NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
534594 | 2lbc | 17554 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 ASP 1 HT1 ASP 1 -43.964 12.120 -3.801 2 H2 ASP 1 HT2 ASP 1 -44.359 12.010 -2.160 3 H3 ASP 1 HT3 ASP 1 -45.246 13.036 -3.179 4 HA ASP 1 HA ASP 1 -46.505 11.052 -2.716 5 HB2 ASP 1 HB2 ASP 1 -45.438 10.928 -5.551 6 HB3 ASP 1 HB1 ASP 1 -47.023 10.407 -4.988 7 H ILE 2 HN ILE 2 -44.465 9.625 -5.177 8 HA ILE 2 HA ILE 2 -43.551 7.628 -3.252 9 HB ILE 2 HB ILE 2 -43.102 7.706 -6.248 10 HG12 ILE 2 HG12 ILE 2 -44.707 5.551 -5.802 11 HG13 ILE 2 HG11 ILE 2 -45.319 6.669 -4.589 12 HG21 ILE 2 HG21 ILE 2 -42.615 5.508 -4.240 13 HG22 ILE 2 HG22 ILE 2 -41.382 6.476 -5.044 14 HG23 ILE 2 HG23 ILE 2 -42.392 5.380 -5.986 15 HD11 ILE 2 HD11 ILE 2 -46.633 6.961 -6.523 16 HD12 ILE 2 HD12 ILE 2 -45.210 7.039 -7.559 17 HD13 ILE 2 HD13 ILE 2 -45.555 8.359 -6.438 18 H ASP 3 HN ASP 3 -42.364 9.253 -2.154 19 HA ASP 3 HA ASP 3 -40.435 10.881 -3.378 20 HB2 ASP 3 HB2 ASP 3 -40.856 10.035 -0.516 21 HB3 ASP 3 HB1 ASP 3 -39.566 11.133 -0.993 22 H GLU 4 HN GLU 4 -38.935 9.958 -4.575 23 HA GLU 4 HA GLU 4 -37.636 7.523 -3.908 24 HB2 GLU 4 HB2 GLU 4 -36.963 9.637 -5.956 25 HB3 GLU 4 HB1 GLU 4 -36.130 8.090 -5.817 26 HG2 GLU 4 HG2 GLU 4 -38.367 6.983 -6.089 27 HG3 GLU 4 HG1 GLU 4 -39.012 8.570 -6.501 28 H SER 5 HN SER 5 -37.319 10.535 -2.615 29 HA SER 5 HA SER 5 -34.617 10.763 -2.006 30 HB2 SER 5 HB2 SER 5 -36.745 11.266 0.055 31 HB3 SER 5 HB1 SER 5 -35.311 12.227 -0.319 32 HG SER 5 HG SER 5 -36.331 12.818 -2.298 33 H SER 6 HN SER 6 -37.158 8.720 -0.677 34 HA SER 6 HA SER 6 -35.774 7.749 1.578 35 HB2 SER 6 HB2 SER 6 -37.948 6.368 -0.004 36 HB3 SER 6 HB1 SER 6 -37.516 6.070 1.680 37 HG SER 6 HG SER 6 -37.978 8.623 1.555 38 H VAL 7 HN VAL 7 -36.186 6.366 -1.697 39 HA VAL 7 HA VAL 7 -34.706 4.025 -1.115 40 HB VAL 7 HB VAL 7 -36.199 3.921 -2.963 41 HG11 VAL 7 HG11 VAL 7 -34.583 6.128 -4.207 42 HG12 VAL 7 HG12 VAL 7 -36.273 6.191 -3.701 43 HG13 VAL 7 HG13 VAL 7 -35.797 5.171 -5.057 44 HG21 VAL 7 HG21 VAL 7 -34.825 2.910 -4.619 45 HG22 VAL 7 HG22 VAL 7 -34.057 2.625 -3.049 46 HG23 VAL 7 HG23 VAL 7 -33.432 3.874 -4.131 47 H MET 8 HN MET 8 -33.821 7.098 -2.608 48 HA MET 8 HA MET 8 -31.166 6.407 -3.187 49 HB2 MET 8 HB2 MET 8 -32.452 9.074 -2.670 50 HB3 MET 8 HB1 MET 8 -30.759 8.906 -3.121 51 HG2 MET 8 HG2 MET 8 -31.561 7.623 -5.138 52 HG3 MET 8 HG1 MET 8 -33.187 8.154 -4.720 53 HE1 MET 8 HE1 MET 8 -32.109 10.313 -7.866 54 HE2 MET 8 HE2 MET 8 -33.246 9.109 -7.261 55 HE3 MET 8 HE3 MET 8 -31.554 8.677 -7.509 56 H GLN 9 HN GLN 9 -32.644 7.636 -0.216 57 HA GLN 9 HA GLN 9 -30.279 8.103 1.201 58 HB2 GLN 9 HB2 GLN 9 -33.020 7.258 2.095 59 HB3 GLN 9 HB1 GLN 9 -31.705 7.458 3.246 60 HG2 GLN 9 HG2 GLN 9 -31.441 9.782 2.537 61 HG3 GLN 9 HG1 GLN 9 -32.771 9.581 1.397 62 HE21 GLN 9 HE21 GLN 9 -31.869 9.830 4.747 63 HE22 GLN 9 HE22 GLN 9 -33.464 10.121 5.357 64 H LEU 10 HN LEU 10 -32.208 5.102 0.936 65 HA LEU 10 HA LEU 10 -30.503 3.449 2.452 66 HB2 LEU 10 HB2 LEU 10 -31.939 2.535 -0.030 67 HB3 LEU 10 HB1 LEU 10 -31.454 1.563 1.335 68 HG LEU 10 HG LEU 10 -33.754 3.469 1.129 69 HD11 LEU 10 HD11 LEU 10 -33.636 0.606 2.011 70 HD12 LEU 10 HD12 LEU 10 -33.883 1.102 0.335 71 HD13 LEU 10 HD13 LEU 10 -35.061 1.554 1.575 72 HD21 LEU 10 HD21 LEU 10 -34.204 2.949 3.517 73 HD22 LEU 10 HD22 LEU 10 -32.766 3.931 3.288 74 HD23 LEU 10 HD23 LEU 10 -32.607 2.210 3.622 75 H ALA 11 HN ALA 11 -30.593 4.201 -0.975 76 HA ALA 11 HA ALA 11 -28.621 2.404 -1.831 77 HB1 ALA 11 HB1 ALA 11 -29.210 5.006 -3.207 78 HB2 ALA 11 HB2 ALA 11 -30.377 3.684 -3.195 79 HB3 ALA 11 HB3 ALA 11 -28.781 3.450 -3.922 80 H GLU 12 HN GLU 12 -28.369 5.877 -1.114 81 HA GLU 12 HA GLU 12 -25.618 6.051 -1.781 82 HB2 GLU 12 HB2 GLU 12 -27.338 7.859 -0.116 83 HB3 GLU 12 HB1 GLU 12 -25.726 8.265 -0.672 84 HG2 GLU 12 HG2 GLU 12 -28.113 7.721 -2.421 85 HG3 GLU 12 HG1 GLU 12 -27.436 9.306 -2.052 86 H MET 13 HN MET 13 -26.932 4.449 0.785 87 HA MET 13 HA MET 13 -24.433 4.800 2.301 88 HB2 MET 13 HB2 MET 13 -25.567 4.579 4.389 89 HB3 MET 13 HB1 MET 13 -26.360 5.858 3.479 90 HG2 MET 13 HG2 MET 13 -28.166 4.386 2.886 91 HG3 MET 13 HG1 MET 13 -27.353 3.028 3.656 92 HE1 MET 13 HE1 MET 13 -27.709 6.760 4.922 93 HE2 MET 13 HE2 MET 13 -29.138 6.625 5.946 94 HE3 MET 13 HE3 MET 13 -29.277 6.407 4.201 95 H GLY 14 HN GLY 14 -25.814 2.706 0.342 96 HA2 GLY 14 HA2 GLY 14 -24.568 0.449 1.586 97 HA3 GLY 14 HA1 GLY 14 -26.317 0.356 1.686 98 H PHE 15 HN PHE 15 -27.518 0.004 -0.176 99 HA PHE 15 HA PHE 15 -25.984 -0.798 -2.556 100 HB2 PHE 15 HB2 PHE 15 -28.153 -2.373 -1.148 101 HB3 PHE 15 HB1 PHE 15 -27.520 -2.775 -2.740 102 HD1 PHE 15 HD2 PHE 15 -25.192 -3.549 -2.981 103 HD2 PHE 15 HD1 PHE 15 -26.969 -2.926 0.837 104 HE1 PHE 15 HE2 PHE 15 -23.418 -4.897 -1.941 105 HE2 PHE 15 HE1 PHE 15 -25.192 -4.270 1.884 106 HZ PHE 15 HZ PHE 15 -23.415 -5.257 0.496 107 HA PRO 16 HA PRO 16 -29.160 1.296 -4.862 108 HB2 PRO 16 HB2 PRO 16 -29.377 -0.241 -7.084 109 HB3 PRO 16 HB1 PRO 16 -27.962 0.773 -6.776 110 HG2 PRO 16 HG2 PRO 16 -28.333 -2.160 -6.285 111 HG3 PRO 16 HG1 PRO 16 -26.959 -1.317 -7.034 112 HD2 PRO 16 HD2 PRO 16 -26.914 -2.115 -4.460 113 HD3 PRO 16 HD1 PRO 16 -26.116 -0.621 -4.991 114 H LEU 17 HN LEU 17 -30.752 0.754 -3.224 115 HA LEU 17 HA LEU 17 -32.179 -1.724 -3.466 116 HB2 LEU 17 HB2 LEU 17 -32.577 0.614 -1.580 117 HB3 LEU 17 HB1 LEU 17 -33.435 -0.920 -1.494 118 HG LEU 17 HG LEU 17 -30.434 -0.639 -1.259 119 HD11 LEU 17 HD11 LEU 17 -31.604 0.398 0.629 120 HD12 LEU 17 HD12 LEU 17 -30.716 -1.047 1.095 121 HD13 LEU 17 HD13 LEU 17 -32.467 -1.114 0.908 122 HD21 LEU 17 HD21 LEU 17 -32.265 -2.979 -0.757 123 HD22 LEU 17 HD22 LEU 17 -30.526 -2.947 -0.462 124 HD23 LEU 17 HD23 LEU 17 -31.146 -2.804 -2.107 125 H GLU 18 HN GLU 18 -32.717 -0.932 -5.818 126 HA GLU 18 HA GLU 18 -34.895 0.694 -6.331 127 HB2 GLU 18 HB2 GLU 18 -33.336 -1.005 -7.764 128 HB3 GLU 18 HB1 GLU 18 -34.843 -1.908 -7.718 129 HG2 GLU 18 HG2 GLU 18 -34.794 0.970 -8.519 130 HG3 GLU 18 HG1 GLU 18 -34.398 -0.316 -9.657 131 H ALA 19 HN ALA 19 -34.717 -2.352 -4.711 132 HA ALA 19 HA ALA 19 -37.392 -3.135 -4.670 133 HB1 ALA 19 HB1 ALA 19 -35.606 -3.338 -2.270 134 HB2 ALA 19 HB2 ALA 19 -35.300 -4.289 -3.720 135 HB3 ALA 19 HB3 ALA 19 -36.824 -4.480 -2.846 136 H CYS 20 HN CYS 20 -35.660 -0.661 -2.925 137 HA CYS 20 HA CYS 20 -37.777 0.048 -1.127 138 HB2 CYS 20 HB2 CYS 20 -35.375 0.632 -0.704 139 HB3 CYS 20 HB1 CYS 20 -35.454 1.748 -2.055 140 HG CYS 20 HG CYS 20 -35.847 2.580 0.913 141 H ARG 21 HN ARG 21 -36.599 1.183 -4.230 142 HA ARG 21 HA ARG 21 -38.155 3.417 -4.669 143 HB2 ARG 21 HB2 ARG 21 -36.441 1.954 -6.139 144 HB3 ARG 21 HB1 ARG 21 -37.945 1.458 -6.892 145 HG2 ARG 21 HG2 ARG 21 -37.179 4.337 -6.573 146 HG3 ARG 21 HG1 ARG 21 -36.690 3.367 -7.960 147 HD2 ARG 21 HD2 ARG 21 -39.042 2.926 -8.474 148 HD3 ARG 21 HD1 ARG 21 -39.528 3.905 -7.089 149 HE ARG 21 HE ARG 21 -38.089 5.679 -8.400 150 HH11 ARG 21 HH11 ARG 21 -40.374 3.377 -9.719 151 HH12 ARG 21 HH12 ARG 21 -40.867 4.416 -11.018 152 HH21 ARG 21 HH21 ARG 21 -38.720 7.041 -10.092 153 HH22 ARG 21 HH22 ARG 21 -39.880 6.485 -11.265 154 H LYS 22 HN LYS 22 -39.013 0.075 -5.534 155 HA LYS 22 HA LYS 22 -41.739 0.696 -6.089 156 HB2 LYS 22 HB2 LYS 22 -42.046 -1.703 -6.328 157 HB3 LYS 22 HB1 LYS 22 -40.564 -1.207 -7.132 158 HG2 LYS 22 HG2 LYS 22 -39.375 -1.904 -4.985 159 HG3 LYS 22 HG1 LYS 22 -40.882 -2.715 -4.565 160 HD2 LYS 22 HD2 LYS 22 -39.571 -4.375 -5.580 161 HD3 LYS 22 HD1 LYS 22 -40.698 -3.865 -6.837 162 HE2 LYS 22 HE2 LYS 22 -37.913 -2.749 -6.556 163 HE3 LYS 22 HE1 LYS 22 -38.287 -4.156 -7.552 164 HZ1 LYS 22 HZ1 LYS 22 -39.468 -1.451 -7.904 165 HZ2 LYS 22 HZ2 LYS 22 -39.767 -2.800 -8.881 166 HZ3 LYS 22 HZ3 LYS 22 -38.220 -2.103 -8.845 167 H ALA 23 HN ALA 23 -39.968 -0.165 -3.237 168 HA ALA 23 HA ALA 23 -42.139 -1.051 -1.644 169 HB1 ALA 23 HB1 ALA 23 -40.673 -0.715 0.251 170 HB2 ALA 23 HB2 ALA 23 -39.575 0.246 -0.742 171 HB3 ALA 23 HB3 ALA 23 -39.781 -1.477 -1.069 172 H VAL 24 HN VAL 24 -40.594 2.112 -2.067 173 HA VAL 24 HA VAL 24 -42.167 3.520 -0.228 174 HB VAL 24 HB VAL 24 -40.912 4.498 -2.811 175 HG11 VAL 24 HG11 VAL 24 -41.096 6.746 -1.899 176 HG12 VAL 24 HG12 VAL 24 -41.956 6.112 -0.484 177 HG13 VAL 24 HG13 VAL 24 -42.691 6.009 -2.086 178 HG21 VAL 24 HG21 VAL 24 -39.157 5.380 -1.323 179 HG22 VAL 24 HG22 VAL 24 -39.278 3.622 -1.259 180 HG23 VAL 24 HG23 VAL 24 -39.949 4.599 0.046 181 H TYR 25 HN TYR 25 -42.658 2.875 -3.692 182 HA TYR 25 HA TYR 25 -45.184 4.149 -3.854 183 HB2 TYR 25 HB2 TYR 25 -43.948 3.621 -5.867 184 HB3 TYR 25 HB1 TYR 25 -44.008 1.896 -5.502 185 HD1 TYR 25 HD2 TYR 25 -46.255 4.807 -6.151 186 HD2 TYR 25 HD1 TYR 25 -45.688 0.601 -6.466 187 HE1 TYR 25 HE2 TYR 25 -48.338 4.628 -7.439 188 HE2 TYR 25 HE1 TYR 25 -47.772 0.413 -7.759 189 HH TYR 25 HH TYR 25 -49.885 1.685 -8.040 190 H PHE 26 HN PHE 26 -44.234 0.865 -2.986 191 HA PHE 26 HA PHE 26 -46.872 -0.196 -2.884 192 HB2 PHE 26 HB2 PHE 26 -44.980 -1.671 -3.204 193 HB3 PHE 26 HB1 PHE 26 -44.278 -1.170 -1.670 194 HD1 PHE 26 HD2 PHE 26 -47.151 -2.946 -3.185 195 HD2 PHE 26 HD1 PHE 26 -44.851 -2.247 0.323 196 HE1 PHE 26 HE2 PHE 26 -48.330 -4.784 -2.051 197 HE2 PHE 26 HE1 PHE 26 -46.022 -4.084 1.462 198 HZ PHE 26 HZ PHE 26 -47.766 -5.353 0.275 199 H THR 27 HN THR 27 -44.679 1.098 -0.408 200 HA THR 27 HA THR 27 -46.207 0.374 1.816 201 HB THR 27 HB THR 27 -44.993 2.268 3.001 202 HG1 THR 27 HG1 THR 27 -43.420 2.404 0.649 203 HG21 THR 27 HG21 THR 27 -43.186 0.375 1.502 204 HG22 THR 27 HG22 THR 27 -44.189 -0.110 2.870 205 HG23 THR 27 HG23 THR 27 -42.918 1.094 3.090 206 H GLY 28 HN GLY 28 -46.475 3.014 -0.421 207 HA2 GLY 28 HA2 GLY 28 -48.425 4.244 -0.823 208 HA3 GLY 28 HA1 GLY 28 -49.052 3.716 0.732 209 H ASN 29 HN ASN 29 -45.943 5.235 0.060 210 HA ASN 29 HA ASN 29 -44.922 7.069 0.925 211 HB2 ASN 29 HB2 ASN 29 -46.633 8.262 -0.422 212 HB3 ASN 29 HB1 ASN 29 -47.713 8.248 0.967 213 HD21 ASN 29 HD21 ASN 29 -44.842 9.604 -0.421 214 HD22 ASN 29 HD22 ASN 29 -44.668 10.924 0.694 215 H MET 30 HN MET 30 -44.531 5.694 2.806 216 HA MET 30 HA MET 30 -46.065 6.593 5.160 217 HB2 MET 30 HB2 MET 30 -44.523 4.035 4.714 218 HB3 MET 30 HB1 MET 30 -45.213 4.508 6.259 219 HG2 MET 30 HG2 MET 30 -46.751 4.010 3.721 220 HG3 MET 30 HG1 MET 30 -46.620 2.905 5.087 221 HE1 MET 30 HE1 MET 30 -50.350 4.146 5.245 222 HE2 MET 30 HE2 MET 30 -49.295 2.735 5.171 223 HE3 MET 30 HE3 MET 30 -49.386 3.840 3.800 224 H GLY 31 HN GLY 31 -43.284 7.171 3.586 225 HA2 GLY 31 HA2 GLY 31 -41.690 8.711 4.505 226 HA3 GLY 31 HA1 GLY 31 -41.913 7.940 6.069 227 H ALA 32 HN ALA 32 -39.412 8.429 4.904 228 HA ALA 32 HA ALA 32 -38.315 6.287 3.467 229 HB1 ALA 32 HB1 ALA 32 -36.923 8.137 5.400 230 HB2 ALA 32 HB2 ALA 32 -37.224 8.468 3.694 231 HB3 ALA 32 HB3 ALA 32 -36.149 7.150 4.160 232 H GLU 33 HN GLU 33 -38.666 6.836 6.919 233 HA GLU 33 HA GLU 33 -37.037 4.791 7.881 234 HB2 GLU 33 HB2 GLU 33 -39.600 5.787 9.138 235 HB3 GLU 33 HB1 GLU 33 -38.293 4.951 9.959 236 HG2 GLU 33 HG2 GLU 33 -38.036 7.207 10.524 237 HG3 GLU 33 HG1 GLU 33 -36.815 6.903 9.289 238 H VAL 34 HN VAL 34 -40.400 4.720 6.829 239 HA VAL 34 HA VAL 34 -40.903 2.070 7.739 240 HB VAL 34 HB VAL 34 -42.387 3.785 5.745 241 HG11 VAL 34 HG11 VAL 34 -43.108 1.103 6.917 242 HG12 VAL 34 HG12 VAL 34 -42.934 1.527 5.211 243 HG13 VAL 34 HG13 VAL 34 -44.273 2.184 6.152 244 HG21 VAL 34 HG21 VAL 34 -42.358 4.649 8.029 245 HG22 VAL 34 HG22 VAL 34 -42.961 3.102 8.628 246 HG23 VAL 34 HG23 VAL 34 -43.970 4.098 7.578 247 H ALA 35 HN ALA 35 -39.966 3.451 4.603 248 HA ALA 35 HA ALA 35 -40.071 0.917 3.281 249 HB1 ALA 35 HB1 ALA 35 -40.274 3.137 2.131 250 HB2 ALA 35 HB2 ALA 35 -39.182 1.971 1.387 251 HB3 ALA 35 HB3 ALA 35 -38.528 3.314 2.332 252 H PHE 36 HN PHE 36 -37.581 2.769 4.932 253 HA PHE 36 HA PHE 36 -35.346 1.186 4.410 254 HB2 PHE 36 HB2 PHE 36 -35.135 3.218 5.700 255 HB3 PHE 36 HB1 PHE 36 -36.199 2.594 6.954 256 HD1 PHE 36 HD2 PHE 36 -32.957 1.854 5.276 257 HD2 PHE 36 HD1 PHE 36 -35.276 1.622 8.835 258 HE1 PHE 36 HE2 PHE 36 -31.000 0.983 6.488 259 HE2 PHE 36 HE1 PHE 36 -33.326 0.755 10.053 260 HZ PHE 36 HZ PHE 36 -31.186 0.432 8.881 261 H ASN 37 HN ASN 37 -37.983 0.792 6.728 262 HA ASN 37 HA ASN 37 -37.033 -1.578 7.940 263 HB2 ASN 37 HB2 ASN 37 -38.756 -0.120 8.961 264 HB3 ASN 37 HB1 ASN 37 -39.888 -0.598 7.700 265 HD21 ASN 37 HD21 ASN 37 -38.173 -1.608 10.552 266 HD22 ASN 37 HD22 ASN 37 -39.093 -3.042 10.840 267 H TRP 38 HN TRP 38 -39.111 -0.953 5.151 268 HA TRP 38 HA TRP 38 -39.951 -3.594 4.699 269 HB2 TRP 38 HB2 TRP 38 -40.838 -1.465 3.583 270 HB3 TRP 38 HB1 TRP 38 -39.451 -1.548 2.515 271 HD1 TRP 38 HD1 TRP 38 -42.788 -3.230 3.214 272 HE1 TRP 38 HE1 TRP 38 -43.367 -4.817 1.270 273 HE3 TRP 38 HE3 TRP 38 -38.357 -3.044 0.667 274 HZ2 TRP 38 HZ2 TRP 38 -42.112 -5.843 -1.033 275 HZ3 TRP 38 HZ3 TRP 38 -38.130 -4.362 -1.396 276 HH2 TRP 38 HH2 TRP 38 -39.969 -5.733 -2.230 277 H ILE 39 HN ILE 39 -37.025 -1.874 3.835 278 HA ILE 39 HA ILE 39 -36.027 -3.962 2.153 279 HB ILE 39 HB ILE 39 -35.294 -1.269 2.754 280 HG12 ILE 39 HG12 ILE 39 -34.018 -1.513 0.651 281 HG13 ILE 39 HG11 ILE 39 -34.267 -3.256 0.724 282 HG21 ILE 39 HG21 ILE 39 -32.969 -3.184 2.957 283 HG22 ILE 39 HG22 ILE 39 -33.568 -2.133 4.248 284 HG23 ILE 39 HG23 ILE 39 -32.851 -1.432 2.792 285 HD11 ILE 39 HD11 ILE 39 -35.813 -2.192 -0.817 286 HD12 ILE 39 HD12 ILE 39 -36.431 -1.180 0.489 287 HD13 ILE 39 HD13 ILE 39 -36.667 -2.927 0.540 288 H ILE 40 HN ILE 40 -35.438 -2.974 5.514 289 HA ILE 40 HA ILE 40 -33.272 -4.783 5.794 290 HB ILE 40 HB ILE 40 -33.404 -4.319 8.206 291 HG12 ILE 40 HG12 ILE 40 -34.992 -2.301 8.737 292 HG13 ILE 40 HG11 ILE 40 -35.931 -2.935 7.392 293 HG21 ILE 40 HG21 ILE 40 -32.992 -1.828 7.932 294 HG22 ILE 40 HG22 ILE 40 -33.423 -2.050 6.242 295 HG23 ILE 40 HG23 ILE 40 -32.039 -2.905 6.920 296 HD11 ILE 40 HD11 ILE 40 -35.244 -4.343 9.955 297 HD12 ILE 40 HD12 ILE 40 -36.001 -5.125 8.567 298 HD13 ILE 40 HD13 ILE 40 -36.837 -3.814 9.406 299 H VAL 41 HN VAL 41 -36.696 -5.124 6.139 300 HA VAL 41 HA VAL 41 -36.477 -7.724 7.344 301 HB VAL 41 HB VAL 41 -38.511 -6.320 7.645 302 HG11 VAL 41 HG11 VAL 41 -39.074 -7.028 4.776 303 HG12 VAL 41 HG12 VAL 41 -38.727 -5.421 5.413 304 HG13 VAL 41 HG13 VAL 41 -40.203 -6.259 5.890 305 HG21 VAL 41 HG21 VAL 41 -38.971 -9.034 6.418 306 HG22 VAL 41 HG22 VAL 41 -40.111 -8.159 7.442 307 HG23 VAL 41 HG23 VAL 41 -38.568 -8.703 8.103 308 H HIS 42 HN HIS 42 -36.619 -6.425 4.054 309 HA HIS 42 HA HIS 42 -36.742 -9.156 2.987 310 HB2 HIS 42 HB2 HIS 42 -37.003 -6.442 1.720 311 HB3 HIS 42 HB1 HIS 42 -36.737 -7.881 0.742 312 HD1 HIS 42 HD1 HIS 42 -39.325 -6.070 2.660 313 HD2 HIS 42 HD2 HIS 42 -38.889 -9.741 0.762 314 HE1 HIS 42 HE1 HIS 42 -41.651 -7.016 2.467 315 HE2 HIS 42 HE2 HIS 42 -41.376 -9.134 1.128 316 H MET 43 HN MET 43 -34.343 -7.501 4.242 317 HA MET 43 HA MET 43 -32.319 -7.431 2.314 318 HB2 MET 43 HB2 MET 43 -30.729 -7.372 4.116 319 HB3 MET 43 HB1 MET 43 -32.130 -6.417 4.573 320 HG2 MET 43 HG2 MET 43 -32.928 -8.156 6.013 321 HG3 MET 43 HG1 MET 43 -31.657 -9.249 5.462 322 HE1 MET 43 HE1 MET 43 -30.932 -9.779 7.954 323 HE2 MET 43 HE2 MET 43 -32.226 -8.731 8.537 324 HE3 MET 43 HE3 MET 43 -30.587 -8.537 9.160 325 H GLU 44 HN GLU 44 -33.818 -10.079 3.838 326 HA GLU 44 HA GLU 44 -31.799 -12.031 3.760 327 HB2 GLU 44 HB2 GLU 44 -34.710 -12.616 3.290 328 HB3 GLU 44 HB1 GLU 44 -33.519 -13.597 4.131 329 HG2 GLU 44 HG2 GLU 44 -33.470 -12.021 5.966 330 HG3 GLU 44 HG1 GLU 44 -34.597 -10.967 5.109 331 H GLU 45 HN GLU 45 -33.925 -10.725 1.337 332 HA GLU 45 HA GLU 45 -33.607 -12.788 -0.596 333 HB2 GLU 45 HB2 GLU 45 -34.362 -9.885 -0.950 334 HB3 GLU 45 HB1 GLU 45 -34.502 -11.124 -2.191 335 HG2 GLU 45 HG2 GLU 45 -36.039 -12.355 -0.618 336 HG3 GLU 45 HG1 GLU 45 -36.039 -10.901 0.381 337 HA PRO 46 HA PRO 46 -29.464 -11.892 -1.830 338 HB2 PRO 46 HB2 PRO 46 -29.485 -13.315 -4.158 339 HB3 PRO 46 HB1 PRO 46 -29.336 -14.060 -2.559 340 HG2 PRO 46 HG2 PRO 46 -31.736 -13.775 -4.320 341 HG3 PRO 46 HG1 PRO 46 -31.222 -15.163 -3.340 342 HD2 PRO 46 HD2 PRO 46 -33.174 -13.467 -2.548 343 HD3 PRO 46 HD1 PRO 46 -32.082 -14.268 -1.400 344 H ASP 47 HN ASP 47 -31.975 -11.690 -4.361 345 HA ASP 47 HA ASP 47 -30.261 -9.741 -5.747 346 HB2 ASP 47 HB2 ASP 47 -30.439 -11.947 -6.843 347 HB3 ASP 47 HB1 ASP 47 -32.180 -11.759 -6.931 348 H PHE 48 HN PHE 48 -32.502 -9.312 -3.758 349 HA PHE 48 HA PHE 48 -34.674 -8.156 -5.214 350 HB2 PHE 48 HB2 PHE 48 -35.473 -7.345 -3.139 351 HB3 PHE 48 HB1 PHE 48 -34.754 -8.907 -2.787 352 HD1 PHE 48 HD2 PHE 48 -32.030 -8.533 -2.287 353 HD2 PHE 48 HD1 PHE 48 -35.206 -5.820 -1.491 354 HE1 PHE 48 HE2 PHE 48 -30.679 -7.475 -0.525 355 HE2 PHE 48 HE1 PHE 48 -33.864 -4.759 0.276 356 HZ PHE 48 HZ PHE 48 -31.597 -5.588 0.760 357 H ALA 49 HN ALA 49 -31.535 -7.227 -4.502 358 HA ALA 49 HA ALA 49 -31.788 -4.745 -5.888 359 HB1 ALA 49 HB1 ALA 49 -32.283 -3.948 -3.669 360 HB2 ALA 49 HB2 ALA 49 -30.643 -3.458 -4.095 361 HB3 ALA 49 HB3 ALA 49 -30.899 -4.819 -3.005 362 H GLU 50 HN GLU 50 -30.084 -4.572 -7.098 363 HA GLU 50 HA GLU 50 -28.181 -6.398 -7.622 364 HB2 GLU 50 HB2 GLU 50 -27.712 -3.421 -7.807 365 HB3 GLU 50 HB1 GLU 50 -26.961 -4.671 -8.791 366 HG2 GLU 50 HG2 GLU 50 -29.044 -5.176 -9.855 367 HG3 GLU 50 HG1 GLU 50 -29.916 -4.106 -8.758 368 HA PRO 51 HA PRO 51 -25.736 -5.969 -3.866 369 HB2 PRO 51 HB2 PRO 51 -24.943 -8.506 -3.675 370 HB3 PRO 51 HB1 PRO 51 -26.626 -8.054 -3.371 371 HG2 PRO 51 HG2 PRO 51 -25.409 -9.342 -5.769 372 HG3 PRO 51 HG1 PRO 51 -26.993 -9.619 -5.028 373 HD2 PRO 51 HD2 PRO 51 -26.469 -8.009 -7.267 374 HD3 PRO 51 HD1 PRO 51 -27.963 -8.016 -6.312 375 H LEU 52 HN LEU 52 -24.740 -5.774 -6.821 376 HA LEU 52 HA LEU 52 -21.897 -6.079 -6.149 377 HB2 LEU 52 HB2 LEU 52 -23.279 -6.734 -8.752 378 HB3 LEU 52 HB1 LEU 52 -21.544 -6.587 -8.589 379 HG LEU 52 HG LEU 52 -23.244 -8.600 -7.123 380 HD11 LEU 52 HD11 LEU 52 -21.412 -8.962 -9.486 381 HD12 LEU 52 HD12 LEU 52 -23.173 -9.043 -9.523 382 HD13 LEU 52 HD13 LEU 52 -22.254 -10.246 -8.619 383 HD21 LEU 52 HD21 LEU 52 -21.087 -9.619 -6.543 384 HD22 LEU 52 HD22 LEU 52 -21.248 -7.992 -5.882 385 HD23 LEU 52 HD23 LEU 52 -20.253 -8.270 -7.314 386 H THR 53 HN THR 53 -23.597 -3.810 -5.863 387 HA THR 53 HA THR 53 -22.218 -1.930 -7.621 388 HB THR 53 HB THR 53 -25.209 -1.776 -7.214 389 HG1 THR 53 HG1 THR 53 -25.015 -2.378 -9.630 390 HG21 THR 53 HG21 THR 53 -25.087 -0.211 -9.111 391 HG22 THR 53 HG22 THR 53 -23.334 -0.396 -9.136 392 HG23 THR 53 HG23 THR 53 -24.122 0.341 -7.740 393 H MET 54 HN MET 54 -21.093 -1.067 -5.875 394 HA MET 54 HA MET 54 -22.584 -0.220 -3.526 395 HB2 MET 54 HB2 MET 54 -20.360 0.494 -2.654 396 HB3 MET 54 HB1 MET 54 -20.449 -1.210 -3.068 397 HG2 MET 54 HG2 MET 54 -19.267 -0.766 -5.160 398 HG3 MET 54 HG1 MET 54 -19.180 0.945 -4.748 399 HE1 MET 54 HE1 MET 54 -18.603 0.834 -1.613 400 HE2 MET 54 HE2 MET 54 -17.771 1.909 -2.736 401 HE3 MET 54 HE3 MET 54 -16.842 0.914 -1.613 402 HA PRO 55 HA PRO 55 -23.088 3.797 -5.521 403 HB2 PRO 55 HB2 PRO 55 -25.063 4.270 -3.431 404 HB3 PRO 55 HB1 PRO 55 -25.299 4.129 -5.174 405 HG2 PRO 55 HG2 PRO 55 -26.190 2.260 -3.439 406 HG3 PRO 55 HG1 PRO 55 -25.646 1.855 -5.079 407 HD2 PRO 55 HD2 PRO 55 -24.153 1.633 -2.481 408 HD3 PRO 55 HD1 PRO 55 -24.276 0.456 -3.809 409 H GLY 56 HN GLY 56 -22.629 3.159 -2.065 410 HA2 GLY 56 HA2 GLY 56 -20.584 4.996 -1.767 411 HA3 GLY 56 HA1 GLY 56 -22.061 5.873 -1.407 412 H TYR 57 HN TYR 57 -20.014 3.184 -0.423 413 HA TYR 57 HA TYR 57 -20.249 3.898 2.291 414 HB2 TYR 57 HB2 TYR 57 -22.475 2.713 1.947 415 HB3 TYR 57 HB1 TYR 57 -21.552 1.236 1.671 416 HD1 TYR 57 HD1 TYR 57 -22.260 3.883 4.160 417 HD2 TYR 57 HD2 TYR 57 -20.762 -0.041 3.499 418 HE1 TYR 57 HE1 TYR 57 -22.201 3.506 6.587 419 HE2 TYR 57 HE2 TYR 57 -20.700 -0.435 5.925 420 HH TYR 57 HH TYR 57 -22.240 1.612 8.163 421 H GLY 58 HN GLY 58 -18.002 3.902 1.621 422 HA2 GLY 58 HA2 GLY 58 -16.801 1.226 1.403 423 HA3 GLY 58 HA1 GLY 58 -16.024 2.733 0.942 424 H GLY 59 HN GLY 59 -14.739 3.747 2.371 425 HA2 GLY 59 HA2 GLY 59 -13.708 4.248 4.384 426 HA3 GLY 59 HA1 GLY 59 -14.967 3.346 5.215 427 H ALA 60 HN ALA 60 -14.815 0.921 4.956 428 HA ALA 60 HA ALA 60 -12.179 0.090 5.723 429 HB1 ALA 60 HB1 ALA 60 -13.184 -2.126 5.995 430 HB2 ALA 60 HB2 ALA 60 -14.667 -1.548 5.236 431 HB3 ALA 60 HB3 ALA 60 -14.146 -0.876 6.782 432 H ALA 61 HN ALA 61 -14.020 0.104 2.811 433 HA ALA 61 HA ALA 61 -12.506 -1.896 1.442 434 HB1 ALA 61 HB1 ALA 61 -13.672 -1.129 -0.558 435 HB2 ALA 61 HB2 ALA 61 -14.283 0.269 0.324 436 HB3 ALA 61 HB3 ALA 61 -14.796 -1.355 0.780 437 H SER 62 HN SER 62 -12.616 1.651 1.224 438 HA SER 62 HA SER 62 -10.183 1.645 -0.362 439 HB2 SER 62 HB2 SER 62 -11.920 3.968 0.496 440 HB3 SER 62 HB1 SER 62 -10.647 4.003 -0.725 441 HG SER 62 HG SER 62 -11.937 2.298 -1.798 442 H ALA 63 HN ALA 63 -8.460 1.266 0.889 443 HA ALA 63 HA ALA 63 -7.820 3.288 2.899 444 HB1 ALA 63 HB1 ALA 63 -7.559 0.329 3.441 445 HB2 ALA 63 HB2 ALA 63 -8.766 1.401 4.155 446 HB3 ALA 63 HB3 ALA 63 -7.054 1.635 4.512 447 H GLY 64 HN GLY 64 -6.512 0.248 1.544 448 HA2 GLY 64 HA2 GLY 64 -4.667 1.004 -0.189 449 HA3 GLY 64 HA1 GLY 64 -3.897 1.526 1.302 450 H ALA 65 HN ALA 65 -2.265 -0.034 0.375 451 HA ALA 65 HA ALA 65 -2.642 -2.603 1.716 452 HB1 ALA 65 HB1 ALA 65 -3.301 -3.042 -0.596 453 HB2 ALA 65 HB2 ALA 65 -1.795 -3.870 -0.195 454 HB3 ALA 65 HB3 ALA 65 -1.760 -2.395 -1.163 455 H SER 66 HN SER 66 -1.128 -2.126 3.227 456 HA SER 66 HA SER 66 1.423 -0.994 2.462 457 HB2 SER 66 HB2 SER 66 1.852 -1.152 4.964 458 HB3 SER 66 HB1 SER 66 0.507 -0.123 4.472 459 HG SER 66 HG SER 66 0.467 -2.179 6.137 460 H VAL 67 HN VAL 67 1.994 -2.836 1.107 461 HA VAL 67 HA VAL 67 3.008 -5.118 2.668 462 HB VAL 67 HB VAL 67 1.327 -5.682 0.933 463 HG11 VAL 67 HG11 VAL 67 1.950 -5.548 -1.439 464 HG12 VAL 67 HG12 VAL 67 3.400 -4.651 -0.992 465 HG13 VAL 67 HG13 VAL 67 1.808 -3.959 -0.689 466 HG21 VAL 67 HG21 VAL 67 2.953 -7.363 1.593 467 HG22 VAL 67 HG22 VAL 67 4.095 -6.756 0.394 468 HG23 VAL 67 HG23 VAL 67 2.587 -7.508 -0.127 469 H PHE 68 HN PHE 68 3.949 -2.353 0.966 470 HA PHE 68 HA PHE 68 6.573 -3.499 0.301 471 HB2 PHE 68 HB2 PHE 68 6.861 -1.498 -1.153 472 HB3 PHE 68 HB1 PHE 68 5.506 -2.517 -1.623 473 HD1 PHE 68 HD1 PHE 68 3.219 -1.746 -1.344 474 HD2 PHE 68 HD2 PHE 68 6.516 0.725 -0.280 475 HE1 PHE 68 HE1 PHE 68 1.728 0.209 -1.273 476 HE2 PHE 68 HE2 PHE 68 5.028 2.685 -0.203 477 HZ PHE 68 HZ PHE 68 2.631 2.428 -0.701 478 H GLY 69 HN GLY 69 5.306 -2.171 2.855 479 HA2 GLY 69 HA2 GLY 69 6.149 -1.032 4.661 480 HA3 GLY 69 HA1 GLY 69 7.736 -1.202 3.923 481 H ALA 70 HN ALA 70 8.603 0.781 4.058 482 HA ALA 70 HA ALA 70 6.970 3.104 3.377 483 HB1 ALA 70 HB1 ALA 70 8.841 4.431 4.240 484 HB2 ALA 70 HB2 ALA 70 9.763 2.950 4.498 485 HB3 ALA 70 HB3 ALA 70 8.286 3.239 5.418 486 H SER 71 HN SER 71 8.311 0.995 1.528 487 HA SER 71 HA SER 71 9.084 0.931 -0.595 488 HB2 SER 71 HB2 SER 71 7.438 2.657 -1.084 489 HB3 SER 71 HB1 SER 71 8.549 3.909 -0.532 490 HG SER 71 HG SER 71 9.604 3.804 -2.361 491 H GLY 72 HN GLY 72 11.150 0.286 -0.461 492 HA2 GLY 72 HA2 GLY 72 13.440 0.451 -0.699 493 HA3 GLY 72 HA1 GLY 72 13.216 2.163 -1.042 494 H LEU 73 HN LEU 73 13.201 -0.153 1.632 495 HA LEU 73 HA LEU 73 13.373 1.857 3.628 496 HB2 LEU 73 HB2 LEU 73 13.558 -1.125 3.639 497 HB3 LEU 73 HB1 LEU 73 14.009 -0.221 5.070 498 HG LEU 73 HG LEU 73 11.713 -1.005 5.230 499 HD11 LEU 73 HD11 LEU 73 12.244 1.069 6.345 500 HD12 LEU 73 HD12 LEU 73 10.615 1.165 5.674 501 HD13 LEU 73 HD13 LEU 73 11.952 1.979 4.862 502 HD21 LEU 73 HD21 LEU 73 9.993 -0.377 3.735 503 HD22 LEU 73 HD22 LEU 73 11.324 -0.978 2.743 504 HD23 LEU 73 HD23 LEU 73 11.047 0.754 2.886 505 H ASP 74 HN ASP 74 15.105 3.121 3.583 506 HA ASP 74 HA ASP 74 