 HD12 LEU 107 HD12 LEU 107 -7.104 -1.211 2.872 877 HD13 LEU 107 HD13 LEU 107 -6.988 0.511 3.241 878 HD21 LEU 107 HD21 LEU 107 -8.921 -0.810 0.520 879 HD22 LEU 107 HD22 LEU 107 -10.516 -0.681 1.266 880 HD23 LEU 107 HD23 LEU 107 -9.439 -2.003 1.713 881 H PHE 108 HN PHE 108 -9.973 2.623 6.073 882 HA PHE 108 HA PHE 108 -12.571 1.543 6.908 883 HB2 PHE 108 HB2 PHE 108 -12.784 3.450 8.419 884 HB3 PHE 108 HB1 PHE 108 -11.289 2.581 8.730 885 HD1 PHE 108 HD2 PHE 108 -12.750 5.651 7.325 886 HD2 PHE 108 HD1 PHE 108 -9.165 3.651 8.454 887 HE1 PHE 108 HE2 PHE 108 -11.516 7.772 7.150 888 HE2 PHE 108 HE1 PHE 108 -7.929 5.772 8.289 889 HZ PHE 108 HZ PHE 108 -9.103 7.833 7.633 890 H LEU 109 HN LEU 109 -14.491 2.538 6.356 891 HA LEU 109 HA LEU 109 -14.328 4.581 4.229 892 HB2 LEU 109 HB2 LEU 109 -16.426 2.412 4.433 893 HB3 LEU 109 HB1 LEU 109 -16.175 3.529 3.107 894 HG LEU 109 HG LEU 109 -14.335 1.270 3.897 895 HD11 LEU 109 HD11 LEU 109 -16.450 0.614 2.774 896 HD12 LEU 109 HD12 LEU 109 -15.001 0.230 1.849 897 HD13 LEU 109 HD13 LEU 109 -15.985 1.626 1.407 898 HD21 LEU 109 HD21 LEU 109 -14.106 3.338 1.721 899 HD22 LEU 109 HD22 LEU 109 -13.153 1.854 1.783 900 HD23 LEU 109 HD23 LEU 109 -12.992 3.059 3.061 901 H HIS 110 HN HIS 110 -16.110 6.124 4.266 902 HA HIS 110 HA HIS 110 -17.069 6.480 7.003 903 HB2 HIS 110 HB2 HIS 110 -15.822 8.276 5.593 904 HB3 HIS 110 HB1 HIS 110 -17.384 8.525 4.823 905 HD1 HIS 110 HD1 HIS 110 -15.419 9.467 7.744 906 HD2 HIS 110 HD2 HIS 110 -19.447 9.381 6.717 907 HE1 HIS 110 HE1 HIS 110 -16.581 10.931 9.425 908 HE2 HIS 110 HE2 HIS 110 -19.038 10.653 8.931 909 H LEU 111 HN LEU 111 -19.222 7.217 7.421 910 HA LEU 111 HA LEU 111 -21.174 5.512 6.495 911 HB2 LEU 111 HB2 LEU 111 -20.983 7.697 8.331 912 HB3 LEU 111 HB1 LEU 111 -22.499 7.797 7.453 913 HG LEU 111 HG LEU 111 -22.622 6.514 9.601 914 HD11 LEU 111 HD11 LEU 111 -23.822 4.561 8.595 915 HD12 LEU 111 HD12 LEU 111 -23.259 5.109 7.015 916 HD13 LEU 111 HD13 LEU 111 -24.327 6.133 7.975 917 HD21 LEU 111 HD21 LEU 111 -20.873 4.628 8.050 918 HD22 LEU 111 HD22 LEU 111 -21.723 4.209 9.542 919 HD23 LEU 111 HD23 LEU 111 -20.469 5.452 9.561 920 H GLU 112 HN GLU 112 -22.776 5.520 5.149 921 HA GLU 112 HA GLU 112 -22.633 6.809 2.697 922 HB2 GLU 112 HB2 GLU 112 -23.849 4.679 3.235 923 HB3 GLU 112 HB1 GLU 112 -25.106 5.645 3.989 924 HG2 GLU 112 HG2 GLU 112 -25.633 6.690 1.889 925 HG3 GLU 112 HG1 GLU 112 -24.301 5.853 1.099 926 H GLY 113 HN GLY 113 -23.422 8.654 1.882 927 HA2 GLY 113 HA2 GLY 113 -25.173 10.351 1.873 