17.200 3.826 4.100 507 HB2 ASP 74 HB2 ASP 74 17.020 1.864 5.786 508 HB3 ASP 74 HB1 ASP 74 18.073 1.005 4.668 509 H ASN 75 HN ASN 75 19.463 3.692 3.363 510 HA ASN 75 HA ASN 75 19.566 2.554 0.652 511 HB2 ASN 75 HB2 ASN 75 20.805 4.588 -0.063 512 HB3 ASN 75 HB1 ASN 75 19.159 4.937 0.450 513 HD21 ASN 75 HD21 ASN 75 18.809 6.040 2.379 514 HD22 ASN 75 HD22 ASN 75 20.076 6.941 3.159 515 H GLN 76 HN GLN 76 20.618 1.565 3.174 516 HA GLN 76 HA GLN 76 23.451 1.984 3.158 517 HB2 GLN 76 HB2 GLN 76 22.100 1.429 5.199 518 HB3 GLN 76 HB1 GLN 76 21.866 -0.185 4.546 519 HG2 GLN 76 HG2 GLN 76 24.292 -0.544 4.603 520 HG3 GLN 76 HG1 GLN 76 24.500 1.062 5.297 521 HE21 GLN 76 HE21 GLN 76 21.821 -1.009 6.119 522 HE22 GLN 76 HE22 GLN 76 22.317 -1.337 7.742 523 HA PRO 77 HA PRO 77 24.822 -1.054 0.132 524 HB2 PRO 77 HB2 PRO 77 26.819 -1.451 2.319 525 HB3 PRO 77 HB1 PRO 77 27.085 -1.287 0.579 526 HG2 PRO 77 HG2 PRO 77 27.559 0.742 2.191 527 HG3 PRO 77 HG1 PRO 77 26.762 1.001 0.633 528 HD2 PRO 77 HD2 PRO 77 25.609 0.996 3.379 529 HD3 PRO 77 HD1 PRO 77 25.161 1.976 1.974 530 HA PRO 78 HA PRO 78 23.413 -5.002 1.412 531 HB2 PRO 78 HB2 PRO 78 25.358 -6.716 0.533 532 HB3 PRO 78 HB1 PRO 78 24.165 -5.961 -0.530 533 HG2 PRO 78 HG2 PRO 78 26.976 -5.134 0.040 534 HG3 PRO 78 HG1 PRO 78 26.146 -5.224 -1.521 535 HD2 PRO 78 HD2 PRO 78 26.488 -2.908 -0.263 536 HD3 PRO 78 HD1 PRO 78 24.990 -3.256 -1.141 537 H GLU 79 HN GLU 79 23.366 -5.349 3.539 538 HA GLU 79 HA GLU 79 25.470 -5.136 5.335 539 HB2 GLU 79 HB2 GLU 79 24.007 -6.225 6.922 540 HB3 GLU 79 HB1 GLU 79 23.085 -5.085 5.959 541 HG2 GLU 79 HG2 GLU 79 22.438 -7.054 4.520 542 HG3 GLU 79 HG1 GLU 79 23.112 -8.074 5.779 543 H GLU 80 HN GLU 80 24.422 -7.803 3.355 544 HA GLU 80 HA GLU 80 25.871 -9.869 4.541 545 HB2 GLU 80 HB2 GLU 80 24.512 -10.667 2.875 546 HB3 GLU 80 HB1 GLU 80 24.796 -9.280 1.840 547 HG2 GLU 80 HG2 GLU 80 26.997 -10.159 1.256 548 HG3 GLU 80 HG1 GLU 80 26.701 -11.565 2.283 549 H ILE 81 HN ILE 81 26.800 -7.567 2.021 550 HA ILE 81 HA ILE 81 29.441 -8.621 1.830 551 HB ILE 81 HB ILE 81 28.204 -6.144 0.657 552 HG12 ILE 81 HG12 ILE 81 29.037 -8.772 -0.579 553 HG13 ILE 81 HG11 ILE 81 27.381 -8.336 -0.171 554 HG21 ILE 81 HG21 ILE 81 30.346 -6.429 -0.839 555 HG22 ILE 81 HG22 ILE 81 30.985 -7.184 0.630 556 HG23 ILE 81 HG23 ILE 81 30.397 -5.521 0.670 557 HD11 ILE 81 HD11 ILE 81 29.118 -7.380 -2.381 558 HD12 ILE 81 HD12 ILE 81 27.926 -6.270 -1.715 559 HD13 ILE 81 HD13 ILE 81 27.407 -7.816 -2.394 560 H VAL 82 HN VAL 82 28.026 -5.683 3.285 561 HA VAL 82 HA VAL 82 30.439 -4.487 4.019 562 HB VAL 82 HB VAL 82 29.258 -3.242 5.677 563 HG11 VAL 82 HG11 VAL 82 27.272 -2.437 4.434 564 HG12 VAL 82 HG12 VAL 82 27.486 -3.784 3.315 565 HG13 VAL 82 HG13 VAL 82 28.734 -2.545 3.456 566 HG21 VAL 82 HG21 VAL 82 27.745 -4.137 7.013 567 HG22 VAL 82 HG22 VAL 82 27.749 -5.607 6.033 568 HG23 VAL 82 HG23 VAL 82 26.632 -4.291 5.652 569 H ALA 83 HN ALA 83 28.500 -6.973 5.521 570 HA ALA 83 HA ALA 83 29.930 -7.461 7.862 571 HB1 ALA 83 HB1 ALA 83 28.994 -9.858 7.398 572 HB2 ALA 83 HB2 ALA 83 28.145 -9.039 6.070 573 HB3 ALA 83 HB3 ALA 83 27.891 -8.525 7.743 574 H ILE 84 HN ILE 84 30.207 -8.935 4.640 575 HA ILE 84 HA ILE 84 32.302 -10.706 5.212 576 HB ILE 84 HB ILE 84 31.536 -9.350 2.615 577 HG12 ILE 84 HG12 ILE 84 31.096 -12.240 3.239 578 HG13 ILE 84 HG11 ILE 84 30.029 -11.048 3.965 579 HG21 ILE 84 HG21 ILE 84 33.380 -11.710 3.006 580 HG22 ILE 84 HG22 ILE 84 33.887 -10.082 2.554 581 HG23 ILE 84 HG23 ILE 84 32.872 -11.025 1.460 582 HD11 ILE 84 HD11 ILE 84 30.535 -11.187 1.017 583 HD12 ILE 84 HD12 ILE 84 29.257 -10.317 1.881 584 HD13 ILE 84 HD13 ILE 84 29.245 -12.083 1.822 585 H ILE 85 HN ILE 85 32.324 -7.364 4.100 586 HA ILE 85 HA ILE 85 35.093 -7.175 3.642 587 HB ILE 85 HB ILE 85 33.098 -5.015 4.302 588 HG12 ILE 85 HG12 ILE 85 34.178 -5.939 1.635 589 HG13 ILE 85 HG11 ILE 85 32.625 -6.429 2.303 590 HG21 ILE 85 HG21 ILE 85 35.979 -4.953 3.768 591 HG22 ILE 85 HG22 ILE 85 34.931 -3.752 4.528 592 HG23 ILE 85 HG23 ILE 85 35.024 -3.854 2.772 593 HD11 ILE 85 HD11 ILE 85 32.514 -4.611 0.611 594 HD12 ILE 85 HD12 ILE 85 33.373 -3.576 1.750 595 HD13 ILE 85 HD13 ILE 85 31.786 -4.213 2.163 596 H THR 86 HN THR 86 33.115 -6.244 6.477 597 HA THR 86 HA THR 86 35.431 -5.498 7.962 598 HB THR 86 HB THR 86 33.517 -4.431 8.735 599 HG1 THR 86 HG1 THR 86 34.830 -5.155 10.453 600 HG21 THR 86 HG21 THR 86 31.632 -5.483 8.060 601 HG22 THR 86 HG22 THR 86 31.619 -5.941 9.772 602 HG23 THR 86 HG23 THR 86 32.203 -7.083 8.559 603 H SER 87 HN SER 87 33.907 -8.528 7.318 604 HA SER 87 HA SER 87 35.291 -9.954 9.387 605 HB2 SER 87 HB2 SER 87 34.079 -10.986 6.809 606 HB3 SER 87 HB1 SER 87 34.611 -11.978 8.167 607 HG SER 87 HG SER 87 32.458 -10.148 8.045 608 H MET 88 HN MET 88 36.079 -8.772 6.234 609 HA MET 88 HA MET 88 38.436 -10.321 5.805 610 HB2 MET 88 HB2 MET 88 37.563 -7.619 4.790 611 HB3 MET 88 HB1 MET 88 39.064 -8.384 4.289 612 HG2 MET 88 HG2 MET 88 36.302 -9.502 3.869 613 HG3 MET 88 HG1 MET 88 37.275 -8.677 2.656 614 HE1 MET 88 HE1 MET 88 35.998 -11.512 2.154 615 HE2 MET 88 HE2 MET 88 37.339 -12.378 1.406 616 HE3 MET 88 HE3 MET 88 37.015 -10.700 0.967 617 H GLY 89 HN GLY 89 37.613 -7.658 7.780 618 HA2 GLY 89 HA2 GLY 89 39.199 -7.404 9.703 619 HA3 GLY 89 HA1 GLY 89 40.436 -7.224 8.469 620 H PHE 90 HN PHE 90 37.841 -5.833 7.153 621 HA PHE 90 HA PHE 90 38.805 -3.180 7.783 622 HB2 PHE 90 HB2 PHE 90 36.718 -4.136 5.810 623 HB3 PHE 90 HB1 PHE 90 37.300 -2.481 5.933 624 HD1 PHE 90 HD2 PHE 90 40.110 -2.614 6.143 625 HD2 PHE 90 HD1 PHE 90 37.527 -5.157 3.917 626 HE1 PHE 90 HE2 PHE 90 41.970 -3.174 4.631 627 HE2 PHE 90 HE1 PHE 90 39.382 -5.722 2.403 628 HZ PHE 90 HZ PHE 90 41.606 -4.731 2.759 629 H GLN 91 HN GLN 91 36.834 -1.500 7.768 630 HA GLN 91 HA GLN 91 35.237 -2.186 10.096 631 HB2 GLN 91 HB2 GLN 91 36.388 -0.062 10.143 632 HB3 GLN 91 HB1 GLN 91 35.719 0.392 8.585 633 HG2 GLN 91 HG2 GLN 91 33.491 0.467 9.596 634 HG3 GLN 91 HG1 GLN 91 34.199 0.071 11.159 635 HE21 GLN 91 HE21 GLN 91 33.926 2.514 8.674 636 HE22 GLN 91 HE22 GLN 91 34.500 3.834 9.632 637 H ARG 92 HN ARG 92 32.971 -2.315 10.076 638 HA ARG 92 HA ARG 92 31.655 -3.147 7.738 639 HB2 ARG 92 HB2 ARG 92 30.792 -3.575 9.999 640 HB3 ARG 92 HB1 ARG 92 30.429 -1.871 10.179 641 HG2 ARG 92 HG2 ARG 92 29.097 -2.298 7.936 642 HG3 ARG 92 HG1 ARG 92 29.044 -3.939 8.584 643 HD2 ARG 92 HD2 ARG 92 28.167 -1.451 10.026 644 HD3 ARG 92 HD1 ARG 92 27.091 -2.593 9.227 645 HE ARG 92 HE ARG 92 28.789 -3.826 11.196 646 HH11 ARG 92 HH11 ARG 92 25.797 -2.067 10.713 647 HH12 ARG 92 HH12 ARG 92 25.059 -2.653 12.174 648 HH21 ARG 92 HH21 ARG 92 27.842 -4.594 13.129 649 HH22 ARG 92 HH22 ARG 92 26.234 -4.079 13.564 650 H ASN 93 HN ASN 93 31.445 -0.022 9.415 651 HA ASN 93 HA ASN 93 29.864 1.287 7.503 652 HB2 ASN 93 HB2 ASN 93 30.223 2.170 9.735 653 HB3 ASN 93 HB1 ASN 93 31.930 2.429 9.386 654 HD21 ASN 93 HD21 ASN 93 28.670 3.486 8.691 655 HD22 ASN 93 HD22 ASN 93 29.118 5.034 8.048 656 H GLN 94 HN GLN 94 33.312 0.803 7.703 657 HA GLN 94 HA GLN 94 34.078 2.521 5.586 658 HB2 GLN 94 HB2 GLN 94 35.837 1.913 6.965 659 HB3 GLN 94 HB1 GLN 94 35.317 0.242 7.054 660 HG2 GLN 94 HG2 GLN 94 36.215 -0.254 4.931 661 HG3 GLN 94 HG1 GLN 94 36.467 1.449 4.557 662 HE21 GLN 94 HE21 GLN 94 38.175 2.547 5.528 663 HE22 GLN 94 HE22 GLN 94 39.497 1.703 6.270 664 H ALA 95 HN ALA 95 33.205 -0.876 5.816 665 HA ALA 95 HA ALA 95 33.433 -1.564 3.109 666 HB1 ALA 95 HB1 ALA 95 31.500 -2.577 5.195 667 HB2 ALA 95 HB2 ALA 95 33.139 -3.180 4.916 668 HB3 ALA 95 HB3 ALA 95 31.896 -3.379 3.672 669 H ILE 96 HN ILE 96 30.760 -0.181 4.979 670 HA ILE 96 HA ILE 96 28.853 -0.034 2.961 671 HB ILE 96 HB ILE 96 29.315 1.534 5.459 672 HG12 ILE 96 HG12 ILE 96 26.651 0.589 5.066 673 HG13 ILE 96 HG11 ILE 96 27.769 -0.699 4.641 674 HG21 ILE 96 HG21 ILE 96 27.110 2.725 4.910 675 HG22 ILE 96 HG22 ILE 96 27.476 2.316 3.228 676 HG23 ILE 96 HG23 ILE 96 28.589 3.324 4.154 677 HD11 ILE 96 HD11 ILE 96 27.645 0.790 7.247 678 HD12 ILE 96 HD12 ILE 96 28.861 -0.413 6.823 679 HD13 ILE 96 HD13 ILE 96 27.165 -0.882 6.955 680 H GLN 97 HN GLN 97 31.207 2.417 3.992 681 HA GLN 97 HA GLN 97 30.689 4.374 2.104 682 HB2 GLN 97 HB2 GLN 97 32.203 4.726 3.964 683 HB3 GLN 97 HB1 GLN 97 33.331 3.565 3.287 684 HG2 GLN 97 HG2 GLN 97 33.809 4.983 1.443 685 HG3 GLN 97 HG1 GLN 97 32.528 6.096 1.902 686 HE21 GLN 97 HE21 GLN 97 33.920 7.829 2.045 687 HE22 GLN 97 HE22 GLN 97 35.078 7.999 3.326 688 H ALA 98 HN ALA 98 32.930 1.666 1.913 689 HA ALA 98 HA ALA 98 33.960 2.199 -0.620 690 HB1 ALA 98 HB1 ALA 98 34.665 0.489 1.208 691 HB2 ALA 98 HB2 ALA 98 34.980 0.127 -0.487 692 HB3 ALA 98 HB3 ALA 98 33.594 -0.602 0.333 693 H LEU 99 HN LEU 99 31.311 -0.020 0.312 694 HA LEU 99 HA LEU 99 30.636 -0.783 -2.296 695 HB2 LEU 99 HB2 LEU 99 28.906 -0.640 0.150 696 HB3 LEU 99 HB1 LEU 99 28.454 -1.443 -1.331 697 HG LEU 99 HG LEU 99 30.861 -2.223 0.298 698 HD11 LEU 99 HD11 LEU 99 28.177 -3.565 0.271 699 HD12 LEU 99 HD12 LEU 99 28.681 -2.419 1.508 700 HD13 LEU 99 HD13 LEU 99 29.566 -3.932 1.297 701 HD21 LEU 99 HD21 LEU 99 31.300 -3.526 -1.440 702 HD22 LEU 99 HD22 LEU 99 29.852 -2.958 -2.261 703 HD23 LEU 99 HD23 LEU 99 29.759 -4.344 -1.181 704 H ARG 100 HN ARG 100 29.679 2.007 -0.384 705 HA ARG 100 HA ARG 100 27.576 2.971 -1.950 706 HB2 ARG 100 HB2 ARG 100 29.712 4.350 -0.347 707 HB3 ARG 100 HB1 ARG 100 28.524 5.277 -1.256 708 HG2 ARG 100 HG2 ARG 100 26.734 4.422 0.035 709 HG3 ARG 100 HG1 ARG 100 27.772 3.205 0.785 710 HD2 ARG 100 HD2 ARG 100 28.970 4.842 1.994 711 HD3 ARG 100 HD1 ARG 100 28.243 6.161 1.074 712 HE ARG 100 HE ARG 100 26.109 4.938 2.231 713 HH11 ARG 100 HH11 ARG 100 29.111 6.258 3.483 714 HH12 ARG 100 HH12 ARG 100 28.442 6.652 5.033 715 HH21 ARG 100 HH21 ARG 100 25.225 5.477 4.271 716 HH22 ARG 100 HH22 ARG 100 26.228 6.209 5.487 717 H ALA 101 HN ALA 101 31.042 3.478 -2.237 718 HA ALA 101 HA ALA 101 30.916 5.030 -4.618 719 HB1 ALA 101 HB1 ALA 101 33.426 4.388 -4.639 720 HB2 ALA 101 HB2 ALA 101 33.074 3.681 -3.055 721 HB3 ALA 101 HB3 ALA 101 32.804 5.402 -3.338 722 H THR 102 HN THR 102 31.498 1.596 -3.950 723 HA THR 102 HA THR 102 32.175 0.998 -6.684 724 HB THR 102 HB THR 102 32.530 -1.240 -5.947 725 HG1 THR 102 HG1 THR 102 31.743 -1.986 -3.965 726 HG21 THR 102 HG21 THR 102 34.358 -0.484 -4.938 727 HG22 THR 102 HG22 THR 102 33.453 -0.308 -3.443 728 HG23 THR 102 HG23 THR 102 33.567 1.043 -4.573 729 H ASN 103 HN ASN 103 29.291 1.508 -5.143 730 HA ASN 103 HA ASN 103 27.113 1.085 -5.550 731 HB2 ASN 103 HB2 ASN 103 27.716 1.615 -7.885 732 HB3 ASN 103 HB1 ASN 103 28.016 -0.090 -8.182 733 HD21 ASN 103 HD21 ASN 103 25.429 1.275 -6.199 734 HD22 ASN 103 HD22 ASN 103 24.133 0.707 -7.199 735 H ASN 104 HN ASN 104 27.825 -0.403 -3.831 736 HA ASN 104 HA ASN 104 27.808 -2.354 -2.702 737 HB2 ASN 104 HB2 ASN 104 25.856 -3.783 -2.987 738 HB3 ASN 104 HB1 ASN 104 25.409 -2.088 -3.040 739 HD21 ASN 104 HD21 ASN 104 25.831 -4.995 -4.927 740 HD22 ASN 104 HD22 ASN 104 24.849 -4.503 -6.262 741 H ASN 105 HN ASN 105 29.561 -2.290 -5.038 742 HA ASN 105 HA ASN 105 29.715 -5.106 -5.796 743 HB2 ASN 105 HB2 ASN 105 31.323 -2.651 -6.525 744 HB3 ASN 105 HB1 ASN 105 31.919 -4.267 -6.885 745 HD21 ASN 105 HD21 ASN 105 28.539 -3.268 -7.010 746 HD22 ASN 105 HD22 ASN 105 28.371 -3.426 -8.726 747 H LEU 106 HN LEU 106 30.479 -6.452 -4.388 748 HA LEU 106 HA LEU 106 31.678 -5.838 -1.958 749 HB2 LEU 106 HB2 LEU 106 30.498 -7.901 -2.392 750 HB3 LEU 106 HB1 LEU 106 31.673 -8.385 -3.582 751 HG LEU 106 HG LEU 106 32.620 -7.970 -0.786 752 HD11 LEU 106 HD11 LEU 106 31.370 -10.564 -1.616 753 HD12 LEU 106 HD12 LEU 106 30.425 -9.299 -0.839 754 HD13 LEU 106 HD13 LEU 106 31.801 -10.008 0.007 755 HD21 LEU 106 HD21 LEU 106 34.051 -9.868 -1.369 756 HD22 LEU 106 HD22 LEU 106 34.214 -8.536 -2.514 757 HD23 LEU 106 HD23 LEU 106 33.269 -9.961 -2.947 758 H GLU 107 HN GLU 107 33.230 -7.466 -4.690 759 HA GLU 107 HA GLU 107 35.829 -7.442 -3.726 760 HB2 GLU 107 HB2 GLU 107 34.865 -7.350 -6.585 761 HB3 GLU 107 HB1 GLU 107 36.523 -7.678 -6.105 762 HG2 GLU 107 HG2 GLU 107 34.287 -9.330 -5.044 763 HG3 GLU 107 HG1 GLU 107 34.949 -9.642 -6.647 764 H ARG 108 HN ARG 108 34.234 -5.056 -5.827 765 HA ARG 108 HA ARG 108 36.499 -3.386 -6.082 766 HB2 ARG 108 HB2 ARG 108 34.373 -3.360 -7.491 767 HB3 ARG 108 HB1 ARG 108 33.649 -2.439 -6.191 768 HG2 ARG 108 HG2 ARG 108 35.344 -0.707 -6.467 769 HG3 ARG 108 HG1 ARG 108 36.047 -1.624 -7.804 770 HD2 ARG 108 HD2 ARG 108 33.175 -0.804 -7.733 771 HD3 ARG 108 HD1 ARG 108 34.427 0.234 -8.425 772 HE ARG 108 HE ARG 108 34.903 -1.914 -9.823 773 HH11 ARG 108 HH11 ARG 108 31.744 -0.703 -8.882 774 HH12 ARG 108 HH12 ARG 108 30.944 -1.390 -10.255 775 HH21 ARG 108 HH21 ARG 108 33.822 -2.801 -11.638 776 HH22 ARG 108 HH22 ARG 108 32.109 -2.563 -11.815 777 H ALA 109 HN ALA 109 34.020 -3.664 -3.626 778 HA ALA 109 HA ALA 109 34.460 -1.199 -2.359 779 HB1 ALA 109 HB1 ALA 109 32.816 -3.390 -1.922 780 HB2 ALA 109 HB2 ALA 109 32.894 -1.933 -0.932 781 HB3 ALA 109 HB3 ALA 109 33.856 -3.347 -0.497 782 H LEU 110 HN LEU 110 35.738 -4.438 -1.731 783 HA LEU 110 HA LEU 110 37.652 -3.770 0.201 784 HB2 LEU 110 HB2 LEU 110 37.809 -5.913 -1.913 785 HB3 LEU 110 HB1 LEU 110 38.687 -5.886 -0.399 786 HG LEU 110 HG LEU 110 35.687 -5.930 -0.481 787 HD11 LEU 110 HD11 LEU 110 37.566 -8.291 -0.442 788 HD12 LEU 110 HD12 LEU 110 36.486 -7.831 -1.760 789 HD13 LEU 110 HD13 LEU 110 35.817 -8.357 -0.215 790 HD21 LEU 110 HD21 LEU 110 35.961 -6.856 1.762 791 HD22 LEU 110 HD22 LEU 110 36.752 -5.284 1.611 792 HD23 LEU 110 HD23 LEU 110 37.716 -6.762 1.589 793 H ASP 111 HN ASP 111 37.767 -3.876 -3.302 794 HA ASP 111 HA ASP 111 40.396 -3.165 -3.838 795 HB2 ASP 111 HB2 ASP 111 38.348 -3.635 -5.436 796 HB3 ASP 111 HB1 ASP 111 38.129 -1.901 -5.332 797 H TRP 112 HN TRP 112 37.601 -1.100 -3.328 798 HA TRP 112 HA TRP 112 38.882 1.391 -3.482 799 HB2 TRP 112 HB2 TRP 112 36.423 0.876 -3.694 800 HB3 TRP 112 HB1 TRP 112 36.381 0.718 -1.943 801 HD1 TRP 112 HD1 TRP 112 36.345 2.938 -0.516 802 HE1 TRP 112 HE1 TRP 112 36.064 5.425 -1.127 803 HE3 TRP 112 HE3 TRP 112 37.037 2.615 -5.568 804 HZ2 TRP 112 HZ2 TRP 112 36.125 7.034 -3.442 805 HZ3 TRP 112 HZ3 TRP 112 36.906 4.676 -6.908 806 HH2 TRP 112 HH2 TRP 112 36.458 6.836 -5.868 807 H ILE 113 HN ILE 113 38.081 -0.692 -0.778 808 HA ILE 113 HA ILE 113 38.913 1.100 1.245 809 HB ILE 113 HB ILE 113 38.485 -1.889 1.298 810 HG12 ILE 113 HG12 ILE 113 36.752 0.450 2.138 811 HG13 ILE 113 HG11 ILE 113 36.455 -0.643 0.796 812 HG21 ILE 113 HG21 ILE 113 38.808 0.018 3.620 813 HG22 ILE 113 HG22 ILE 113 40.000 -1.167 3.094 814 HG23 ILE 113 HG23 ILE 113 38.447 -1.706 3.728 815 HD11 ILE 113 HD11 ILE 113 36.656 -1.750 3.544 816 HD12 ILE 113 HD12 ILE 113 35.748 -2.327 2.142 817 HD13 ILE 113 HD13 ILE 113 35.189 -0.917 3.035 818 H PHE 114 HN PHE 114 40.496 -1.556 -0.453 819 HA PHE 114 HA PHE 114 42.700 -1.910 1.227 820 HB2 PHE 114 HB2 PHE 114 41.976 -3.479 -0.558 821 HB3 PHE 114 HB1 PHE 114 42.566 -2.346 -1.768 822 HD1 PHE 114 HD2 PHE 114 43.546 -4.669 0.908 823 HD2 PHE 114 HD1 PHE 114 44.890 -2.183 -2.272 824 HE1 PHE 114 HE2 PHE 114 45.763 -5.733 1.022 825 HE2 PHE 114 HE1 PHE 114 47.105 -3.244 -2.169 826 HZ PHE 114 HZ PHE 114 47.543 -5.020 -0.519 827 H SER 115 HN SER 115 42.148 0.427 -1.318 828 HA SER 115 HA SER 115 44.890 1.269 -1.456 829 HB2 SER 115 HB2 SER 115 43.939 3.107 -2.861 830 HB3 SER 115 HB1 SER 115 43.503 1.488 -3.384 831 HG SER 115 HG SER 115 41.746 2.634 -1.604 832 H HIS 116 HN HIS 116 42.762 1.524 0.885 833 HA HIS 116 HA HIS 116 43.927 4.063 1.874 834 HB2 HIS 116 HB2 HIS 116 41.476 4.249 1.462 835 HB3 HIS 116 HB1 HIS 116 41.200 2.904 2.559 836 HD1 HIS 116 HD1 HIS 116 41.386 3.384 5.108 837 HD2 HIS 116 HD2 HIS 116 42.054 6.699 2.681 838 HE1 HIS 116 HE1 HIS 116 41.281 5.381 6.635 839 HE2 HIS 116 HE2 HIS 116 41.833 7.361 5.169 840 HA PRO 117 HA PRO 117 45.608 0.578 4.486 841 HB2 PRO 117 HB2 PRO 117 47.709 2.299 5.159 842 HB3 PRO 117 HB1 PRO 117 47.774 1.014 3.953 843 HG2 PRO 117 HG2 PRO 117 47.260 3.939 3.595 844 HG3 PRO 117 HG1 PRO 117 48.202 2.830 2.576 845 HD2 PRO 117 HD2 PRO 117 45.777 3.561 1.811 846 HD3 PRO 117 HD1 PRO 117 46.281 1.868 1.657 847 H GLU 118 HN GLU 118 46.346 3.880 5.400 848 HA GLU 118 HA GLU 118 44.288 4.195 7.282 849 HB2 GLU 118 HB2 GLU 118 45.864 4.350 9.274 850 HB3 GLU 118 HB1 GLU 118 45.400 2.742 8.745 851 HG2 GLU 118 HG2 GLU 118 47.545 2.623 7.497 852 HG3 GLU 118 HG1 GLU 118 48.004 4.155 8.241 853 H PHE 119 HN PHE 119 47.693 5.133 6.866 854 HA PHE 119 HA PHE 119 46.784 7.908 6.526 855 HB2 PHE 119 HB2 PHE 119 47.847 7.473 8.772 856 HB3 PHE 119 HB1 PHE 119 49.340 7.081 7.926 857 HD1 PHE 119 HD1 PHE 119 46.802 9.821 7.832 858 HD2 PHE 119 HD2 PHE 119 50.913 8.744 7.962 859 HE1 PHE 119 HE1 PHE 119 47.420 12.201 7.853 860 HE2 PHE 119 HE2 PHE 119 51.541 11.123 7.985 861 HZ PHE 119 HZ PHE 119 49.792 12.855 7.929 862 H GLU 120 HN GLU 120 47.398 5.767 4.632 863 HA GLU 120 HA GLU 120 48.368 5.472 2.620 864 HB2 GLU 120 HB2 GLU 120 48.906 8.412 2.980 865 HB3 GLU 120 HB1 GLU 120 49.273 7.535 1.500 866 HG2 GLU 120 HG2 GLU 120 46.537 7.537 2.717 867 HG3 GLU 120 HG1 GLU 120 47.064 8.777 1.572 868 H GLU 121 HN GLU 121 49.973 4.069 2.835 869 HA GLU 121 HA GLU 121 52.419 4.861 4.196 870 HB2 GLU 121 HB2 GLU 121 52.960 2.445 4.129 871 HB3 GLU 121 HB1 GLU 121 51.432 2.790 4.929 872 HG2 GLU 121 HG2 GLU 121 50.175 1.899 3.209 873 HG3 GLU 121 HG1 GLU 121 51.476 2.082 2.034 874 H ASP 122 HN ASP 122 54.451 3.835 3.339 875 HA ASP 122 HA ASP 122 54.589 3.771 0.399 876 HB2 ASP 122 HB2 ASP 122 56.629 5.065 0.401 877 HB3 ASP 122 HB1 ASP 122 55.410 5.987 1.273 878 H SER 123 HN SER 123 54.590 1.919 2.829 879 HA SER 123 HA SER 123 57.272 0.811 2.824 880 HB2 SER 123 HB2 SER 123 55.894 1.173 4.922 881 HB3 SER 123 HB1 SER 123 54.877 -0.162 4.390 882 HG SER 123 HG SER 123 56.294 -1.305 5.454 883 H ASP 124 HN ASP 124 55.637 0.616 0.433 884 HA ASP 124 HA ASP 124 54.904 -2.165 0.211 885 HB2 ASP 124 HB2 ASP 124 54.712 -1.504 -2.287 886 HB3 ASP 124 HB1 ASP 124 53.555 -0.832 -1.146 887 H PHE 125 HN PHE 125 57.121 -0.230 -1.791 888 HA PHE 125 HA PHE 125 59.117 -0.705 -2.750 889 HB2 PHE 125 HB2 PHE 125 59.777 -0.506 -0.351 890 HB3 PHE 125 HB1 PHE 125 59.623 -2.252 -0.199 891 HD1 PHE 125 HD2 PHE 125 61.383 0.313 -2.255 892 HD2 PHE 125 HD1 PHE 125 61.494 -3.566 -0.501 893 HE1 PHE 125 HE2 PHE 125 63.713 0.049 -2.994 894 HE2 PHE 125 HE1 PHE 125 63.829 -3.837 -1.237 895 HZ PHE 125 HZ PHE 125 64.943 -2.030 -2.484 896 H VAL 126 HN VAL 126 57.808 -2.025 -4.260 897 HA VAL 126 HA VAL 126 58.359 -4.890 -4.014 898 HB VAL 126 HB VAL 126 56.020 -4.442 -4.396 899 HG11 VAL 126 HG11 VAL 126 55.197 -3.326 -6.411 900 HG12 VAL 126 HG12 VAL 126 56.857 -2.959 -6.884 901 HG13 VAL 126 HG13 VAL 126 56.178 -2.245 -5.421 902 HG21 VAL 126 HG21 VAL 126 56.930 -6.429 -5.447 903 HG22 VAL 126 HG22 VAL 126 57.334 -5.502 -6.892 904 HG23 VAL 126 HG23 VAL 126 55.646 -5.739 -6.442 Start of MODEL 2 1 H1 ASP 1 HT1 ASP 1 -42.595 8.693 0.771 2 H2 ASP 1 HT2 ASP 1 -44.283 8.744 0.907 3 H3 ASP 1 HT3 ASP 1 -43.561 8.481 -0.606 4 HA ASP 1 HA ASP 1 -43.365 6.659 1.716 5 HB2 ASP 1 HB2 ASP 1 -45.097 6.582 -0.755 6 HB3 ASP 1 HB1 ASP 1 -44.741 5.140 0.192 7 H ILE 2 HN ILE 2 -42.024 4.949 1.456 8 HA ILE 2 HA ILE 2 -40.155 3.879 0.787 9 HB ILE 2 HB ILE 2 -40.933 4.597 -2.045 10 HG12 ILE 2 HG12 ILE 2 -41.708 2.177 -0.393 11 HG13 ILE 2 HG11 ILE 2 -42.797 3.470 -0.889 12 HG21 ILE 2 HG21 ILE 2 -39.676 2.503 -2.556 13 HG22 ILE 2 HG22 ILE 2 -39.182 2.451 -0.863 14 HG23 ILE 2 HG23 ILE 2 -38.677 3.795 -1.887 15 HD11 ILE 2 HD11 ILE 2 -41.345 1.604 -2.751 16 HD12 ILE 2 HD12 ILE 2 -42.485 2.863 -3.212 17 HD13 ILE 2 HD13 ILE 2 -43.039 1.478 -2.277 18 H ASP 3 HN ASP 3 -38.868 5.415 1.790 19 HA ASP 3 HA ASP 3 -37.931 7.788 0.560 20 HB2 ASP 3 HB2 ASP 3 -37.934 7.283 3.025 21 HB3 ASP 3 HB1 ASP 3 -36.586 6.186 2.748 22 H GLU 4 HN GLU 4 -37.340 7.064 -1.538 23 HA GLU 4 HA GLU 4 -35.262 5.158 -1.918 24 HB2 GLU 4 HB2 GLU 4 -36.584 7.125 -3.770 25 HB3 GLU 4 HB1 GLU 4 -35.268 6.077 -4.289 26 HG2 GLU 4 HG2 GLU 4 -36.596 4.122 -3.591 27 HG3 GLU 4 HG1 GLU 4 -37.931 5.203 -3.197 28 H SER 5 HN SER 5 -35.175 8.407 -0.937 29 HA SER 5 HA SER 5 -32.702 9.132 -2.110 30 HB2 SER 5 HB2 SER 5 -32.638 10.943 -0.593 31 HB3 SER 5 HB1 SER 5 -34.356 10.648 -0.843 32 HG SER 5 HG SER 5 -34.319 9.416 1.125 33 H SER 6 HN SER 6 -33.628 7.263 0.668 34 HA SER 6 HA SER 6 -31.164 6.946 1.948 35 HB2 SER 6 HB2 SER 6 -33.418 4.945 1.694 36 HB3 SER 6 HB1 SER 6 -32.142 4.914 2.910 37 HG SER 6 HG SER 6 -34.070 6.979 2.557 38 H VAL 7 HN VAL 7 -32.675 4.813 -0.513 39 HA VAL 7 HA VAL 7 -30.468 3.076 -0.678 40 HB VAL 7 HB VAL 7 -32.556 2.281 -1.510 41 HG11 VAL 7 HG11 VAL 7 -32.427 4.489 -3.544 42 HG12 VAL 7 HG12 VAL 7 -33.615 4.295 -2.253 43 HG13 VAL 7 HG13 VAL 7 -33.566 3.145 -3.588 44 HG21 VAL 7 HG21 VAL 7 -31.902 1.374 -3.647 45 HG22 VAL 7 HG22 VAL 7 -30.506 1.426 -2.565 46 HG23 VAL 7 HG23 VAL 7 -30.688 2.639 -3.836 47 H MET 8 HN MET 8 -31.326 5.977 -2.448 48 HA MET 8 HA MET 8 -29.222 5.921 -4.294 49 HB2 MET 8 HB2 MET 8 -30.711 8.255 -3.114 50 HB3 MET 8 HB1 MET 8 -29.564 8.398 -4.442 51 HG2 MET 8 HG2 MET 8 -30.959 6.825 -5.746 52 HG3 MET 8 HG1 MET 8 -32.132 6.829 -4.436 53 HE1 MET 8 HE1 MET 8 -32.835 7.520 -7.481 54 HE2 MET 8 HE2 MET 8 -33.914 8.896 -7.249 55 HE3 MET 8 HE3 MET 8 -34.024 7.503 -6.178 56 H GLN 9 HN GLN 9 -29.269 6.850 -0.910 57 HA GLN 9 HA GLN 9 -26.791 8.216 -0.898 58 HB2 GLN 9 HB2 GLN 9 -28.189 6.696 1.307 59 HB3 GLN 9 HB1 GLN 9 -26.739 7.659 1.550 60 HG2 GLN 9 HG2 GLN 9 -27.973 9.644 0.749 61 HG3 GLN 9 HG1 GLN 9 -29.426 8.653 0.638 62 HE21 GLN 9 HE21 GLN 9 -28.642 7.132 3.056 63 HE22 GLN 9 HE22 GLN 9 -29.006 8.179 4.380 64 H LEU 10 HN LEU 10 -27.611 4.799 -0.246 65 HA LEU 10 HA LEU 10 -24.896 3.951 0.038 66 HB2 LEU 10 HB2 LEU 10 -26.433 1.833 -1.121 67 HB3 LEU 10 HB1 LEU 10 -25.822 1.978 0.515 68 HG LEU 10 HG LEU 10 -28.460 3.125 -0.384 69 HD11 LEU 10 HD11 LEU 10 -27.861 0.527 1.022 70 HD12 LEU 10 HD12 LEU 10 -28.413 0.691 -0.645 71 HD13 LEU 10 HD13 LEU 10 -29.464 1.181 0.686 72 HD21 LEU 10 HD21 LEU 10 -27.715 4.228 1.572 73 HD22 LEU 10 HD22 LEU 10 -27.121 2.725 2.264 74 HD23 LEU 10 HD23 LEU 10 -28.853 2.994 2.119 75 H ALA 11 HN ALA 11 -27.121 4.194 -2.598 76 HA ALA 11 HA ALA 11 -25.661 2.850 -4.578 77 HB1 ALA 11 HB1 ALA 11 -27.531 5.129 -5.146 78 HB2 ALA 11 HB2 ALA 11 -28.100 3.554 -4.602 79 HB3 ALA 11 HB3 ALA 11 -27.215 3.695 -6.124 80 H GLU 12 HN GLU 12 -25.794 6.334 -3.862 81 HA GLU 12 HA GLU 12 -24.093 7.124 -5.960 82 HB2 GLU 12 HB2 GLU 12 -24.795 8.449 -3.362 83 HB3 GLU 12 HB1 GLU 12 -23.744 9.205 -4.548 84 HG2 GLU 12 HG2 GLU 12 -26.622 8.408 -4.928 85 HG3 GLU 12 HG1 GLU 12 -25.975 10.043 -4.802 86 H MET 13 HN MET 13 -23.369 5.826 -2.819 87 HA MET 13 HA MET 13 -20.570 6.645 -3.074 88 HB2 MET 13 HB2 MET 13 -20.308 6.112 -0.758 89 HB3 MET 13 HB1 MET 13 -21.775 7.064 -0.929 90 HG2 MET 13 HG2 MET 13 -23.110 5.022 -0.807 91 HG3 MET 13 HG1 MET 13 -21.632 4.082 -0.627 92 HE1 MET 13 HE1 MET 13 -20.009 4.276 1.503 93 HE2 MET 13 HE2 MET 13 -20.305 5.378 2.848 94 HE3 MET 13 HE3 MET 13 -19.903 6.019 1.255 95 H GLY 14 HN GLY 14 -22.360 4.173 -4.147 96 HA2 GLY 14 HA2 GLY 14 -20.103 2.437 -4.414 97 HA3 GLY 14 HA1 GLY 14 -21.272 1.814 -3.260 98 H PHE 15 HN PHE 15 -22.761 0.512 -4.051 99 HA PHE 15 HA PHE 15 -23.115 0.401 -6.964 100 HB2 PHE 15 HB2 PHE 15 -23.702 -1.636 -4.801 101 HB3 PHE 15 HB1 PHE 15 -24.061 -1.875 -6.506 102 HD1 PHE 15 HD2 PHE 15 -22.242 -2.155 -8.127 103 HD2 PHE 15 HD1 PHE 15 -21.493 -1.847 -3.953 104 HE1 PHE 15 HE2 PHE 15 -19.972 -3.042 -8.474 105 HE2 PHE 15 HE1 PHE 15 -19.223 -2.728 -4.290 106 HZ PHE 15 HZ PHE 15 -18.491 -3.404 -6.562 107 HA PRO 16 HA PRO 16 -27.385 1.656 -6.624 108 HB2 PRO 16 HB2 PRO 16 -28.451 0.346 -8.734 109 HB3 PRO 16 HB1 PRO 16 -27.382 1.740 -8.930 110 HG2 PRO 16 HG2 PRO 16 -26.730 -1.184 -9.113 111 HG3 PRO 16 HG1 PRO 16 -26.250 0.138 -10.198 112 HD2 PRO 16 HD2 PRO 16 -24.596 -0.845 -8.302 113 HD3 PRO 16 HD1 PRO 16 -24.582 0.865 -8.776 114 H LEU 17 HN LEU 17 -27.711 0.529 -4.618 115 HA LEU 17 HA LEU 17 -28.403 -2.249 -4.611 116 HB2 LEU 17 HB2 LEU 17 -28.049 -0.124 -2.577 117 HB3 LEU 17 HB1 LEU 17 -29.117 -1.433 -2.143 118 HG LEU 17 HG LEU 17 -26.995 -1.980 -1.277 119 HD11 LEU 17 HD11 LEU 17 -26.404 -4.030 -2.463 120 HD12 LEU 17 HD12 LEU 17 -27.360 -3.507 -3.850 121 HD13 LEU 17 HD13 LEU 17 -28.152 -3.852 -2.313 122 HD21 LEU 17 HD21 LEU 17 -25.849 -1.455 -4.012 123 HD22 LEU 17 HD22 LEU 17 -24.963 -2.011 -2.594 124 HD23 LEU 17 HD23 LEU 17 -25.685 -0.404 -2.605 125 H GLU 18 HN GLU 18 -30.221 -1.710 -6.296 126 HA GLU 18 HA GLU 18 -32.638 -0.620 -5.520 127 HB2 GLU 18 HB2 GLU 18 -31.923 -1.671 -7.789 128 HB3 GLU 18 HB1 GLU 18 -32.600 -3.153 -7.114 129 HG2 GLU 18 HG2 GLU 18 -34.689 -1.796 -6.619 130 HG3 GLU 18 HG1 GLU 18 -33.966 -0.557 -7.641 131 H ALA 19 HN ALA 19 -31.179 -3.628 -4.573 132 HA ALA 19 HA ALA 19 -33.356 -4.959 -3.462 133 HB1 ALA 19 HB1 ALA 19 -30.679 -4.900 -2.106 134 HB2 ALA 19 HB2 ALA 19 -30.894 -5.692 -3.661 135 HB3 ALA 19 HB3 ALA 19 -31.817 -6.243 -2.265 136 H CYS 20 HN CYS 20 -31.494 -2.243 -2.344 137 HA CYS 20 HA CYS 20 -32.675 -2.098 0.263 138 HB2 CYS 20 HB2 CYS 20 -30.466 -1.032 -0.371 139 HB3 CYS 20 HB1 CYS 20 -31.388 0.161 -1.271 140 HG CYS 20 HG CYS 20 -31.363 -0.297 2.116 141 H ARG 21 HN ARG 21 -33.267 -0.571 -2.883 142 HA ARG 21 HA ARG 21 -35.304 1.175 -2.157 143 HB2 ARG 21 HB2 ARG 21 -34.651 1.373 -4.380 144 HB3 ARG 21 HB1 ARG 21 -34.733 -0.360 -4.666 145 HG2 ARG 21 HG2 ARG 21 -36.953 -0.331 -5.107 146 HG3 ARG 21 HG1 ARG 21 -37.267 1.031 -4.038 147 HD2 ARG 21 HD2 ARG 21 -37.626 1.749 -6.289 148 HD3 ARG 21 HD1 ARG 21 -36.149 2.509 -5.697 149 HE ARG 21 HE ARG 21 -35.832 0.044 -7.208 150 HH11 ARG 21 HH11 ARG 21 -35.796 3.558 -7.215 151 HH12 ARG 21 HH12 ARG 21 -34.838 3.663 -8.672 152 HH21 ARG 21 HH21 ARG 21 -34.586 0.180 -9.123 153 HH22 ARG 21 HH22 ARG 21 -34.150 1.744 -9.751 154 H LYS 22 HN LYS 22 -35.663 -2.222 -3.178 155 HA LYS 22 HA LYS 22 -38.445 -2.263 -2.545 156 HB2 LYS 22 HB2 LYS 22 -38.277 -4.698 -2.944 157 HB3 LYS 22 HB1 LYS 22 -37.605 -3.739 -4.251 158 HG2 LYS 22 HG2 LYS 22 -35.353 -4.127 -2.974 159 HG3 LYS 22 HG1 LYS 22 -36.227 -5.497 -2.286 160 HD2 LYS 22 HD2 LYS 22 -35.076 -6.286 -4.221 161 HD3 LYS 22 HD1 LYS 22 -36.791 -6.192 -4.630 162 HE2 LYS 22 HE2 LYS 22 -36.361 -3.966 -5.657 163 HE3 LYS 22 HE1 LYS 22 -34.640 -4.204 -5.352 164 HZ1 LYS 22 HZ1 LYS 22 -35.162 -4.792 -7.608 165 HZ2 LYS 22 HZ2 LYS 22 -36.379 -5.861 -7.102 166 HZ3 LYS 22 HZ3 LYS 22 -34.756 -6.208 -6.758 167 H ALA 23 HN ALA 23 -35.550 -2.797 -0.754 168 HA ALA 23 HA ALA 23 -36.669 -4.137 1.480 169 HB1 ALA 23 HB1 ALA 23 -34.676 -3.441 2.671 170 HB2 ALA 23 HB2 ALA 23 -34.296 -2.287 1.391 171 HB3 ALA 23 HB3 ALA 23 -34.248 -4.020 1.058 172 H VAL 24 HN VAL 24 -36.129 -0.728 0.696 173 HA VAL 24 HA VAL 24 -37.070 0.391 3.070 174 HB VAL 24 HB VAL 24 -37.256 1.473 0.243 175 HG11 VAL 24 HG11 VAL 24 -37.627 3.663 1.216 176 HG12 VAL 24 HG12 VAL 24 -37.637 2.965 2.837 177 HG13 VAL 24 HG13 VAL 24 -38.916 2.555 1.692 178 HG21 VAL 24 HG21 VAL 24 -35.323 2.811 0.867 179 HG22 VAL 24 HG22 VAL 24 -34.979 1.091 1.050 180 HG23 VAL 24 HG23 VAL 24 -35.318 2.079 2.472 181 H TYR 25 HN TYR 25 -38.843 -0.577 0.146 182 HA TYR 25 HA TYR 25 -41.392 0.137 1.175 183 HB2 TYR 25 HB2 TYR 25 -40.959 -0.256 -1.238 184 HB3 TYR 25 HB1 TYR 25 -40.744 -1.973 -0.897 185 HD1 TYR 25 HD2 TYR 25 -43.284 0.664 -0.078 186 HD2 TYR 25 HD1 TYR 25 -42.523 -3.280 -1.469 187 HE1 TYR 25 HE2 TYR 25 -45.701 0.297 -0.349 188 HE2 TYR 25 HE1 TYR 25 -44.932 -3.660 -1.740 189 HH TYR 25 HH TYR 25 -47.041 -2.779 -0.825 190 H PHE 26 HN PHE 26 -39.460 -2.813 1.328 191 HA PHE 26 HA PHE 26 -41.440 -4.468 2.488 192 HB2 PHE 26 HB2 PHE 26 -39.463 -5.382 1.371 193 HB3 PHE 26 HB1 PHE 26 -38.420 -4.664 2.589 194 HD1 PHE 26 HD2 PHE 26 -41.019 -7.224 2.009 195 HD2 PHE 26 HD1 PHE 26 -38.007 -5.759 4.642 196 HE1 PHE 26 HE2 PHE 26 -41.201 -9.274 3.353 197 HE2 PHE 26 HE1 PHE 26 -38.185 -7.812 5.986 198 HZ PHE 26 HZ PHE 26 -39.784 -9.573 5.343 199 H THR 27 HN THR 27 -38.995 -2.329 3.867 200 HA THR 27 HA THR 27 -39.308 -3.222 6.544 201 HB THR 27 HB THR 27 -38.144 -1.046 7.134 202 HG1 THR 27 HG1 THR 27 -37.647 -0.823 4.360 203 HG21 THR 27 HG21 THR 27 -36.745 -2.713 5.052 204 HG22 THR 27 HG22 THR 27 -36.988 -3.227 6.721 205 HG23 THR 27 HG23 THR 27 -36.005 -1.804 6.369 206 H GLY 28 HN GLY 28 -41.198 -1.230 4.542 207 HA2 GLY 28 HA2 GLY 28 -43.301 -0.337 5.138 208 HA3 GLY 28 HA1 GLY 28 -42.807 -0.370 6.828 209 H ASN 29 HN ASN 29 -40.639 0.851 4.459 210 HA ASN 29 HA ASN 29 -39.718 2.876 4.070 211 HB2 ASN 29 HB2 ASN 29 -42.046 3.433 3.329 212 HB3 ASN 29 HB1 ASN 29 -42.373 4.039 4.951 213 HD21 ASN 29 HD21 ASN 29 -42.789 6.100 4.186 214 HD22 ASN 29 HD22 ASN 29 -41.518 7.150 3.651 215 H MET 30 HN MET 30 -38.687 1.956 6.172 216 HA MET 30 HA MET 30 -39.238 3.548 8.530 217 HB2 MET 30 HB2 MET 30 -37.363 1.251 8.002 218 HB3 MET 30 HB1 MET 30 -37.438 2.091 9.544 219 HG2 MET 30 HG2 MET 30 -39.663 0.565 8.216 220 HG3 MET 30 HG1 MET 30 -38.738 0.068 9.632 221 HE1 MET 30 HE1 MET 30 -39.850 2.839 12.230 222 HE2 MET 30 HE2 MET 30 -38.522 3.001 11.080 223 HE3 MET 30 HE3 MET 30 -38.766 1.478 11.936 224 H GLY 31 HN GLY 31 -37.166 3.741 5.848 225 HA2 GLY 31 HA2 GLY 31 -36.088 5.898 5.565 226 HA3 GLY 31 HA1 GLY 31 -35.682 5.850 7.272 227 H ALA 32 HN ALA 32 -33.603 6.450 6.175 228 HA ALA 32 HA ALA 32 -32.150 4.746 4.524 229 HB1 ALA 32 HB1 ALA 32 -31.059 6.723 6.522 230 HB2 ALA 32 HB2 ALA 32 -31.629 7.116 4.899 231 HB3 ALA 32 HB3 ALA 32 -30.219 6.079 5.111 232 H GLU 33 HN GLU 33 -31.904 5.105 8.062 233 HA GLU 33 HA GLU 33 -29.662 3.419 8.290 234 HB2 GLU 33 HB2 GLU 33 -31.668 4.197 10.404 235 HB3 GLU 33 HB1 GLU 33 -30.064 3.536 10.699 236 HG2 GLU 33 HG2 GLU 33 -29.083 5.506 9.604 237 HG3 GLU 33 HG1 GLU 33 -30.701 6.170 9.395 238 H VAL 34 HN VAL 34 -33.113 2.795 8.827 239 HA VAL 34 HA VAL 34 -32.759 0.167 9.806 240 HB VAL 34 HB VAL 34 -35.171 1.392 8.462 241 HG11 VAL 34 HG11 VAL 34 -34.895 -1.148 10.059 242 HG12 VAL 34 HG12 VAL 34 -35.363 -0.999 8.365 243 HG13 VAL 34 HG13 VAL 34 -36.433 -0.399 9.631 244 HG21 VAL 34 HG21 VAL 34 -35.993 1.682 10.759 245 HG22 VAL 34 HG22 VAL 34 -34.507 2.586 10.470 246 HG23 VAL 34 HG23 VAL 34 -34.455 1.073 11.376 247 H ALA 35 HN ALA 35 -33.363 1.407 6.523 248 HA ALA 35 HA ALA 35 -33.429 -1.242 5.417 249 HB1 ALA 35 HB1 ALA 35 -34.645 0.699 4.427 250 HB2 ALA 35 HB2 ALA 35 -33.678 -0.251 3.300 251 HB3 ALA 35 HB3 ALA 35 -33.083 1.312 3.875 252 H PHE 36 HN PHE 36 -30.980 1.183 5.971 253 HA PHE 36 HA PHE 36 -28.900 0.054 4.451 254 HB2 PHE 36 HB2 PHE 36 -28.614 2.216 5.505 255 HB3 PHE 36 HB1 PHE 36 -28.822 1.512 7.105 256 HD1 PHE 36 HD2 PHE 36 -26.583 1.605 4.161 257 HD2 PHE 36 HD1 PHE 36 -27.001 0.620 8.280 258 HE1 PHE 36 HE2 PHE 36 -24.152 1.271 4.324 259 HE2 PHE 36 HE1 PHE 36 -24.567 0.285 8.451 260 HZ PHE 36 HZ PHE 36 -23.142 0.612 6.471 261 H ASN 37 HN ASN 37 -30.129 -0.648 7.700 262 HA ASN 37 HA ASN 37 -28.360 -2.716 8.367 263 HB2 ASN 37 HB2 ASN 37 -31.230 -2.195 9.149 264 HB3 ASN 37 HB1 ASN 37 -30.303 -3.536 9.799 265 HD21 ASN 37 HD21 ASN 37 -31.476 -1.230 11.143 266 HD22 ASN 37 HD22 ASN 37 -30.173 -0.431 11.949 267 H TRP 38 HN TRP 38 -31.468 -2.773 6.646 268 HA TRP 38 HA TRP 38 -31.618 -5.560 6.322 269 HB2 TRP 38 HB2 TRP 38 -33.451 -3.824 5.856 270 HB3 TRP 38 HB1 TRP 38 -32.663 -3.560 4.310 271 HD1 TRP 38 HD1 TRP 38 -34.868 -6.029 6.146 272 HE1 TRP 38 HE1 TRP 38 -35.670 -7.844 4.503 273 HE3 TRP 38 HE3 TRP 38 -31.914 -4.863 2.130 274 HZ2 TRP 38 HZ2 TRP 38 -35.130 -8.661 1.861 275 HZ3 TRP 38 HZ3 TRP 38 -32.123 -6.212 0.085 276 HH2 TRP 38 HH2 TRP 38 -33.697 -8.071 -0.045 277 H ILE 39 HN ILE 39 -30.046 -3.045 4.405 278 HA ILE 39 HA ILE 39 -29.494 -4.782 2.219 279 HB ILE 39 HB ILE 39 -29.657 -2.166 2.268 280 HG12 ILE 39 HG12 ILE 39 -28.455 -2.102 0.145 281 HG13 ILE 39 HG11 ILE 39 -27.638 -3.611 0.549 282 HG21 ILE 39 HG21 ILE 39 -26.681 -2.527 2.533 283 HG22 ILE 39 HG22 ILE 39 -27.722 -1.832 3.775 284 HG23 ILE 39 HG23 ILE 39 -27.539 -1.017 2.215 285 HD11 ILE 39 HD11 ILE 39 -29.467 -3.952 -1.025 286 HD12 ILE 39 HD12 ILE 39 -30.599 -3.282 0.150 287 HD13 ILE 39 HD13 ILE 39 -29.756 -4.791 0.498 288 H ILE 40 HN ILE 40 -27.632 -3.713 5.031 289 HA ILE 40 HA ILE 40 -25.220 -4.918 4.118 290 HB ILE 40 HB ILE 40 -24.371 -4.656 6.384 291 HG12 ILE 40 HG12 ILE 40 -26.012 -3.220 7.893 292 HG13 ILE 40 HG11 ILE 40 -27.231 -4.133 7.012 293 HG21 ILE 40 HG21 ILE 40 -25.149 -2.066 6.463 294 HG22 ILE 40 HG22 ILE 40 -25.565 -2.504 4.810 295 HG23 ILE 40 HG23 ILE 40 -23.911 -2.709 5.386 296 HD11 ILE 40 HD11 ILE 40 -25.046 -5.217 8.763 297 HD12 ILE 40 HD12 ILE 40 -26.046 -6.218 7.710 298 HD13 ILE 40 HD13 ILE 40 -26.791 -5.301 9.024 299 H VAL 41 HN VAL 41 -28.028 -6.121 5.715 300 HA VAL 41 HA VAL 41 -26.904 -8.666 6.386 301 HB VAL 41 HB VAL 41 -29.791 -7.877 5.933 302 HG11 VAL 41 HG11 VAL 41 -30.387 -9.948 7.068 303 HG12 VAL 41 HG12 VAL 41 -28.684 -10.388 7.185 304 HG13 VAL 41 HG13 VAL 41 -29.462 -10.287 5.604 305 HG21 VAL 41 HG21 VAL 41 -29.938 -7.888 8.371 306 HG22 VAL 41 HG22 VAL 41 -28.733 -6.730 7.812 307 HG23 VAL 41 HG23 VAL 41 -28.223 -8.281 8.479 308 H HIS 42 HN HIS 42 -28.639 -7.378 3.572 309 HA HIS 42 HA HIS 42 -28.349 -9.981 2.243 310 HB2 HIS 42 HB2 HIS 42 -30.157 -7.636 1.805 311 HB3 HIS 42 HB1 HIS 42 -29.854 -8.764 0.487 312 HD1 HIS 42 HD1 HIS 42 -31.433 -10.636 0.364 313 HD2 HIS 42 HD2 HIS 42 -31.114 -9.129 4.231 314 HE1 HIS 42 HE1 HIS 42 -33.080 -11.953 1.747 315 HE2 HIS 42 HE2 HIS 42 -32.744 -11.137 4.114 316 H MET 43 HN MET 43 -26.329 -7.656 2.600 317 HA MET 43 HA MET 43 -25.669 -6.666 0.075 318 HB2 MET 43 HB2 MET 43 -23.445 -6.212 1.007 319 HB3 MET 43 HB1 MET 43 -24.717 -5.751 2.125 320 HG2 MET 43 HG2 MET 43 -23.277 -6.772 3.557 321 HG3 MET 43 HG1 MET 43 -24.291 -8.139 3.109 322 HE1 MET 43 HE1 MET 43 -21.540 -6.359 0.947 323 HE2 MET 43 HE2 MET 43 -20.121 -7.350 1.291 324 HE3 MET 43 HE3 MET 43 -20.828 -6.351 2.561 325 H GLU 44 HN GLU 44 -25.317 -9.790 1.384 326 HA GLU 44 HA GLU 44 -23.175 -10.811 -0.097 327 HB2 GLU 44 HB2 GLU 44 -24.211 -13.024 0.370 328 HB3 GLU 44 HB1 GLU 44 -24.059 -12.010 1.799 329 HG2 GLU 44 HG2 GLU 44 -26.400 -11.439 1.700 330 HG3 GLU 44 HG1 GLU 44 -26.584 -12.325 0.187 331 H GLU 45 HN GLU 45 -26.357 -9.951 -1.112 332 HA GLU 45 HA GLU 45 -26.423 -11.860 -3.296 333 HB2 GLU 45 HB2 GLU 45 -28.352 -9.599 -2.788 334 HB3 GLU 45 HB1 GLU 45 -28.634 -11.067 -3.717 335 HG2 GLU 45 HG2 GLU 45 -28.269 -12.335 -1.555 336 HG3 GLU 45 HG1 GLU 45 -28.355 -10.768 -0.756 337 HA PRO 46 HA PRO 46 -24.003 -9.062 -5.803 338 HB2 PRO 46 HB2 PRO 46 -24.102 -10.668 -8.028 339 HB3 PRO 46 HB1 PRO 46 -22.951 -10.878 -6.699 340 HG2 PRO 46 HG2 PRO 46 -25.513 -12.312 -7.258 341 HG3 PRO 46 HG1 PRO 46 -23.974 -12.960 -6.654 342 HD2 PRO 46 HD2 PRO 46 -26.064 -12.505 -5.026 343 HD3 PRO 46 HD1 PRO 46 -24.387 -12.273 -4.493 344 H ASP 47 HN ASP 47 -26.820 -10.706 -7.235 345 HA ASP 47 HA ASP 47 -26.989 -8.537 -9.192 346 HB2 ASP 47 HB2 ASP 47 -26.761 -10.727 -10.137 347 HB3 ASP 47 HB1 ASP 47 -28.078 -11.351 -9.160 348 H PHE 48 HN PHE 48 -28.410 -9.443 -6.321 349 HA PHE 48 HA PHE 48 -31.103 -8.716 -6.849 350 HB2 PHE 48 HB2 PHE 48 -29.513 -9.203 -4.366 351 HB3 PHE 48 HB1 PHE 48 -31.026 -8.307 -4.229 352 HD1 PHE 48 HD2 PHE 48 -29.569 -11.492 -5.440 353 HD2 PHE 48 HD1 PHE 48 -33.086 -9.408 -4.262 354 HE1 PHE 48 HE2 PHE 48 -30.830 -13.602 -5.484 355 HE2 PHE 48 HE1 PHE 48 -34.357 -11.515 -4.312 356 HZ PHE 48 HZ PHE 48 -33.227 -13.616 -4.923 357 H ALA 49 HN ALA 49 -28.277 -6.878 -6.605 358 HA ALA 49 HA ALA 49 -29.654 -4.413 -5.959 359 HB1 ALA 49 HB1 ALA 49 -27.353 -4.575 -5.281 360 HB2 ALA 49 HB2 ALA 49 -27.473 -3.354 -6.551 361 HB3 ALA 49 HB3 ALA 49 -26.849 -4.960 -6.925 362 H GLU 50 HN GLU 50 -27.617 -3.604 -8.387 363 HA GLU 50 HA GLU 50 -29.440 -4.267 -10.570 364 HB2 GLU 50 HB2 GLU 50 -28.284 -1.523 -10.032 365 HB3 GLU 50 HB1 GLU 50 -29.120 -1.987 -11.509 366 HG2 GLU 50 HG2 GLU 50 -31.040 -2.636 -9.885 367 HG3 GLU 50 HG1 GLU 50 -30.206 -1.553 -8.773 368 HA PRO 51 HA PRO 51 -25.571 -5.168 -12.653 369 HB2 PRO 51 HB2 PRO 51 -27.067 -4.887 -15.151 370 HB3 PRO 51 HB1 PRO 51 -26.298 -6.324 -14.474 371 HG2 PRO 51 HG2 PRO 51 -28.980 -6.059 -14.604 372 HG3 PRO 51 HG1 PRO 51 -28.178 -6.933 -13.284 373 HD2 PRO 51 HD2 PRO 51 -29.296 -4.150 -13.318 374 HD3 PRO 51 HD1 PRO 51 -29.396 -5.390 -12.048 375 H LEU 52 HN LEU 52 -25.164 -2.865 -11.880 376 HA LEU 52 HA LEU 52 -24.717 -1.142 -14.203 377 HB2 LEU 52 HB2 LEU 52 -26.768 -0.366 -13.090 378 HB3 LEU 52 HB1 LEU 52 -25.892 -0.216 -11.578 379 HG LEU 52 HG LEU 52 -24.470 1.534 -12.598 380 HD11 LEU 52 HD11 LEU 52 -24.617 0.836 -14.921 381 HD12 LEU 52 HD12 LEU 52 -25.134 2.513 -14.742 382 HD13 LEU 52 HD13 LEU 52 -26.335 1.237 -14.947 383 HD21 LEU 52 HD21 LEU 52 -26.445 2.159 -11.324 384 HD22 LEU 52 HD22 LEU 52 -27.435 2.037 -12.779 385 HD23 LEU 52 HD23 LEU 52 -26.186 3.277 -12.663 386 H THR 53 HN THR 53 -22.576 -1.133 -14.299 387 HA THR 53 HA THR 53 -20.642 -1.485 -12.429 388 HB THR 53 HB THR 53 -20.416 0.709 -14.488 389 HG1 THR 53 HG1 THR 53 -20.908 -0.775 -15.906 390 HG21 THR 53 HG21 THR 53 -18.434 -1.298 -13.407 391 HG22 THR 53 HG22 THR 53 -18.497 0.416 -13.003 392 HG23 THR 53 HG23 THR 53 -18.098 -0.090 -14.645 393 H MET 54 HN MET 54 -20.100 -0.538 -10.581 394 HA MET 54 HA MET 54 -21.652 1.541 -9.517 395 HB2 MET 54 HB2 MET 54 -20.175 1.481 -7.584 396 HB3 MET 54 HB1 MET 54 -20.557 -0.151 -8.114 397 HG2 MET 54 HG2 MET 54 -18.412 -0.493 -8.973 398 HG3 MET 54 HG1 MET 54 -18.037 1.230 -8.957 399 HE1 MET 54 HE1 MET 54 -17.560 1.991 -5.180 400 HE2 MET 54 HE2 MET 54 -19.016 2.205 -6.150 401 HE3 MET 54 HE3 MET 54 -17.439 2.612 -6.827 402 HA PRO 55 HA PRO 55 -19.476 5.171 -10.917 403 HB2 PRO 55 HB2 PRO 55 -20.912 6.619 -8.836 404 HB3 PRO 55 HB1 PRO 55 -21.090 6.731 -10.589 405 HG2 PRO 55 HG2 PRO 55 -22.993 5.660 -8.972 406 HG3 PRO 55 HG1 PRO 55 -22.751 5.152 -10.651 407 HD2 PRO 55 HD2 PRO 55 -21.863 3.821 -8.120 408 HD3 PRO 55 HD1 PRO 55 -22.511 3.097 -9.608 409 H GLY 56 HN GLY 56 -17.566 5.979 -10.298 410 HA2 GLY 56 HA2 GLY 56 -16.536 5.268 -7.688 411 HA3 GLY 56 HA1 GLY 56 -15.644 6.037 -8.994 412 H TYR 57 HN TYR 57 -17.778 6.554 -6.276 413 HA TYR 57 HA TYR 57 -17.922 9.378 -6.461 414 HB2 TYR 57 HB2 TYR 57 -19.435 7.948 -5.072 415 HB3 TYR 57 HB1 TYR 57 -18.096 7.674 -3.963 416 HD1 TYR 57 HD1 TYR 57 -20.321 10.308 -5.359 417 HD2 TYR 57 HD2 TYR 57 -17.582 9.238 -2.281 418 HE1 TYR 57 HE1 TYR 57 -20.929 12.343 -4.116 419 HE2 TYR 57 HE2 TYR 57 -18.185 11.266 -1.033 420 HH TYR 57 HH TYR 57 -19.119 13.469 -1.439 421 H GLY 58 HN GLY 58 -16.044 10.452 -6.682 422 HA2 GLY 58 HA2 GLY 58 -14.232 11.578 -5.655 423 HA3 GLY 58 HA1 GLY 58 -14.114 10.269 -4.485 424 H GLY 59 HN GLY 59 -14.350 9.980 -7.987 425 HA2 GLY 59 HA2 GLY 59 -12.098 8.165 -7.978 426 HA3 GLY 59 HA1 GLY 59 -13.120 8.558 -9.350 427 H ALA 60 HN ALA 60 -11.537 10.991 -7.407 428 HA ALA 60 HA ALA 60 -10.013 11.849 -9.730 429 HB1 ALA 60 HB1 ALA 60 -9.459 13.816 -8.403 430 HB2 ALA 60 HB2 ALA 60 -10.219 13.091 -6.986 431 HB3 ALA 60 HB3 ALA 60 -11.200 13.530 -8.384 432 H ALA 61 HN ALA 61 -9.552 10.403 -6.584 433 HA ALA 61 HA ALA 61 -6.656 10.502 -6.796 434 HB1 ALA 61 HB1 ALA 61 -8.382 9.228 -4.675 435 HB2 ALA 61 HB2 ALA 61 -7.743 10.872 -4.616 436 HB3 ALA 61 HB3 ALA 61 -6.640 9.496 -4.588 437 H SER 62 HN SER 62 -6.413 9.232 -8.679 438 HA SER 62 HA SER 62 -7.506 6.653 -9.004 439 HB2 SER 62 HB2 SER 62 -5.618 6.473 -10.750 440 HB3 SER 62 HB1 SER 62 -6.821 7.743 -10.973 441 HG SER 62 HG SER 62 -5.301 9.173 -10.779 442 H ALA 63 HN ALA 63 -4.441 7.796 -7.679 443 HA ALA 63 HA ALA 63 -3.828 5.016 -6.906 444 HB1 ALA 63 HB1 ALA 63 -1.465 5.631 -6.927 445 HB2 ALA 63 HB2 ALA 63 -1.887 7.267 -7.430 446 HB3 ALA 63 HB3 ALA 63 -2.207 5.903 -8.503 447 H GLY 64 HN GLY 64 -5.505 6.870 -5.452 448 HA2 GLY 64 HA2 GLY 64 -5.878 7.405 -3.252 449 HA3 GLY 64 HA1 GLY 64 -4.426 6.500 -2.855 450 H ALA 65 HN ALA 65 -3.187 7.729 -1.630 451 HA ALA 65 HA ALA 65 -3.110 10.599 -1.957 452 HB1 ALA 65 HB1 ALA 65 -1.749 10.644 0.016 453 HB2 ALA 65 HB2 ALA 65 -1.567 8.900 -0.055 454 HB3 ALA 65 HB3 ALA 65 -3.143 9.596 0.284 455 H SER 66 HN SER 66 -1.189 7.825 -2.671 456 HA SER 66 HA SER 66 0.490 7.487 -4.142 457 HB2 SER 66 HB2 SER 66 -0.006 10.346 -4.999 458 HB3 SER 66 HB1 SER 66 0.849 9.109 -5.921 459 HG SER 66 HG SER 66 -1.472 8.064 -5.282 460 H VAL 67 HN VAL 67 1.092 8.425 -1.480 461 HA VAL 67 HA VAL 67 3.842 9.135 -1.979 462 HB VAL 67 HB VAL 67 2.962 11.356 -1.833 463 HG11 VAL 67 HG11 VAL 67 1.705 12.196 0.080 464 HG12 VAL 67 HG12 VAL 67 1.686 10.581 0.786 465 HG13 VAL 67 HG13 VAL 67 0.840 10.888 -0.732 466 HG21 VAL 67 HG21 VAL 67 4.292 10.585 0.760 467 HG22 VAL 67 HG22 VAL 67 4.152 12.228 0.134 468 HG23 VAL 67 HG23 VAL 67 5.094 11.027 -0.748 469 H PHE 68 HN PHE 68 4.437 7.191 -1.127 470 HA PHE 68 HA PHE 68 3.706 6.600 1.628 471 HB2 PHE 68 HB2 PHE 68 4.853 4.481 1.327 472 HB3 PHE 68 HB1 PHE 68 3.760 4.751 -0.022 473 HD1 PHE 68 HD1 PHE 68 4.671 5.348 -2.246 474 HD2 PHE 68 HD2 PHE 68 7.195 4.288 1.012 475 HE1 PHE 68 HE1 PHE 68 6.520 4.943 -3.813 476 HE2 PHE 68 HE2 PHE 68 9.055 3.887 -0.552 477 HZ PHE 68 HZ PHE 68 8.716 4.214 -2.966 478 H GLY 69 HN GLY 69 5.070 6.736 3.344 479 HA2 GLY 69 HA2 GLY 69 7.538 8.250 2.857 480 HA3 GLY 69 HA1 GLY 69 6.674 8.152 4.387 481 H ALA 70 HN ALA 70 9.329 7.796 4.454 482 HA ALA 70 HA ALA 70 9.944 4.964 4.277 483 HB1 ALA 70 HB1 ALA 70 12.195 5.612 4.965 484 HB2 ALA 70 HB2 ALA 70 11.642 7.262 5.248 485 HB3 ALA 70 HB3 ALA 70 11.637 6.599 3.614 486 H SER 71 HN SER 71 8.676 7.132 6.502 487 HA SER 71 HA SER 71 7.873 6.908 8.603 488 HB2 SER 71 HB2 SER 71 8.833 4.041 8.497 489 HB3 SER 71 HB1 SER 71 7.634 4.715 9.602 490 HG SER 71 HG SER 71 6.494 5.295 7.521 491 H GLY 72 HN GLY 72 10.785 4.839 8.595 492 HA2 GLY 72 HA2 GLY 72 12.074 6.730 10.419 493 HA3 GLY 72 HA1 GLY 72 11.839 5.082 10.990 494 H LEU 73 HN LEU 73 14.107 7.018 9.845 495 HA LEU 73 HA LEU 73 15.347 5.082 8.036 496 HB2 LEU 73 HB2 LEU 73 15.935 7.944 8.712 497 HB3 LEU 73 HB1 LEU 73 17.138 6.951 7.914 498 HG LEU 73 HG LEU 73 15.964 8.272 6.276 499 HD11 LEU 73 HD11 LEU 73 15.109 5.385 6.154 500 HD12 LEU 73 HD12 LEU 73 16.652 6.036 5.601 501 HD13 LEU 73 HD13 LEU 73 15.154 6.505 4.792 502 HD21 LEU 73 HD21 LEU 73 13.588 7.325 7.746 503 HD22 LEU 73 HD22 LEU 73 13.445 7.455 5.999 504 HD23 LEU 73 HD23 LEU 73 13.891 8.871 6.948 505 H ASP 74 HN ASP 74 15.051 5.261 11.160 506 HA ASP 74 HA ASP 74 17.875 4.981 11.881 507 HB2 ASP 74 HB2 ASP 74 15.452 5.216 13.685 508 HB3 ASP 74 HB1 ASP 74 17.138 5.227 14.194 509 H ASN 75 HN ASN 75 18.408 2.947 11.319 510 HA ASN 75 HA ASN 75 17.383 0.802 12.945 511 HB2 ASN 75 HB2 ASN 75 15.763 0.785 11.071 512 HB3 ASN 75 HB1 ASN 75 17.097 0.643 9.930 513 HD21 ASN 75 HD21 ASN 75 16.445 -1.311 9.109 514 HD22 ASN 75 HD22 ASN 75 16.495 -2.787 10.018 515 H GLN 76 HN GLN 76 19.120 -0.347 13.501 516 HA GLN 76 HA GLN 76 21.600 0.108 12.116 517 HB2 GLN 76 HB2 GLN 76 21.361 -0.119 14.640 518 HB3 GLN 76 HB1 GLN 76 21.099 -1.838 14.375 519 HG2 GLN 76 HG2 GLN 76 23.303 -1.938 13.233 520 HG3 GLN 76 HG1 GLN 76 23.561 -0.256 13.691 521 HE21 GLN 76 HE21 GLN 76 21.904 -2.524 15.749 522 HE22 GLN 76 HE22 GLN 76 23.133 -2.617 16.962 523 HA PRO 77 HA PRO 77 21.360 -3.173 9.169 524 HB2 PRO 77 HB2 PRO 77 24.247 -3.385 9.859 525 HB3 PRO 77 HB1 PRO 77 23.481 -3.300 8.269 526 HG2 PRO 77 HG2 PRO 77 24.661 -1.175 9.235 527 HG3 PRO 77 HG1 PRO 77 23.072 -1.012 8.467 528 HD2 PRO 77 HD2 PRO 77 23.782 -1.046 11.372 529 HD3 PRO 77 HD1 PRO 77 22.614 -0.025 10.513 530 HA PRO 78 HA PRO 78 21.192 -7.023 11.267 531 HB2 PRO 78 HB2 PRO 78 21.878 -8.748 9.276 532 HB3 PRO 78 HB1 PRO 78 20.316 -7.922 9.337 533 HG2 PRO 78 HG2 PRO 78 22.765 -7.207 7.787 534 HG3 PRO 78 HG1 PRO 78 21.082 -7.228 7.239 535 HD2 PRO 78 HD2 PRO 78 22.331 -4.962 7.930 536 HD3 PRO 78 HD1 PRO 78 20.612 -5.216 8.267 537 H GLU 79 HN GLU 79 22.655 -7.386 12.778 538 HA GLU 79 HA GLU 79 25.408 -7.144 12.580 539 HB2 GLU 79 HB2 GLU 79 25.477 -8.347 14.705 540 HB3 GLU 79 HB1 GLU 79 24.212 -7.128 14.701 541 HG2 GLU 79 HG2 GLU 79 22.744 -9.169 13.920 542 HG3 GLU 79 HG1 GLU 79 24.014 -10.086 14.724 543 H GLU 80 HN GLU 80 23.345 -9.861 11.849 544 HA GLU 80 HA GLU 80 25.245 -11.880 11.592 545 HB2 GLU 80 HB2 GLU 80 23.122 -12.700 11.312 546 HB3 GLU 80 HB1 GLU 80 22.580 -11.282 10.429 547 HG2 GLU 80 HG2 GLU 80 23.859 -12.074 8.465 548 HG3 GLU 80 HG1 GLU 80 24.244 -13.547 9.357 549 H ILE 81 HN ILE 81 24.099 -9.529 9.204 550 HA ILE 81 HA ILE 81 25.856 -10.516 7.193 551 HB ILE 81 HB ILE 81 24.101 -8.080 7.289 552 HG12 ILE 81 HG12 ILE 81 23.906 -10.675 5.748 553 HG13 ILE 81 HG11 ILE 81 22.976 -10.281 7.192 554 HG21 ILE 81 HG21 ILE 81 24.595 -8.223 4.720 555 HG22 ILE 81 HG22 ILE 81 26.089 -8.987 5.278 556 HG23 ILE 81 HG23 ILE 81 25.682 -7.354 5.804 557 HD11 ILE 81 HD11 ILE 81 22.732 -9.210 4.426 558 HD12 ILE 81 HD12 ILE 81 22.228 -8.223 5.791 559 HD13 ILE 81 HD13 ILE 81 21.477 -9.797 5.519 560 H VAL 82 HN VAL 82 25.865 -7.662 9.318 561 HA VAL 82 HA VAL 82 28.084 -6.404 8.179 562 HB VAL 82 HB VAL 82 28.427 -5.257 10.255 563 HG11 VAL 82 HG11 VAL 82 26.163 -4.407 10.726 564 HG12 VAL 82 HG12 VAL 82 25.499 -5.738 9.775 565 HG13 VAL 82 HG13 VAL 82 26.511 -4.517 9.001 566 HG21 VAL 82 HG21 VAL 82 28.253 -6.289 12.201 567 HG22 VAL 82 HG22 VAL 82 27.472 -7.670 11.424 568 HG23 VAL 82 HG23 VAL 82 26.500 -6.312 12.009 569 H ALA 83 HN ALA 83 27.777 -9.004 10.481 570 HA ALA 83 HA ALA 83 30.456 -9.461 11.137 571 HB1 ALA 83 HB1 ALA 83 29.492 -11.882 11.410 572 HB2 ALA 83 HB2 ALA 83 27.945 -11.071 11.093 573 HB3 ALA 83 HB3 ALA 83 28.944 -10.579 12.466 574 H ILE 84 HN ILE 84 28.411 -10.852 8.588 575 HA ILE 84 HA ILE 84 30.328 -12.554 7.451 576 HB ILE 84 HB ILE 84 27.944 -11.186 6.191 577 HG12 ILE 84 HG12 ILE 84 28.070 -14.086 6.879 578 HG13 ILE 84 HG11 ILE 84 27.824 -12.928 8.176 579 HG21 ILE 84 HG21 ILE 84 29.567 -13.502 5.144 580 HG22 ILE 84 HG22 ILE 84 29.547 -11.866 4.478 581 HG23 ILE 84 HG23 ILE 84 28.091 -12.861 4.425 582 HD11 ILE 84 HD11 ILE 84 26.104 -12.971 5.728 583 HD12 ILE 84 HD12 ILE 84 25.795 -12.203 7.295 584 HD13 ILE 84 HD13 ILE 84 25.771 -13.963 7.150 585 H ILE 85 HN ILE 85 29.476 -9.196 6.752 586 HA ILE 85 HA ILE 85 31.088 -8.890 4.479 587 HB ILE 85 HB ILE 85 30.142 -6.816 6.452 588 HG12 ILE 85 HG12 ILE 85 29.019 -7.635 3.768 589 HG13 ILE 85 HG11 ILE 85 28.406 -8.201 5.317 590 HG21 ILE 85 HG21 ILE 85 31.790 -6.629 4.035 591 HG22 ILE 85 HG22 ILE 85 31.583 -5.482 5.362 592 HG23 ILE 85 HG23 ILE 85 30.398 -5.546 4.057 593 HD11 ILE 85 HD11 ILE 85 27.125 -6.332 4.268 594 HD12 ILE 85 HD12 ILE 85 28.526 -5.302 4.563 595 HD13 ILE 85 HD13 ILE 85 27.673 -6.040 5.917 596 H THR 86 HN THR 86 31.742 -8.138 7.906 597 HA THR 86 HA THR 86 34.408 -7.300 7.305 598 HB THR 86 HB THR 86 33.567 -6.319 9.250 599 HG1 THR 86 HG1 THR 86 35.785 -7.199 9.354 600 HG21 THR 86 HG21 THR 86 31.817 -7.498 10.073 601 HG22 THR 86 HG22 THR 86 33.055 -7.904 11.279 602 HG23 THR 86 HG23 THR 86 32.670 -9.048 9.990 603 H SER 87 HN SER 87 32.937 -10.365 7.835 604 HA SER 87 HA SER 87 35.421 -11.755 8.228 605 HB2 SER 87 HB2 SER 87 32.697 -12.799 7.428 606 HB3 SER 87 HB1 SER 87 34.077 -13.793 7.901 607 HG SER 87 HG SER 87 32.476 -12.087 9.463 608 H MET 88 HN MET 88 33.714 -10.472 5.550 609 HA MET 88 HA MET 88 34.898 -12.092 3.508 610 HB2 MET 88 HB2 MET 88 33.633 -9.354 3.414 611 HB3 MET 88 HB1 MET 88 34.216 -10.199 1.988 612 HG2 MET 88 HG2 MET 88 32.025 -11.126 3.830 613 HG3 MET 88 HG1 MET 88 31.814 -10.434 2.223 614 HE1 MET 88 HE1 MET 88 33.446 -13.180 -0.052 615 HE2 MET 88 HE2 MET 88 34.233 -11.761 0.637 616 HE3 MET 88 HE3 MET 88 32.601 -11.634 -0.019 617 H GLY 89 HN GLY 89 35.845 -9.403 5.386 618 HA2 GLY 89 HA2 GLY 89 38.377 -9.173 5.386 619 HA3 GLY 89 HA1 GLY 89 38.167 -8.891 3.665 620 H PHE 90 HN PHE 90 35.505 -7.616 5.011 621 HA PHE 90 HA PHE 90 36.618 -4.925 4.921 622 HB2 PHE 90 HB2 PHE 90 33.751 -5.910 4.934 623 HB3 PHE 90 HB1 PHE 90 34.232 -4.225 4.772 624 HD1 PHE 90 HD2 PHE 90 36.370 -4.181 2.910 625 HD2 PHE 90 HD1 PHE 90 32.956 -6.725 2.944 626 HE1 PHE 90 HE2 PHE 90 36.592 -4.504 0.479 627 HE2 PHE 90 HE1 PHE 90 33.177 -7.057 0.516 628 HZ PHE 90 HZ PHE 90 34.993 -5.943 -0.721 629 H GLN 91 HN GLN 91 35.050 -3.457 6.472 630 HA GLN 91 HA GLN 91 35.613 -4.429 9.168 631 HB2 GLN 91 HB2 GLN 91 36.610 -2.291 8.586 632 HB3 GLN 91 HB1 GLN 91 35.056 -1.668 8.061 633 HG2 GLN 91 HG2 GLN 91 34.242 -1.842 10.366 634 HG3 GLN 91 HG1 GLN 91 35.841 -2.383 10.868 635 HE21 GLN 91 HE21 GLN 91 37.186 -0.575 8.981 636 HE22 GLN 91 HE22 GLN 91 37.059 1.008 9.670 637 H ARG 92 HN ARG 92 33.960 -4.472 10.769 638 HA ARG 92 HA ARG 92 31.361 -5.125 9.920 639 HB2 ARG 92 HB2 ARG 92 32.226 -5.770 12.117 640 HB3 ARG 92 HB1 ARG 92 32.224 -4.086 12.621 641 HG2 ARG 92 HG2 ARG 92 29.691 -4.276 11.862 642 HG3 ARG 92 HG1 ARG 92 29.972 -5.967 12.275 643 HD2 ARG 92 HD2 ARG 92 30.515 -3.626 14.084 644 HD3 ARG 92 HD1 ARG 92 29.073 -4.637 14.145 645 HE ARG 92 HE ARG 92 30.992 -6.475 14.407 646 HH11 ARG 92 HH11 ARG 92 30.525 -3.390 16.012 647 HH12 ARG 92 HH12 ARG 92 31.369 -3.872 17.459 648 HH21 ARG 92 HH21 ARG 92 32.078 -7.125 16.309 649 HH22 ARG 92 HH22 ARG 92 32.209 -6.020 17.649 650 H ASN 93 HN ASN 93 32.529 -2.160 11.476 651 HA ASN 93 HA ASN 93 30.161 -0.683 11.332 652 HB2 ASN 93 HB2 ASN 93 32.115 -0.022 12.649 653 HB3 ASN 93 HB1 ASN 93 33.014 0.313 11.171 654 HD21 ASN 93 HD21 ASN 93 33.329 2.466 11.539 655 HD22 ASN 93 HD22 ASN 93 32.043 3.628 11.548 656 H GLN 94 HN GLN 94 32.729 -1.112 8.979 657 HA GLN 94 HA GLN 94 31.759 0.697 7.041 658 HB2 GLN 94 HB2 GLN 94 33.982 0.036 6.776 659 HB3 GLN 94 HB1 GLN 94 33.598 -1.659 6.991 660 HG2 GLN 94 HG2 GLN 94 33.000 -1.954 4.825 661 HG3 GLN 94 HG1 GLN 94 32.448 -0.287 4.632 662 HE21 GLN 94 HE21 GLN 94 35.180 -2.429 4.544 663 HE22 GLN 94 HE22 GLN 94 36.283 -1.323 3.821 664 H ALA 95 HN ALA 95 31.215 -2.701 7.701 665 HA ALA 95 HA ALA 95 29.507 -3.275 5.545 666 HB1 ALA 95 HB1 ALA 95 29.600 -4.455 8.321 667 HB2 ALA 95 HB2 ALA 95 30.551 -4.983 6.929 668 HB3 ALA 95 HB3 ALA 95 28.793 -5.170 6.923 669 H ILE 96 HN ILE 96 28.903 -1.937 8.777 670 HA ILE 96 HA ILE 96 26.119 -1.940 8.726 671 HB ILE 96 HB ILE 96 28.139 -0.279 10.169 672 HG12 ILE 96 HG12 ILE 96 26.046 -1.269 11.807 673 HG13 ILE 96 HG11 ILE 96 26.490 -2.545 10.684 674 HG21 ILE 96 HG21 ILE 96 26.157 0.854 11.337 675 HG22 ILE 96 HG22 ILE 96 25.234 0.418 9.890 676 HG23 ILE 96 HG23 ILE 96 26.648 1.468 9.757 677 HD11 ILE 96 HD11 ILE 96 28.286 -1.103 12.609 678 HD12 ILE 96 HD12 ILE 96 28.848 -2.237 11.382 679 HD13 ILE 96 HD13 ILE 96 27.779 -2.793 12.671 680 H GLN 97 HN GLN 97 28.345 0.655 7.778 681 HA GLN 97 HA GLN 97 26.433 2.496 6.938 682 HB2 GLN 97 HB2 GLN 97 28.786 3.044 7.249 683 HB3 GLN 97 HB1 GLN 97 29.197 2.057 5.862 684 HG2 GLN 97 HG2 GLN 97 28.069 3.530 4.375 685 HG3 GLN 97 HG1 GLN 97 27.406 4.450 5.720 686 HE21 GLN 97 HE21 GLN 97 29.939 4.291 7.213 687 HE22 GLN 97 HE22 GLN 97 30.999 5.423 6.445 688 H ALA 98 HN ALA 98 28.122 -0.001 5.136 689 HA ALA 98 HA ALA 98 27.082 0.534 2.615 690 HB1 ALA 98 HB1 ALA 98 28.954 -1.084 3.377 691 HB2 ALA 98 HB2 ALA 98 27.994 -1.503 1.959 692 HB3 ALA 98 HB3 ALA 98 27.646 -2.262 3.516 693 H LEU 99 HN LEU 99 25.936 -1.798 5.070 694 HA LEU 99 HA LEU 99 23.662 -2.633 3.664 695 HB2 LEU 99 HB2 LEU 99 24.142 -2.516 6.624 696 HB3 LEU 99 HB1 LEU 99 22.797 -3.344 5.880 697 HG LEU 99 HG LEU 99 25.671 -4.037 5.330 698 HD11 LEU 99 HD11 LEU 99 23.765 -5.423 7.197 699 HD12 LEU 99 HD12 LEU 99 25.053 -4.338 7.707 700 HD13 LEU 99 HD13 LEU 99 25.450 -5.844 6.880 701 HD21 LEU 99 HD21 LEU 99 24.801 -5.329 3.757 702 HD22 LEU 99 HD22 LEU 99 23.180 -4.799 4.193 703 HD23 LEU 99 HD23 LEU 99 23.893 -6.191 4.999 704 H ARG 100 HN ARG 100 24.165 0.109 5.824 705 HA ARG 100 HA ARG 100 21.497 0.870 6.205 706 HB2 ARG 100 HB2 ARG 100 23.985 2.559 5.965 707 HB3 ARG 100 HB1 ARG 100 22.422 3.187 6.477 708 HG2 ARG 100 HG2 ARG 100 22.421 1.748 8.410 709 HG3 ARG 100 HG1 ARG 100 23.925 0.990 7.884 710 HD2 ARG 100 HD2 ARG 100 24.331 2.635 9.629 711 HD3 ARG 100 HD1 ARG 100 25.081 3.126 8.108 712 HE ARG 100 HE ARG 100 22.608 4.323 8.105 713 HH11 ARG 100 HH11 ARG 100 25.450 4.428 10.153 714 HH12 ARG 100 HH12 ARG 100 25.050 5.974 10.837 715 HH21 ARG 100 HH21 ARG 100 22.094 6.351 8.972 716 HH22 ARG 100 HH22 ARG 100 23.132 7.075 10.167 717 H ALA 101 HN ALA 101 23.744 1.592 3.617 718 HA ALA 101 HA ALA 101 21.952 3.266 2.154 719 HB1 ALA 101 HB1 ALA 101 23.720 2.791 0.327 720 HB2 ALA 101 HB2 ALA 101 24.598 1.992 1.639 721 HB3 ALA 101 HB3 ALA 101 24.188 3.704 1.763 722 H THR 102 HN THR 102 22.867 -0.140 2.035 723 HA THR 102 HA THR 102 21.378 -0.630 -0.383 724 HB THR 102 HB THR 102 22.285 -2.846 -0.270 725 HG1 THR 102 HG1 THR 102 23.268 -3.616 1.579 726 HG21 THR 102 HG21 THR 102 24.377 -2.128 -0.727 727 HG22 THR 102 HG22 THR 102 24.573 -1.325 0.815 728 HG23 THR 102 HG23 THR 102 23.692 -0.535 -0.492 729 H ASN 103 HN ASN 103 20.393 -0.201 2.665 730 HA ASN 103 HA ASN 103 18.678 -0.829 3.997 731 HB2 ASN 103 HB2 ASN 103 17.417 -0.355 1.893 732 HB3 ASN 103 HB1 ASN 103 17.447 -2.078 1.544 733 HD21 ASN 103 HD21 ASN 103 15.284 -2.445 1.711 734 HD22 ASN 103 HD22 ASN 103 14.396 -2.285 3.190 735 H ASN 104 HN ASN 104 20.480 -2.240 4.666 736 HA ASN 104 HA ASN 104 21.361 -4.159 5.453 737 HB2 ASN 104 HB2 ASN 104 19.837 -5.719 6.551 738 HB3 ASN 104 HB1 ASN 104 19.402 -4.056 6.891 739 HD21 ASN 104 HD21 ASN 104 18.512 -6.956 5.144 740 HD22 ASN 104 HD22 ASN 104 16.848 -6.520 4.901 741 H ASN 105 HN ASN 105 20.999 -4.059 2.542 742 HA ASN 105 HA ASN 105 20.600 -6.865 1.852 743 HB2 ASN 105 HB2 ASN 105 19.835 -4.944 0.357 744 HB3 ASN 105 HB1 ASN 105 21.537 -4.651 0.017 745 HD21 ASN 105 HD21 ASN 105 18.842 -6.777 -0.451 746 HD22 ASN 105 HD22 ASN 105 19.570 -7.771 -1.666 747 H LEU 106 HN LEU 106 22.167 -8.172 2.295 748 HA LEU 106 HA LEU 106 24.759 -7.593 3.047 749 HB2 LEU 106 HB2 LEU 106 23.681 -9.715 3.485 750 HB3 LEU 106 HB1 LEU 106 23.611 -10.086 1.780 751 HG LEU 106 HG LEU 106 26.308 -9.680 2.972 752 HD11 LEU 106 HD11 LEU 106 25.002 -12.351 3.217 753 HD12 LEU 106 HD12 LEU 106 24.761 -11.149 4.478 754 HD13 LEU 106 HD13 LEU 106 26.393 -11.704 4.097 755 HD21 LEU 106 HD21 LEU 106 26.869 -11.492 1.429 756 HD22 LEU 106 HD22 LEU 106 26.061 -10.158 0.603 757 HD23 LEU 106 HD23 LEU 106 25.167 -11.633 0.981 758 H GLU 107 HN GLU 107 23.780 -9.007 -0.025 759 HA GLU 107 HA GLU 107 26.205 -8.961 -1.343 760 HB2 GLU 107 HB2 GLU 107 23.408 -8.689 -2.436 761 HB3 GLU 107 HB1 GLU 107 24.834 -8.955 -3.432 762 HG2 GLU 107 HG2 GLU 107 24.240 -10.795 -1.181 763 HG3 GLU 107 HG1 GLU 107 23.375 -10.966 -2.713 764 H ARG 108 HN ARG 108 23.636 -6.511 -1.514 765 HA ARG 108 HA ARG 108 25.090 -4.794 -3.217 766 HB2 ARG 108 HB2 ARG 108 22.580 -4.796 -2.745 767 HB3 ARG 108 HB1 ARG 108 22.969 -3.882 -1.301 768 HG2 ARG 108 HG2 ARG 108 24.035 -2.168 -2.703 769 HG3 ARG 108 HG1 ARG 108 23.528 -3.067 -4.135 770 HD2 ARG 108 HD2 ARG 108 21.615 -2.214 -2.014 771 HD3 ARG 108 HD1 ARG 108 22.031 -1.156 -3.366 772 HE ARG 108 HE ARG 108 21.107 -3.826 -4.061 773 HH11 ARG 108 HH11 ARG 108 20.335 -0.432 -3.689 774 HH12 ARG 108 HH12 ARG 108 18.835 -0.547 -4.552 775 HH21 ARG 108 HH21 ARG 108 19.148 -3.975 -5.232 776 HH22 ARG 108 HH22 ARG 108 18.158 -2.564 -5.447 777 H ALA 109 HN ALA 109 25.056 -5.198 0.261 778 HA ALA 109 HA ALA 109 26.259 -2.765 0.974 779 HB1 ALA 109 HB1 ALA 109 25.436 -5.021 2.335 780 HB2 ALA 109 HB2 ALA 109 26.261 -3.635 3.046 781 HB3 ALA 109 HB3 ALA 109 27.188 -5.043 2.538 782 H LEU 110 HN LEU 110 27.641 -5.973 0.327 783 HA LEU 110 HA LEU 110 30.353 -5.269 0.358 784 HB2 LEU 110 HB2 LEU 110 28.995 -7.353 -1.343 785 HB3 LEU 110 HB1 LEU 110 30.688 -7.317 -0.915 786 HG LEU 110 HG LEU 110 28.551 -7.513 1.182 787 HD11 LEU 110 HD11 LEU 110 29.890 -9.775 -0.298 788 HD12 LEU 110 HD12 LEU 110 28.181 -9.337 -0.371 789 HD13 LEU 110 HD13 LEU 110 28.874 -9.941 1.137 790 HD21 LEU 110 HD21 LEU 110 30.367 -8.514 2.473 791 HD22 LEU 110 HD22 LEU 110 30.792 -6.899 1.903 792 HD23 LEU 110 HD23 LEU 110 31.452 -8.321 1.096 793 H ASP 111 HN ASP 111 27.946 -5.285 -2.190 794 HA ASP 111 HA ASP 111 29.393 -4.445 -4.400 795 HB2 ASP 111 HB2 ASP 111 26.841 -4.960 -4.131 796 HB3 ASP 111 HB1 ASP 111 26.721 -3.263 -3.723 797 H TRP 112 HN TRP 112 27.785 -2.507 -1.952 798 HA TRP 112 HA TRP 112 28.529 0.032 -2.868 799 HB2 TRP 112 HB2 TRP 112 26.686 -0.546 -1.261 800 HB3 TRP 112 HB1 TRP 112 27.922 -0.781 -0.030 801 HD1 TRP 112 HD1 TRP 112 29.231 1.424 0.839 802 HE1 TRP 112 HE1 TRP 112 28.576 3.916 0.809 803 HE3 TRP 112 HE3 TRP 112 25.433 1.204 -2.577 804 HZ2 TRP 112 HZ2 TRP 112 26.679 5.561 -0.491 805 HZ3 TRP 112 HZ3 TRP 112 24.247 3.282 -3.157 806 HH2 TRP 112 HH2 TRP 112 24.858 5.414 -2.135 807 H ILE 113 HN ILE 113 29.874 -2.051 -0.369 808 HA ILE 113 HA ILE 113 31.938 -0.353 0.465 809 HB ILE 113 HB ILE 113 31.742 -3.366 0.560 810 HG12 ILE 113 HG12 ILE 113 31.095 -1.198 2.573 811 HG13 ILE 113 HG11 ILE 113 29.953 -2.282 1.792 812 HG21 ILE 113 HG21 ILE 113 33.619 -1.517 2.035 813 HG22 ILE 113 HG22 ILE 113 34.065 -2.638 0.749 814 HG23 ILE 113 HG23 ILE 113 33.472 -3.257 2.289 815 HD11 ILE 113 HD11 ILE 113 32.125 -3.486 3.399 816 HD12 ILE 113 HD12 ILE 113 30.454 -4.009 3.145 817 HD13 ILE 113 HD13 ILE 113 30.806 -2.674 4.239 818 H PHE 114 HN PHE 114 31.830 -2.856 -2.030 819 HA PHE 114 HA PHE 114 34.556 -2.917 -2.696 820 HB2 PHE 114 HB2 PHE 114 32.802 -4.570 -3.415 821 HB3 PHE 114 HB1 PHE 114 32.216 -3.360 -4.556 822 HD1 PHE 114 HD2 PHE 114 35.199 -5.372 -3.657 823 HD2 PHE 114 HD1 PHE 114 33.158 -3.179 -6.681 824 HE1 PHE 114 HE2 PHE 114 36.812 -6.180 -5.325 825 HE2 PHE 114 HE1 PHE 114 34.769 -3.988 -8.357 826 HZ PHE 114 HZ PHE 114 36.598 -5.490 -7.682 827 H SER 115 HN SER 115 32.051 -0.681 -3.474 828 HA SER 115 HA SER 115 33.367 0.515 -5.715 829 HB2 SER 115 HB2 SER 115 31.076 1.449 -3.984 830 HB3 SER 115 HB1 SER 115 31.580 2.230 -5.482 831 HG SER 115 HG SER 115 30.671 -0.458 -5.215 832 H HIS 116 HN HIS 116 34.072 0.490 -2.528 833 HA HIS 116 HA HIS 116 35.849 2.806 -2.850 834 HB2 HIS 116 HB2 HIS 116 34.149 2.259 -0.392 835 HB3 HIS 116 HB1 HIS 116 35.488 3.400 -0.440 836 HD1 HIS 116 HD1 HIS 116 35.108 5.213 -2.610 837 HD2 HIS 116 HD2 HIS 116 31.798 3.526 -0.734 838 HE1 HIS 116 HE1 HIS 116 33.175 6.738 -3.129 839 HE2 HIS 116 HE2 HIS 116 31.155 5.562 -2.198 840 HA PRO 117 HA PRO 117 37.963 -1.332 -2.307 841 HB2 PRO 117 HB2 PRO 117 40.281 0.189 -2.947 842 HB3 PRO 117 HB1 PRO 117 39.429 -0.961 -3.975 843 HG2 PRO 117 HG2 PRO 117 39.187 2.003 -3.809 844 HG3 PRO 117 HG1 PRO 117 38.980 0.932 -5.215 845 HD2 PRO 117 HD2 PRO 117 36.849 1.998 -4.086 846 HD3 PRO 117 HD1 PRO 117 36.829 0.275 -4.523 847 H GLU 118 HN GLU 118 39.651 1.640 -1.485 848 HA GLU 118 HA GLU 118 39.748 1.158 1.295 849 HB2 GLU 118 HB2 GLU 118 42.276 0.958 1.355 850 HB3 GLU 118 HB1 GLU 118 41.403 -0.484 0.863 851 HG2 GLU 118 HG2 GLU 118 41.882 0.047 -1.470 852 HG3 GLU 118 HG1 GLU 118 42.783 1.474 -0.961 853 H PHE 119 HN PHE 119 41.560 2.582 -1.365 854 HA PHE 119 HA PHE 119 40.916 5.240 -0.361 855 HB2 PHE 119 HB2 PHE 119 43.259 4.538 0.365 856 HB3 PHE 119 HB1 PHE 119 43.686 4.505 -1.341 857 HD1 PHE 119 HD1 PHE 119 42.147 6.803 1.171 858 HD2 PHE 119 HD2 PHE 119 44.635 6.375 -2.253 859 HE1 PHE 119 HE1 PHE 119 42.673 9.203 1.258 860 HE2 PHE 119 HE2 PHE 119 45.165 8.774 -2.170 861 HZ PHE 119 HZ PHE 119 44.153 10.199 -0.397 862 H GLU 120 HN GLU 120 39.737 3.677 -2.314 863 HA GLU 120 HA GLU 120 38.884 3.811 -4.383 864 HB2 GLU 120 HB2 GLU 120 40.474 6.361 -4.559 865 HB3 GLU 120 HB1 GLU 120 39.259 5.843 -5.723 866 HG2 GLU 120 HG2 GLU 120 38.708 6.220 -2.812 867 HG3 GLU 120 HG1 GLU 120 38.466 7.495 -4.010 868 H GLU 121 HN GLU 121 39.849 4.236 -6.864 869 HA GLU 121 HA GLU 121 42.210 2.475 -6.862 870 HB2 GLU 121 HB2 GLU 121 41.280 1.221 -8.677 871 HB3 GLU 121 HB1 GLU 121 40.063 1.322 -7.417 872 HG2 GLU 121 HG2 GLU 121 40.133 3.050 -9.874 873 HG3 GLU 121 HG1 GLU 121 39.164 1.594 -9.693 874 H ASP 122 HN ASP 122 43.464 2.471 -8.825 875 HA ASP 122 HA ASP 122 44.396 3.249 -10.730 876 HB2 ASP 122 HB2 ASP 122 42.154 3.560 -11.628 877 HB3 ASP 122 HB1 ASP 122 42.047 5.142 -10.857 878 H SER 123 HN SER 123 46.106 4.430 -10.979 879 HA SER 123 HA SER 123 46.208 7.219 -10.325 880 HB2 SER 123 HB2 SER 123 46.719 6.076 -8.130 881 HB3 SER 123 HB1 SER 123 48.134 5.361 -8.901 882 HG SER 123 HG SER 123 47.940 8.083 -9.241 883 H ASP 124 HN ASP 124 47.721 8.218 -11.639 884 HA ASP 124 HA ASP 124 49.727 6.593 -12.974 885 HB2 ASP 124 HB2 ASP 124 48.998 6.960 -15.200 886 HB3 ASP 124 HB1 ASP 124 47.576 6.403 -14.325 887 H PHE 125 HN PHE 125 51.356 7.767 -13.946 888 HA PHE 125 HA PHE 125 51.265 10.691 -13.625 889 HB2 PHE 125 HB2 PHE 125 53.602 8.884 -12.944 890 HB3 PHE 125 HB1 PHE 125 53.630 10.643 -12.902 891 HD1 PHE 125 HD1 PHE 125 52.447 7.610 -11.237 892 HD2 PHE 125 HD2 PHE 125 52.539 11.861 -11.131 893 HE1 PHE 125 HE1 PHE 125 51.684 7.562 -8.898 894 HE2 PHE 125 HE2 PHE 125 51.777 11.822 -8.794 895 HZ PHE 125 HZ PHE 125 51.348 9.673 -7.675 896 H VAL 126 HN VAL 126 50.669 9.251 -15.930 897 HA VAL 126 HA VAL 126 51.119 9.104 -18.145 898 HB VAL 126 HB VAL 126 53.514 10.863 -17.577 899 HG11 VAL 126 HG11 VAL 126 53.418 11.399 -19.964 900 HG12 VAL 126 HG12 VAL 126 52.092 10.253 -20.169 901 HG13 VAL 126 HG13 VAL 126 53.694 9.677 -19.703 902 HG21 VAL 126 HG21 VAL 126 50.725 11.592 -18.472 903 HG22 VAL 126 HG22 VAL 126 52.086 12.710 -18.351 904 HG23 VAL 126 HG23 VAL 126 51.440 11.943 -16.899 Start of MODEL 3 1 H1 ASP 1 HT1 ASP 1 -36.915 7.383 -12.712 2 H2 ASP 1 HT2 ASP 1 -36.500 5.991 -11.839 3 H3 ASP 1 HT3 ASP 1 -35.857 7.494 -11.388 4 HA ASP 1 HA ASP 1 -38.094 8.287 -10.845 5 HB2 ASP 1 HB2 ASP 1 -38.819 5.389 -11.369 6 HB3 ASP 1 HB1 ASP 1 -39.876 6.569 -10.599 7 H ILE 2 HN ILE 2 -37.369 4.905 -10.056 8 HA ILE 2 HA ILE 2 -37.407 5.356 -7.241 9 HB ILE 2 HB ILE 2 -36.276 3.046 -8.843 10 HG12 ILE 2 HG12 ILE 2 -38.927 3.284 -7.406 11 HG13 ILE 2 HG11 ILE 2 -38.721 3.494 -9.141 12 HG21 ILE 2 HG21 ILE 2 -36.967 3.191 -5.909 13 HG22 ILE 2 HG22 ILE 2 -35.339 3.160 -6.585 14 HG23 ILE 2 HG23 ILE 2 -36.396 1.763 -6.776 15 HD11 ILE 2 HD11 ILE 2 -38.058 0.980 -7.631 16 HD12 ILE 2 HD12 ILE 2 -38.027 1.212 -9.381 17 HD13 ILE 2 HD13 ILE 2 -39.559 1.272 -8.509 18 H ASP 3 HN ASP 3 -35.866 6.409 -6.172 19 HA ASP 3 HA ASP 3 -33.407 7.169 -7.334 20 HB2 ASP 3 HB2 ASP 3 -34.399 7.284 -4.484 21 HB3 ASP 3 HB1 ASP 3 -32.839 7.927 -4.982 22 H GLU 4 HN GLU 4 -32.569 5.108 -8.001 23 HA GLU 4 HA GLU 4 -31.693 3.204 -6.078 24 HB2 GLU 4 HB2 GLU 4 -30.845 3.649 -8.942 25 HB3 GLU 4 HB1 GLU 4 -30.323 2.291 -7.950 26 HG2 GLU 4 HG2 GLU 4 -32.777 1.757 -7.629 27 HG3 GLU 4 HG1 GLU 4 -33.092 2.932 -8.905 28 H SER 5 HN SER 5 -30.596 6.267 -6.869 29 HA SER 5 HA SER 5 -27.875 6.119 -6.331 30 HB2 SER 5 HB2 SER 5 -29.757 8.285 -5.356 31 HB3 SER 5 HB1 SER 5 -28.036 8.446 -5.710 32 HG SER 5 HG SER 5 -29.523 9.207 -7.395 33 H SER 6 HN SER 6 -30.676 5.978 -4.238 34 HA SER 6 HA SER 6 -29.380 6.212 -1.746 35 HB2 SER 6 HB2 SER 6 -31.905 4.635 -2.253 36 HB3 SER 6 HB1 SER 6 -31.461 5.555 -0.816 37 HG SER 6 HG SER 6 -32.637 6.398 -3.146 38 H VAL 7 HN VAL 7 -30.466 3.339 -3.562 39 HA VAL 7 HA VAL 7 -29.542 1.486 -1.655 40 HB VAL 7 HB VAL 7 -31.196 0.742 -3.202 41 HG11 VAL 7 HG11 VAL 7 -29.197 1.252 -5.389 42 HG12 VAL 7 HG12 VAL 7 -30.728 2.090 -5.132 43 HG13 VAL 7 HG13 VAL 7 -30.720 0.389 -5.595 44 HG21 VAL 7 HG21 VAL 7 -30.202 -1.338 -4.002 45 HG22 VAL 7 HG22 VAL 7 -29.656 -0.940 -2.367 46 HG23 VAL 7 HG23 VAL 7 -28.592 -0.661 -3.751 47 H MET 8 HN MET 8 -28.065 2.828 -4.556 48 HA MET 8 HA MET 8 -25.755 1.231 -4.510 49 HB2 MET 8 HB2 MET 8 -26.201 3.991 -5.622 50 HB3 MET 8 HB1 MET 8 -24.719 3.073 -5.864 51 HG2 MET 8 HG2 MET 8 -26.117 1.258 -6.873 52 HG3 MET 8 HG1 MET 8 -27.485 2.367 -6.801 53 HE1 MET 8 HE1 MET 8 -23.736 3.285 -7.544 54 HE2 MET 8 HE2 MET 8 -23.689 3.178 -9.304 55 HE3 MET 8 HE3 MET 8 -23.923 1.720 -8.338 56 H GLN 9 HN GLN 9 -26.565 4.206 -2.809 57 HA GLN 9 HA GLN 9 -24.046 4.747 -1.724 58 HB2 GLN 9 HB2 GLN 9 -26.817 5.208 -0.622 59 HB3 GLN 9 HB1 GLN 9 -25.365 5.749 0.207 60 HG2 GLN 9 HG2 GLN 9 -26.118 6.550 -2.591 61 HG3 GLN 9 HG1 GLN 9 -26.480 7.495 -1.149 62 HE21 GLN 9 HE21 GLN 9 -24.014 6.907 0.192 63 HE22 GLN 9 HE22 GLN 9 -22.769 7.778 -0.633 64 H LEU 10 HN LEU 10 -26.681 2.708 -0.435 65 HA LEU 10 HA LEU 10 -25.247 1.770 1.827 66 HB2 LEU 10 HB2 LEU 10 -27.272 0.132 0.325 67 HB3 LEU 10 HB1 LEU 10 -26.878 0.055 2.025 68 HG LEU 10 HG LEU 10 -28.453 2.180 0.601 69 HD11 LEU 10 HD11 LEU 10 -29.173 0.273 2.805 70 HD12 LEU 10 HD12 LEU 10 -29.574 0.066 1.099 71 HD13 LEU 10 HD13 LEU 10 -30.249 1.421 2.008 72 HD21 LEU 10 HD21 LEU 10 -28.758 3.149 2.883 73 HD22 LEU 10 HD22 LEU 10 -27.138 3.320 2.225 74 HD23 LEU 10 HD23 LEU 10 -27.463 2.094 3.445 75 H ALA 11 HN ALA 11 -25.651 0.550 -1.429 76 HA ALA 11 HA ALA 11 -24.481 -1.971 -1.081 77 HB1 ALA 11 HB1 ALA 11 -24.445 -0.496 -3.690 78 HB2 ALA 11 HB2 ALA 11 -25.949 -1.088 -2.989 79 HB3 ALA 11 HB3 ALA 11 -24.658 -2.223 -3.393 80 H GLU 12 HN GLU 12 -23.073 1.037 -2.344 81 HA GLU 12 HA GLU 12 -20.643 -0.132 -3.158 82 HB2 GLU 12 HB2 GLU 12 -19.958 2.015 -3.720 83 HB3 GLU 12 HB1 GLU 12 -21.708 2.108 -3.800 84 HG2 GLU 12 HG2 GLU 12 -21.828 3.249 -1.716 85 HG3 GLU 12 HG1 GLU 12 -20.101 3.016 -1.439 86 H MET 13 HN MET 13 -21.643 1.332 -0.150 87 HA MET 13 HA MET 13 -18.952 0.874 0.952 88 HB2 MET 13 HB2 MET 13 -19.550 2.380 2.759 89 HB3 MET 13 HB1 MET 13 -19.843 3.150 1.206 90 HG2 MET 13 HG2 MET 13 -22.202 2.759 1.396 91 HG3 MET 13 HG1 MET 13 -21.958 1.829 2.872 92 HE1 MET 13 HE1 MET 13 -23.787 5.146 4.022 93 HE2 MET 13 HE2 MET 13 -23.885 3.386 3.977 94 HE3 MET 13 HE3 MET 13 -24.001 4.313 2.482 95 H GLY 14 HN GLY 14 -21.131 -1.195 0.549 96 HA2 GLY 14 HA2 GLY 14 -20.743 -2.480 3.094 97 HA3 GLY 14 HA1 GLY 14 -22.406 -1.979 2.828 98 H PHE 15 HN PHE 15 -23.639 -2.991 1.281 99 HA PHE 15 HA PHE 15 -22.589 -5.067 -0.384 100 HB2 PHE 15 HB2 PHE 15 -23.818 -6.936 0.654 101 HB3 PHE 15 HB1 PHE 15 -22.627 -6.268 1.750 102 HD1 PHE 15 HD1 PHE 15 -23.440 -4.698 3.584 103 HD2 PHE 15 HD2 PHE 15 -26.039 -7.159 1.278 104 HE1 PHE 15 HE1 PHE 15 -25.154 -4.529 5.341 105 HE2 PHE 15 HE2 PHE 15 -27.759 -6.986 3.027 106 HZ PHE 15 HZ PHE 15 -27.319 -5.673 5.061 107 HA PRO 16 HA PRO 16 -25.925 -3.965 -2.864 108 HB2 PRO 16 HB2 PRO 16 -26.969 -6.183 -3.954 109 HB3 PRO 16 HB1 PRO 16 -25.290 -5.710 -4.257 110 HG2 PRO 16 HG2 PRO 16 -26.359 -7.652 -2.224 111 HG3 PRO 16 HG1 PRO 16 -25.066 -7.906 -3.426 112 HD2 PRO 16 HD2 PRO 16 -24.484 -7.271 -0.899 113 HD3 PRO 16 HD1 PRO 16 -23.544 -6.592 -2.242 114 H LEU 17 HN LEU 17 -27.251 -3.128 -1.039 115 HA LEU 17 HA LEU 17 -29.433 -4.712 -0.092 116 HB2 LEU 17 HB2 LEU 17 -28.738 -1.799 0.164 117 HB3 LEU 17 HB1 LEU 17 -30.341 -2.358 0.589 118 HG LEU 17 HG LEU 17 -29.135 -2.254 2.601 119 HD11 LEU 17 HD11 LEU 17 -29.034 -4.582 3.348 120 HD12 LEU 17 HD12 LEU 17 -29.146 -5.117 1.670 121 HD13 LEU 17 HD13 LEU 17 -30.488 -4.242 2.408 122 HD21 LEU 17 HD21 LEU 17 -26.894 -2.095 1.719 123 HD22 LEU 17 HD22 LEU 17 -26.934 -3.791 1.241 124 HD23 LEU 17 HD23 LEU 17 -26.975 -3.356 2.950 125 H GLU 18 HN GLU 18 -29.898 -5.231 -2.614 126 HA GLU 18 HA GLU 18 -31.493 -3.413 -4.012 127 HB2 GLU 18 HB2 GLU 18 -30.707 -5.895 -4.600 128 HB3 GLU 18 HB1 GLU 18 -32.349 -6.256 -4.068 129 HG2 GLU 18 HG2 GLU 18 -33.262 -4.703 -5.678 130 HG3 GLU 18 HG1 GLU 18 -31.636 -4.208 -6.145 131 H ALA 19 HN ALA 19 -32.076 -5.134 -1.107 132 HA ALA 19 HA ALA 19 -34.842 -4.929 -0.811 133 HB1 ALA 19 HB1 ALA 19 -32.872 -4.353 1.380 134 HB2 ALA 19 HB2 ALA 19 -33.135 -5.976 0.754 135 HB3 ALA 19 HB3 ALA 19 -34.466 -5.098 1.508 136 H CYS 20 HN CYS 20 -32.301 -2.593 -0.599 137 HA CYS 20 HA CYS 20 -33.861 -0.418 0.402 138 HB2 CYS 20 HB2 CYS 20 -31.331 -0.539 0.502 139 HB3 CYS 20 HB1 CYS 20 -31.321 -0.248 -1.229 140 HG CYS 20 HG CYS 20 -32.325 1.914 1.214 141 H ARG 21 HN ARG 21 -32.757 -1.457 -2.814 142 HA ARG 21 HA ARG 21 -33.930 0.562 -4.336 143 HB2 ARG 21 HB2 ARG 21 -32.620 -0.853 -5.609 144 HB3 ARG 21 HB1 ARG 21 -33.263 -2.302 -4.854 145 HG2 ARG 21 HG2 ARG 21 -35.184 -2.281 -6.192 146 HG3 ARG 21 HG1 ARG 21 -34.916 -0.609 -6.702 147 HD2 ARG 21 HD2 ARG 21 -33.059 -1.249 -8.058 148 HD3 ARG 21 HD1 ARG 21 -33.044 -2.875 -7.371 149 HE ARG 21 HE ARG 21 -35.408 -2.973 -8.444 150 HH11 ARG 21 HH11 ARG 21 -32.669 -1.241 -9.789 151 HH12 ARG 21 HH12 ARG 21 -33.115 -1.567 -11.435 152 HH21 ARG 21 HH21 ARG 21 -35.996 -3.382 -10.621 153 HH22 ARG 21 HH22 ARG 21 -34.973 -2.819 -11.911 154 H LYS 22 HN LYS 22 -35.364 -2.460 -3.193 155 HA LYS 22 HA LYS 22 -37.978 -1.909 -4.168 156 HB2 LYS 22 HB2 LYS 22 -36.901 -3.835 -2.106 157 HB3 LYS 22 HB1 LYS 22 -38.604 -3.771 -2.549 158 HG2 LYS 22 HG2 LYS 22 -38.157 -4.453 -4.766 159 HG3 LYS 22 HG1 LYS 22 -36.426 -4.181 -4.579 160 HD2 LYS 22 HD2 LYS 22 -37.881 -6.217 -2.913 161 HD3 LYS 22 HD1 LYS 22 -37.295 -6.600 -4.534 162 HE2 LYS 22 HE2 LYS 22 -35.024 -5.856 -3.806 163 HE3 LYS 22 HE1 LYS 22 -35.646 -5.704 -2.165 164 HZ1 LYS 22 HZ1 LYS 22 -36.330 -8.137 -2.448 165 HZ2 LYS 22 HZ2 LYS 22 -34.677 -7.818 -2.259 166 HZ3 LYS 22 HZ3 LYS 22 -35.302 -8.149 -3.800 167 H ALA 23 HN ALA 23 -36.224 -1.028 -1.314 168 HA ALA 23 HA ALA 23 -38.467 -0.252 0.278 169 HB1 ALA 23 HB1 ALA 23 -36.816 0.785 1.735 170 HB2 ALA 23 HB2 ALA 23 -35.578 0.588 0.491 171 HB3 ALA 23 HB3 ALA 23 -36.293 -0.830 1.257 172 H VAL 24 HN VAL 24 -36.122 1.491 -1.735 173 HA VAL 24 HA VAL 24 -37.023 4.092 -1.421 174 HB VAL 24 HB VAL 24 -35.958 2.761 -3.927 175 HG11 VAL 24 HG11 VAL 24 -35.438 4.929 -4.779 176 HG12 VAL 24 HG12 VAL 24 -36.010 5.705 -3.297 177 HG13 VAL 24 HG13 VAL 24 -37.157 4.898 -4.368 178 HG21 VAL 24 HG21 VAL 24 -33.817 3.753 -3.270 179 HG22 VAL 24 HG22 VAL 24 -34.417 2.625 -2.054 180 HG23 VAL 24 HG23 VAL 24 -34.560 4.363 -1.791 181 H TYR 25 HN TYR 25 -38.068 1.653 -3.778 182 HA TYR 25 HA TYR 25 -40.142 3.053 -4.983 183 HB2 TYR 25 HB2 TYR 25 -39.342 0.901 -5.801 184 HB3 TYR 25 HB1 TYR 25 -39.937 0.102 -4.352 185 HD1 TYR 25 HD2 TYR 25 -41.130 2.138 -7.240 186 HD2 TYR 25 HD1 TYR 25 -42.043 -0.874 -4.377 187 HE1 TYR 25 HE2 TYR 25 -43.283 1.742 -8.352 188 HE2 TYR 25 HE1 TYR 25 -44.203 -1.274 -5.480 189 HH TYR 25 HH TYR 25 -44.966 0.073 -8.560 190 H PHE 26 HN PHE 26 -40.209 1.064 -2.030 191 HA PHE 26 HA PHE 26 -42.980 1.336 -1.547 192 HB2 PHE 26 HB2 PHE 26 -41.684 -0.450 -0.519 193 HB3 PHE 26 HB1 PHE 26 -40.723 0.724 0.373 194 HD1 PHE 26 HD2 PHE 26 -44.140 -0.644 -0.006 195 HD2 PHE 26 HD1 PHE 26 -41.436 1.539 2.454 196 HE1 PHE 26 HE2 PHE 26 -45.748 -0.750 1.848 197 HE2 PHE 26 HE1 PHE 26 -43.042 1.428 4.316 198 HZ PHE 26 HZ PHE 26 -45.194 0.297 4.021 199 H THR 27 HN THR 27 -40.192 3.230 -0.429 200 HA THR 27 HA THR 27 -41.649 4.840 1.384 201 HB THR 27 HB THR 27 -39.742 6.404 1.300 202 HG1 THR 27 HG1 THR 27 -39.115 4.856 -0.949 203 HG21 THR 27 HG21 THR 27 -39.034 3.483 1.531 204 HG22 THR 27 HG22 THR 27 -39.615 4.537 2.820 205 HG23 THR 