928 HA3 GLY 113 HA1 GLY 113 -25.147 10.288 3.630 929 H HIS 114 HN HIS 114 -22.484 10.404 4.225 930 HA HIS 114 HA HIS 114 -21.410 12.699 2.798 931 HB2 HIS 114 HB2 HIS 114 -21.117 14.046 4.866 932 HB3 HIS 114 HB1 HIS 114 -22.798 13.833 4.407 933 HD1 HIS 114 HD1 HIS 114 -20.587 13.623 7.233 934 HD2 HIS 114 HD2 HIS 114 -24.086 11.705 6.059 935 HE1 HIS 114 HE1 HIS 114 -21.544 12.614 9.328 936 HE2 HIS 114 HE2 HIS 114 -23.513 11.254 8.547 937 HA PRO 115 HA PRO 115 -18.019 10.174 4.455 938 HB2 PRO 115 HB2 PRO 115 -17.369 8.774 2.272 939 HB3 PRO 115 HB1 PRO 115 -18.785 8.352 3.240 940 HG2 PRO 115 HG2 PRO 115 -18.656 9.564 0.560 941 HG3 PRO 115 HG1 PRO 115 -19.994 8.708 1.340 942 HD2 PRO 115 HD2 PRO 115 -19.523 11.576 1.142 943 HD3 PRO 115 HD1 PRO 115 -20.967 10.721 1.729 944 HA PRO 116 HA PRO 116 -14.828 12.617 2.371 945 HB2 PRO 116 HB2 PRO 116 -13.988 13.966 4.581 946 HB3 PRO 116 HB1 PRO 116 -15.291 14.541 3.540 947 HG2 PRO 116 HG2 PRO 116 -15.443 13.572 6.268 948 HG3 PRO 116 HG1 PRO 116 -16.713 14.317 5.284 949 HD2 PRO 116 HD2 PRO 116 -16.185 11.468 5.815 950 HD3 PRO 116 HD1 PRO 116 -17.671 12.252 5.233 951 H VAL 117 HN VAL 117 -13.569 10.651 2.135 952 HA VAL 117 HA VAL 117 -11.876 10.138 4.499 953 HB VAL 117 HB VAL 117 -12.844 8.154 2.445 954 HG11 VAL 117 HG11 VAL 117 -10.735 7.870 4.565 955 HG12 VAL 117 HG12 VAL 117 -10.557 7.625 2.833 956 HG13 VAL 117 HG13 VAL 117 -11.521 6.501 3.790 957 HG21 VAL 117 HG21 VAL 117 -13.715 6.991 4.456 958 HG22 VAL 117 HG22 VAL 117 -14.454 8.570 4.186 959 HG23 VAL 117 HG23 VAL 117 -13.216 8.375 5.429 960 H ASN 118 HN ASN 118 -9.947 10.949 4.198 961 HA ASN 118 HA ASN 118 -8.444 10.198 1.813 962 HB2 ASN 118 HB2 ASN 118 -9.473 12.503 1.453 963 HB3 ASN 118 HB1 ASN 118 -8.453 13.068 2.762 964 HD21 ASN 118 HD21 ASN 118 -6.059 12.700 2.448 965 HD22 ASN 118 HD22 ASN 118 -5.445 12.851 0.834 966 H HIS 119 HN HIS 119 -6.968 8.959 2.948 967 HA HIS 119 HA HIS 119 -5.586 10.294 5.191 968 HB2 HIS 119 HB2 HIS 119 -7.227 8.476 5.879 969 HB3 HIS 119 HB1 HIS 119 -6.156 7.343 5.063 970 HD1 HIS 119 HD1 HIS 119 -5.533 6.070 7.194 971 HD2 HIS 119 HD2 HIS 119 -4.675 10.142 7.369 972 HE1 HIS 119 HE1 HIS 119 -4.083 6.375 9.228 973 HE2 HIS 119 HE2 HIS 119 -3.550 8.840 9.305 974 H LEU 120 HN LEU 120 -3.446 10.199 5.210 975 HA LEU 120 HA LEU 120 -1.993 8.236 3.613 976 HB2 LEU 120 HB2 LEU 120 -1.955 11.195 3.204 977 HB3 LEU 120 HB1 LEU 120 -0.459 10.310 3.006 978 HG LEU 120 HG LEU 120 -2.938 9.525 1.509 979 HD11 LEU 120 HD11 LEU 120 -1.273 10.797 -0.262 