27 HG23 THR 27 -38.023 4.808 2.110 206 H GLY 28 HN GLY 28 -41.726 4.742 -1.967 207 HA2 GLY 28 HA2 GLY 28 -42.974 6.051 -3.421 208 HA3 GLY 28 HA1 GLY 28 -43.259 7.186 -2.111 209 H ASN 29 HN ASN 29 -40.060 6.114 -2.883 210 HA ASN 29 HA ASN 29 -38.191 7.186 -3.582 211 HB2 ASN 29 HB2 ASN 29 -40.132 8.775 -5.282 212 HB3 ASN 29 HB1 ASN 29 -38.387 8.713 -5.506 213 HD21 ASN 29 HD21 ASN 29 -40.632 7.933 -7.255 214 HD22 ASN 29 HD22 ASN 29 -40.323 6.291 -7.693 215 H MET 30 HN MET 30 -38.581 7.958 -1.213 216 HA MET 30 HA MET 30 -39.147 10.789 -0.981 217 HB2 MET 30 HB2 MET 30 -38.605 8.595 0.979 218 HB3 MET 30 HB1 MET 30 -38.520 10.275 1.492 219 HG2 MET 30 HG2 MET 30 -40.911 8.958 0.223 220 HG3 MET 30 HG1 MET 30 -40.698 9.248 1.948 221 HE1 MET 30 HE1 MET 30 -43.487 11.810 0.854 222 HE2 MET 30 HE2 MET 30 -43.083 10.492 1.955 223 HE3 MET 30 HE3 MET 30 -43.222 10.184 0.223 224 H GLY 31 HN GLY 31 -36.319 8.686 -0.852 225 HA2 GLY 31 HA2 GLY 31 -34.423 10.333 -1.705 226 HA3 GLY 31 HA1 GLY 31 -34.643 10.942 -0.072 227 H ALA 32 HN ALA 32 -32.209 10.117 -0.709 228 HA ALA 32 HA ALA 32 -31.623 7.402 -0.480 229 HB1 ALA 32 HB1 ALA 32 -30.106 9.090 -1.396 230 HB2 ALA 32 HB2 ALA 32 -29.349 8.133 -0.135 231 HB3 ALA 32 HB3 ALA 32 -29.891 9.764 0.220 232 H GLU 33 HN GLU 33 -31.199 9.950 1.985 233 HA GLU 33 HA GLU 33 -30.480 8.253 4.077 234 HB2 GLU 33 HB2 GLU 33 -31.970 10.870 4.320 235 HB3 GLU 33 HB1 GLU 33 -31.026 10.087 5.577 236 HG2 GLU 33 HG2 GLU 33 -29.517 11.620 4.868 237 HG3 GLU 33 HG1 GLU 33 -29.106 10.292 3.786 238 H VAL 34 HN VAL 34 -33.625 9.107 2.845 239 HA VAL 34 HA VAL 34 -35.172 8.174 5.019 240 HB VAL 34 HB VAL 34 -35.924 8.340 2.095 241 HG11 VAL 34 HG11 VAL 34 -37.605 7.996 4.573 242 HG12 VAL 34 HG12 VAL 34 -37.495 6.918 3.179 243 HG13 VAL 34 HG13 VAL 34 -38.255 8.500 3.012 244 HG21 VAL 34 HG21 VAL 34 -36.945 10.484 2.700 245 HG22 VAL 34 HG22 VAL 34 -35.204 10.486 2.986 246 HG23 VAL 34 HG23 VAL 34 -36.319 10.313 4.341 247 H ALA 35 HN ALA 35 -34.069 6.598 2.019 248 HA ALA 35 HA ALA 35 -35.286 4.100 2.755 249 HB1 ALA 35 HB1 ALA 35 -34.907 4.883 0.390 250 HB2 ALA 35 HB2 ALA 35 -34.459 3.220 0.758 251 HB3 ALA 35 HB3 ALA 35 -33.208 4.459 0.619 252 H PHE 36 HN PHE 36 -32.115 5.562 3.100 253 HA PHE 36 HA PHE 36 -30.646 3.371 4.025 254 HB2 PHE 36 HB2 PHE 36 -29.545 5.483 3.755 255 HB3 PHE 36 HB1 PHE 36 -30.635 6.274 4.888 256 HD1 PHE 36 HD2 PHE 36 -28.008 3.657 4.673 257 HD2 PHE 36 HD1 PHE 36 -30.064 6.446 7.142 258 HE1 PHE 36 HE2 PHE 36 -26.418 3.210 6.494 259 HE2 PHE 36 HE1 PHE 36 -28.479 6.001 8.971 260 HZ PHE 36 HZ PHE 36 -26.659 4.394 8.657 261 H ASN 37 HN ASN 37 -32.894 5.521 5.690 262 HA ASN 37 HA ASN 37 -32.806 4.341 8.239 263 HB2 ASN 37 HB2 ASN 37 -33.831 6.575 7.544 264 HB3 ASN 37 HB1 ASN 37 -35.225 5.653 6.996 265 HD21 ASN 37 HD21 ASN 37 -35.134 7.672 9.022 266 HD22 ASN 37 HD22 ASN 37 -35.634 6.933 10.503 267 H TRP 38 HN TRP 38 -34.867 3.714 5.412 268 HA TRP 38 HA TRP 38 -36.545 1.861 6.716 269 HB2 TRP 38 HB2 TRP 38 -36.900 3.059 4.429 270 HB3 TRP 38 HB1 TRP 38 -35.988 1.710 3.766 271 HD1 TRP 38 HD1 TRP 38 -37.600 -0.015 2.782 272 HE1 TRP 38 HE1 TRP 38 -39.869 -1.036 3.446 273 HE3 TRP 38 HE3 TRP 38 -38.459 2.673 7.043 274 HZ2 TRP 38 HZ2 TRP 38 -41.760 -0.742 5.521 275 HZ3 TRP 38 HZ3 TRP 38 -40.524 2.238 8.311 276 HH2 TRP 38 HH2 TRP 38 -42.136 0.570 7.565 277 H ILE 39 HN ILE 39 -33.412 1.534 5.202 278 HA ILE 39 HA ILE 39 -33.572 -1.317 4.987 279 HB ILE 39 HB ILE 39 -32.028 0.405 3.688 280 HG12 ILE 39 HG12 ILE 39 -30.629 -1.495 3.015 281 HG13 ILE 39 HG11 ILE 39 -31.149 -2.388 4.444 282 HG21 ILE 39 HG21 ILE 39 -30.161 -0.584 5.838 283 HG22 ILE 39 HG22 ILE 39 -30.738 1.076 5.691 284 HG23 ILE 39 HG23 ILE 39 -29.727 0.374 4.422 285 HD11 ILE 39 HD11 ILE 39 -32.323 -3.109 2.435 286 HD12 ILE 39 HD12 ILE 39 -32.936 -1.470 2.205 287 HD13 ILE 39 HD13 ILE 39 -33.432 -2.408 3.614 288 H ILE 40 HN ILE 40 -32.193 0.948 7.337 289 HA ILE 40 HA ILE 40 -31.026 -1.120 8.913 290 HB ILE 40 HB ILE 40 -30.731 0.561 10.655 291 HG12 ILE 40 HG12 ILE 40 -31.293 2.998 9.821 292 HG13 ILE 40 HG11 ILE 40 -32.567 2.170 8.930 293 HG21 ILE 40 HG21 ILE 40 -29.532 2.268 9.010 294 HG22 ILE 40 HG22 ILE 40 -29.902 0.999 7.847 295 HG23 ILE 40 HG23 ILE 40 -28.932 0.632 9.274 296 HD11 ILE 40 HD11 ILE 40 -32.153 2.189 11.907 297 HD12 ILE 40 HD12 ILE 40 -33.358 1.211 11.069 298 HD13 ILE 40 HD13 ILE 40 -33.447 2.974 11.002 299 H VAL 41 HN VAL 41 -34.177 0.230 8.662 300 HA VAL 41 HA VAL 41 -35.255 -1.049 10.978 301 HB VAL 41 HB VAL 41 -36.611 -0.093 8.444 302 HG11 VAL 41 HG11 VAL 41 -38.714 -0.292 9.683 303 HG12 VAL 41 HG12 VAL 41 -37.847 -1.021 11.035 304 HG13 VAL 41 HG13 VAL 41 -37.930 -1.859 9.486 305 HG21 VAL 41 HG21 VAL 41 -35.599 1.683 9.793 306 HG22 VAL 41 HG22 VAL 41 -36.480 1.110 11.209 307 HG23 VAL 41 HG23 VAL 41 -37.359 1.773 9.830 308 H HIS 42 HN HIS 42 -35.200 -1.864 7.505 309 HA HIS 42 HA HIS 42 -36.344 -4.470 8.053 310 HB2 HIS 42 HB2 HIS 42 -35.842 -2.861 5.624 311 HB3 HIS 42 HB1 HIS 42 -35.761 -4.610 5.427 312 HD1 HIS 42 HD1 HIS 42 -37.929 -5.613 4.790 313 HD2 HIS 42 HD2 HIS 42 -38.427 -2.199 7.129 314 HE1 HIS 42 HE1 HIS 42 -40.412 -5.275 4.984 315 HE2 HIS 42 HE2 HIS 42 -40.673 -3.406 6.651 316 H MET 43 HN MET 43 -33.378 -3.471 8.635 317 HA MET 43 HA MET 43 -31.750 -5.469 7.518 318 HB2 MET 43 HB2 MET 43 -30.184 -5.060 9.279 319 HB3 MET 43 HB1 MET 43 -30.907 -3.517 8.855 320 HG2 MET 43 HG2 MET 43 -32.294 -3.562 10.805 321 HG3 MET 43 HG1 MET 43 -31.771 -5.201 11.192 322 HE1 MET 43 HE1 MET 43 -31.731 -2.689 13.206 323 HE2 MET 43 HE2 MET 43 -30.184 -2.940 14.014 324 HE3 MET 43 HE3 MET 43 -31.239 -4.314 13.687 325 H GLU 44 HN GLU 44 -34.231 -5.563 9.876 326 HA GLU 44 HA GLU 44 -33.848 -7.902 11.262 327 HB2 GLU 44 HB2 GLU 44 -36.359 -8.131 11.159 328 HB3 GLU 44 HB1 GLU 44 -35.782 -6.557 11.685 329 HG2 GLU 44 HG2 GLU 44 -36.164 -5.669 9.431 330 HG3 GLU 44 HG1 GLU 44 -36.767 -7.243 8.923 331 H GLU 45 HN GLU 45 -34.626 -7.474 7.876 332 HA GLU 45 HA GLU 45 -34.377 -10.379 7.515 333 HB2 GLU 45 HB2 GLU 45 -35.441 -9.576 5.162 334 HB3 GLU 45 HB1 GLU 45 -36.398 -10.121 6.534 335 HG2 GLU 45 HG2 GLU 45 -36.675 -7.785 7.242 336 HG3 GLU 45 HG1 GLU 45 -35.776 -7.263 5.818 337 HA PRO 46 HA PRO 46 -30.368 -8.518 6.196 338 HB2 PRO 46 HB2 PRO 46 -29.225 -11.060 6.104 339 HB3 PRO 46 HB1 PRO 46 -29.177 -9.962 7.496 340 HG2 PRO 46 HG2 PRO 46 -31.007 -12.259 6.924 341 HG3 PRO 46 HG1 PRO 46 -30.277 -11.758 8.468 342 HD2 PRO 46 HD2 PRO 46 -32.830 -11.230 7.949 343 HD3 PRO 46 HD1 PRO 46 -31.810 -10.021 8.759 344 H ASP 47 HN ASP 47 -31.835 -11.465 5.000 345 HA ASP 47 HA ASP 47 -30.203 -11.359 2.594 346 HB2 ASP 47 HB2 ASP 47 -30.139 -13.393 3.841 347 HB3 ASP 47 HB1 ASP 47 -31.886 -13.489 3.911 348 H PHE 48 HN PHE 48 -32.712 -9.723 3.268 349 HA PHE 48 HA PHE 48 -34.557 -10.386 1.161 350 HB2 PHE 48 HB2 PHE 48 -35.052 -9.030 3.295 351 HB3 PHE 48 HB1 PHE 48 -34.277 -7.681 2.472 352 HD1 PHE 48 HD2 PHE 48 -36.985 -10.190 2.022 353 HD2 PHE 48 HD1 PHE 48 -35.543 -6.289 1.128 354 HE1 PHE 48 HE2 PHE 48 -39.118 -9.663 0.912 355 HE2 PHE 48 HE1 PHE 48 -37.673 -5.750 0.021 356 HZ PHE 48 HZ PHE 48 -39.462 -7.439 -0.088 357 H ALA 49 HN ALA 49 -31.512 -9.092 1.324 358 HA ALA 49 HA ALA 49 -31.706 -7.882 -1.342 359 HB1 ALA 49 HB1 ALA 49 -30.925 -6.163 0.054 360 HB2 ALA 49 HB2 ALA 49 -29.447 -6.845 -0.650 361 HB3 ALA 49 HB3 ALA 49 -29.926 -7.267 0.998 362 H GLU 50 HN GLU 50 -31.306 -9.608 -2.580 363 HA GLU 50 HA GLU 50 -29.731 -11.799 -2.214 364 HB2 GLU 50 HB2 GLU 50 -30.047 -10.250 -4.783 365 HB3 GLU 50 HB1 GLU 50 -29.504 -11.918 -4.660 366 HG2 GLU 50 HG2 GLU 50 -31.688 -12.279 -5.117 367 HG3 GLU 50 HG1 GLU 50 -31.788 -12.187 -3.364 368 HA PRO 51 HA PRO 51 -25.790 -9.706 -1.754 369 HB2 PRO 51 HB2 PRO 51 -24.738 -12.138 -0.658 370 HB3 PRO 51 HB1 PRO 51 -25.197 -10.665 0.193 371 HG2 PRO 51 HG2 PRO 51 -26.516 -13.070 0.436 372 HG3 PRO 51 HG1 PRO 51 -27.245 -11.489 0.769 373 HD2 PRO 51 HD2 PRO 51 -27.472 -13.213 -1.669 374 HD3 PRO 51 HD1 PRO 51 -28.715 -12.232 -0.857 375 H LEU 52 HN LEU 52 -26.115 -10.342 -4.298 376 HA LEU 52 HA LEU 52 -24.115 -12.346 -5.051 377 HB2 LEU 52 HB2 LEU 52 -26.022 -10.769 -6.781 378 HB3 LEU 52 HB1 LEU 52 -25.004 -12.095 -7.311 379 HG LEU 52 HG LEU 52 -27.282 -12.320 -5.341 380 HD11 LEU 52 HD11 LEU 52 -27.060 -13.216 -8.211 381 HD12 LEU 52 HD12 LEU 52 -28.050 -11.885 -7.614 382 HD13 LEU 52 HD13 LEU 52 -28.413 -13.539 -7.128 383 HD21 LEU 52 HD21 LEU 52 -25.565 -14.459 -6.595 384 HD22 LEU 52 HD22 LEU 52 -26.932 -14.721 -5.513 385 HD23 LEU 52 HD23 LEU 52 -25.475 -13.925 -4.917 386 H THR 53 HN THR 53 -23.329 -9.796 -3.870 387 HA THR 53 HA THR 53 -21.331 -9.053 -5.818 388 HB THR 53 HB THR 53 -23.070 -6.818 -4.766 389 HG1 THR 53 HG1 THR 53 -23.360 -8.367 -7.109 390 HG21 THR 53 HG21 THR 53 -21.975 -5.518 -6.529 391 HG22 THR 53 HG22 THR 53 -21.070 -6.946 -7.027 392 HG23 THR 53 HG23 THR 53 -20.785 -6.232 -5.440 393 H MET 54 HN MET 54 -19.649 -9.397 -4.422 394 HA MET 54 HA MET 54 -19.740 -8.258 -1.747 395 HB2 MET 54 HB2 MET 54 -18.704 -10.469 -2.065 396 HB3 MET 54 HB1 MET 54 -17.517 -9.760 -3.149 397 HG2 MET 54 HG2 MET 54 -16.601 -8.441 -1.346 398 HG3 MET 54 HG1 MET 54 -17.847 -9.030 -0.248 399 HE1 MET 54 HE1 MET 54 -18.079 -12.087 -0.941 400 HE2 MET 54 HE2 MET 54 -17.966 -11.465 0.705 401 HE3 MET 54 HE3 MET 54 -16.915 -12.784 0.184 402 HA PRO 55 HA PRO 55 -17.927 -4.592 -3.688 403 HB2 PRO 55 HB2 PRO 55 -18.875 -3.109 -1.406 404 HB3 PRO 55 HB1 PRO 55 -19.480 -3.076 -3.062 405 HG2 PRO 55 HG2 PRO 55 -20.902 -4.081 -0.953 406 HG3 PRO 55 HG1 PRO 55 -21.119 -4.614 -2.631 407 HD2 PRO 55 HD2 PRO 55 -19.546 -5.902 -0.422 408 HD3 PRO 55 HD1 PRO 55 -20.629 -6.650 -1.619 409 H GLY 56 HN GLY 56 -15.826 -4.189 -3.476 410 HA2 GLY 56 HA2 GLY 56 -14.499 -4.592 -0.921 411 HA3 GLY 56 HA1 GLY 56 -13.720 -4.262 -2.463 412 H TYR 57 HN TYR 57 -15.911 -2.693 -0.149 413 HA TYR 57 HA TYR 57 -15.108 -0.075 -0.969 414 HB2 TYR 57 HB2 TYR 57 -16.502 0.722 0.907 415 HB3 TYR 57 HB1 TYR 57 -17.358 -0.413 -0.124 416 HD1 TYR 57 HD2 TYR 57 -17.733 -2.757 0.691 417 HD2 TYR 57 HD1 TYR 57 -16.174 0.294 3.207 418 HE1 TYR 57 HE2 TYR 57 -18.328 -4.094 2.665 419 HE2 TYR 57 HE1 TYR 57 -16.762 -1.034 5.190 420 HH TYR 57 HH TYR 57 -18.162 -2.794 5.881 421 H GLY 58 HN GLY 58 -13.665 1.283 -0.096 422 HA2 GLY 58 HA2 GLY 58 -12.423 1.821 2.050 423 HA3 GLY 58 HA1 GLY 58 -11.919 0.137 1.991 424 H GLY 59 HN GLY 59 -9.726 0.809 1.906 425 HA2 GLY 59 HA2 GLY 59 -7.802 1.020 0.631 426 HA3 GLY 59 HA1 GLY 59 -8.807 1.255 -0.792 427 H ALA 60 HN ALA 60 -8.359 3.118 -1.712 428 HA ALA 60 HA ALA 60 -8.030 5.327 -2.070 429 HB1 ALA 60 HB1 ALA 60 -9.991 5.720 -0.692 430 HB2 ALA 60 HB2 ALA 60 -8.779 6.972 -0.416 431 HB3 ALA 60 HB3 ALA 60 -8.998 5.680 0.765 432 H ALA 61 HN ALA 61 -7.130 5.132 1.367 433 HA ALA 61 HA ALA 61 -4.486 6.188 0.656 434 HB1 ALA 61 HB1 ALA 61 -5.760 7.409 2.365 435 HB2 ALA 61 HB2 ALA 61 -4.256 6.749 3.010 436 HB3 ALA 61 HB3 ALA 61 -5.793 5.959 3.367 437 H SER 62 HN SER 62 -5.838 3.822 2.978 438 HA SER 62 HA SER 62 -4.936 1.965 3.940 439 HB2 SER 62 HB2 SER 62 -3.918 1.579 1.112 440 HB3 SER 62 HB1 SER 62 -3.990 0.318 2.345 441 HG SER 62 HG SER 62 -5.814 0.510 0.775 442 H ALA 63 HN ALA 63 -3.523 3.884 4.846 443 HA ALA 63 HA ALA 63 -0.713 3.543 4.087 444 HB1 ALA 63 HB1 ALA 63 -0.317 5.691 5.134 445 HB2 ALA 63 HB2 ALA 63 -1.982 5.746 5.711 446 HB3 ALA 63 HB3 ALA 63 -1.646 5.819 3.982 447 H GLY 64 HN GLY 64 -0.587 1.516 5.268 448 HA2 GLY 64 HA2 GLY 64 -0.705 1.546 8.140 449 HA3 GLY 64 HA1 GLY 64 0.024 0.293 7.138 450 H ALA 65 HN ALA 65 1.522 2.491 5.756 451 HA ALA 65 HA ALA 65 3.242 3.824 7.552 452 HB1 ALA 65 HB1 ALA 65 4.127 1.559 7.949 453 HB2 ALA 65 HB2 ALA 65 5.314 2.587 7.147 454 HB3 ALA 65 HB3 ALA 65 4.424 1.379 6.220 455 H SER 66 HN SER 66 3.164 2.169 4.436 456 HA SER 66 HA SER 66 3.814 4.693 3.091 457 HB2 SER 66 HB2 SER 66 3.734 1.887 1.940 458 HB3 SER 66 HB1 SER 66 4.344 3.336 1.143 459 HG SER 66 HG SER 66 6.133 2.401 1.930 460 H VAL 67 HN VAL 67 2.543 4.935 0.957 461 HA VAL 67 HA VAL 67 -0.268 4.579 1.591 462 HB VAL 67 HB VAL 67 -0.686 6.027 -0.392 463 HG11 VAL 67 HG11 VAL 67 1.236 7.133 1.656 464 HG12 VAL 67 HG12 VAL 67 -0.514 6.997 1.827 465 HG13 VAL 67 HG13 VAL 67 0.172 8.089 0.625 466 HG21 VAL 67 HG21 VAL 67 1.204 7.201 -1.427 467 HG22 VAL 67 HG22 VAL 67 1.294 5.462 -1.700 468 HG23 VAL 67 HG23 VAL 67 2.329 6.219 -0.490 469 H PHE 68 HN PHE 68 -1.665 3.314 0.525 470 HA PHE 68 HA PHE 68 -2.418 1.551 -0.666 471 HB2 PHE 68 HB2 PHE 68 -2.118 3.173 -2.526 472 HB3 PHE 68 HB1 PHE 68 -0.501 2.535 -2.792 473 HD1 PHE 68 HD1 PHE 68 -3.934 1.123 -2.365 474 HD2 PHE 68 HD2 PHE 68 -0.322 1.163 -4.612 475 HE1 PHE 68 HE1 PHE 68 -4.871 -0.566 -3.887 476 HE2 PHE 68 HE2 PHE 68 -1.249 -0.527 -6.140 477 HZ PHE 68 HZ PHE 68 -3.510 -1.410 -5.771 478 H GLY 69 HN GLY 69 -0.896 0.594 1.153 479 HA2 GLY 69 HA2 GLY 69 -0.267 -1.780 1.134 480 HA3 GLY 69 HA1 GLY 69 0.737 -1.418 -0.261 481 H ALA 70 HN ALA 70 2.634 -2.140 0.626 482 HA ALA 70 HA ALA 70 3.699 -0.507 2.840 483 HB1 ALA 70 HB1 ALA 70 3.077 -2.722 3.692 484 HB2 ALA 70 HB2 ALA 70 4.822 -2.471 3.747 485 HB3 ALA 70 HB3 ALA 70 4.112 -3.477 2.482 486 H SER 71 HN SER 71 3.971 -0.156 0.021 487 HA SER 71 HA SER 71 6.389 -1.169 -0.984 488 HB2 SER 71 HB2 SER 71 5.036 1.444 -1.693 489 HB3 SER 71 HB1 SER 71 6.167 0.535 -2.698 490 HG SER 71 HG SER 71 3.639 0.317 -2.838 491 H GLY 72 HN GLY 72 8.342 -0.862 -0.108 492 HA2 GLY 72 HA2 GLY 72 10.235 0.501 0.254 493 HA3 GLY 72 HA1 GLY 72 9.175 1.882 0.485 494 H LEU 73 HN LEU 73 8.642 -1.173 2.083 495 HA LEU 73 HA LEU 73 8.831 0.151 4.658 496 HB2 LEU 73 HB2 LEU 73 7.400 -2.075 3.586 497 HB3 LEU 73 HB1 LEU 73 8.328 -2.622 4.970 498 HG LEU 73 HG LEU 73 6.073 -1.964 5.633 499 HD11 LEU 73 HD11 LEU 73 7.871 -1.664 7.244 500 HD12 LEU 73 HD12 LEU 73 6.666 -0.389 7.418 501 HD13 LEU 73 HD13 LEU 73 8.192 -0.053 6.605 502 HD21 LEU 73 HD21 LEU 73 5.383 0.393 5.497 503 HD22 LEU 73 HD22 LEU 73 5.610 -0.327 3.902 504 HD23 LEU 73 HD23 LEU 73 6.839 0.750 4.567 505 H ASP 74 HN ASP 74 11.289 0.168 3.662 506 HA ASP 74 HA ASP 74 12.762 -1.439 5.550 507 HB2 ASP 74 HB2 ASP 74 12.398 -2.782 3.309 508 HB3 ASP 74 HB1 ASP 74 13.660 -1.718 2.698 509 H ASN 75 HN ASN 75 15.006 -0.774 5.661 510 HA ASN 75 HA ASN 75 15.389 1.938 4.587 511 HB2 ASN 75 HB2 ASN 75 16.622 2.531 6.604 512 HB3 ASN 75 HB1 ASN 75 15.019 1.950 7.044 513 HD21 ASN 75 HD21 ASN 75 14.816 -0.010 8.116 514 HD22 ASN 75 HD22 ASN 75 16.164 -0.816 8.836 515 H GLN 76 HN GLN 76 16.192 -0.867 3.820 516 HA GLN 76 HA GLN 76 18.974 -1.167 4.048 517 HB2 GLN 76 HB2 GLN 76 17.355 -2.953 3.400 518 HB3 GLN 76 HB1 GLN 76 17.155 -2.166 1.843 519 HG2 GLN 76 HG2 GLN 76 19.530 -2.536 1.366 520 HG3 GLN 76 HG1 GLN 76 19.702 -3.359 2.913 521 HE21 GLN 76 HE21 GLN 76 16.854 -3.661 0.948 522 HE22 GLN 76 HE22 GLN 76 17.105 -5.308 0.481 523 HA PRO 77 HA PRO 77 20.809 1.823 1.288 524 HB2 PRO 77 HB2 PRO 77 22.421 -0.561 0.491 525 HB3 PRO 77 HB1 PRO 77 22.963 1.067 0.918 526 HG2 PRO 77 HG2 PRO 77 23.203 -0.905 2.645 527 HG3 PRO 77 HG1 PRO 77 22.673 0.696 3.179 528 HD2 PRO 77 HD2 PRO 77 21.084 -1.791 2.771 529 HD3 PRO 77 HD1 PRO 77 20.905 -0.532 4.000 530 HA PRO 78 HA PRO 78 19.104 1.297 -2.734 531 HB2 PRO 78 HB2 PRO 78 21.061 2.288 -4.361 532 HB3 PRO 78 HB1 PRO 78 20.034 3.318 -3.353 533 HG2 PRO 78 HG2 PRO 78 22.789 2.290 -2.803 534 HG3 PRO 78 HG1 PRO 78 22.167 3.934 -2.594 535 HD2 PRO 78 HD2 PRO 78 22.414 2.278 -0.532 536 HD3 PRO 78 HD1 PRO 78 21.031 3.373 -0.657 537 H GLU 79 HN GLU 79 18.855 -0.733 -3.398 538 HA GLU 79 HA GLU 79 20.778 -2.722 -3.531 539 HB2 GLU 79 HB2 GLU 79 19.192 -3.993 -4.802 540 HB3 GLU 79 HB1 GLU 79 18.316 -3.087 -3.579 541 HG2 GLU 79 HG2 GLU 79 17.735 -1.419 -5.260 542 HG3 GLU 79 HG1 GLU 79 18.581 -2.358 -6.480 543 H GLU 80 HN GLU 80 19.836 -0.296 -5.841 544 HA GLU 80 HA GLU 80 21.136 -1.195 -8.110 545 HB2 GLU 80 HB2 GLU 80 19.931 0.694 -8.558 546 HB3 GLU 80 HB1 GLU 80 20.321 1.431 -7.013 547 HG2 GLU 80 HG2 GLU 80 22.579 1.940 -7.861 548 HG3 GLU 80 HG1 GLU 80 22.101 1.290 -9.434 549 H ILE 81 HN ILE 81 22.393 0.778 -5.447 550 HA ILE 81 HA ILE 81 25.010 0.890 -6.590 551 HB ILE 81 HB ILE 81 23.970 1.743 -3.904 552 HG12 ILE 81 HG12 ILE 81 24.914 3.312 -6.306 553 HG13 ILE 81 HG11 ILE 81 23.229 3.050 -5.877 554 HG21 ILE 81 HG21 ILE 81 26.266 3.001 -3.964 555 HG22 ILE 81 HG22 ILE 81 26.731 1.647 -5.007 556 HG23 ILE 81 HG23 ILE 81 26.160 1.347 -3.364 557 HD11 ILE 81 HD11 ILE 81 25.269 4.802 -4.613 558 HD12 ILE 81 HD12 ILE 81 23.991 4.131 -3.606 559 HD13 ILE 81 HD13 ILE 81 23.579 5.138 -4.998 560 H VAL 82 HN VAL 82 23.537 -0.890 -3.884 561 HA VAL 82 HA VAL 82 25.880 -2.070 -2.932 562 HB VAL 82 HB VAL 82 24.552 -3.787 -1.939 563 HG11 VAL 82 HG11 VAL 82 22.768 -2.498 -0.825 564 HG12 VAL 82 HG12 VAL 82 23.021 -1.199 -1.991 565 HG13 VAL 82 HG13 VAL 82 24.311 -1.647 -0.873 566 HG21 VAL 82 HG21 VAL 82 22.929 -4.778 -3.057 567 HG22 VAL 82 HG22 VAL 82 22.911 -3.479 -4.256 568 HG23 VAL 82 HG23 VAL 82 21.921 -3.351 -2.793 569 H ALA 83 HN ALA 83 23.739 -2.887 -5.570 570 HA ALA 83 HA ALA 83 24.890 -5.272 -6.475 571 HB1 ALA 83 HB1 ALA 83 23.912 -4.355 -8.720 572 HB2 ALA 83 HB2 ALA 83 23.237 -3.095 -7.664 573 HB3 ALA 83 HB3 ALA 83 22.832 -4.797 -7.394 574 H ILE 84 HN ILE 84 25.492 -1.891 -7.386 575 HA ILE 84 HA ILE 84 27.464 -2.365 -9.327 576 HB ILE 84 HB ILE 84 27.016 0.012 -7.508 577 HG12 ILE 84 HG12 ILE 84 26.478 0.004 -10.441 578 HG13 ILE 84 HG11 ILE 84 25.357 -0.849 -9.394 579 HG21 ILE 84 HG21 ILE 84 28.762 -0.153 -9.961 580 HG22 ILE 84 HG22 ILE 84 29.342 -0.063 -8.295 581 HG23 ILE 84 HG23 ILE 84 28.447 1.290 -8.994 582 HD11 ILE 84 HD11 ILE 84 26.137 2.007 -8.945 583 HD12 ILE 84 HD12 ILE 84 24.779 1.109 -8.247 584 HD13 ILE 84 HD13 ILE 84 24.780 1.525 -9.965 585 H ILE 85 HN ILE 85 27.660 -1.887 -5.843 586 HA ILE 85 HA ILE 85 30.464 -1.766 -5.672 587 HB ILE 85 HB ILE 85 28.435 -2.589 -3.607 588 HG12 ILE 85 HG12 ILE 85 29.820 0.053 -4.062 589 HG13 ILE 85 HG11 ILE 85 28.188 -0.321 -4.603 590 HG21 ILE 85 HG21 ILE 85 31.358 -2.418 -3.537 591 HG22 ILE 85 HG22 ILE 85 30.237 -3.264 -2.469 592 HG23 ILE 85 HG23 ILE 85 30.538 -1.542 -2.243 593 HD11 ILE 85 HD11 ILE 85 28.301 1.000 -2.508 594 HD12 ILE 85 HD12 ILE 85 29.058 -0.390 -1.730 595 HD13 ILE 85 HD13 ILE 85 27.417 -0.517 -2.356 596 H THR 86 HN THR 86 28.204 -4.494 -5.168 597 HA THR 86 HA THR 86 30.337 -6.335 -4.752 598 HB THR 86 HB THR 86 28.342 -7.062 -3.791 599 HG1 THR 86 HG1 THR 86 29.517 -8.696 -5.068 600 HG21 THR 86 HG21 THR 86 26.549 -5.996 -4.652 601 HG22 THR 86 HG22 THR 86 26.338 -7.568 -5.441 602 HG23 THR 86 HG23 THR 86 27.066 -6.227 -6.329 603 H SER 87 HN SER 87 28.847 -5.015 -7.562 604 HA SER 87 HA SER 87 29.871 -6.945 -9.406 605 HB2 SER 87 HB2 SER 87 27.936 -5.383 -9.857 606 HB3 SER 87 HB1 SER 87 29.107 -4.073 -9.978 607 HG SER 87 HG SER 87 29.268 -4.653 -11.985 608 H MET 88 HN MET 88 31.168 -4.259 -7.691 609 HA MET 88 HA MET 88 33.438 -3.792 -9.376 610 HB2 MET 88 HB2 MET 88 32.859 -3.099 -6.505 611 HB3 MET 88 HB1 MET 88 34.343 -2.634 -7.322 612 HG2 MET 88 HG2 MET 88 31.559 -1.816 -8.127 613 HG3 MET 88 HG1 MET 88 32.722 -0.815 -7.263 614 HE1 MET 88 HE1 MET 88 32.574 0.856 -10.794 615 HE2 MET 88 HE2 MET 88 32.385 1.097 -9.057 616 HE3 MET 88 HE3 MET 88 31.235 0.090 -9.940 617 H GLY 89 HN GLY 89 32.598 -6.029 -6.927 618 HA2 GLY 89 HA2 GLY 89 34.047 -8.082 -7.011 619 HA3 GLY 89 HA1 GLY 89 35.380 -6.965 -6.757 620 H PHE 90 HN PHE 90 32.688 -5.900 -5.113 621 HA PHE 90 HA PHE 90 33.677 -7.021 -2.597 622 HB2 PHE 90 HB2 PHE 90 31.838 -4.675 -3.124 623 HB3 PHE 90 HB1 PHE 90 32.408 -5.180 -1.533 624 HD1 PHE 90 HD2 PHE 90 35.209 -5.703 -1.878 625 HD2 PHE 90 HD1 PHE 90 32.822 -2.675 -3.684 626 HE1 PHE 90 HE2 PHE 90 37.208 -4.297 -2.153 627 HE2 PHE 90 HE1 PHE 90 34.818 -1.261 -3.957 628 HZ PHE 90 HZ PHE 90 37.039 -2.114 -3.234 629 H GLN 91 HN GLN 91 31.601 -6.999 -0.969 630 HA GLN 91 HA GLN 91 29.770 -8.928 -2.179 631 HB2 GLN 91 HB2 GLN 91 30.979 -9.644 -0.174 632 HB3 GLN 91 HB1 GLN 91 30.358 -8.260 0.707 633 HG2 GLN 91 HG2 GLN 91 28.081 -9.132 0.363 634 HG3 GLN 91 HG1 GLN 91 28.771 -10.560 -0.403 635 HE21 GLN 91 HE21 GLN 91 27.115 -10.482 1.934 636 HE22 GLN 91 HE22 GLN 91 28.049 -11.137 3.239 637 H ARG 92 HN ARG 92 27.502 -8.627 -2.062 638 HA ARG 92 HA ARG 92 26.534 -6.012 -2.259 639 HB2 ARG 92 HB2 ARG 92 25.318 -7.962 -3.105 640 HB3 ARG 92 HB1 ARG 92 25.007 -8.485 -1.460 641 HG2 ARG 92 HG2 ARG 92 23.997 -6.061 -1.257 642 HG3 ARG 92 HG1 ARG 92 23.805 -6.262 -2.999 643 HD2 ARG 92 HD2 ARG 92 22.796 -8.158 -0.897 644 HD3 ARG 92 HD1 ARG 92 21.819 -6.961 -1.742 645 HE ARG 92 HE ARG 92 23.087 -8.557 -3.659 646 HH11 ARG 92 HH11 ARG 92 20.620 -8.863 -1.186 647 HH12 ARG 92 HH12 ARG 92 19.792 -10.155 -2.007 648 HH21 ARG 92 HH21 ARG 92 22.011 -10.244 -4.723 649 HH22 ARG 92 HH22 ARG 92 20.589 -10.941 -4.018 650 H ASN 93 HN ASN 93 26.210 -8.279 0.451 651 HA ASN 93 HA ASN 93 24.962 -6.536 2.245 652 HB2 ASN 93 HB2 ASN 93 25.118 -8.955 2.567 653 HB3 ASN 93 HB1 ASN 93 26.851 -8.817 2.849 654 HD21 ASN 93 HD21 ASN 93 23.676 -8.165 4.112 655 HD22 ASN 93 HD22 ASN 93 24.165 -7.937 5.763 656 H GLN 94 HN GLN 94 28.352 -7.037 1.531 657 HA GLN 94 HA GLN 94 29.416 -5.383 3.564 658 HB2 GLN 94 HB2 GLN 94 30.981 -6.806 2.630 659 HB3 GLN 94 HB1 GLN 94 30.405 -6.532 0.995 660 HG2 GLN 94 HG2 GLN 94 31.564 -4.501 0.811 661 HG3 GLN 94 HG1 GLN 94 31.839 -4.402 2.550 662 HE21 GLN 94 HE21 GLN 94 33.464 -5.631 3.467 663 HE22 GLN 94 HE22 GLN 94 34.693 -6.405 2.527 664 H ALA 95 HN ALA 95 28.368 -4.844 0.258 665 HA ALA 95 HA ALA 95 28.990 -2.110 0.063 666 HB1 ALA 95 HB1 ALA 95 26.804 -3.724 -1.249 667 HB2 ALA 95 HB2 ALA 95 28.448 -3.500 -1.855 668 HB3 ALA 95 HB3 ALA 95 27.341 -2.123 -1.761 669 H ILE 96 HN ILE 96 26.132 -3.843 1.263 670 HA ILE 96 HA ILE 96 24.490 -1.649 1.755 671 HB ILE 96 HB ILE 96 24.635 -4.388 2.935 672 HG12 ILE 96 HG12 ILE 96 22.039 -3.525 2.129 673 HG13 ILE 96 HG11 ILE 96 23.191 -3.057 0.888 674 HG21 ILE 96 HG21 ILE 96 22.543 -3.752 4.260 675 HG22 ILE 96 HG22 ILE 96 23.088 -2.079 4.061 676 HG23 ILE 96 HG23 ILE 96 24.105 -3.247 4.909 677 HD11 ILE 96 HD11 ILE 96 22.735 -5.821 1.973 678 HD12 ILE 96 HD12 ILE 96 23.987 -5.385 0.813 679 HD13 ILE 96 HD13 ILE 96 22.286 -5.216 0.376 680 H GLN 97 HN GLN 97 26.696 -3.325 3.975 681 HA GLN 97 HA GLN 97 26.413 -1.666 6.182 682 HB2 GLN 97 HB2 GLN 97 27.596 -3.798 6.240 683 HB3 GLN 97 HB1 GLN 97 28.875 -3.111 5.257 684 HG2 GLN 97 HG2 GLN 97 29.573 -1.666 6.984 685 HG3 GLN 97 HG1 GLN 97 28.133 -2.009 7.938 686 HE21 GLN 97 HE21 GLN 97 28.027 -3.915 9.122 687 HE22 GLN 97 HE22 GLN 97 29.394 -4.944 9.371 688 H ALA 98 HN ALA 98 28.653 -1.426 3.476 689 HA ALA 98 HA ALA 98 30.067 0.816 4.334 690 HB1 ALA 98 HB1 ALA 98 30.490 -0.786 2.355 691 HB2 ALA 98 HB2 ALA 98 30.993 0.898 2.208 692 HB3 ALA 98 HB3 ALA 98 29.498 0.347 1.438 693 H LEU 99 HN LEU 99 27.275 0.655 2.095 694 HA LEU 99 HA LEU 99 26.977 3.412 1.782 695 HB2 LEU 99 HB2 LEU 99 24.908 1.247 1.664 696 HB3 LEU 99 HB1 LEU 99 24.646 2.886 1.123 697 HG LEU 99 HG LEU 99 26.747 1.068 -0.036 698 HD11 LEU 99 HD11 LEU 99 24.052 1.746 -1.183 699 HD12 LEU 99 HD12 LEU 99 24.431 0.236 -0.364 700 HD13 LEU 99 HD13 LEU 99 25.263 0.656 -1.859 701 HD21 LEU 99 HD21 LEU 99 27.460 2.997 -0.878 702 HD22 LEU 99 HD22 LEU 99 26.012 3.839 -0.358 703 HD23 LEU 99 HD23 LEU 99 26.009 2.964 -1.884 704 H ARG 100 HN ARG 100 25.724 1.249 4.276 705 HA ARG 100 HA ARG 100 23.946 2.968 5.562 706 HB2 ARG 100 HB2 ARG 100 25.781 0.808 6.582 707 HB3 ARG 100 HB1 ARG 100 24.747 1.719 7.680 708 HG2 ARG 100 HG2 ARG 100 22.777 0.942 6.601 709 HG3 ARG 100 HG1 ARG 100 23.713 0.219 5.290 710 HD2 ARG 100 HD2 ARG 100 24.627 -1.424 6.738 711 HD3 ARG 100 HD1 ARG 100 23.974 -0.615 8.169 712 HE ARG 100 HE ARG 100 21.893 -1.313 6.367 713 HH11 ARG 100 HH11 ARG 100 24.003 -2.647 8.835 714 HH12 ARG 100 HH12 ARG 100 22.951 -3.994 9.169 715 HH21 ARG 100 HH21 ARG 100 20.514 -3.056 6.829 716 HH22 ARG 100 HH22 ARG 100 20.951 -4.208 8.051 717 H ALA 101 HN ALA 101 27.415 2.595 5.976 718 HA ALA 101 HA ALA 101 27.708 4.654 7.912 719 HB1 ALA 101 HB1 ALA 101 30.169 4.438 7.094 720 HB2 ALA 101 HB2 ALA 101 29.536 3.050 6.195 721 HB3 ALA 101 HB3 ALA 101 29.404 3.102 7.954 722 H THR 102 HN THR 102 28.085 4.540 4.388 723 HA THR 102 HA THR 102 29.137 7.212 4.238 724 HB THR 102 HB THR 102 29.380 6.806 1.893 725 HG1 THR 102 HG1 THR 102 28.325 5.101 0.868 726 HG21 THR 102 HG21 THR 102 31.061 5.423 2.381 727 HG22 THR 102 HG22 THR 102 29.951 4.070 2.507 728 HG23 THR 102 HG23 THR 102 30.305 5.058 3.923 729 H ASN 103 HN ASN 103 26.090 6.143 4.714 730 HA ASN 103 HA ASN 103 23.992 6.938 4.445 731 HB2 ASN 103 HB2 ASN 103 25.341 9.477 3.501 732 HB3 ASN 103 HB1 ASN 103 23.662 9.311 3.994 733 HD21 ASN 103 HD21 ASN 103 23.182 8.999 6.192 734 HD22 ASN 103 HD22 ASN 103 24.323 9.402 7.431 735 H ASN 104 HN ASN 104 24.422 5.259 2.663 736 HA ASN 104 HA ASN 104 24.195 4.453 0.575 737 HB2 ASN 104 HB2 ASN 104 22.219 5.158 -0.664 738 HB3 ASN 104 HB1 ASN 104 21.864 4.991 1.048 739 HD21 ASN 104 HD21 ASN 104 22.141 7.173 -1.626 740 HD22 ASN 104 HD22 ASN 104 21.417 8.540 -0.853 741 H ASN 105 HN ASN 105 26.262 6.377 0.849 742 HA ASN 105 HA ASN 105 26.363 7.661 -1.778 743 HB2 ASN 105 HB2 ASN 105 27.267 8.761 0.353 744 HB3 ASN 105 HB1 ASN 105 28.561 7.569 0.303 745 HD21 ASN 105 HD21 ASN 105 27.305 10.472 -1.013 746 HD22 ASN 105 HD22 ASN 105 28.599 10.793 -2.128 747 H LEU 106 HN LEU 106 26.905 6.444 -3.416 748 HA LEU 106 HA LEU 106 27.765 3.797 -3.301 749 HB2 LEU 106 HB2 LEU 106 26.610 4.732 -5.200 750 HB3 LEU 106 HB1 LEU 106 27.902 5.858 -5.506 751 HG LEU 106 HG LEU 106 28.527 2.949 -5.663 752 HD11 LEU 106 HD11 LEU 106 27.332 4.393 -7.997 753 HD12 LEU 106 HD12 LEU 106 26.322 3.518 -6.853 754 HD13 LEU 106 HD13 LEU 106 27.561 2.655 -7.763 755 HD21 LEU 106 HD21 LEU 106 29.952 3.731 -7.514 756 HD22 LEU 106 HD22 LEU 106 30.311 4.532 -5.986 757 HD23 LEU 106 HD23 LEU 106 29.382 5.378 -7.224 758 H GLU 107 HN GLU 107 29.579 6.601 -4.423 759 HA GLU 107 HA GLU 107 32.054 5.407 -4.802 760 HB2 GLU 107 HB2 GLU 107 31.639 8.248 -3.879 761 HB3 GLU 107 HB1 GLU 107 32.952 7.623 -4.868 762 HG2 GLU 107 HG2 GLU 107 30.841 6.908 -6.360 763 HG3 GLU 107 HG1 GLU 107 30.209 8.366 -5.605 764 H ARG 108 HN ARG 108 30.897 7.173 -1.968 765 HA ARG 108 HA ARG 108 33.218 6.777 -0.418 766 HB2 ARG 108 HB2 ARG 108 31.271 8.417 -0.055 767 HB3 ARG 108 HB1 ARG 108 30.482 7.081 0.755 768 HG2 ARG 108 HG2 ARG 108 32.323 6.940 2.331 769 HG3 ARG 108 HG1 ARG 108 33.112 8.303 1.524 770 HD2 ARG 108 HD2 ARG 108 30.350 8.366 2.663 771 HD3 ARG 108 HD1 ARG 108 31.777 8.948 3.530 772 HE ARG 108 HE ARG 108 31.825 10.280 1.147 773 HH11 ARG 108 HH11 ARG 108 29.535 9.984 3.779 774 HH12 ARG 108 HH12 ARG 108 28.747 11.493 3.421 775 HH21 ARG 108 HH21 ARG 108 30.821 12.263 0.695 776 HH22 ARG 108 HH22 ARG 108 29.491 12.804 1.678 777 H ALA 109 HN ALA 109 30.369 4.786 -0.939 778 HA ALA 109 HA ALA 109 30.721 3.038 1.223 779 HB1 ALA 109 HB1 ALA 109 28.989 3.201 -0.951 780 HB2 ALA 109 HB2 ALA 109 28.951 1.987 0.329 781 HB3 ALA 109 HB3 ALA 109 29.828 1.664 -1.168 782 H LEU 110 HN LEU 110 31.818 2.860 -2.134 783 HA LEU 110 HA LEU 110 33.467 0.604 -1.910 784 HB2 LEU 110 HB2 LEU 110 33.832 3.014 -3.678 785 HB3 LEU 110 HB1 LEU 110 34.502 1.421 -3.952 786 HG LEU 110 HG LEU 110 31.536 1.874 -3.824 787 HD11 LEU 110 HD11 LEU 110 33.291 1.989 -6.275 788 HD12 LEU 110 HD12 LEU 110 32.484 3.364 -5.521 789 HD13 LEU 110 HD13 LEU 110 31.528 2.067 -6.242 790 HD21 LEU 110 HD21 LEU 110 31.496 -0.184 -5.131 791 HD22 LEU 110 HD22 LEU 110 32.362 -0.411 -3.610 792 HD23 LEU 110 HD23 LEU 110 33.260 -0.234 -5.116 793 H ASP 111 HN ASP 111 34.026 4.018 -1.379 794 HA ASP 111 HA ASP 111 36.750 4.056 -0.774 795 HB2 ASP 111 HB2 ASP 111 35.006 6.011 -0.852 796 HB3 ASP 111 HB1 ASP 111 34.744 5.604 0.832 797 H TRP 112 HN TRP 112 33.979 3.641 1.336 798 HA TRP 112 HA TRP 112 35.296 3.190 3.755 799 HB2 TRP 112 HB2 TRP 112 32.869 3.759 3.364 800 HB3 TRP 112 HB1 TRP 112 32.623 2.067 2.942 801 HD1 TRP 112 HD1 TRP 112 33.255 4.343 5.928 802 HE1 TRP 112 HE1 TRP 112 32.869 3.014 8.097 803 HE3 TRP 112 HE3 TRP 112 32.706 -0.325 3.922 804 HZ2 TRP 112 HZ2 TRP 112 32.383 0.338 8.851 805 HZ3 TRP 112 HZ3 TRP 112 32.286 -2.217 5.435 806 HH2 TRP 112 HH2 TRP 112 32.129 -1.891 7.850 807 H ILE 113 HN ILE 113 34.060 0.983 1.326 808 HA ILE 113 HA ILE 113 34.735 -1.394 2.687 809 HB ILE 113 HB ILE 113 34.234 -0.895 -0.250 810 HG12 ILE 113 HG12 ILE 113 32.457 -1.908 1.985 811 HG13 ILE 113 HG11 ILE 113 32.311 -0.364 1.160 812 HG21 ILE 113 HG21 ILE 113 34.350 -3.497 1.276 813 HG22 ILE 113 HG22 ILE 113 35.521 -2.937 0.083 814 HG23 ILE 113 HG23 ILE 113 33.873 -3.314 -0.412 815 HD11 ILE 113 HD11 ILE 113 32.141 -2.870 -0.419 816 HD12 ILE 113 HD12 ILE 113 31.397 -1.291 -0.699 817 HD13 ILE 113 HD13 ILE 113 30.767 -2.354 0.555 818 H PHE 114 HN PHE 114 36.446 0.657 0.402 819 HA PHE 114 HA PHE 114 38.654 -1.062 -0.074 820 HB2 PHE 114 HB2 PHE 114 38.053 0.904 -1.490 821 HB3 PHE 114 HB1 PHE 114 38.575 1.962 -0.185 822 HD1 PHE 114 HD2 PHE 114 39.814 -0.778 -2.379 823 HD2 PHE 114 HD1 PHE 114 40.756 2.702 -0.124 824 HE1 PHE 114 HE2 PHE 114 42.114 -0.837 -3.253 825 HE2 PHE 114 HE1 PHE 114 43.057 2.652 -0.995 826 HZ PHE 114 HZ PHE 114 43.730 0.881 -2.587 827 H SER 115 HN SER 115 37.867 1.252 2.416 828 HA SER 115 HA SER 115 40.438 1.109 3.704 829 HB2 SER 115 HB2 SER 115 37.770 2.176 4.637 830 HB3 SER 115 HB1 SER 115 39.291 2.363 5.509 831 HG SER 115 HG SER 115 39.718 3.150 3.027 832 H HIS 116 HN HIS 116 38.253 -1.144 3.246 833 HA HIS 116 HA HIS 116 38.742 -2.403 5.855 834 HB2 HIS 116 HB2 HIS 116 36.352 -1.954 5.539 835 HB3 HIS 116 HB1 HIS 116 36.382 -2.775 3.986 836 HD1 HIS 116 HD1 HIS 116 36.578 -5.406 4.042 837 HD2 HIS 116 HD2 HIS 116 36.031 -3.587 7.747 838 HE1 HIS 116 HE1 HIS 116 35.879 -7.245 5.606 839 HE2 HIS 116 HE2 HIS 116 35.504 -6.126 7.827 840 HA PRO 117 HA PRO 117 41.216 -4.868 2.776 841 HB2 PRO 117 HB2 PRO 117 42.725 -5.747 4.963 842 HB3 PRO 117 HB1 PRO 117 43.203 -4.505 3.809 843 HG2 PRO 117 HG2 PRO 117 41.953 -4.215 6.505 844 HG3 PRO 117 HG1 PRO 117 43.194 -3.210 5.723 845 HD2 PRO 117 HD2 PRO 117 40.683 -2.354 5.851 846 HD3 PRO 117 HD1 PRO 117 41.625 -2.139 4.364 847 H GLU 118 HN GLU 118 40.735 -5.834 6.118 848 HA GLU 118 HA GLU 118 38.502 -7.408 5.753 849 HB2 GLU 118 HB2 GLU 118 39.592 -9.651 6.247 850 HB3 GLU 118 HB1 GLU 118 39.675 -9.059 4.599 851 HG2 GLU 118 HG2 GLU 118 41.959 -8.277 5.044 852 HG3 GLU 118 HG1 GLU 118 41.866 -8.992 6.655 853 H PHE 119 HN PHE 119 41.477 -6.947 7.603 854 HA PHE 119 HA PHE 119 39.822 -6.986 10.028 855 HB2 PHE 119 HB2 PHE 119 41.131 -9.101 9.787 856 HB3 PHE 119 HB1 PHE 119 42.606 -8.147 9.786 857 HD1 PHE 119 HD1 PHE 119 39.670 -9.061 11.858 858 HD2 PHE 119 HD2 PHE 119 43.656 -7.571 11.786 859 HE1 PHE 119 HE1 PHE 119 39.785 -9.255 14.306 860 HE2 PHE 119 HE2 PHE 119 43.776 -7.763 14.236 861 HZ PHE 119 HZ PHE 119 41.839 -8.607 15.500 862 H GLU 120 HN GLU 120 41.431 -5.128 8.102 863 HA GLU 120 HA GLU 120 42.847 -3.371 8.105 864 HB2 GLU 120 HB2 GLU 120 41.307 -2.905 10.623 865 HB3 GLU 120 HB1 GLU 120 42.531 -1.796 10.024 866 HG2 GLU 120 HG2 GLU 120 41.319 -1.515 7.956 867 HG3 GLU 120 HG1 GLU 120 40.121 -2.690 8.494 868 H GLU 121 HN GLU 121 44.367 -5.186 8.482 869 HA GLU 121 HA GLU 121 45.925 -4.859 10.939 870 HB2 GLU 121 HB2 GLU 121 47.046 -6.934 10.316 871 HB3 GLU 121 HB1 GLU 121 45.306 -7.170 10.310 872 HG2 GLU 121 HG2 GLU 121 46.780 -6.516 7.790 873 HG3 GLU 121 HG1 GLU 121 46.711 -8.169 8.401 874 H ASP 122 HN ASP 122 48.411 -5.311 10.315 875 HA ASP 122 HA ASP 122 50.306 -4.397 9.472 876 HB2 ASP 122 HB2 ASP 122 49.560 -5.786 7.535 877 HB3 ASP 122 HB1 ASP 122 48.759 -4.365 6.871 878 H SER 123 HN SER 123 49.772 -2.488 10.792 879 HA SER 123 HA SER 123 48.352 -0.302 9.725 880 HB2 SER 123 HB2 SER 123 49.619 0.869 11.716 881 HB3 SER 123 HB1 SER 123 48.352 -0.314 12.034 882 HG SER 123 HG SER 123 51.086 -0.468 12.456 883 H ASP 124 HN ASP 124 49.000 0.817 8.040 884 HA ASP 124 HA ASP 124 51.385 0.574 6.752 885 HB2 ASP 124 HB2 ASP 124 50.732 2.723 5.548 886 HB3 ASP 124 HB1 ASP 124 49.573 1.402 5.514 887 H PHE 125 HN PHE 125 50.619 3.825 8.024 888 HA PHE 125 HA PHE 125 53.406 3.936 8.982 889 HB2 PHE 125 HB2 PHE 125 51.862 6.086 7.524 890 HB3 PHE 125 HB1 PHE 125 53.409 6.351 8.321 891 HD1 PHE 125 HD1 PHE 125 55.411 5.039 7.522 892 HD2 PHE 125 HD2 PHE 125 51.759 5.234 5.351 893 HE1 PHE 125 HE1 PHE 125 56.590 4.324 5.485 894 HE2 PHE 125 HE2 PHE 125 52.928 4.521 3.309 895 HZ PHE 125 HZ PHE 125 55.347 4.062 3.374 896 H VAL 126 HN VAL 126 50.476 3.706 10.118 897 HA VAL 126 HA VAL 126 50.514 5.951 11.958 898 HB VAL 126 HB VAL 126 48.342 5.395 11.107 899 HG11 VAL 126 HG11 VAL 126 48.770 2.623 12.215 900 HG12 VAL 126 HG12 VAL 126 48.683 3.072 10.511 901 HG13 VAL 126 HG13 VAL 126 47.260 3.232 11.539 902 HG21 VAL 126 HG21 VAL 126 47.095 5.023 13.190 903 HG22 VAL 126 HG22 VAL 126 48.406 6.183 13.401 904 HG23 VAL 126 HG23 VAL 126 48.589 4.529 13.984 Start of MODEL 4 1 H1 ASP 1 HT1 ASP 1 -45.452 12.972 -1.516 2 H2 ASP 1 HT2 ASP 1 -46.793 13.298 -2.500 3 H3 ASP 1 HT3 ASP 1 -45.624 12.179 -3.007 4 HA ASP 1 HA ASP 1 -47.446 11.887 -0.686 5 HB2 ASP 1 HB2 ASP 1 -47.303 10.328 -3.279 6 HB3 ASP 1 HB1 ASP 1 -48.445 10.059 -1.965 7 H ILE 2 HN ILE 2 -44.979 10.360 -2.719 8 HA ILE 2 HA ILE 2 -44.183 8.697 -0.414 9 HB ILE 2 HB ILE 2 -43.725 8.168 -3.361 10 HG12 ILE 2 HG12 ILE 2 -45.616 6.805 -1.434 11 HG13 ILE 2 HG11 ILE 2 -46.095 7.932 -2.700 12 HG21 ILE 2 HG21 ILE 2 -43.171 6.437 -0.956 13 HG22 ILE 2 HG22 ILE 2 -41.964 7.264 -1.940 14 HG23 ILE 2 HG23 ILE 2 -42.940 5.973 -2.642 15 HD11 ILE 2 HD11 ILE 2 -44.783 5.258 -3.117 16 HD12 ILE 2 HD12 ILE 2 -45.256 6.385 -4.389 17 HD13 ILE 2 HD13 ILE 2 -46.486 5.637 -3.371 18 H ASP 3 HN ASP 3 -42.155 8.991 0.358 19 HA ASP 3 HA ASP 3 -40.490 11.043 -0.761 20 HB2 ASP 3 HB2 ASP 3 -40.626 10.498 1.700 21 HB3 ASP 3 HB1 ASP 3 -39.721 9.025 1.358 22 H GLU 4 HN GLU 4 -40.319 10.106 -2.892 23 HA GLU 4 HA GLU 4 -38.980 7.632 -3.281 24 HB2 GLU 4 HB2 GLU 4 -39.655 9.866 -5.182 25 HB3 GLU 4 HB1 GLU 4 -38.880 8.367 -5.684 26 HG2 GLU 4 HG2 GLU 4 -40.797 7.115 -4.747 27 HG3 GLU 4 HG1 GLU 4 -41.582 8.654 -4.393 28 H SER 5 HN SER 5 -37.800 10.691 -2.440 29 HA SER 5 HA SER 5 -35.323 10.653 -3.782 30 HB2 SER 5 HB2 SER 5 -34.575 12.267 -2.188 31 HB3 SER 5 HB1 SER 5 -36.291 12.570 -2.428 32 HG SER 5 HG SER 5 -36.624 11.267 -0.474 33 H SER 6 HN SER 6 -36.456 9.163 -0.827 34 HA SER 6 HA SER 6 -34.057 8.090 0.125 35 HB2 SER 6 HB2 SER 6 -36.869 6.986 0.353 36 HB3 SER 6 HB1 SER 6 -35.500 6.517 1.361 37 HG SER 6 HG SER 6 -36.739 9.080 1.197 38 H VAL 7 HN VAL 7 -36.524 6.557 -1.972 39 HA VAL 7 HA VAL 7 -35.098 4.141 -2.212 40 HB VAL 7 HB VAL 7 -37.449 4.131 -2.695 41 HG11 VAL 7 HG11 VAL 7 -36.793 5.947 -4.999 42 HG12 VAL 7 HG12 VAL 7 -37.820 6.304 -3.608 43 HG13 VAL 7 HG13 VAL 7 -38.330 5.109 -4.798 44 HG21 VAL 7 HG21 VAL 7 -37.451 2.835 -4.728 45 HG22 VAL 7 HG22 VAL 7 -35.987 2.478 -3.803 46 HG23 VAL 7 HG23 VAL 7 -35.910 3.542 -5.210 47 H MET 8 HN MET 8 -35.173 7.043 -4.208 48 HA MET 8 HA MET 8 -33.564 6.120 -6.300 49 HB2 MET 8 HB2 MET 8 -33.832 8.901 -5.167 50 HB3 MET 8 HB1 MET 8 -32.998 8.525 -6.668 51 HG2 MET 8 HG2 MET 8 -35.073 7.597 -7.575 52 HG3 MET 8 HG1 MET 8 -35.903 8.024 -6.081 53 HE1 MET 8 HE1 MET 8 -37.444 10.653 -8.474 54 HE2 MET 8 HE2 MET 8 -37.751 9.408 -7.264 55 HE3 MET 8 HE3 MET 8 -37.071 8.966 -8.829 56 H GLN 9 HN GLN 9 -32.703 7.302 -3.108 57 HA GLN 9 HA GLN 9 -29.932 7.538 -3.490 58 HB2 GLN 9 HB2 GLN 9 -31.556 6.850 -1.042 59 HB3 GLN 9 HB1 GLN 9 -29.810 7.047 -0.994 60 HG2 GLN 9 HG2 GLN 9 -31.755 9.153 -1.907 61 HG3 GLN 9 HG1 GLN 9 -31.044 9.063 -0.297 62 HE21 GLN 9 HE21 GLN 9 -28.451 8.203 -1.235 63 HE22 GLN 9 HE22 GLN 9 -27.705 9.576 -1.973 64 H LEU 10 HN LEU 10 -31.772 4.737 -2.170 65 HA LEU 10 HA LEU 10 -29.477 3.034 -2.248 66 HB2 LEU 10 HB2 LEU 10 -31.566 1.267 -2.373 67 HB3 LEU 10 HB1 LEU 10 -30.833 1.882 -0.912 68 HG LEU 10 HG LEU 10 -33.035 3.492 -2.053 69 HD11 LEU 10 HD11 LEU 10 -33.562 0.939 -0.565 70 HD12 LEU 10 HD12 LEU 10 -33.621 1.059 -2.320 71 HD13 LEU 10 HD13 LEU 10 -34.728 2.018 -1.335 72 HD21 LEU 10 HD21 LEU 10 -33.495 3.934 0.217 73 HD22 LEU 10 HD22 LEU 10 -31.733 3.878 0.143 74 HD23 LEU 10 HD23 LEU 10 -32.632 2.498 0.759 75 H ALA 11 HN ALA 11 -31.907 3.852 -4.584 76 HA ALA 11 HA ALA 11 -31.561 1.706 -6.375 77 HB1 ALA 11 HB1 ALA 11 -32.203 4.485 -7.289 78 HB2 ALA 11 HB2 ALA 11 -33.352 3.567 -6.322 79 HB3 ALA 11 HB3 ALA 11 -32.823 2.944 -7.889 80 H GLU 12 HN GLU 12 -29.867 4.762 -6.003 81 HA GLU 12 HA GLU 12 -28.171 4.330 -8.286 82 HB2 GLU 12 HB2 GLU 12 -28.025 6.333 -6.047 83 HB3 GLU 12 HB1 GLU 12 -26.910 6.303 -7.401 84 HG2 GLU 12 HG2 GLU 12 -29.881 6.758 -7.536 85 HG3 GLU 12 HG1 GLU 12 -28.616 7.968 -7.752 86 H MET 13 HN MET 13 -27.824 4.002 -4.774 87 HA MET 13 HA MET 13 -25.083 3.072 -5.117 88 HB2 MET 13 HB2 MET 13 -24.919 3.094 -2.693 89 HB3 MET 13 HB1 MET 13 -25.531 4.636 -3.284 90 HG2 MET 13 HG2 MET 13 -27.790 3.990 -2.677 91 HG3 MET 13 HG1 MET 13 -27.197 2.420 -2.139 92 HE1 MET 13 HE1 MET 13 -28.194 4.273 1.202 93 HE2 MET 13 HE2 MET 13 -28.457 2.843 0.203 94 HE3 MET 13 HE3 MET 13 -28.991 4.425 -0.365 95 H GLY 14 HN GLY 14 -27.239 1.449 -6.146 96 HA2 GLY 14 HA2 GLY 14 -26.378 -1.056 -5.122 97 HA3 GLY 14 HA1 GLY 14 -27.984 -0.663 -4.527 98 H PHE 15 HN PHE 15 -29.705 -0.570 -5.941 99 HA PHE 15 HA PHE 15 -29.482 -1.024 -8.727 100 HB2 PHE 15 HB2 PHE 15 -30.483 -3.334 -8.721 101 HB3 PHE 15 HB1 PHE 15 -28.826 -3.263 -8.154 102 HD1 PHE 15 HD1 PHE 15 -28.481 -3.252 -5.594 103 HD2 PHE 15 HD2 PHE 15 -32.105 -4.414 -7.495 104 HE1 PHE 15 HE1 PHE 15 -29.113 -4.535 -3.594 105 HE2 PHE 15 HE2 PHE 15 -32.750 -5.690 -5.494 106 HZ PHE 15 HZ PHE 15 -31.251 -5.753 -3.540 107 HA PRO 16 HA PRO 16 -33.520 0.633 -8.871 108 HB2 PRO 16 HB2 PRO 16 -35.007 -1.170 -10.334 109 HB3 PRO 16 HB1 PRO 16 -33.879 -0.002 -11.037 110 HG2 PRO 16 HG2 PRO 16 -33.411 -2.880 -10.304 111 HG3 PRO 16 HG1 PRO 16 -33.008 -2.041 -11.825 112 HD2 PRO 16 HD2 PRO 16 -31.108 -2.422 -10.055 113 HD3 PRO 16 HD1 PRO 16 -31.261 -0.816 -10.799 114 H LEU 17 HN LEU 17 -34.037 0.467 -6.670 115 HA LEU 17 HA LEU 17 -35.422 -1.940 -5.787 116 HB2 LEU 17 HB2 LEU 17 -34.187 0.376 -4.295 117 HB3 LEU 17 HB1 LEU 17 -35.197 -0.817 -3.503 118 HG LEU 17 HG LEU 17 -32.737 -1.571 -5.072 119 HD11 LEU 17 HD11 LEU 17 -31.574 -1.755 -2.938 120 HD12 LEU 17 HD12 LEU 17 -32.977 -1.084 -2.107 121 HD13 LEU 17 HD13 LEU 17 -32.071 -0.094 -3.251 122 HD21 LEU 17 HD21 LEU 17 -32.922 -3.634 -3.765 123 HD22 LEU 17 HD22 LEU 17 -34.368 -3.342 -4.733 124 HD23 LEU 17 HD23 LEU 17 -34.386 -3.015 -3.000 125 H GLU 18 HN GLU 18 -37.076 -0.793 -7.484 126 HA GLU 18 HA GLU 18 -38.846 1.136 -6.569 127 HB2 GLU 18 HB2 GLU 18 -38.705 -0.480 -8.755 128 HB3 GLU 18 HB1 GLU 18 -40.091 -1.165 -7.915 129 HG2 GLU 18 HG2 GLU 18 -40.143 1.749 -8.043 130 HG3 GLU 18 HG1 GLU 18 -40.149 0.958 -9.620 131 H ALA 19 HN ALA 19 -38.427 -2.153 -5.557 132 HA ALA 19 HA ALA 19 -40.752 -2.590 -4.097 133 HB1 ALA 19 HB1 ALA 19 -38.007 -3.372 -3.157 134 HB2 ALA 19 HB2 ALA 19 -38.818 -4.175 -4.494 135 HB3 ALA 19 HB3 ALA 19 -39.535 -4.213 -2.883 136 H CYS 20 HN CYS 20 -37.876 -0.744 -3.354 137 HA CYS 20 HA CYS 20 -38.653 -0.067 -0.685 138 HB2 CYS 20 HB2 CYS 20 -36.278 0.020 -1.558 139 HB3 CYS 20 HB1 CYS 20 -36.737 1.477 -2.419 140 HG CYS 20 HG CYS 20 -37.682 2.588 0.165 141 H ARG 21 HN ARG 21 -39.057 1.363 -3.865 142 HA ARG 21 HA ARG 21 -40.093 3.853 -3.160 143 HB2 ARG 21 HB2 ARG 21 -39.662 2.853 -5.492 144 HB3 ARG 21 HB1 ARG 21 -41.247 2.118 -5.348 145 HG2 ARG 21 HG2 ARG 21 -40.944 5.062 -4.995 146 HG3 ARG 21 HG1 ARG 21 -40.941 4.364 -6.612 147 HD2 ARG 21 HD2 ARG 21 -43.113 3.939 -4.564 148 HD3 ARG 21 HD1 ARG 21 -43.179 5.135 -5.856 149 HE ARG 21 HE ARG 21 -42.799 2.307 -6.557 150 HH11 ARG 21 HH11 ARG 21 -44.841 5.160 -6.550 151 HH12 ARG 21 HH12 ARG 21 -45.948 4.521 -7.724 152 HH21 ARG 21 HH21 ARG 21 -44.259 1.467 -8.080 153 HH22 ARG 21 HH22 ARG 21 -45.626 2.417 -8.581 154 H LYS 22 HN LYS 22 -41.762 0.754 -3.523 155 HA LYS 22 HA LYS 22 -44.271 1.561 -2.494 156 HB2 LYS 22 HB2 LYS 22 -43.148 -1.225 -2.232 157 HB3 LYS 22 HB1 LYS 22 -44.817 -0.739 -2.495 158 HG2 LYS 22 HG2 LYS 22 -44.390 -0.196 -4.757 159 HG3 LYS 22 HG1 LYS 22 -42.644 -0.320 -4.521 160 HD2 LYS 22 HD2 LYS 22 -43.298 -2.768 -3.753 161 HD3 LYS 22 HD1 LYS 22 -44.684 -2.462 -4.798 162 HE2 LYS 22 HE2 LYS 22 -41.797 -2.176 -5.611 163 HE3 LYS 22 HE1 LYS 22 -42.812 -3.573 -5.957 164 HZ1 LYS 22 HZ1 LYS 22 -44.321 -2.022 -7.164 165 HZ2 LYS 22 HZ2 LYS 22 -42.795 -2.202 -7.869 166 HZ3 LYS 22 HZ3 LYS 22 -43.154 -0.803 -6.976 167 H ALA 23 HN ALA 23 -41.394 0.119 -1.038 168 HA ALA 23 HA ALA 23 -42.345 -0.324 1.552 169 HB1 ALA 23 HB1 ALA 23 -40.038 -0.455 2.214 170 HB2 ALA 23 HB2 ALA 23 -39.538 0.418 0.765 171 HB3 ALA 23 HB3 ALA 23 -40.224 -1.203 0.627 172 H VAL 24 HN VAL 24 -40.790 2.528 0.150 173 HA VAL 24 HA VAL 24 -40.641 4.077 2.469 174 HB VAL 24 HB VAL 24 -40.955 4.871 -0.431 175 HG11 VAL 24 HG11 VAL 24 -40.444 7.164 0.185 176 HG12 VAL 24 HG12 VAL 24 -40.457 6.725 1.896 177 HG13 VAL 24 HG13 VAL 24 -41.943 6.638 0.954 178 HG21 VAL 24 HG21 VAL 24 -38.617 5.554 -0.198 179 HG22 VAL 24 HG22 VAL 24 -38.835 3.847 0.189 180 HG23 VAL 24 HG23 VAL 24 -38.633 5.028 1.483 181 H TYR 25 HN TYR 25 -43.254 3.834 0.047 182 HA TYR 25 HA TYR 25 -45.055 5.517 1.414 183 HB2 TYR 25 HB2 TYR 25 -45.425 4.786 -0.910 184 HB3 TYR 25 HB1 TYR 25 -45.695 3.137 -0.347 185 HD1 TYR 25 HD2 TYR 25 -47.038 6.593 -0.166 186 HD2 TYR 25 HD1 TYR 25 -47.810 2.451 0.400 187 HE1 TYR 25 HE2 TYR 25 -49.431 7.084 0.103 188 HE2 TYR 25 HE1 TYR 25 -50.208 2.926 0.666 189 HH TYR 25 HH TYR 25 -51.593 5.852 -0.220 190 H PHE 26 HN PHE 26 -44.412 2.065 1.665 191 HA PHE 26 HA PHE 26 -46.521 1.431 3.435 192 HB2 PHE 26 HB2 PHE 26 -45.384 -0.244 2.058 193 HB3 PHE 26 HB1 PHE 26 -43.893 0.016 2.955 194 HD1 PHE 26 HD2 PHE 26 -47.407 -1.105 3.352 195 HD2 PHE 26 HD1 PHE 26 -43.429 -1.236 4.858 196 HE1 PHE 26 HE2 PHE 26 -48.070 -2.864 4.940 197 HE2 PHE 26 HE1 PHE 26 -44.084 -2.995 6.445 198 HZ PHE 26 HZ PHE 26 -46.407 -3.811 6.487 199 H THR 27 HN THR 27 -43.121 2.280 4.019 200 HA THR 27 HA THR 27 -43.135 1.836 6.805 201 HB THR 27 HB THR 27 -41.171 3.422 6.849 202 HG1 THR 27 HG1 THR 27 -41.317 3.306 4.021 203 HG21 THR 27 HG21 THR 27 -40.986 1.219 4.801 204 HG22 THR 27 HG22 THR 27 -40.980 0.955 6.542 205 HG23 THR 27 HG23 THR 27 -39.675 1.868 5.783 206 H GLY 28 HN GLY 28 -44.378 4.362 4.838 207 HA2 GLY 28 HA2 GLY 28 -45.910 5.997 5.596 208 HA3 GLY 28 HA1 GLY 28 -45.262 5.816 7.221 209 H ASN 29 HN ASN 29 -43.222 6.163 4.410 210 HA ASN 29 HA ASN 29 -41.670 7.709 3.819 211 HB2 ASN 29 HB2 ASN 29 -43.781 9.568 4.929 212 HB3 ASN 29 HB1 ASN 29 -42.319 10.140 4.134 213 HD21 ASN 29 HD21 ASN 29 -45.229 10.295 3.465 214 HD22 ASN 29 HD22 ASN 29 -45.332 9.715 1.832 215 H MET 30 HN MET 30 -40.952 6.403 5.984 216 HA MET 30 HA MET 30 -40.479 8.138 8.242 217 HB2 MET 30 HB2 MET 30 -39.887 5.258 7.649 218 HB3 MET 30 HB1 MET 30 -39.185 6.051 9.051 219 HG2 MET 30 HG2 MET 30 -42.128 5.830 8.467 220 HG3 MET 30 HG1 MET 30 -41.225 4.821 9.597 221 HE1 MET 30 HE1 MET 30 -40.091 7.463 12.273 222 HE2 MET 30 HE2 MET 30 -39.205 6.926 10.845 223 HE3 MET 30 HE3 MET 30 -40.084 5.757 11.829 224 H GLY 31 HN GLY 31 -38.990 8.011 5.375 225 HA2 GLY 31 HA2 GLY 31 -37.053 9.403 5.051 226 HA3 GLY 31 HA1 GLY 31 -36.433 8.818 6.587 227 H ALA 32 HN ALA 32 -34.721 8.763 4.621 228 HA ALA 32 HA ALA 32 -34.848 6.559 2.858 229 HB1 ALA 32 HB1 ALA 32 -32.440 8.149 3.732 230 HB2 ALA 32 HB2 ALA 32 -33.516 8.559 2.396 231 HB3 ALA 32 HB3 ALA 32 -32.537 7.093 2.324 232 H GLU 33 HN GLU 33 -33.219 7.068 5.964 233 HA GLU 33 HA GLU 33 -31.691 4.681 5.801 234 HB2 GLU 33 HB2 GLU 33 -32.382 6.356 8.216 235 HB3 GLU 33 HB1 GLU 33 -31.114 5.137 8.140 236 HG2 GLU 33 HG2 GLU 33 -29.976 6.437 6.404 237 HG3 GLU 33 HG1 GLU 33 -31.236 7.665 6.508 238 H VAL 34 HN VAL 34 -34.862 5.408 7.106 239 HA VAL 34 HA VAL 34 -35.136 2.966 8.559 240 HB VAL 34 HB VAL 34 -37.261 4.857 7.536 241 HG11 VAL 34 HG11 VAL 34 -37.440 2.503 9.406 242 HG12 VAL 34 HG12 VAL 34 -38.342 2.770 7.909 243 HG13 VAL 34 HG13 VAL 34 -38.666 3.766 9.329 244 HG21 VAL 34 HG21 VAL 34 -35.752 5.908 9.120 245 HG22 VAL 34 HG22 VAL 34 -35.979 4.573 10.250 246 HG23 VAL 34 HG23 VAL 34 -37.328 5.643 9.867 247 H ALA 35 HN ALA 35 -36.189 4.048 5.332 248 HA ALA 35 HA ALA 35 -37.354 1.509 4.711 249 HB1 ALA 35 HB1 ALA 35 -38.116 3.592 3.644 250 HB2 ALA 35 HB2 ALA 35 -37.653 2.343 2.489 251 HB3 ALA 35 HB3 ALA 35 -36.567 3.699 2.802 252 H PHE 36 HN PHE 36 -34.225 3.002 4.315 253 HA PHE 36 HA PHE 36 -32.962 1.162 2.658 254 HB2 PHE 36 HB2 PHE 36 -31.864 3.204 3.465 255 HB3 PHE 36 HB1 PHE 36 -31.861 2.572 5.106 256 HD1 PHE 36 HD2 PHE 36 -30.604 1.783 1.686 257 HD2 PHE 36 HD1 PHE 36 -30.007 1.448 5.889 258 HE1 PHE 36 HE2 PHE 36 -28.394 0.775 1.291 259 HE2 PHE 36 HE1 PHE 36 -27.796 0.441 5.497 260 HZ PHE 36 HZ PHE 36 -26.987 0.104 3.197 261 H ASN 37 HN ASN 37 -33.609 1.079 6.141 262 HA ASN 37 HA ASN 37 -32.428 -1.403 6.702 263 HB2 ASN 37 HB2 ASN 37 -34.705 0.088 8.002 264 HB3 ASN 37 HB1 ASN 37 -34.091 -1.433 8.627 265 HD21 ASN 37 HD21 ASN 37 -31.334 -0.837 7.906 266 HD22 ASN 37 HD22 ASN 37 -30.781 0.325 9.059 267 H TRP 38 HN TRP 38 -35.750 -0.556 5.755 268 HA TRP 38 HA TRP 38 -36.834 -3.137 5.877 269 HB2 TRP 38 HB2 TRP 38 -38.004 -0.824 5.471 270 HB3 TRP 38 HB1 TRP 38 -37.691 -1.159 3.774 271 HD1 TRP 38 HD1 TRP 38 -39.831 -2.324 6.707 272 HE1 TRP 38 HE1 TRP 38 -41.708 -3.839 5.815 273 HE3 TRP 38 HE3 TRP 38 -38.263 -2.804 1.862 274 HZ2 TRP 38 HZ2 TRP 38 -42.429 -5.072 3.394 275 HZ3 TRP 38 HZ3 TRP 38 -39.607 -4.176 0.325 276 HH2 TRP 38 HH2 TRP 38 -41.646 -5.287 1.079 277 H ILE 39 HN ILE 39 -35.139 -1.428 3.301 278 HA ILE 39 HA ILE 39 -35.641 -3.457 1.364 279 HB ILE 39 HB ILE 39 -35.094 -0.887 1.063 280 HG12 ILE 39 HG12 ILE 39 -34.600 -1.345 -1.291 281 HG13 ILE 39 HG11 ILE 39 -34.156 -3.004 -0.882 282 HG21 ILE 39 HG21 ILE 39 -32.388 -2.121 0.581 283 HG22 ILE 39 HG22 ILE 39 -32.784 -1.088 1.955 284 HG23 ILE 39 HG23 ILE 39 -32.855 -0.440 0.313 285 HD11 ILE 39 HD11 ILE 39 -36.387 -2.862 -1.855 286 HD12 ILE 39 HD12 ILE 39 -36.887 -1.793 -0.544 287 HD13 ILE 39 HD13 ILE 39 -36.437 -3.462 -0.198 288 H ILE 40 HN ILE 40 -32.904 -2.716 3.489 289 HA ILE 40 HA ILE 40 -31.182 -4.585 2.203 290 HB ILE 40 HB ILE 40 -29.707 -4.371 4.131 291 HG12 ILE 40 HG12 ILE 40 -30.460 -2.394 5.728 292 HG13 ILE 40 HG11 ILE 40 -32.065 -2.993 5.327 293 HG21 ILE 40 HG21 ILE 40 -29.687 -1.705 3.941 294 HG22 ILE 40 HG22 ILE 40 -30.759 -2.088 2.598 295 HG23 ILE 40 HG23 ILE 40 -29.136 -2.772 2.652 296 HD11 ILE 40 HD11 ILE 40 -29.833 -4.464 6.685 297 HD12 ILE 40 HD12 ILE 40 -31.264 -5.266 6.039 298 HD13 ILE 40 HD13 ILE 40 -31.428 -4.064 7.325 299 H VAL 41 HN VAL 41 -33.635 -4.907 4.615 300 HA VAL 41 HA VAL 41 -32.926 -7.597 5.308 301 HB VAL 41 HB VAL 41 -35.574 -6.155 5.562 302 HG11 VAL 41 HG11 VAL 41 -35.965 -8.543 5.505 303 HG12 VAL 41 HG12 VAL 41 -36.167 -7.951 7.155 304 HG13 VAL 41 HG13 VAL 41 -34.694 -8.808 6.700 305 HG21 VAL 41 HG21 VAL 41 -33.775 -5.181 6.899 306 HG22 VAL 41 HG22 VAL 41 -33.443 -6.761 7.610 307 HG23 VAL 41 HG23 VAL 41 -34.983 -5.957 7.921 308 H HIS 42 HN HIS 42 -34.926 -6.070 2.841 309 HA HIS 42 HA HIS 42 -35.774 -8.715 1.894 310 HB2 HIS 42 HB2 HIS 42 -36.764 -5.938 1.272 311 HB3 HIS 42 HB1 HIS 42 -37.325 -7.372 0.418 312 HD1 HIS 42 HD1 HIS 42 -37.453 -5.712 3.796 313 HD2 HIS 42 HD2 HIS 42 -39.136 -8.952 1.802 314 HE1 HIS 42 HE1 HIS 42 -39.295 -6.546 5.290 315 HE2 HIS 42 HE2 HIS 42 -40.128 -8.646 4.174 316 H MET 43 HN MET 43 -33.162 -6.919 1.362 317 HA MET 43 HA MET 43 -33.039 -6.961 -1.501 318 HB2 MET 43 HB2 MET 43 -30.698 -6.336 -1.244 319 HB3 MET 43 HB1 MET 43 -31.722 -5.340 -0.224 320 HG2 MET 43 HG2 MET 43 -29.973 -5.793 1.188 321 HG3 MET 43 HG1 MET 43 -31.109 -7.067 1.618 322 HE1 MET 43 HE1 MET 43 -28.941 -6.938 -1.660 323 HE2 MET 43 HE2 MET 43 -27.478 -7.777 -1.146 324 HE3 MET 43 HE3 MET 43 -27.878 -6.201 -0.462 325 H GLU 44 HN GLU 44 -32.543 -9.232 0.968 326 HA GLU 44 HA GLU 44 -30.511 -10.812 -0.205 327 HB2 GLU 44 HB2 GLU 44 -32.560 -11.891 1.707 328 HB3 GLU 44 HB1 GLU 44 -30.842 -12.267 1.593 329 HG2 GLU 44 HG2 GLU 44 -30.383 -9.909 2.321 330 HG3 GLU 44 HG1 GLU 44 -32.111 -9.760 2.642 331 H GLU 45 HN GLU 45 -33.916 -10.614 -0.665 332 HA GLU 45 HA GLU 45 -33.959 -13.050 -2.246 333 HB2 GLU 45 HB2 GLU 45 -36.377 -12.315 -2.660 334 HB3 GLU 45 HB1 GLU 45 -35.943 -12.804 -1.032 335 HG2 GLU 45 HG2 GLU 45 -35.511 -10.250 -0.696 336 HG3 GLU 45 HG1 GLU 45 -36.587 -10.104 -2.084 337 HA PRO 46 HA PRO 46 -32.029 -11.072 -5.546 338 HB2 PRO 46 HB2 PRO 46 -32.884 -12.737 -7.571 339 HB3 PRO 46 HB1 PRO 46 -31.562 -13.102 -6.451 340 HG2 PRO 46 HG2 PRO 46 -34.446 -13.944 -6.340 341 HG3 PRO 46 HG1 PRO 46 -32.983 -14.914 -6.045 342 HD2 PRO 46 HD2 PRO 46 -34.415 -14.000 -4.009 343 HD3 PRO 46 HD1 PRO 46 -32.638 -13.957 -3.938 344 H ASP 47 HN ASP 47 -35.391 -11.966 -6.232 345 HA ASP 47 HA ASP 47 -35.366 -10.002 -8.412 346 HB2 ASP 47 HB2 ASP 47 -35.705 -12.299 -9.110 347 HB3 ASP 47 HB1 ASP 47 -37.021 -12.495 -7.967 348 H PHE 48 HN PHE 48 -35.874 -9.535 -5.524 349 HA PHE 48 HA PHE 48 -38.670 -8.954 -5.268 350 HB2 PHE 48 HB2 PHE 48 -37.075 -9.502 -3.368 351 HB3 PHE 48 HB1 PHE 48 -36.420 -7.881 -3.560 352 HD1 PHE 48 HD2 PHE 48 -39.682 -9.615 -3.076 353 HD2 PHE 48 HD1 PHE 48 -37.292 -6.185 -2.283 354 HE1 PHE 48 HE2 PHE 48 -41.440 -8.737 -1.596 355 HE2 PHE 48 HE1 PHE 48 -39.046 -5.300 -0.805 356 HZ PHE 48 HZ PHE 48 -41.114 -6.589 -0.439 357 H ALA 49 HN ALA 49 -35.875 -7.286 -6.435 358 HA ALA 49 HA ALA 49 -37.206 -4.685 -6.406 359 HB1 ALA 49 HB1 ALA 49 -34.915 -4.644 -5.733 360 HB2 ALA 49 HB2 ALA 49 -35.010 -3.879 -7.325 361 HB3 ALA 49 HB3 ALA 49 -34.418 -5.535 -7.170 362 H GLU 50 HN GLU 50 -35.201 -4.555 -8.952 363 HA GLU 50 HA GLU 50 -37.178 -5.503 -10.908 364 HB2 GLU 50 HB2 GLU 50 -35.632 -2.902 -11.011 365 HB3 GLU 50 HB1 GLU 50 -36.639 -3.530 -12.308 366 HG2 GLU 50 HG2 GLU 50 -38.608 -3.331 -10.925 367 HG3 GLU 50 HG1 GLU 50 -37.624 -2.799 -9.562 368 HA PRO 51 HA PRO 51 -33.487 -7.401 -12.555 369 HB2 PRO 51 HB2 PRO 51 -35.010 -8.190 -14.871 370 HB3 PRO 51 HB1 PRO 51 -34.462 -9.196 -13.529 371 HG2 PRO 51 HG2 PRO 51 -37.092 -8.609 -14.011 372 HG3 PRO 51 HG1 PRO 51 -36.445 -9.002 -12.410 373 HD2 PRO 51 HD2 PRO 51 -37.083 -6.327 -13.593 374 HD3 PRO 51 HD1 PRO 51 -37.359 -6.924 -11.941 375 H LEU 52 HN LEU 52 -32.997 -4.945 -12.906 376 HA LEU 52 HA LEU 52 -32.535 -4.568 -15.764 377 HB2 LEU 52 HB2 LEU 52 -34.603 -3.339 -15.202 378 HB3 LEU 52 HB1 LEU 52 -33.722 -2.441 -13.981 379 HG LEU 52 HG LEU 52 -32.277 -1.493 -15.760 380 HD11 LEU 52 HD11 LEU 52 -32.473 -3.258 -17.410 381 HD12 LEU 52 HD12 LEU 52 -32.990 -1.719 -18.099 382 HD13 LEU 52 HD13 LEU 52 -34.192 -2.913 -17.608 383 HD21 LEU 52 HD21 LEU 52 -33.950 0.030 -16.668 384 HD22 LEU 52 HD22 LEU 52 -34.226 -0.267 -14.951 385 HD23 LEU 52 HD23 LEU 52 -35.236 -1.064 -16.158 386 H THR 53 HN THR 53 -30.412 -4.686 -15.760 387 HA THR 53 HA THR 53 -28.226 -4.386 -15.191 388 HB THR 53 HB THR 53 -28.565 -2.638 -16.772 389 HG1 THR 53 HG1 THR 53 -27.177 -1.237 -14.755 390 HG21 THR 53 HG21 THR 53 -30.467 -1.488 -15.789 391 HG22 THR 53 HG22 THR 53 -29.174 -0.343 -16.145 392 HG23 THR 53 HG23 THR 53 -29.450 -0.876 -14.485 393 H MET 54 HN MET 54 -28.551 -5.277 -13.003 394 HA MET 54 HA MET 54 -28.409 -3.374 -10.818 395 HB2 MET 54 HB2 MET 54 -28.206 -6.395 -10.845 396 HB3 MET 54 HB1 MET 54 -28.192 -5.410 -9.390 397 HG2 MET 54 HG2 MET 54 -30.377 -6.205 -9.557 398 HG3 MET 54 HG1 MET 54 -30.457 -4.544 -10.137 399 HE1 MET 54 HE1 MET 54 -30.570 -8.275 -12.847 400 HE2 MET 54 HE2 MET 54 -30.566 -8.334 -11.084 401 HE3 MET 54 HE3 MET 54 -29.133 -7.782 -11.952 402 HA PRO 55 HA PRO 55 -23.934 -3.390 -11.404 403 HB2 PRO 55 HB2 PRO 55 -23.860 -1.024 -9.754 404 HB3 PRO 55 HB1 PRO 55 -23.586 -1.161 -11.491 405 HG2 PRO 55 HG2 PRO 55 -25.745 0.107 -10.375 406 HG3 PRO 55 HG1 PRO 55 -25.745 -0.605 -11.999 407 HD2 PRO 55 HD2 PRO 55 -26.842 -1.710 -9.440 408 HD3 PRO 55 HD1 PRO 55 -27.527 -1.775 -11.079 409 H GLY 56 HN GLY 56 -25.252 -2.325 -8.250 410 HA2 GLY 56 HA2 GLY 56 -24.649 -4.112 -6.455 411 HA3 GLY 56 HA1 GLY 56 -23.008 -3.683 -6.925 412 H TYR 57 HN TYR 57 -23.247 -3.227 -4.422 413 HA TYR 57 HA TYR 57 -24.263 -0.493 -4.100 414 HB2 TYR 57 HB2 TYR 57 -24.333 -1.069 -1.617 415 HB3 TYR 57 HB1 TYR 57 -25.543 -1.807 -2.659 416 HD1 TYR 57 HD2 TYR 57 -25.348 -4.225 -3.258 417 HD2 TYR 57 HD1 TYR 57 -22.756 -2.403 -0.416 418 HE1 TYR 57 HE2 TYR 57 -24.693 -6.449 -2.432 419 HE2 TYR 57 HE1 TYR 57 -22.094 -4.619 0.412 420 HH TYR 57 HH TYR 57 -23.192 -6.976 0.441 421 H GLY 58 HN GLY 58 -21.479 -2.587 -3.454 422 HA2 GLY 58 HA2 GLY 58 -19.522 -0.827 -3.873 423 HA3 GLY 58 HA1 GLY 58 -20.060 -0.323 -2.279 424 H GLY 59 HN GLY 59 -18.344 -0.855 -1.070 425 HA2 GLY 59 HA2 GLY 59 -17.444 -2.685 0.297 426 HA3 GLY 59 HA1 GLY 59 -17.422 -3.662 -1.167 427 H ALA 60 HN ALA 60 -16.396 -0.303 -0.668 428 HA ALA 60 HA ALA 60 -13.702 -1.094 -1.576 429 HB1 ALA 60 HB1 ALA 60 -14.951 -0.071 -3.417 430 HB2 ALA 60 HB2 ALA 60 -13.594 0.938 -2.921 431 HB3 ALA 60 HB3 ALA 60 -15.231 1.364 -2.427 432 H ALA 61 HN ALA 61 -12.546 1.422 -1.494 433 HA ALA 61 HA ALA 61 -11.465 2.875 -0.156 434 HB1 ALA 61 HB1 ALA 61 -13.766 3.712 0.256 435 HB2 ALA 61 HB2 ALA 61 -12.649 3.984 1.590 436 HB3 ALA 61 HB3 ALA 61 -13.835 2.686 1.690 437 H SER 62 HN SER 62 -10.477 0.453 0.043 438 HA SER 62 HA SER 62 -10.289 -0.273 2.863 439 HB2 SER 62 HB2 SER 62 -10.613 -2.050 1.150 440 HB3 SER 62 HB1 SER 62 -9.062 -1.614 0.439 441 HG SER 62 HG SER 62 -9.014 -2.133 3.159 442 H ALA 63 HN ALA 63 -8.758 0.599 4.079 443 HA ALA 63 HA ALA 63 -6.267 1.502 2.780 444 HB1 ALA 63 HB1 ALA 63 -6.040 3.135 4.584 445 HB2 ALA 63 HB2 ALA 63 -7.552 2.569 5.293 446 HB3 ALA 63 HB3 ALA 63 -7.557 3.356 3.714 447 H GLY 64 HN GLY 64 -4.313 0.902 3.667 448 HA2 GLY 64 HA2 GLY 64 -4.484 -1.018 5.907 449 HA3 GLY 64 HA1 GLY 64 -3.561 -1.381 4.458 450 H ALA 65 HN ALA 65 -3.674 0.388 7.424 451 HA ALA 65 HA ALA 65 -0.891 1.264 7.022 452 HB1 ALA 65 HB1 ALA 65 -2.853 2.068 9.177 453 HB2 ALA 65 HB2 ALA 65 -2.466 3.013 7.739 454 HB3 ALA 65 HB3 ALA 65 -1.226 2.714 8.957 455 H SER 66 HN SER 66 0.671 0.792 8.706 456 HA SER 66 HA SER 66 0.011 -1.111 10.738 457 HB2 SER 66 HB2 SER 66 0.066 -2.498 8.633 458 HB3 SER 66 HB1 SER 66 1.773 -2.088 8.483 459 HG SER 66 HG SER 66 0.471 -3.657 10.438 460 H VAL 67 HN VAL 67 2.640 -2.253 10.893 461 HA VAL 67 HA VAL 67 3.824 -0.271 12.513 462 HB VAL 67 HB VAL 67 4.015 -2.680 12.953 463 HG11 VAL 67 HG11 VAL 67 5.618 -4.053 11.715 464 HG12 VAL 67 HG12 VAL 67 5.890 -2.719 10.593 465 HG13 VAL 67 HG13 VAL 67 4.305 -3.488 10.683 466 HG21 VAL 67 HG21 VAL 67 6.657 -1.267 12.625 467 HG22 VAL 67 HG22 VAL 67 6.389 -2.709 13.604 468 HG23 VAL 67 HG23 VAL 67 5.589 -1.195 14.027 469 H PHE 68 HN PHE 68 4.240 -1.005 9.147 470 HA PHE 68 HA PHE 68 6.851 0.176 8.961 471 HB2 PHE 68 HB2 PHE 68 6.433 -0.010 6.453 472 HB3 PHE 68 HB1 PHE 68 6.488 -1.508 7.369 473 HD1 PHE 68 HD2 PHE 68 4.346 0.792 5.484 474 HD2 PHE 68 HD1 PHE 68 4.529 -2.876 7.631 475 HE1 PHE 68 HE2 PHE 68 2.180 0.130 4.528 476 HE2 PHE 68 HE1 PHE 68 2.365 -3.550 6.674 477 HZ PHE 68 HZ PHE 68 1.186 -2.045 5.119 478 H GLY 69 HN GLY 69 5.892 2.101 10.168 479 HA2 GLY 69 HA2 GLY 69 4.567 4.047 8.464 480 HA3 GLY 69 HA1 GLY 69 5.050 4.277 10.139 481 H ALA 70 HN ALA 70 7.745 3.073 9.119 482 HA ALA 70 HA ALA 70 8.777 5.578 7.958 483 HB1 ALA 70 HB1 ALA 70 9.502 5.292 10.282 484 HB2 ALA 70 HB2 ALA 70 10.863 5.183 9.166 485 HB3 ALA 70 HB3 ALA 70 10.183 3.717 9.874 486 H SER 71 HN SER 71 10.585 5.341 6.508 487 HA SER 71 HA SER 71 10.304 3.021 4.824 488 HB2 SER 71 HB2 SER 71 12.124 4.328 3.495 489 HB3 SER 71 HB1 SER 71 10.495 4.998 3.601 490 HG SER 71 HG SER 71 11.206 6.590 4.806 491 H GLY 72 HN GLY 72 11.185 1.879 6.972 492 HA2 GLY 72 HA2 GLY 72 12.787 0.280 7.498 493 HA3 GLY 72 HA1 GLY 72 13.806 0.918 6.219 494 H LEU 73 HN LEU 73 14.347 3.387 6.807 495 HA LEU 73 HA LEU 73 15.607 4.787 8.051 496 HB2 LEU 73 HB2 LEU 73 13.813 3.578 9.998 497 HB3 LEU 73 HB1 LEU 73 15.336 4.071 10.711 498 HG LEU 73 HG LEU 73 13.604 5.811 10.888 499 HD11 LEU 73 HD11 LEU 73 15.920 6.525 9.094 500 HD12 LEU 73 HD12 LEU 73 15.941 6.462 10.857 501 HD13 LEU 73 HD13 LEU 73 14.955 7.667 10.030 502 HD21 LEU 73 HD21 LEU 73 12.881 7.022 8.892 503 HD22 LEU 73 HD22 LEU 73 12.373 5.335 8.836 504 HD23 LEU 73 HD23 LEU 73 13.752 5.873 7.876 505 H ASP 74 HN ASP 74 16.658 2.237 7.125 506 HA ASP 74 HA ASP 74 18.998 2.227 8.899 507 HB2 ASP 74 HB2 ASP 74 19.342 -0.084 8.654 508 HB3 ASP 74 HB1 ASP 74 17.603 0.047 8.873 509 H ASN 75 HN ASN 75 20.914 2.577 7.931 510 HA ASN 75 HA ASN 75 20.969 2.652 5.004 511 HB2 ASN 75 HB2 ASN 75 22.257 4.798 5.136 512 HB3 ASN 75 HB1 ASN 75 20.584 4.940 5.663 513 HD21 ASN 75 HD21 ASN 75 20.960 6.753 6.890 514 HD22 ASN 75 HD22 ASN 75 21.850 6.704 8.383 515 H GLN 76 HN GLN 76 21.980 0.854 7.092 516 HA GLN 76 HA GLN 76 24.872 1.224 6.937 517 HB2 GLN 76 HB2 GLN 76 23.788 0.630 9.121 518 HB3 GLN 76 HB1 GLN 76 23.320 -0.910 8.411 519 HG2 GLN 76 HG2 GLN 76 25.851 -1.154 7.906 520 HG3 GLN 76 HG1 GLN 76 26.031 0.077 9.153 521 HE21 GLN 76 HE21 GLN 76 25.043 -3.184 8.465 522 HE22 GLN 76 HE22 GLN 76 24.972 -3.731 10.109 523 HA PRO 77 HA PRO 77 25.410 -1.715 3.581 524 HB2 PRO 77 HB2 PRO 77 27.936 -2.111 5.116 525 HB3 PRO 77 HB1 PRO 77 27.705 -1.842 3.385 526 HG2 PRO 77 HG2 PRO 77 28.585 0.108 4.910 527 HG3 PRO 77 HG1 PRO 77 27.369 0.432 3.664 528 HD2 PRO 77 HD2 PRO 77 27.031 0.154 6.620 529 HD3 PRO 77 HD1 PRO 77 26.258 1.293 5.506 530 HA PRO 78 HA PRO 78 24.437 -5.637 5.279 531 HB2 PRO 78 HB2 PRO 78 25.925 -7.350 3.757 532 HB3 PRO 78 HB1 PRO 78 24.457 -6.554 3.179 533 HG2 PRO 78 HG2 PRO 78 27.310 -5.787 2.757 534 HG3 PRO 78 HG1 PRO 78 25.987 -5.818 1.580 535 HD2 PRO 78 HD2 PRO 78 26.815 -3.547 2.707 536 HD3 PRO 78 HD1 PRO 78 25.104 -3.832 2.356 537 H GLU 79 HN GLU 79 25.113 -6.030 7.282 538 HA GLU 79 HA GLU 79 27.720 -5.861 8.222 539 HB2 GLU 79 HB2 GLU 79 26.884 -7.020 10.213 540 HB3 GLU 79 HB1 GLU 79 25.824 -5.718 9.706 541 HG2 GLU 79 HG2 GLU 79 24.213 -7.240 10.031 542 HG3 GLU 79 HG1 GLU 79 24.685 -7.798 8.427 543 H GLU 80 HN GLU 80 26.078 -8.458 6.635 544 HA GLU 80 HA GLU 80 27.843 -10.554 7.205 545 HB2 GLU 80 HB2 GLU 80 26.005 -11.317 6.064 546 HB3 GLU 80 HB1 GLU 80 25.917 -9.892 5.045 547 HG2 GLU 80 HG2 GLU 80 27.802 -10.725 3.727 548 HG3 GLU 80 HG1 GLU 80 27.867 -12.166 4.744 549 H ILE 81 HN ILE 81 27.851 -8.167 4.592 550 HA ILE 81 HA ILE 81 30.276 -9.179 3.495 551 HB ILE 81 HB ILE 81 28.698 -6.697 2.877 552 HG12 ILE 81 HG12 ILE 81 29.117 -9.280 1.360 553 HG13 ILE 81 HG11 ILE 81 27.671 -8.870 2.279 554 HG21 ILE 81 HG21 ILE 81 30.229 -6.861 0.753 555 HG22 ILE 81 HG22 ILE 81 31.327 -7.662 1.885 556 HG23 ILE 81 HG23 ILE 81 30.777 -6.017 2.202 557 HD11 ILE 81 HD11 ILE 81 28.648 -7.787 -0.318 558 HD12 ILE 81 HD12 ILE 81 27.622 -6.789 0.706 559 HD13 ILE 81 HD13 ILE 81 27.037 -8.353 0.129 560 H VAL 82 HN VAL 82 29.441 -6.324 5.457 561 HA VAL 82 HA VAL 82 31.960 -5.120 5.383 562 HB VAL 82 HB VAL 82 31.410 -3.964 7.406 563 HG11 VAL 82 HG11 VAL 82 29.137 -3.110 6.919 564 HG12 VAL 82 HG12 VAL 82 28.949 -4.406 5.737 565 HG13 VAL 82 HG13 VAL 82 30.192 -3.175 5.507 566 HG21 VAL 82 HG21 VAL 82 30.417 -4.957 9.118 567 HG22 VAL 82 HG22 VAL 82 30.070 -6.363 8.106 568 HG23 VAL 82 HG23 VAL 82 28.913 -5.030 8.195 569 H ALA 83 HN ALA 83 30.644 -7.707 7.340 570 HA ALA 83 HA ALA 83 32.796 -8.233 9.041 571 HB1 ALA 83 HB1 ALA 83 31.777 -10.639 8.828 572 HB2 ALA 83 HB2 ALA 83 30.516 -9.783 7.914 573 HB3 ALA 83 HB3 ALA 83 30.858 -9.339 9.592 574 H ILE 84 HN ILE 84 31.986 -9.582 5.849 575 HA ILE 84 HA ILE 84 34.171 -11.323 5.607 576 HB ILE 84 HB ILE 84 32.552 -9.897 3.486 577 HG12 ILE 84 HG12 ILE 84 32.348 -12.806 4.118 578 HG13 ILE 84 HG11 ILE 84 31.604 -11.657 5.219 579 HG21 ILE 84 HG21 ILE 84 34.419 -12.245 3.151 580 HG22 ILE 84 HG22 ILE 84 34.734 -10.597 2.601 581 HG23 ILE 84 HG23 ILE 84 33.408 -11.523 1.897 582 HD11 ILE 84 HD11 ILE 84 31.046 -11.682 2.275 583 HD12 ILE 84 HD12 ILE 84 30.147 -10.862 3.560 584 HD13 ILE 84 HD13 ILE 84 30.125 -12.623 3.446 585 H ILE 85 HN ILE 85 33.765 -7.943 4.660 586 HA ILE 85 HA ILE 85 36.184 -7.680 3.264 587 HB ILE 85 HB ILE 85 34.542 -5.599 4.689 588 HG12 ILE 85 HG12 ILE 85 34.644 -6.372 1.770 589 HG13 ILE 85 HG11 ILE 85 33.421 -6.927 2.908 590 HG21 ILE 85 HG21 ILE 85 37.059 -5.437 3.189 591 HG22 ILE 85 HG22 ILE 85 36.338 -4.308 4.339 592 HG23 ILE 85 HG23 ILE 85 35.811 -4.310 2.659 593 HD11 ILE 85 HD11 ILE 85 32.724 -5.029 1.454 594 HD12 ILE 85 HD12 ILE 85 33.914 -4.033 2.296 595 HD13 ILE 85 HD13 ILE 85 32.568 -4.736 3.184 596 H THR 86 HN THR 86 35.370 -6.847 6.650 597 HA THR 86 HA THR 86 38.058 -6.085 7.206 598 HB THR 86 HB THR 86 36.525 -5.089 8.662 599 HG1 THR 86 HG1 THR 86 38.484 -6.066 9.653 600 HG21 THR 86 HG21 THR 86 34.550 -6.209 8.689 601 HG22 THR 86 HG22 THR 86 35.185 -6.683 10.275 602 HG23 THR 86 HG23 THR 86 35.320 -7.790 8.907 603 H SER 87 HN SER 87 36.398 -9.133 7.161 604 HA SER 87 HA SER 87 38.381 -10.601 8.564 605 HB2 SER 87 HB2 SER 87 36.436 -11.519 6.436 606 HB3 SER 87 HB1 SER 87 37.396 -12.584 7.463 607 HG SER 87 HG SER 87 35.314 -10.813 8.213 608 H MET 88 HN MET 88 38.035 -9.486 5.265 609 HA MET 88 HA MET 88 40.102 -10.954 4.052 610 HB2 MET 88 HB2 MET 88 38.999 -8.213 3.445 611 HB3 MET 88 HB1 MET 88 40.210 -8.999 2.443 612 HG2 MET 88 HG2 MET 88 37.447 -10.051 3.005 613 HG3 MET 88 HG1 MET 88 37.963 -9.231 1.536 614 HE1 MET 88 HE1 MET 88 39.696 -10.211 -0.183 615 HE2 MET 88 HE2 MET 88 40.516 -11.760 0.012 616 HE3 MET 88 HE3 MET 88 40.892 -10.422 1.097 617 H GLY 89 HN GLY 89 40.117 -8.210 6.134 618 HA2 GLY 89 HA2 GLY 89 42.378 -8.034 7.294 619 HA3 GLY 89 HA1 GLY 89 42.982 -7.791 5.663 620 H PHE 90 HN PHE 90 40.042 -6.434 5.615 621 HA PHE 90 HA PHE 90 41.128 -3.766 6.016 622 HB2 PHE 90 HB2 PHE 90 38.500 -4.708 4.853 623 HB3 PHE 90 HB1 PHE 90 39.031 -3.030 4.904 624 HD1 PHE 90 HD2 PHE 90 41.781 -3.092 4.101 625 HD2 PHE 90 HD1 PHE 90 38.541 -5.459 2.683 626 HE1 PHE 90 HE2 PHE 90 42.951 -3.407 1.958 627 HE2 PHE 90 HE1 PHE 90 39.706 -5.776 0.539 628 HZ PHE 90 HZ PHE 90 41.948 -4.767 0.199 629 H GLN 91 HN GLN 91 39.068 -2.252 6.782 630 HA GLN 91 HA GLN 91 38.472 -3.258 9.467 631 HB2 GLN 91 HB2 GLN 91 39.648 -1.137 9.385 632 HB3 GLN 91 HB1 GLN 91 38.445 -0.473 8.292 633 HG2 GLN 91 HG2 GLN 91 36.768 -0.682 10.064 634 HG3 GLN 91 HG1 GLN 91 38.014 -1.284 11.153 635 HE21 GLN 91 HE21 GLN 91 38.577 1.240 8.802 636 HE22 GLN 91 HE22 GLN 91 38.761 2.528 9.941 637 H ARG 92 HN ARG 92 36.303 -3.209 10.271 638 HA ARG 92 HA ARG 92 34.273 -3.854 8.433 639 HB2 ARG 92 HB2 ARG 92 34.170 -4.445 10.811 640 HB3 ARG 92 HB1 ARG 92 33.955 -2.753 11.220 641 HG2 ARG 92 HG2 ARG 92 31.948 -2.946 9.537 642 HG3 ARG 92 HG1 ARG 92 32.048 -4.653 9.977 643 HD2 ARG 92 HD2 ARG 92 31.820 -2.377 11.925 644 HD3 ARG 92 HD1 ARG 92 30.466 -3.356 11.365 645 HE ARG 92 HE ARG 92 31.942 -5.281 12.320 646 HH11 ARG 92 HH11 ARG 92 31.577 -2.071 13.676 647 HH12 ARG 92 HH12 ARG 92 31.831 -2.589 15.315 648 HH21 ARG 92 HH21 ARG 92 32.251 -5.981 14.473 649 HH22 ARG 92 HH22 ARG 92 32.187 -4.832 15.774 650 H ASN 93 HN ASN 93 34.732 -0.857 10.286 651 HA ASN 93 HA ASN 93 32.681 0.640 9.119 652 HB2 ASN 93 HB2 ASN 93 33.863 1.321 11.142 653 HB3 ASN 93 HB1 ASN 93 35.338 1.583 10.214 654 HD21 ASN 93 HD21 ASN 93 35.545 3.415 8.973 655 HD22 ASN 93 HD22 ASN 93 34.447 4.749 9.072 656 H GLN 94 HN GLN 94 35.982 0.107 8.091 657 HA GLN 94 HA GLN 94 35.997 1.904 5.908 658 HB2 GLN 94 HB2 GLN 94 38.104 1.215 6.582 659 HB3 GLN 94 HB1 GLN 94 37.611 -0.459 6.742 660 HG2 GLN 94 HG2 GLN 94 37.788 -0.857 4.453 661 HG3 GLN 94 HG1 GLN 94 37.794 0.863 4.062 662 HE21 GLN 94 HE21 GLN 94 39.682 2.032 4.317 663 HE22 GLN 94 HE22 GLN 94 41.226 1.289 4.563 664 H ALA 95 HN ALA 95 35.139 -1.480 6.289 665 HA ALA 95 HA ALA 95 34.461 -2.048 3.617 666 HB1 ALA 95 HB1 ALA 95 33.335 -3.183 6.181 667 HB2 ALA 95 HB2 ALA 95 34.784 -3.754 5.344 668 HB3 ALA 95 HB3 ALA 95 33.199 -3.909 4.578 669 H ILE 96 HN ILE 96 32.592 -0.735 6.330 670 HA ILE 96 HA ILE 96 30.101 -0.628 5.105 671 HB ILE 96 HB ILE 96 31.343 0.939 7.323 672 HG12 ILE 96 HG12 ILE 96 28.736 -0.117 7.839 673 HG13 ILE 96 HG11 ILE 96 29.699 -1.351 7.040 674 HG21 ILE 96 HG21 ILE 96 29.056 2.054 7.587 675 HG22 ILE 96 HG22 ILE 96 28.815 1.649 5.880 676 HG23 ILE 96 HG23 ILE 96 30.149 2.702 6.362 677 HD11 ILE 96 HD11 ILE 96 30.379 0.116 9.569 678 HD12 ILE 96 HD12 ILE 96 31.450 -1.010 8.738 679 HD13 ILE 96 HD13 ILE 96 29.920 -1.582 9.407 680 H GLN 97 HN GLN 97 32.594 1.892 5.293 681 HA GLN 97 HA GLN 97 31.344 3.813 3.731 682 HB2 GLN 97 HB2 GLN 97 33.382 4.216 5.027 683 HB3 GLN 97 HB1 GLN 97 34.291 3.243 3.882 684 HG2 GLN 97 HG2 GLN 97 34.026 4.798 2.161 685 HG3 GLN 97 HG1 GLN 97 32.744 5.650 3.012 686 HE21 GLN 97 HE21 GLN 97 36.161 5.147 2.738 687 HE22 GLN 97 HE22 GLN 97 36.647 6.504 3.691 688 H ALA 98 HN ALA 98 33.490 1.204 2.757 689 HA ALA 98 HA ALA 98 33.612 1.791 0.035 690 HB1 ALA 98 HB1 ALA 98 34.934 0.087 1.453 691 HB2 ALA 98 HB2 ALA 98 34.604 -0.290 -0.237 692 HB3 ALA 98 HB3 ALA 98 33.625 -1.023 1.042 693 H LEU 99 HN LEU 99 31.456 -0.497 1.746 694 HA LEU 99 HA LEU 99 29.971 -1.227 -0.508 695 HB2 LEU 99 HB2 LEU 99 29.148 -1.165 2.373 696 HB3 LEU 99 HB1 LEU 99 28.241 -1.953 1.109 697 HG LEU 99 HG LEU 99 31.062 -2.703 1.833 698 HD11 LEU 99 HD11 LEU 99 28.535 -4.104 2.648 699 HD12 LEU 99 HD12 LEU 99 29.428 -2.998 3.690 700 HD13 LEU 99 HD13 LEU 99 30.189 -4.490 3.130 701 HD21 LEU 99 HD21 LEU 99 30.917 -3.866 -0.048 702 HD22 LEU 99 HD22 LEU 99 29.220 -3.445 -0.238 703 HD23 LEU 99 HD23 LEU 99 29.674 -4.841 0.735 704 H ARG 100 HN ARG 100 29.635 1.486 1.701 705 HA ARG 100 HA ARG 100 27.109 2.423 0.984 706 HB2 ARG 100 HB2 ARG 100 29.644 3.817 1.794 707 HB3 ARG 100 HB1 ARG 100 28.215 4.744 1.358 708 HG2 ARG 100 HG2 ARG 100 26.981 3.881 3.175 709 HG3 ARG 100 HG1 ARG 100 28.195 2.637 3.500 710 HD2 ARG 100 HD2 ARG 100 29.765 4.239 4.237 711 HD3 ARG 100 HD1 ARG 100 28.789 5.582 3.652 712 HE ARG 100 HE ARG 100 27.335 4.147 5.587 713 HH11 ARG 100 HH11 ARG 100 30.062 6.315 5.256 714 HH12 ARG 100 HH12 ARG 100 29.987 6.869 6.905 715 HH21 ARG 100 HH21 ARG 100 27.204 4.882 7.734 716 HH22 ARG 100 HH22 ARG 100 28.337 6.070 8.318 717 H ALA 101 HN ALA 101 30.251 2.993 -0.489 718 HA ALA 101 HA ALA 101 29.259 4.613 -2.619 719 HB1 ALA 101 HB1 ALA 101 31.631 4.088 -3.518 720 HB2 ALA 101 HB2 ALA 101 31.863 3.331 -1.934 721 HB3 ALA 101 HB3 ALA 101 31.453 5.043 -2.044 722 H THR 102 HN THR 102 30.091 1.192 -2.287 723 HA THR 102 HA THR 102 29.819 0.674 -5.110 724 HB THR 102 HB THR 102 30.511 -1.556 -4.597 725 HG1 THR 102 HG1 THR 102 30.460 -2.371 -2.526 726 HG21 THR 102 HG21 THR 102 32.567 -0.751 -4.255 727 HG22 THR 102 HG22 THR 102 32.206 -0.480 -2.561 728 HG23 THR 102 HG23 THR 102 31.881 0.781 -3.747 729 H ASN 103 HN ASN 103 27.578 1.172 -2.814 730 HA ASN 103 HA ASN 103 25.374 0.711 -2.550 731 HB2 ASN 103 HB2 ASN 103 25.448 0.977 -5.103 732 HB3 ASN 103 HB1 ASN 103 25.413 -0.774 -5.170 733 HD21 ASN 103 HD21 ASN 103 23.543 -1.870 -4.591 734 HD22 ASN 103 HD22 ASN 103 22.021 -1.068 -4.409 735 H ASN 104 HN ASN 104 27.152 -0.905 -1.281 736 HA ASN 104 HA ASN 104 27.128 -2.736 0.058 737 HB2 ASN 104 HB2 ASN 104 24.459 -3.302 -1.255 738 HB3 ASN 104 HB1 ASN 104 25.125 -4.236 0.078 739 HD21 ASN 104 HD21 ASN 104 25.477 -0.755 -0.153 740 HD22 ASN 104 HD22 ASN 104 24.418 -0.375 1.158 741 H ASN 105 HN ASN 105 27.902 -2.686 -2.930 742 HA ASN 105 HA ASN 105 27.925 -5.489 -3.630 743 HB2 ASN 105 HB2 ASN 105 27.963 -3.526 -5.272 744 HB3 ASN 105 HB1 ASN 105 29.646 -3.301 -4.813 745 HD21 ASN 105 HD21 ASN 105 28.110 -6.437 -5.038 746 HD22 ASN 105 HD22 ASN 105 28.993 -6.976 -6.424 747 H LEU 106 HN LEU 106 29.125 -6.839 -2.555 748 HA LEU 106 HA LEU 106 31.108 -6.271 -0.700 749 HB2 LEU 106 HB2 LEU 106 29.880 -8.360 -0.764 750 HB3 LEU 106 HB1 LEU 106 30.573 -8.773 -2.309 751 HG LEU 106 HG LEU 106 32.431 -8.408 -0.005 752 HD11 LEU 106 HD11 LEU 106 31.014 -11.011 -0.451 753 HD12 LEU 106 HD12 LEU 106 30.380 -9.801 0.658 754 HD13 LEU 106 HD13 LEU 106 31.978 -10.499 0.940 755 HD21 LEU 106 HD21 LEU 106 33.575 -10.291 -1.124 756 HD22 LEU 106 HD22 LEU 106 33.377 -8.880 -2.160 757 HD23 LEU 106 HD23 LEU 106 32.321 -10.277 -2.364 758 H GLU 107 HN GLU 107 31.547 -7.771 -3.859 759 HA GLU 107 HA GLU 107 34.303 -7.811 -3.995 760 HB2 GLU 107 HB2 GLU 107 32.582 -7.192 -6.388 761 HB3 GLU 107 HB1 GLU 107 34.085 -8.096 -6.340 762 HG2 GLU 107 HG2 GLU 107 32.647 -9.835 -6.498 763 HG3 GLU 107 HG1 GLU 107 32.656 -9.642 -4.746 764 H ARG 108 HN ARG 108 32.154 -5.308 -5.257 765 HA ARG 108 HA ARG 108 34.190 -3.585 -6.153 766 HB2 ARG 108 HB2 ARG 108 31.688 -3.600 -6.706 767 HB3 ARG 108 HB1 ARG 108 31.490 -2.656 -5.247 768 HG2 ARG 108 HG2 ARG 108 32.938 -0.935 -6.154 769 HG3 ARG 108 HG1 ARG 108 33.148 -1.888 -7.630 770 HD2 ARG 108 HD2 ARG 108 30.515 -0.985 -6.535 771 HD3 ARG 108 HD1 ARG 108 31.392 -0.131 -7.812 772 HE ARG 108 HE ARG 108 30.675 -2.955 -8.202 773 HH11 ARG 108 HH11 ARG 108 30.187 0.408 -9.059 774 HH12 ARG 108 HH12 ARG 108 29.331 0.034 -10.527 775 HH21 ARG 108 HH21 ARG 108 29.571 -3.443 -10.141 776 HH22 ARG 108 HH22 ARG 108 28.998 -2.139 -11.153 777 H ALA 109 HN ALA 109 32.688 -4.000 -3.007 778 HA ALA 109 HA ALA 109 33.478 -1.553 -1.885 779 HB1 ALA 109 HB1 ALA 109 32.133 -3.791 -0.987 780 HB2 ALA 109 HB2 ALA 109 32.545 -2.378 -0.018 781 HB3 ALA 109 HB3 ALA 109 33.609 -3.784 -0.022 782 H LEU 110 HN LEU 110 34.982 -4.757 -1.831 783 HA LEU 110 HA LEU 110 37.424 -4.065 -0.650 784 HB2 LEU 110 HB2 LEU 110 36.929 -6.155 -2.768 785 HB3 LEU 110 HB1 LEU 110 38.252 -6.127 -1.624 786 HG LEU 110 HG LEU 110 35.399 -6.291 -0.702 787 HD11 LEU 110 HD11 LEU 110 37.220 -8.576 -1.457 788 HD12 LEU 110 HD12 LEU 110 35.717 -8.115 -2.262 789 HD13 LEU 110 HD13 LEU 110 35.681 -8.729 -0.607 790 HD21 LEU 110 HD21 LEU 110 36.437 -7.314 1.256 791 HD22 LEU 110 HD22 LEU 110 37.100 -5.709 0.938 792 HD23 LEU 110 HD23 LEU 110 38.024 -7.146 0.506 793 H ASP 111 HN ASP 111 36.334 -4.076 -3.985 794 HA ASP 111 HA ASP 111 38.637 -3.278 -5.331 795 HB2 ASP 111 HB2 ASP 111 36.144 -3.799 -6.145 796 HB3 ASP 111 HB1 ASP 111 36.028 -2.047 -6.078 797 H TRP 112 HN TRP 112 36.086 -1.340 -3.895 798 HA TRP 112 HA TRP 112 37.132 1.208 -4.400 799 HB2 TRP 112 HB2 TRP 112 34.780 0.610 -3.722 800 HB3 TRP 112 HB1 TRP 112 35.382 0.405 -2.082 801 HD1 TRP 112 HD1 TRP 112 34.392 3.057 -4.587 802 HE1 TRP 112 HE1 TRP 112 34.428 5.370 -3.448 803 HE3 TRP 112 HE3 TRP 112 36.618 1.750 -0.177 804 HZ2 TRP 112 HZ2 TRP 112 35.290 6.482 -1.005 805 HZ3 TRP 112 HZ3 TRP 112 37.014 3.496 1.509 806 HH2 TRP 112 HH2 TRP 112 36.361 5.814 1.101 807 H ILE 113 HN ILE 113 37.319 -0.890 -1.585 808 HA ILE 113 HA ILE 113 38.808 0.839 0.046 809 HB ILE 113 HB ILE 113 38.602 -2.175 