980 HD12 LEU 120 HD12 LEU 120 -1.239 11.859 1.149 981 HD13 LEU 120 HD13 LEU 120 -2.779 11.450 0.386 982 HD21 LEU 120 HD21 LEU 120 -0.825 8.058 1.804 983 HD22 LEU 120 HD22 LEU 120 -0.081 9.200 0.682 984 HD23 LEU 120 HD23 LEU 120 -1.498 8.274 0.187 985 H ARG 121 HN ARG 121 0.019 7.728 4.417 986 HA ARG 121 HA ARG 121 0.847 9.036 6.911 987 HB2 ARG 121 HB2 ARG 121 1.271 6.758 7.903 988 HB3 ARG 121 HB1 ARG 121 -0.412 7.200 7.737 989 HG2 ARG 121 HG2 ARG 121 -0.625 5.125 6.913 990 HG3 ARG 121 HG1 ARG 121 -0.047 5.855 5.423 991 HD2 ARG 121 HD2 ARG 121 1.532 4.214 7.430 992 HD3 ARG 121 HD1 ARG 121 1.220 3.854 5.744 993 HE ARG 121 HE ARG 121 2.805 6.183 6.478 994 HH11 ARG 121 HH11 ARG 121 2.866 3.028 5.024 995 HH12 ARG 121 HH12 ARG 121 4.002 3.486 3.798 996 HH21 ARG 121 HH21 ARG 121 4.199 6.780 4.804 997 HH22 ARG 121 HH22 ARG 121 4.779 5.576 3.698 998 H CYS 122 HN CYS 122 3.102 8.347 7.606 999 HA CYS 122 HA CYS 122 4.779 7.657 5.268 1000 HB2 CYS 122 HB2 CYS 122 6.556 9.046 6.281 1001 HB3 CYS 122 HB1 CYS 122 5.118 9.973 5.871 1002 HG CYS 122 HG CYS 122 4.472 10.749 8.282 1003 H GLU 123 HN GLU 123 5.852 5.731 5.430 1004 HA GLU 123 HA GLU 123 6.526 4.687 8.113 1005 HB2 GLU 123 HB2 GLU 123 6.072 3.263 5.479 1006 HB3 GLU 123 HB1 GLU 123 6.743 2.473 6.901 1007 HG2 GLU 123 HG2 GLU 123 4.131 3.887 7.049 1008 HG3 GLU 123 HG1 GLU 123 4.208 2.262 6.363 1009 H LYS 124 HN LYS 124 8.570 3.565 8.302 1010 HA LYS 124 HA LYS 124 10.616 4.550 6.443 1011 HB2 LYS 124 HB2 LYS 124 10.453 5.960 8.481 1012 HB3 LYS 124 HB1 LYS 124 10.768 4.531 9.454 1013 HG2 LYS 124 HG2 LYS 124 12.978 4.320 8.411 1014 HG3 LYS 124 HG1 LYS 124 12.636 5.749 7.437 1015 HD2 LYS 124 HD2 LYS 124 12.761 5.652 10.433 1016 HD3 LYS 124 HD1 LYS 124 14.011 6.270 9.352 1017 HE2 LYS 124 HE2 LYS 124 11.906 7.632 8.438 1018 HE3 LYS 124 HE1 LYS 124 11.409 7.434 10.118 1019 HZ1 LYS 124 HZ1 LYS 124 13.536 8.399 10.815 1020 HZ2 LYS 124 HZ2 LYS 124 12.636 9.482 9.869 1021 HZ3 LYS 124 HZ3 LYS 124 13.952 8.660 9.190 1022 H LEU 125 HN LEU 125 12.091 3.047 5.871 1023 HA LEU 125 HA LEU 125 12.233 0.573 7.481 1024 HB2 LEU 125 HB2 LEU 125 12.774 0.809 4.528 1025 HB3 LEU 125 HB1 LEU 125 12.605 -0.661 5.461 1026 HG LEU 125 HG LEU 125 10.247 1.144 5.409 1027 HD11 LEU 125 HD11 LEU 125 10.902 1.259 3.079 1028 HD12 LEU 125 HD12 LEU 125 9.501 0.196 3.258 1029 HD13 LEU 125 HD13 LEU 125 11.106 -0.497 3.033 1030 HD21 LEU 125 HD21 LEU 125 9.135 -1.125 5.142 1031 HD22 LEU 125 HD22 LEU 125 10.020 -0.855 6.648 1032 HD23 LEU 125 HD23 LEU 125 10.744 -1.823 5.364 1033 H THR 126 HN THR 126 14.143 0.509 8.535 1034 HA THR 126 HA THR 126 16.470 1.858 7.361 1035 HB THR 126 HB THR 126 16.663 0.654 10.068 1036 HG1 THR 126 HG1 THR 126 14.571 1.636 10.111 1037 HG21 THR 126 HG21 THR 126 18.411 2.033 8.817 1038 HG22 THR 126 HG22 THR 126 18.071 2.475 10.490 1039 HG23 THR 126 HG23 THR 126 17.385 3.423 9.172 1040 H PHE 127 HN PHE 127 18.065 0.723 6.485 1041 HA PHE 127 HA PHE 127 18.241 -2.154 7.095 1042 HB2 PHE 127 HB2 PHE 127 19.020 -0.715 4.548 1043 HB3 PHE 127 HB1 PHE 127 19.158 -2.449 4.827 1044 HD1 PHE 127 HD1 PHE 127 17.113 -3.848 5.003 1045 HD2 PHE 127 HD2 PHE 127 16.945 0.303 4.048 1046 HE1 PHE 127 HE1 PHE 127 14.798 -4.115 4.253 1047 HE2 PHE 127 HE2 PHE 127 14.628 0.039 3.288 1048 HZ PHE 127 HZ PHE 127 13.543 -2.170 3.400 1049 H ASN 128 HN ASN 128 19.841 -2.460 8.476 1050 HA ASN 128 HA ASN 128 21.972 -0.537 8.724 1051 HB2 ASN 128 HB2 ASN 128 21.477 -3.136 10.191 1052 HB3 ASN 128 HB1 ASN 128 22.733 -1.971 10.592 1053 HD21 ASN 128 HD21 ASN 128 19.336 -2.653 10.648 1054 HD22 ASN 128 HD22 ASN 128 18.879 -1.356 11.703 1055 H ASN 129 HN ASN 129 23.719 -0.587 7.507 1056 HA ASN 129 HA ASN 129 25.458 -1.295 6.228 1057 HB2 ASN 129 HB2 ASN 129 25.287 -3.580 8.195 1058 HB3 ASN 129 HB1 ASN 129 26.567 -3.441 6.978 1059 HD21 ASN 129 HD21 ASN 129 26.428 -3.218 10.085 1060 HD22 ASN 129 HD22 ASN 129 27.336 -1.768 10.378 1061 HA PRO 130 HA PRO 130 22.945 -4.208 3.673 1062 HB2 PRO 130 HB2 PRO 130 22.130 -2.506 1.748 1063 HB3 PRO 130 HB1 PRO 130 21.265 -2.680 3.278 1064 HG2 PRO 130 HG2 PRO 130 23.000 -0.482 2.330 1065 HG3 PRO 130 HG1 PRO 130 21.665 -0.444 3.492 1066 HD2 PRO 130 HD2 PRO 130 24.450 -0.507 4.054 1067 HD3 PRO 130 HD1 PRO 130 23.117 -0.609 5.219 1068 H THR 131 HN THR 131 23.409 -4.969 1.486 1069 HA THR 131 HA THR 131 26.100 -4.776 0.718 1070 HB THR 131 HB THR 131 24.747 -6.701 0.037 1071 HG1 THR 131 HG1 THR 131 26.524 -6.310 -1.247 1072 HG21 THR 131 HG21 THR 131 22.601 -5.711 -0.391 1073 HG22 THR 131 HG22 THR 131 23.164 -6.458 -1.888 1074 HG23 THR 131 HG23 THR 131 23.266 -4.710 -1.684 1075 H GLU 132 HN GLU 132 26.984 -3.819 -1.288 1076 HA GLU 132 HA GLU 132 26.595 -1.058 -1.239 1077 HB2 GLU 132 HB2 GLU 132 28.588 -2.463 -2.212 1078 HB3 GLU 132 HB1 GLU 132 27.662 -2.367 -3.706 1079 HG2 GLU 132 HG2 GLU 132 29.333 -0.635 -3.619 1080 HG3 GLU 132 HG1 GLU 132 27.715 0.059 -3.585 1081 H ASP 133 HN ASP 133 25.401 -3.481 -3.489 1082 HA ASP 133 HA ASP 133 24.275 -1.784 -5.402 1083 HB2 ASP 133 HB2 ASP 133 23.319 -4.542 -4.624 1084 HB3 ASP 133 HB1 ASP 133 23.026 -3.722 -6.154 1085 H PHE 134 HN PHE 134 22.901 -3.192 -2.457 1086 HA PHE 134 HA PHE 134 20.269 -2.249 -2.904 1087 HB2 PHE 134 HB2 PHE 134 21.017 -4.051 -1.201 1088 HB3 PHE 134 HB1 PHE 134 21.455 -2.691 -0.169 1089 HD1 PHE 134 HD1 PHE 134 18.566 -2.908 -2.470 1090 HD2 PHE 134 HD2 PHE 134 19.864 -2.835 1.581 1091 HE1 PHE 134 HE1 PHE 134 16.261 -2.698 -1.727 1092 HE2 PHE 134 HE2 PHE 134 17.537 -2.639 2.321 1093 HZ PHE 134 HZ PHE 134 15.727 -2.570 0.656 1094 H ARG 135 HN ARG 135 22.925 -1.083 -0.902 1095 HA ARG 135 HA ARG 135 21.777 1.192 0.146 1096 HB2 ARG 135 HB2 ARG 135 23.891 0.459 0.945 1097 HB3 ARG 135 HB1 ARG 135 24.619 0.604 -0.651 1098 HG2 ARG 135 HG2 ARG 135 24.318 3.042 -0.538 1099 HG3 ARG 135 HG1 ARG 135 23.672 2.857 1.097 1100 HD2 ARG 135 HD2 ARG 135 26.461 2.084 0.196 1101 HD3 ARG 135 HD1 ARG 135 26.013 3.463 1.206 1102 HE ARG 135 HE ARG 135 25.343 1.895 2.921 1103 HH11 ARG 135 HH11 ARG 135 27.354 0.643 0.325 1104 HH12 ARG 135 HH12 ARG 135 27.934 -0.702 1.263 1105 HH21 ARG 135 HH21 ARG 135 26.112 0.134 4.139 1106 HH22 ARG 135 HH22 ARG 135 27.243 -0.985 3.443 1107 H ARG 136 HN ARG 136 23.579 0.868 -2.888 1108 HA ARG 136 HA ARG 136 23.563 3.454 -3.770 1109 HB2 ARG 136 HB2 ARG 136 23.649 0.777 -4.988 1110 HB3 ARG 136 HB1 ARG 136 23.327 2.136 -6.020 1111 HG2 ARG 136 HG2 ARG 136 25.370 3.122 -5.634 1112 HG3 ARG 136 HG1 ARG 136 25.626 2.201 -4.151 1113 HD2 ARG 136 HD2 ARG 136 25.756 0.139 -5.578 1114 HD3 ARG 136 HD1 ARG 136 25.743 1.197 -6.989 1115 HE ARG 136 HE ARG 136 27.759 2.027 -5.203 1116 HH11 ARG 136 HH11 ARG 136 27.030 -0.602 -7.418 1117 HH12 ARG 136 HH12 ARG 136 28.707 -0.947 -7.746 1118 HH21 ARG 136 HH21 ARG 136 29.946 1.566 -5.631 1119 HH22 ARG 136 HH22 ARG 136 30.369 0.295 -6.739 1120 H LYS 137 HN LYS 137 21.072 0.968 -4.285 1121 HA LYS 137 HA LYS 137 19.427 2.575 -5.909 1122 HB2 LYS 137 HB2 LYS 137 18.616 0.277 -4.120 1123 HB3 LYS 137 HB1 LYS 137 17.661 0.951 -5.434 1124 HG2 LYS 137 HG2 LYS 137 19.319 0.225 -7.047 1125 HG3 LYS 137 HG1 LYS 137 20.345 -0.380 -5.747 1126 HD2 LYS 137 HD2 LYS 137 18.306 -1.824 -5.107 1127 HD3 LYS 137 HD1 LYS 137 17.721 -1.447 -6.733 1128 HE2 LYS 137 HE2 LYS 137 19.833 -2.318 -7.658 1129 HE3 LYS 137 HE1 LYS 137 20.350 -2.750 -6.032 1130 HZ1 LYS 137 HZ1 LYS 137 18.393 -4.215 -5.891 1131 HZ2 LYS 137 HZ2 LYS 137 19.468 -4.669 -7.120 1132 HZ3 LYS 137 HZ3 LYS 137 18.029 -3.862 -7.511 1133 H LEU 138 HN LEU 138 19.409 1.843 -2.486 1134 HA LEU 138 HA LEU 138 17.171 3.258 -1.646 1135 HB2 LEU 138 HB2 LEU 138 19.733 2.948 -0.103 1136 HB3 LEU 138 HB1 LEU 138 18.139 3.239 0.557 1137 HG LEU 138 HG LEU 138 19.168 0.714 -0.711 1138 HD11 LEU 138 HD11 LEU 138 19.715 1.128 1.661 1139 HD12 LEU 138 HD12 LEU 138 18.670 -0.274 1.425 1140 HD13 LEU 138 HD13 LEU 138 17.988 1.244 2.006 1141 HD21 LEU 138 HD21 LEU 138 16.353 1.405 0.059 1142 HD22 LEU 138 HD22 LEU 138 16.923 -0.219 -0.314 1143 HD23 LEU 138 HD23 LEU 138 16.944 1.034 -1.558 1144 H LEU 139 HN LEU 139 20.421 4.404 -2.323 1145 HA LEU 139 HA LEU 139 19.999 7.019 -1.201 1146 HB2 LEU 139 HB2 LEU 139 22.154 6.103 -3.101 1147 HB3 LEU 139 HB1 LEU 139 22.184 7.546 -2.106 1148 HG LEU 139 HG LEU 139 22.133 4.740 -1.000 1149 HD11 LEU 139 HD11 LEU 139 24.409 4.698 -0.893 1150 HD12 LEU 139 HD12 LEU 139 24.553 6.458 -0.884 1151 HD13 LEU 139 HD13 LEU 139 24.203 5.610 -2.391 1152 HD21 LEU 139 HD21 LEU 139 21.240 6.537 0.437 1153 HD22 LEU 139 HD22 LEU 139 22.789 7.372 0.314 1154 HD23 LEU 139 HD23 LEU 139 22.698 5.789 1.088 1155 H LYS 140 HN LYS 140 19.905 5.561 -4.387 1156 HA LYS 140 HA LYS 140 19.733 7.914 -5.924 1157 HB2 LYS 140 HB2 LYS 140 19.606 5.089 -6.353 1158 HB3 LYS 140 HB1 LYS 140 18.332 5.898 -7.247 1159 HG2 LYS 140 HG2 LYS 140 19.765 6.965 -8.622 1160 HG3 LYS 140 HG1 LYS 140 21.034 7.067 -7.402 1161 HD2 LYS 140 HD2 LYS 140 20.241 4.416 -8.538 1162 HD3 LYS 140 HD1 LYS 140 21.355 5.465 -9.410 1163 HE2 LYS 140 HE2 LYS 140 21.702 4.558 -6.562 1164 HE3 LYS 140 HE1 LYS 140 22.456 3.797 -7.956 1165 HZ1 LYS 140 HZ1 LYS 140 22.874 6.600 -7.054 1166 HZ2 LYS 140 HZ2 LYS 140 23.575 5.908 -8.434 1167 HZ3 LYS 140 HZ3 LYS 140 23.982 5.326 -6.897 1168 H ALA 141 HN ALA 141 17.436 6.157 -4.099 1169 HA ALA 141 HA ALA 141 15.016 6.653 -5.254 1170 HB1 ALA 141 HB1 ALA 141 14.073 6.144 -3.218 1171 HB2 ALA 141 HB2 ALA 141 15.339 6.967 -2.307 1172 HB3 ALA 141 HB3 ALA 141 15.673 5.418 -3.082 1173 H1 GLY 212 HT1 GLY 212 -20.814 7.399 16.633 1174 H2 GLY 212 HT2 GLY 212 -21.603 7.829 15.192 1175 H3 GLY 212 HT3 GLY 212 -20.497 8.896 15.906 1176 HA2 GLY 212 HA1 GLY 212 -18.694 7.337 15.507 1177 HA3 GLY 212 HA2 GLY 212 -19.846 6.240 14.755 1178 H GLY 213 HN GLY 213 -18.130 6.547 13.023 1179 HA2 GLY 213 HA2 GLY 213 -19.131 8.568 11.162 1180 HA3 GLY 213 HA1 GLY 213 -17.427 8.657 11.581 1181 H LYS 214 HN LYS 214 -16.875 5.903 11.731 1182 HA LYS 214 HA LYS 214 -16.615 5.320 8.932 1183 HB2 LYS 214 HB2 LYS 214 -15.370 3.329 9.672 1184 HB3 LYS 214 HB1 LYS 214 -14.777 4.797 10.434 1185 HG2 LYS 214 HG2 LYS 214 -15.864 4.243 12.492 1186 HG3 LYS 214 HG1 LYS 214 -16.676 2.865 11.746 1187 HD2 LYS 214 HD2 LYS 214 -14.506 1.803 11.353 1188 HD3 LYS 214 HD1 LYS 214 -13.695 3.185 12.094 1189 HE2 LYS 214 HE2 LYS 214 -13.915 1.281 13.641 1190 HE3 LYS 214 HE1 LYS 214 -14.756 2.718 14.215 1191 HZ1 LYS 214 HZ1 LYS 214 -16.154 0.576 12.720 1192 HZ2 LYS 214 HZ2 LYS 214 -16.828 1.795 13.687 1193 HZ3 LYS 214 HZ3 LYS 214 -15.967 0.520 14.404 1194 H ALA 215 HN ALA 215 -17.481 3.665 7.789 1195 HA ALA 215 HA ALA 215 -20.133 2.853 8.571 1196 HB1 ALA 215 HB1 ALA 215 -18.512 2.306 6.083 1197 HB2 ALA 215 HB2 ALA 215 -19.690 3.599 6.301 1198 HB3 ALA 215 HB3 ALA 215 -20.219 1.917 6.290 1199 HA PRO 216 HA PRO 216 -19.518 -1.334 9.853 1200 HB2 PRO 216 HB2 PRO 216 -20.810 -2.894 7.973 1201 HB3 PRO 216 HB1 PRO 216 -21.598 -2.085 9.330 1202 HG2 PRO 216 HG2 PRO 216 -21.421 -1.258 6.475 1203 HG3 PRO 216 HG1 PRO 216 -22.770 -1.094 7.610 1204 HD2 PRO 216 HD2 PRO 216 -21.181 0.976 6.943 1205 HD3 PRO 216 HD1 PRO 216 -21.893 0.817 8.564 1206 H ARG 217 HN ARG 217 -18.530 -3.442 9.305 1207 HA ARG 217 HA ARG 217 -16.700 -3.233 7.019 1208 HB2 ARG 217 HB2 ARG 217 -15.881 -3.647 9.900 1209 HB3 ARG 217 HB1 ARG 217 -14.808 -3.856 8.525 1210 HG2 ARG 217 HG2 ARG 217 -14.998 -1.518 7.966 1211 HG3 ARG 217 HG1 ARG 217 -16.189 -1.281 9.247 1212 HD2 ARG 217 HD2 ARG 217 -13.913 -0.528 9.868 1213 HD3 ARG 217 HD1 ARG 217 -14.549 -1.780 10.937 1214 HE ARG 217 HE ARG 217 -13.176 -3.341 9.431 1215 HH11 ARG 217 HH11 ARG 217 -12.265 -0.048 10.211 1216 HH12 ARG 217 HH12 ARG 217 -10.559 -0.355 10.081 1217 HH21 ARG 217 HH21 ARG 217 -10.939 -3.744 9.278 1218 HH22 ARG 217 HH22 ARG 217 -9.810 -2.449 9.572 1219 H1 KCR 218 HN KCR 218 -15.355 -5.239 6.811 1220 H4 KCR 218 HA KCR 218 -16.949 -7.619 7.501 1221 H5 KCR 218 HB1 KCR 218 -15.945 -8.704 5.567 1222 H6 KCR 218 HB2 KCR 218 -14.916 -7.308 5.280 1223 H7 KCR 218 HG1 KCR 218 -16.897 -5.953 4.802 1224 H8 KCR 218 HG2 KCR 218 -17.919 -7.366 5.071 1225 H9 KCR 218 HD1 KCR 218 -16.973 -8.500 3.194 1226 H10 KCR 218 HD2 KCR 218 -15.737 -7.254 2.999 1227 H11 KCR 218 HE1 KCR 218 -17.447 -5.618 2.440 1228 H12 KCR 218 HE2 KCR 218 -18.706 -6.832 2.678 1229 H13 KCR 218 HZ1 KCR 218 -17.844 -8.002 0.760 1230 H14 KCR 218 HH1 KCR 218 -17.236 -7.847 -1.580 1231 H15 KCR 218 HJ1 KCR 218 -17.074 -4.859 -2.327 1232 H16 KCR 218 HF3 KCR 218 -17.749 -6.332 -4.413 1233 H17 KCR 218 HF1 KCR 218 -16.021 -5.985 -4.351 1234 H18 KCR 218 HF2 KCR 218 -16.628 -7.544 -3.790 1235 H GLN 219 HN GLN 219 -16.129 -8.709 9.138 1236 HA GLN 219 HA GLN 219 -14.704 -9.595 10.662 1237 HB2 GLN 219 HB2 GLN 219 -12.633 -9.320 8.476 1238 HB3 GLN 219 HB1 GLN 219 -12.434 -10.245 9.957 1239 HG2 GLN 219 HG2 GLN 219 -14.328 -11.677 9.263 1240 HG3 GLN 219 HG1 GLN 219 -14.391 -10.793 7.738 1241 HE21 GLN 219 HE21 GLN 219 -11.449 -10.514 7.707 1242 HE22 GLN 219 HE22 GLN 219 -10.841 -12.062 7.222 1243 H LEU 220 HN LEU 220 -14.963 -7.735 11.953 1244 HA LEU 220 HA LEU 220 -12.967 -5.619 11.743 1245 HB2 LEU 220 HB2 LEU 220 -15.260 -5.977 13.680 1246 HB3 LEU 220 HB1 LEU 220 -14.217 -4.573 13.604 1247 HG LEU 220 HG LEU 220 -15.057 -4.316 11.183 1248 HD11 LEU 220 HD11 LEU 220 -17.230 -6.094 12.280 1249 HD12 LEU 220 HD12 LEU 220 -16.103 -6.516 10.991 1250 HD13 LEU 220 HD13 LEU 220 -17.273 -5.219 10.748 1251 HD21 LEU 220 HD21 LEU 220 -16.917 -3.880 13.512 1252 HD22 LEU 220 HD22 LEU 220 -17.016 -3.073 11.948 1253 HD23 LEU 220 HD23 LEU 220 -15.623 -2.799 12.994 1254 H ALA 221 HN ALA 221 -13.259 -8.584 13.164 1255 HA ALA 221 HA ALA 221 -12.357 -8.318 15.764 1256 HB1 ALA 221 HB1 ALA 221 -13.240 -10.397 14.819 1257 HB2 ALA 221 HB2 ALA 221 -11.684 -10.648 15.611 1258 HB3 ALA 221 HB3 ALA 221 -11.776 -10.574 13.852 1259 H THR 222 HN THR 222 -10.582 -7.486 16.549 1260 HA THR 222 HA THR 222 -8.222 -7.102 14.951 1261 HB THR 222 HB THR 222 -8.994 -5.472 16.701 1262 HG1 THR 222 HG1 THR 222 -6.595 -6.063 15.991 1263 HG21 THR 222 HG21 THR 222 -7.958 -7.568 18.613 1264 HG22 THR 222 HG22 THR 222 -9.638 -7.062 18.439 1265 HG23 THR 222 HG23 THR 222 -8.433 -5.927 19.047 1266 H LYS 223 HN LYS 223 -9.474 -9.592 16.868 1267 HA LYS 223 HA LYS 223 -6.823 -10.828 17.186 1268 HB2 LYS 223 HB2 LYS 223 -8.181 -10.648 19.244 1269 HB3 LYS 223 HB1 LYS 223 -9.461 -11.572 18.469 1270 HG2 LYS 223 HG2 LYS 223 -7.677 -13.399 18.171 1271 HG3 LYS 223 HG1 LYS 223 -6.761 -12.494 19.377 1272 HD2 LYS 223 HD2 LYS 223 -8.052 -14.258 20.438 1273 HD3 LYS 223 HD1 LYS 223 -8.656 -12.674 20.930 1274 HE2 LYS 223 HE2 LYS 223 -10.508 -14.166 20.448 1275 HE3 LYS 223 HE1 LYS 223 -10.456 -12.858 19.268 1276 HZ1 LYS 223 HZ1 LYS 223 -9.534 -15.653 18.869 1277 HZ2 LYS 223 HZ2 LYS 223 -9.299 -14.408 17.746 1278 HZ3 LYS 223 HZ3 LYS 223 -10.871 -14.907 18.138 1279 H ALA 224 HN ALA 224 -6.655 -11.468 14.996 1280 HA ALA 224 HA ALA 224 -8.664 -13.338 13.993 1281 HB1 ALA 224 HB1 ALA 224 -7.865 -11.586 12.483 1282 HB2 ALA 224 HB2 ALA 224 -7.466 -13.192 11.874 1283 HB3 ALA 224 HB3 ALA 224 -6.220 -12.204 12.635
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