0.092 810 HG12 ILE 113 HG12 ILE 113 37.166 0.009 1.614 811 HG13 ILE 113 HG11 ILE 113 36.461 -1.067 0.420 812 HG21 ILE 113 HG21 ILE 113 39.654 -0.284 2.195 813 HG22 ILE 113 HG22 ILE 113 40.616 -1.418 1.250 814 HG23 ILE 113 HG23 ILE 113 39.421 -2.019 2.395 815 HD11 ILE 113 HD11 ILE 113 37.725 -2.308 2.782 816 HD12 ILE 113 HD12 ILE 113 36.291 -2.780 1.866 817 HD13 ILE 113 HD13 ILE 113 36.205 -1.449 3.015 818 H PHE 114 HN PHE 114 39.777 -1.570 -2.340 819 HA PHE 114 HA PHE 114 42.554 -1.465 -1.774 820 HB2 PHE 114 HB2 PHE 114 41.495 -3.302 -3.066 821 HB3 PHE 114 HB1 PHE 114 41.180 -2.176 -4.380 822 HD1 PHE 114 HD2 PHE 114 43.899 -3.767 -2.432 823 HD2 PHE 114 HD1 PHE 114 42.792 -1.753 -6.011 824 HE1 PHE 114 HE2 PHE 114 46.101 -4.282 -3.398 825 HE2 PHE 114 HE1 PHE 114 44.994 -2.261 -6.983 826 HZ PHE 114 HZ PHE 114 46.653 -3.529 -5.672 827 H SER 115 HN SER 115 40.396 0.569 -3.533 828 HA SER 115 HA SER 115 42.491 2.049 -4.870 829 HB2 SER 115 HB2 SER 115 40.089 1.704 -5.705 830 HB3 SER 115 HB1 SER 115 39.621 2.913 -4.518 831 HG SER 115 HG SER 115 41.602 3.341 -6.502 832 H HIS 116 HN HIS 116 41.470 1.799 -1.788 833 HA HIS 116 HA HIS 116 42.449 4.493 -1.127 834 HB2 HIS 116 HB2 HIS 116 39.945 4.359 -0.909 835 HB3 HIS 116 HB1 HIS 116 40.159 3.100 0.298 836 HD1 HIS 116 HD1 HIS 116 39.836 6.689 -0.075 837 HD2 HIS 116 HD2 HIS 116 41.565 4.114 2.698 838 HE1 HIS 116 HE1 HIS 116 40.144 8.048 2.022 839 HE2 HIS 116 HE2 HIS 116 41.041 6.424 3.728 840 HA PRO 117 HA PRO 117 45.072 1.064 0.731 841 HB2 PRO 117 HB2 PRO 117 47.116 3.003 0.817 842 HB3 PRO 117 HB1 PRO 117 46.980 1.662 -0.318 843 HG2 PRO 117 HG2 PRO 117 46.187 4.512 -0.625 844 HG3 PRO 117 HG1 PRO 117 46.796 3.375 -1.843 845 HD2 PRO 117 HD2 PRO 117 44.224 4.043 -1.783 846 HD3 PRO 117 HD1 PRO 117 44.713 2.371 -2.100 847 H GLU 118 HN GLU 118 45.173 4.490 1.476 848 HA GLU 118 HA GLU 118 44.276 4.248 4.130 849 HB2 GLU 118 HB2 GLU 118 46.479 5.145 5.104 850 HB3 GLU 118 HB1 GLU 118 46.365 3.423 4.791 851 HG2 GLU 118 HG2 GLU 118 47.559 3.760 2.674 852 HG3 GLU 118 HG1 GLU 118 47.719 5.472 3.051 853 H PHE 119 HN PHE 119 46.616 6.190 2.349 854 HA PHE 119 HA PHE 119 44.731 8.365 2.044 855 HB2 PHE 119 HB2 PHE 119 45.942 8.645 4.287 856 HB3 PHE 119 HB1 PHE 119 47.408 8.898 3.348 857 HD1 PHE 119 HD1 PHE 119 43.903 10.171 3.529 858 HD2 PHE 119 HD2 PHE 119 48.011 11.058 2.861 859 HE1 PHE 119 HE1 PHE 119 43.349 12.558 3.313 860 HE2 PHE 119 HE2 PHE 119 47.463 13.447 2.645 861 HZ PHE 119 HZ PHE 119 45.130 14.200 2.873 862 H GLU 120 HN GLU 120 46.123 6.403 0.414 863 HA GLU 120 HA GLU 120 47.172 6.218 -1.569 864 HB2 GLU 120 HB2 GLU 120 46.914 9.227 -1.560 865 HB3 GLU 120 HB1 GLU 120 47.438 8.279 -2.945 866 HG2 GLU 120 HG2 GLU 120 44.829 7.816 -1.571 867 HG3 GLU 120 HG1 GLU 120 45.007 8.957 -2.901 868 H GLU 121 HN GLU 121 49.161 8.049 -2.679 869 HA GLU 121 HA GLU 121 51.440 7.214 -1.170 870 HB2 GLU 121 HB2 GLU 121 52.728 8.482 -2.838 871 HB3 GLU 121 HB1 GLU 121 51.567 7.396 -3.595 872 HG2 GLU 121 HG2 GLU 121 50.042 9.298 -3.915 873 HG3 GLU 121 HG1 GLU 121 51.262 10.361 -3.213 874 H ASP 122 HN ASP 122 53.182 9.335 -1.231 875 HA ASP 122 HA ASP 122 52.406 10.806 1.042 876 HB2 ASP 122 HB2 ASP 122 54.764 10.313 0.549 877 HB3 ASP 122 HB1 ASP 122 54.682 11.363 -0.866 878 H SER 123 HN SER 123 50.727 12.118 0.888 879 HA SER 123 HA SER 123 50.336 13.777 -1.462 880 HB2 SER 123 HB2 SER 123 48.653 13.539 1.048 881 HB3 SER 123 HB1 SER 123 48.169 14.295 -0.472 882 HG SER 123 HG SER 123 48.965 11.578 -0.330 883 H ASP 124 HN ASP 124 49.855 16.088 -1.205 884 HA ASP 124 HA ASP 124 51.909 17.338 0.394 885 HB2 ASP 124 HB2 ASP 124 51.425 19.334 -0.833 886 HB3 ASP 124 HB1 ASP 124 51.378 17.996 -1.974 887 H PHE 125 HN PHE 125 48.936 16.335 1.163 888 HA PHE 125 HA PHE 125 47.982 18.653 2.588 889 HB2 PHE 125 HB2 PHE 125 46.424 17.024 1.537 890 HB3 PHE 125 HB1 PHE 125 46.985 15.796 2.667 891 HD1 PHE 125 HD2 PHE 125 45.428 19.173 2.573 892 HD2 PHE 125 HD1 PHE 125 45.901 15.510 4.687 893 HE1 PHE 125 HE2 PHE 125 43.728 19.894 4.194 894 HE2 PHE 125 HE1 PHE 125 44.199 16.226 6.317 895 HZ PHE 125 HZ PHE 125 43.096 18.418 6.058 896 H VAL 126 HN VAL 126 49.594 19.125 4.049 897 HA VAL 126 HA VAL 126 49.566 17.485 6.433 898 HB VAL 126 HB VAL 126 51.456 16.491 5.391 899 HG11 VAL 126 HG11 VAL 126 52.536 19.258 4.883 900 HG12 VAL 126 HG12 VAL 126 51.888 18.154 3.670 901 HG13 VAL 126 HG13 VAL 126 53.370 17.743 4.533 902 HG21 VAL 126 HG21 VAL 126 53.301 17.098 6.900 903 HG22 VAL 126 HG22 VAL 126 51.762 16.952 7.751 904 HG23 VAL 126 HG23 VAL 126 52.417 18.548 7.378 Start of MODEL 5 1 H1 ASP 1 HT1 ASP 1 -45.910 15.513 -3.678 2 H2 ASP 1 HT2 ASP 1 -44.553 14.663 -3.118 3 H3 ASP 1 HT3 ASP 1 -46.064 14.446 -2.375 4 HA ASP 1 HA ASP 1 -46.975 13.401 -4.248 5 HB2 ASP 1 HB2 ASP 1 -45.422 12.930 -6.238 6 HB3 ASP 1 HB1 ASP 1 -46.084 14.553 -6.087 7 H ILE 2 HN ILE 2 -43.472 12.698 -4.323 8 HA ILE 2 HA ILE 2 -44.078 10.158 -2.962 9 HB ILE 2 HB ILE 2 -42.134 10.455 -5.259 10 HG12 ILE 2 HG12 ILE 2 -44.915 9.256 -5.294 11 HG13 ILE 2 HG11 ILE 2 -44.471 10.797 -6.020 12 HG21 ILE 2 HG21 ILE 2 -43.300 7.969 -4.028 13 HG22 ILE 2 HG22 ILE 2 -41.750 8.660 -3.564 14 HG23 ILE 2 HG23 ILE 2 -41.992 8.072 -5.208 15 HD11 ILE 2 HD11 ILE 2 -43.416 8.097 -6.822 16 HD12 ILE 2 HD12 ILE 2 -42.970 9.637 -7.555 17 HD13 ILE 2 HD13 ILE 2 -44.626 9.043 -7.686 18 H ASP 3 HN ASP 3 -43.173 10.688 -0.991 19 HA ASP 3 HA ASP 3 -40.628 11.939 -0.731 20 HB2 ASP 3 HB2 ASP 3 -42.188 12.044 1.126 21 HB3 ASP 3 HB1 ASP 3 -42.209 10.286 1.247 22 H GLU 4 HN GLU 4 -39.118 10.874 -1.925 23 HA GLU 4 HA GLU 4 -38.767 8.059 -1.810 24 HB2 GLU 4 HB2 GLU 4 -37.005 10.255 -2.880 25 HB3 GLU 4 HB1 GLU 4 -36.648 8.538 -3.050 26 HG2 GLU 4 HG2 GLU 4 -38.809 8.242 -4.207 27 HG3 GLU 4 HG1 GLU 4 -39.054 9.988 -4.124 28 H SER 5 HN SER 5 -38.105 10.341 0.487 29 HA SER 5 HA SER 5 -35.627 9.541 1.515 30 HB2 SER 5 HB2 SER 5 -37.999 10.319 3.213 31 HB3 SER 5 HB1 SER 5 -36.292 10.596 3.542 32 HG SER 5 HG SER 5 -38.054 12.106 2.131 33 H SER 6 HN SER 6 -38.887 8.274 1.974 34 HA SER 6 HA SER 6 -38.306 6.344 3.924 35 HB2 SER 6 HB2 SER 6 -40.426 5.258 3.053 36 HB3 SER 6 HB1 SER 6 -40.577 6.948 3.536 37 HG SER 6 HG SER 6 -40.777 7.546 1.476 38 H VAL 7 HN VAL 7 -38.576 5.957 0.371 39 HA VAL 7 HA VAL 7 -37.918 3.230 0.375 40 HB VAL 7 HB VAL 7 -38.947 4.101 -1.591 41 HG11 VAL 7 HG11 VAL 7 -36.532 5.853 -1.920 42 HG12 VAL 7 HG12 VAL 7 -38.183 6.375 -1.588 43 HG13 VAL 7 HG13 VAL 7 -37.790 5.630 -3.137 44 HG21 VAL 7 HG21 VAL 7 -37.635 3.084 -3.270 45 HG22 VAL 7 HG22 VAL 7 -37.240 2.234 -1.768 46 HG23 VAL 7 HG23 VAL 7 -36.136 3.448 -2.416 47 H MET 8 HN MET 8 -35.899 6.101 0.111 48 HA MET 8 HA MET 8 -33.496 4.702 -0.371 49 HB2 MET 8 HB2 MET 8 -34.112 7.456 0.603 50 HB3 MET 8 HB1 MET 8 -32.463 6.856 0.708 51 HG2 MET 8 HG2 MET 8 -32.515 6.382 -1.701 52 HG3 MET 8 HG1 MET 8 -34.131 7.066 -1.783 53 HE1 MET 8 HE1 MET 8 -33.828 9.537 0.286 54 HE2 MET 8 HE2 MET 8 -34.660 9.654 -1.265 55 HE3 MET 8 HE3 MET 8 -33.420 10.831 -0.840 56 H GLN 9 HN GLN 9 -35.260 5.317 2.583 57 HA GLN 9 HA GLN 9 -33.125 4.607 4.324 58 HB2 GLN 9 HB2 GLN 9 -36.118 4.611 4.683 59 HB3 GLN 9 HB1 GLN 9 -35.010 4.134 5.966 60 HG2 GLN 9 HG2 GLN 9 -33.964 6.314 5.918 61 HG3 GLN 9 HG1 GLN 9 -34.987 6.799 4.569 62 HE21 GLN 9 HE21 GLN 9 -35.797 8.529 5.708 63 HE22 GLN 9 HE22 GLN 9 -36.962 8.337 6.976 64 H LEU 10 HN LEU 10 -35.691 2.758 2.718 65 HA LEU 10 HA LEU 10 -34.902 0.220 3.753 66 HB2 LEU 10 HB2 LEU 10 -36.022 0.623 1.005 67 HB3 LEU 10 HB1 LEU 10 -36.212 -0.757 2.054 68 HG LEU 10 HG LEU 10 -37.575 1.905 2.234 69 HD11 LEU 10 HD11 LEU 10 -38.648 -0.875 1.930 70 HD12 LEU 10 HD12 LEU 10 -38.402 0.276 0.614 71 HD13 LEU 10 HD13 LEU 10 -39.569 0.630 1.893 72 HD21 LEU 10 HD21 LEU 10 -38.828 0.692 4.147 73 HD22 LEU 10 HD22 LEU 10 -37.291 1.470 4.482 74 HD23 LEU 10 HD23 LEU 10 -37.358 -0.278 4.270 75 H ALA 11 HN ALA 11 -34.075 2.117 0.950 76 HA ALA 11 HA ALA 11 -32.438 0.284 -0.392 77 HB1 ALA 11 HB1 ALA 11 -31.933 3.227 -0.517 78 HB2 ALA 11 HB2 ALA 11 -33.446 2.564 -1.139 79 HB3 ALA 11 HB3 ALA 11 -31.898 2.028 -1.812 80 H GLU 12 HN GLU 12 -31.652 2.730 2.036 81 HA GLU 12 HA GLU 12 -28.861 2.505 1.943 82 HB2 GLU 12 HB2 GLU 12 -30.741 3.395 4.093 83 HB3 GLU 12 HB1 GLU 12 -29.005 3.372 4.350 84 HG2 GLU 12 HG2 GLU 12 -30.447 4.914 2.208 85 HG3 GLU 12 HG1 GLU 12 -29.814 5.580 3.713 86 H MET 13 HN MET 13 -31.226 0.485 3.584 87 HA MET 13 HA MET 13 -29.199 -0.777 5.214 88 HB2 MET 13 HB2 MET 13 -30.930 -2.174 6.093 89 HB3 MET 13 HB1 MET 13 -31.547 -0.532 6.010 90 HG2 MET 13 HG2 MET 13 -32.795 -1.059 4.024 91 HG3 MET 13 HG1 MET 13 -32.098 -2.676 3.992 92 HE1 MET 13 HE1 MET 13 -34.489 -0.204 5.864 93 HE2 MET 13 HE2 MET 13 -33.342 -0.629 7.131 94 HE3 MET 13 HE3 MET 13 -35.017 -1.170 7.242 95 H GLY 14 HN GLY 14 -30.069 -0.959 2.041 96 HA2 GLY 14 HA2 GLY 14 -28.700 -2.208 0.573 97 HA3 GLY 14 HA1 GLY 14 -28.547 -3.455 1.801 98 H PHE 15 HN PHE 15 -31.376 -1.864 0.386 99 HA PHE 15 HA PHE 15 -32.044 -4.334 -1.010 100 HB2 PHE 15 HB2 PHE 15 -33.911 -2.968 0.926 101 HB3 PHE 15 HB1 PHE 15 -34.446 -4.127 -0.275 102 HD1 PHE 15 HD2 PHE 15 -33.300 -6.456 -0.204 103 HD2 PHE 15 HD1 PHE 15 -33.305 -3.692 3.032 104 HE1 PHE 15 HE2 PHE 15 -32.819 -8.289 1.359 105 HE2 PHE 15 HE1 PHE 15 -32.824 -5.526 4.601 106 HZ PHE 15 HZ PHE 15 -32.630 -7.843 3.764 107 HA PRO 16 HA PRO 16 -32.994 -1.243 -4.094 108 HB2 PRO 16 HB2 PRO 16 -33.579 -2.957 -6.066 109 HB3 PRO 16 HB1 PRO 16 -31.918 -2.772 -5.485 110 HG2 PRO 16 HG2 PRO 16 -33.952 -4.865 -4.751 111 HG3 PRO 16 HG1 PRO 16 -32.256 -5.090 -5.241 112 HD2 PRO 16 HD2 PRO 16 -33.017 -5.082 -2.639 113 HD3 PRO 16 HD1 PRO 16 -31.440 -4.455 -3.173 114 H LEU 17 HN LEU 17 -34.965 -0.914 -2.489 115 HA LEU 17 HA LEU 17 -37.324 -2.338 -3.439 116 HB2 LEU 17 HB2 LEU 17 -37.025 -0.609 -0.966 117 HB3 LEU 17 HB1 LEU 17 -38.457 -1.515 -1.430 118 HG LEU 17 HG LEU 17 -35.771 -2.718 -0.745 119 HD11 LEU 17 HD11 LEU 17 -38.392 -2.791 0.737 120 HD12 LEU 17 HD12 LEU 17 -36.965 -1.867 1.205 121 HD13 LEU 17 HD13 LEU 17 -36.911 -3.629 1.199 122 HD21 LEU 17 HD21 LEU 17 -38.374 -4.057 -1.462 123 HD22 LEU 17 HD22 LEU 17 -36.903 -4.871 -0.928 124 HD23 LEU 17 HD23 LEU 17 -36.925 -4.004 -2.465 125 H GLU 18 HN GLU 18 -36.648 -0.707 -5.398 126 HA GLU 18 HA GLU 18 -37.903 1.767 -5.461 127 HB2 GLU 18 HB2 GLU 18 -36.645 0.413 -7.347 128 HB3 GLU 18 HB1 GLU 18 -38.284 -0.071 -7.777 129 HG2 GLU 18 HG2 GLU 18 -38.925 2.323 -7.863 130 HG3 GLU 18 HG1 GLU 18 -37.235 2.725 -7.556 131 H ALA 19 HN ALA 19 -39.215 -1.404 -5.219 132 HA ALA 19 HA ALA 19 -41.885 -0.970 -5.889 133 HB1 ALA 19 HB1 ALA 19 -42.378 -2.830 -4.368 134 HB2 ALA 19 HB2 ALA 19 -40.757 -2.703 -3.688 135 HB3 ALA 19 HB3 ALA 19 -40.971 -3.179 -5.372 136 H CYS 20 HN CYS 20 -39.992 -0.006 -3.128 137 HA CYS 20 HA CYS 20 -42.166 0.923 -1.510 138 HB2 CYS 20 HB2 CYS 20 -39.837 0.451 -0.617 139 HB3 CYS 20 HB1 CYS 20 -39.301 1.895 -1.454 140 HG CYS 20 HG CYS 20 -41.318 3.460 -0.001 141 H ARG 21 HN ARG 21 -39.840 2.406 -3.732 142 HA ARG 21 HA ARG 21 -40.749 5.026 -3.662 143 HB2 ARG 21 HB2 ARG 21 -38.798 4.537 -4.928 144 HB3 ARG 21 HB1 ARG 21 -39.650 3.387 -5.943 145 HG2 ARG 21 HG2 ARG 21 -40.467 4.974 -7.304 146 HG3 ARG 21 HG1 ARG 21 -40.643 6.157 -6.007 147 HD2 ARG 21 HD2 ARG 21 -38.951 6.912 -7.549 148 HD3 ARG 21 HD1 ARG 21 -38.192 6.478 -6.020 149 HE ARG 21 HE ARG 21 -38.224 4.515 -8.197 150 HH11 ARG 21 HH11 ARG 21 -36.430 6.827 -6.266 151 HH12 ARG 21 HH12 ARG 21 -34.883 6.117 -6.626 152 HH21 ARG 21 HH21 ARG 21 -36.164 3.612 -8.724 153 HH22 ARG 21 HH22 ARG 21 -34.725 4.312 -8.032 154 H LYS 22 HN LYS 22 -42.040 2.307 -5.499 155 HA LYS 22 HA LYS 22 -44.172 3.752 -6.725 156 HB2 LYS 22 HB2 LYS 22 -44.066 0.782 -6.168 157 HB3 LYS 22 HB1 LYS 22 -44.962 1.599 -7.442 158 HG2 LYS 22 HG2 LYS 22 -42.956 2.126 -8.608 159 HG3 LYS 22 HG1 LYS 22 -41.964 1.597 -7.247 160 HD2 LYS 22 HD2 LYS 22 -43.221 -0.676 -7.625 161 HD3 LYS 22 HD1 LYS 22 -43.459 -0.022 -9.249 162 HE2 LYS 22 HE2 LYS 22 -41.001 0.405 -9.334 163 HE3 LYS 22 HE1 LYS 22 -40.853 -0.484 -7.816 164 HZ1 LYS 22 HZ1 LYS 22 -40.394 -1.888 -9.749 165 HZ2 LYS 22 HZ2 LYS 22 -41.941 -1.577 -10.358 166 HZ3 LYS 22 HZ3 LYS 22 -41.764 -2.437 -8.911 167 H ALA 23 HN ALA 23 -43.845 1.803 -3.809 168 HA ALA 23 HA ALA 23 -46.531 1.749 -3.009 169 HB1 ALA 23 HB1 ALA 23 -45.661 1.228 -0.779 170 HB2 ALA 23 HB2 ALA 23 -44.041 1.691 -1.307 171 HB3 ALA 23 HB3 ALA 23 -44.841 0.297 -2.033 172 H VAL 24 HN VAL 24 -43.937 4.032 -2.261 173 HA VAL 24 HA VAL 24 -45.354 5.719 -0.542 174 HB VAL 24 HB VAL 24 -43.172 6.440 -2.514 175 HG11 VAL 24 HG11 VAL 24 -42.765 8.405 -1.189 176 HG12 VAL 24 HG12 VAL 24 -44.055 7.959 -0.066 177 HG13 VAL 24 HG13 VAL 24 -44.447 8.404 -1.727 178 HG21 VAL 24 HG21 VAL 24 -41.674 6.246 -0.592 179 HG22 VAL 24 HG22 VAL 24 -42.488 4.721 -0.941 180 HG23 VAL 24 HG23 VAL 24 -43.029 5.722 0.407 181 H TYR 25 HN TYR 25 -44.946 5.930 -4.089 182 HA TYR 25 HA TYR 25 -46.692 8.025 -4.602 183 HB2 TYR 25 HB2 TYR 25 -45.462 7.181 -6.434 184 HB3 TYR 25 HB1 TYR 25 -46.022 5.534 -6.164 185 HD1 TYR 25 HD2 TYR 25 -47.315 8.918 -7.064 186 HD2 TYR 25 HD1 TYR 25 -47.754 4.708 -7.478 187 HE1 TYR 25 HE2 TYR 25 -49.078 9.273 -8.739 188 HE2 TYR 25 HE1 TYR 25 -49.523 5.053 -9.150 189 HH TYR 25 HH TYR 25 -50.130 8.134 -10.563 190 H PHE 26 HN PHE 26 -47.461 4.574 -4.219 191 HA PHE 26 HA PHE 26 -50.223 4.846 -4.792 192 HB2 PHE 26 HB2 PHE 26 -49.023 2.707 -4.992 193 HB3 PHE 26 HB1 PHE 26 -48.806 2.665 -3.245 194 HD1 PHE 26 HD2 PHE 26 -51.413 2.734 -5.887 195 HD2 PHE 26 HD1 PHE 26 -50.424 1.687 -1.881 196 HE1 PHE 26 HE2 PHE 26 -53.576 1.585 -5.658 197 HE2 PHE 26 HE1 PHE 26 -52.585 0.537 -1.647 198 HZ PHE 26 HZ PHE 26 -54.165 0.483 -3.534 199 H THR 27 HN THR 27 -48.408 4.860 -1.739 200 HA THR 27 HA THR 27 -50.693 4.847 -0.063 201 HB THR 27 HB THR 27 -49.148 5.740 1.716 202 HG1 THR 27 HG1 THR 27 -47.125 5.359 -0.246 203 HG21 THR 27 HG21 THR 27 -48.088 3.354 0.219 204 HG22 THR 27 HG22 THR 27 -49.491 3.317 1.282 205 HG23 THR 27 HG23 THR 27 -47.899 3.699 1.935 206 H GLY 28 HN GLY 28 -49.394 7.225 -2.075 207 HA2 GLY 28 HA2 GLY 28 -50.139 9.386 -2.467 208 HA3 GLY 28 HA1 GLY 28 -51.204 9.237 -1.073 209 H ASN 29 HN ASN 29 -47.802 8.546 -0.957 210 HA ASN 29 HA ASN 29 -46.116 9.340 0.314 211 HB2 ASN 29 HB2 ASN 29 -46.285 11.304 -1.167 212 HB3 ASN 29 HB1 ASN 29 -47.453 12.029 -0.066 213 HD21 ASN 29 HD21 ASN 29 -46.034 13.818 0.180 214 HD22 ASN 29 HD22 ASN 29 -44.633 13.709 1.193 215 H MET 30 HN MET 30 -47.205 8.072 1.994 216 HA MET 30 HA MET 30 -48.328 9.735 4.130 217 HB2 MET 30 HB2 MET 30 -48.417 6.786 3.575 218 HB3 MET 30 HB1 MET 30 -48.824 7.423 5.163 219 HG2 MET 30 HG2 MET 30 -50.177 8.080 2.557 220 HG3 MET 30 HG1 MET 30 -50.825 7.093 3.867 221 HE1 MET 30 HE1 MET 30 -53.028 10.364 3.919 222 HE2 MET 30 HE2 MET 30 -53.050 8.606 3.781 223 HE3 MET 30 HE3 MET 30 -52.327 9.581 2.501 224 H GLY 31 HN GLY 31 -45.436 9.320 3.265 225 HA2 GLY 31 HA2 GLY 31 -43.541 9.786 4.533 226 HA3 GLY 31 HA1 GLY 31 -44.439 9.369 5.982 227 H ALA 32 HN ALA 32 -42.114 8.462 6.197 228 HA ALA 32 HA ALA 32 -41.445 6.086 4.801 229 HB1 ALA 32 HB1 ALA 32 -40.368 7.052 7.446 230 HB2 ALA 32 HB2 ALA 32 -39.777 7.556 5.863 231 HB3 ALA 32 HB3 ALA 32 -39.620 5.874 6.367 232 H GLU 33 HN GLU 33 -43.104 6.723 7.847 233 HA GLU 33 HA GLU 33 -42.925 4.207 9.030 234 HB2 GLU 33 HB2 GLU 33 -45.349 6.012 9.116 235 HB3 GLU 33 HB1 GLU 33 -44.908 4.788 10.295 236 HG2 GLU 33 HG2 GLU 33 -43.396 7.325 9.725 237 HG3 GLU 33 HG1 GLU 33 -44.442 7.026 11.110 238 H VAL 34 HN VAL 34 -45.516 5.485 6.993 239 HA VAL 34 HA VAL 34 -47.021 3.112 6.933 240 HB VAL 34 HB VAL 34 -47.068 5.511 5.098 241 HG11 VAL 34 HG11 VAL 34 -48.931 3.159 5.312 242 HG12 VAL 34 HG12 VAL 34 -48.100 3.772 3.882 243 HG13 VAL 34 HG13 VAL 34 -49.409 4.701 4.604 244 HG21 VAL 34 HG21 VAL 34 -47.569 6.025 7.420 245 HG22 VAL 34 HG22 VAL 34 -48.773 4.739 7.459 246 HG23 VAL 34 HG23 VAL 34 -49.025 6.151 6.433 247 H ALA 35 HN ALA 35 -44.577 4.409 4.717 248 HA ALA 35 HA ALA 35 -45.123 2.417 2.741 249 HB1 ALA 35 HB1 ALA 35 -44.223 4.691 2.232 250 HB2 ALA 35 HB2 ALA 35 -43.401 3.335 1.460 251 HB3 ALA 35 HB3 ALA 35 -42.666 4.130 2.854 252 H PHE 36 HN PHE 36 -42.683 2.781 5.293 253 HA PHE 36 HA PHE 36 -41.108 0.555 4.632 254 HB2 PHE 36 HB2 PHE 36 -40.366 2.035 6.373 255 HB3 PHE 36 HB1 PHE 36 -41.822 1.745 7.325 256 HD1 PHE 36 HD2 PHE 36 -38.635 0.287 6.178 257 HD2 PHE 36 HD1 PHE 36 -41.988 -0.149 8.759 258 HE1 PHE 36 HE2 PHE 36 -37.472 -1.517 7.380 259 HE2 PHE 36 HE1 PHE 36 -40.829 -1.952 9.969 260 HZ PHE 36 HZ PHE 36 -38.556 -2.631 9.282 261 H ASN 37 HN ASN 37 -44.107 0.850 6.490 262 HA ASN 37 HA ASN 37 -44.390 -1.925 7.010 263 HB2 ASN 37 HB2 ASN 37 -46.265 0.416 7.098 264 HB3 ASN 37 HB1 ASN 37 -46.870 -1.223 7.294 265 HD21 ASN 37 HD21 ASN 37 -45.033 1.330 8.723 266 HD22 ASN 37 HD22 ASN 37 -44.846 0.596 10.285 267 H TRP 38 HN TRP 38 -45.458 0.198 4.397 268 HA TRP 38 HA TRP 38 -47.206 -1.660 3.190 269 HB2 TRP 38 HB2 TRP 38 -46.781 0.940 2.750 270 HB3 TRP 38 HB1 TRP 38 -45.733 0.303 1.483 271 HD1 TRP 38 HD1 TRP 38 -49.362 0.784 2.397 272 HE1 TRP 38 HE1 TRP 38 -50.862 0.067 0.435 273 HE3 TRP 38 HE3 TRP 38 -45.819 -1.420 -0.560 274 HZ2 TRP 38 HZ2 TRP 38 -50.577 -1.258 -2.039 275 HZ3 TRP 38 HZ3 TRP 38 -46.520 -2.394 -2.706 276 HH2 TRP 38 HH2 TRP 38 -48.851 -2.316 -3.433 277 H ILE 39 HN ILE 39 -43.756 -1.066 2.913 278 HA ILE 39 HA ILE 39 -43.414 -2.780 0.667 279 HB ILE 39 HB ILE 39 -41.842 -0.875 1.562 280 HG12 ILE 39 HG12 ILE 39 -39.977 -1.901 0.296 281 HG13 ILE 39 HG11 ILE 39 -40.819 -3.450 0.363 282 HG21 ILE 39 HG21 ILE 39 -40.522 -3.272 2.823 283 HG22 ILE 39 HG22 ILE 39 -41.380 -2.027 3.732 284 HG23 ILE 39 HG23 ILE 39 -39.933 -1.606 2.807 285 HD11 ILE 39 HD11 ILE 39 -41.565 -0.978 -1.144 286 HD12 ILE 39 HD12 ILE 39 -42.744 -2.239 -0.801 287 HD13 ILE 39 HD13 ILE 39 -41.306 -2.614 -1.751 288 H ILE 40 HN ILE 40 -43.096 -3.245 4.173 289 HA ILE 40 HA ILE 40 -42.004 -5.856 3.886 290 HB ILE 40 HB ILE 40 -42.478 -6.172 6.264 291 HG12 ILE 40 HG12 ILE 40 -43.232 -3.943 7.446 292 HG13 ILE 40 HG11 ILE 40 -44.053 -3.659 5.915 293 HG21 ILE 40 HG21 ILE 40 -41.223 -3.922 6.940 294 HG22 ILE 40 HG22 ILE 40 -41.038 -3.825 5.193 295 HG23 ILE 40 HG23 ILE 40 -40.427 -5.231 6.064 296 HD11 ILE 40 HD11 ILE 40 -44.455 -5.968 7.796 297 HD12 ILE 40 HD12 ILE 40 -45.179 -5.853 6.193 298 HD13 ILE 40 HD13 ILE 40 -45.593 -4.666 7.435 299 H VAL 41 HN VAL 41 -45.198 -4.599 3.789 300 HA VAL 41 HA VAL 41 -46.525 -7.120 3.991 301 HB VAL 41 HB VAL 41 -47.435 -4.508 2.769 302 HG11 VAL 41 HG11 VAL 41 -48.629 -6.371 1.737 303 HG12 VAL 41 HG12 VAL 41 -49.693 -5.443 2.795 304 HG13 VAL 41 HG13 VAL 41 -49.048 -6.993 3.334 305 HG21 VAL 41 HG21 VAL 41 -48.087 -5.833 5.400 306 HG22 VAL 41 HG22 VAL 41 -48.814 -4.343 4.797 307 HG23 VAL 41 HG23 VAL 41 -47.091 -4.393 5.171 308 H HIS 42 HN HIS 42 -45.314 -5.147 1.295 309 HA HIS 42 HA HIS 42 -46.258 -7.179 -0.608 310 HB2 HIS 42 HB2 HIS 42 -46.756 -4.662 -0.812 311 HB3 HIS 42 HB1 HIS 42 -45.075 -4.492 -1.291 312 HD1 HIS 42 HD1 HIS 42 -44.920 -4.271 -3.741 313 HD2 HIS 42 HD2 HIS 42 -47.960 -6.884 -2.632 314 HE1 HIS 42 HE1 HIS 42 -45.933 -5.088 -5.893 315 HE2 HIS 42 HE2 HIS 42 -47.860 -6.551 -5.199 316 H MET 43 HN MET 43 -43.678 -7.022 1.179 317 HA MET 43 HA MET 43 -41.502 -6.937 -0.647 318 HB2 MET 43 HB2 MET 43 -40.105 -7.619 1.178 319 HB3 MET 43 HB1 MET 43 -41.277 -6.457 1.779 320 HG2 MET 43 HG2 MET 43 -42.612 -8.304 2.697 321 HG3 MET 43 HG1 MET 43 -41.396 -9.444 2.125 322 HE1 MET 43 HE1 MET 43 -41.228 -10.441 4.584 323 HE2 MET 43 HE2 MET 43 -42.406 -9.271 5.179 324 HE3 MET 43 HE3 MET 43 -40.865 -9.473 6.012 325 H GLU 44 HN GLU 44 -43.721 -9.396 0.203 326 HA GLU 44 HA GLU 44 -42.048 -11.635 -0.314 327 HB2 GLU 44 HB2 GLU 44 -44.245 -12.878 -0.507 328 HB3 GLU 44 HB1 GLU 44 -43.949 -12.055 1.020 329 HG2 GLU 44 HG2 GLU 44 -45.390 -10.220 0.310 330 HG3 GLU 44 HG1 GLU 44 -45.679 -11.040 -1.225 331 H GLU 45 HN GLU 45 -43.030 -9.294 -2.367 332 HA GLU 45 HA GLU 45 -43.116 -11.005 -4.734 333 HB2 GLU 45 HB2 GLU 45 -42.965 -7.991 -4.618 334 HB3 GLU 45 HB1 GLU 45 -43.465 -8.982 -5.978 335 HG2 GLU 45 HG2 GLU 45 -44.956 -8.655 -3.398 336 HG3 GLU 45 HG1 GLU 45 -45.342 -7.863 -4.917 337 HA PRO 46 HA PRO 46 -38.651 -10.929 -4.006 338 HB2 PRO 46 HB2 PRO 46 -38.033 -12.583 -6.120 339 HB3 PRO 46 HB1 PRO 46 -38.527 -13.152 -4.517 340 HG2 PRO 46 HG2 PRO 46 -40.161 -12.804 -7.003 341 HG3 PRO 46 HG1 PRO 46 -40.182 -14.138 -5.830 342 HD2 PRO 46 HD2 PRO 46 -42.069 -12.253 -5.798 343 HD3 PRO 46 HD1 PRO 46 -41.418 -12.914 -4.283 344 H ASP 47 HN ASP 47 -40.007 -10.634 -7.261 345 HA ASP 47 HA ASP 47 -37.624 -9.102 -8.047 346 HB2 ASP 47 HB2 ASP 47 -37.775 -11.309 -9.083 347 HB3 ASP 47 HB1 ASP 47 -39.382 -10.941 -9.682 348 H PHE 48 HN PHE 48 -40.508 -8.432 -7.036 349 HA PHE 48 HA PHE 48 -41.455 -6.769 -9.220 350 HB2 PHE 48 HB2 PHE 48 -42.524 -7.370 -6.465 351 HB3 PHE 48 HB1 PHE 48 -43.161 -6.028 -7.417 352 HD1 PHE 48 HD2 PHE 48 -42.405 -9.670 -7.763 353 HD2 PHE 48 HD1 PHE 48 -44.945 -6.415 -8.799 354 HE1 PHE 48 HE2 PHE 48 -43.894 -11.217 -8.966 355 HE2 PHE 48 HE1 PHE 48 -46.438 -7.958 -9.996 356 HZ PHE 48 HZ PHE 48 -45.914 -10.363 -10.081 357 H ALA 49 HN ALA 49 -39.243 -6.482 -6.717 358 HA ALA 49 HA ALA 49 -39.498 -3.626 -6.354 359 HB1 ALA 49 HB1 ALA 49 -38.688 -4.797 -4.465 360 HB2 ALA 49 HB2 ALA 49 -37.292 -3.936 -5.126 361 HB3 ALA 49 HB3 ALA 49 -37.489 -5.661 -5.428 362 H GLU 50 HN GLU 50 -36.416 -5.001 -6.880 363 HA GLU 50 HA GLU 50 -36.202 -3.942 -9.600 364 HB2 GLU 50 HB2 GLU 50 -34.262 -3.413 -7.334 365 HB3 GLU 50 HB1 GLU 50 -33.886 -3.128 -9.027 366 HG2 GLU 50 HG2 GLU 50 -35.687 -1.491 -9.159 367 HG3 GLU 50 HG1 GLU 50 -36.084 -1.786 -7.468 368 HA PRO 51 HA PRO 51 -34.199 -7.798 -10.596 369 HB2 PRO 51 HB2 PRO 51 -31.875 -6.163 -11.522 370 HB3 PRO 51 HB1 PRO 51 -32.739 -7.462 -12.357 371 HG2 PRO 51 HG2 PRO 51 -33.155 -4.918 -13.019 372 HG3 PRO 51 HG1 PRO 51 -34.491 -6.083 -12.982 373 HD2 PRO 51 HD2 PRO 51 -33.817 -3.906 -11.058 374 HD3 PRO 51 HD1 PRO 51 -35.402 -4.548 -11.534 375 H LEU 52 HN LEU 52 -33.391 -9.023 -9.048 376 HA LEU 52 HA LEU 52 -32.487 -8.132 -6.653 377 HB2 LEU 52 HB2 LEU 52 -32.138 -10.779 -8.007 378 HB3 LEU 52 HB1 LEU 52 -31.470 -10.502 -6.410 379 HG LEU 52 HG LEU 52 -33.579 -11.602 -6.167 380 HD11 LEU 52 HD11 LEU 52 -34.827 -9.994 -4.816 381 HD12 LEU 52 HD12 LEU 52 -33.861 -8.684 -5.498 382 HD13 LEU 52 HD13 LEU 52 -33.094 -9.921 -4.501 383 HD21 LEU 52 HD21 LEU 52 -34.559 -11.067 -8.313 384 HD22 LEU 52 HD22 LEU 52 -34.766 -9.393 -7.810 385 HD23 LEU 52 HD23 LEU 52 -35.672 -10.669 -7.000 386 H THR 53 HN THR 53 -30.898 -6.664 -6.595 387 HA THR 53 HA THR 53 -28.190 -7.735 -6.800 388 HB THR 53 HB THR 53 -28.770 -4.944 -7.798 389 HG1 THR 53 HG1 THR 53 -29.877 -6.573 -9.111 390 HG21 THR 53 HG21 THR 53 -26.599 -5.229 -8.914 391 HG22 THR 53 HG22 THR 53 -26.469 -6.855 -8.242 392 HG23 THR 53 HG23 THR 53 -26.463 -5.455 -7.168 393 H MET 54 HN MET 54 -29.110 -7.755 -4.454 394 HA MET 54 HA MET 54 -29.326 -5.218 -3.135 395 HB2 MET 54 HB2 MET 54 -29.513 -6.503 -1.064 396 HB3 MET 54 HB1 MET 54 -30.585 -7.133 -2.305 397 HG2 MET 54 HG2 MET 54 -29.088 -8.977 -2.718 398 HG3 MET 54 HG1 MET 54 -27.912 -8.316 -1.584 399 HE1 MET 54 HE1 MET 54 -27.858 -10.738 -0.441 400 HE2 MET 54 HE2 MET 54 -29.106 -11.331 -1.537 401 HE3 MET 54 HE3 MET 54 -29.286 -11.548 0.206 402 HA PRO 55 HA PRO 55 -24.966 -4.761 -2.484 403 HB2 PRO 55 HB2 PRO 55 -25.465 -2.365 -0.989 404 HB3 PRO 55 HB1 PRO 55 -24.934 -2.509 -2.664 405 HG2 PRO 55 HG2 PRO 55 -27.390 -1.526 -1.884 406 HG3 PRO 55 HG1 PRO 55 -27.042 -2.210 -3.481 407 HD2 PRO 55 HD2 PRO 55 -28.374 -3.479 -1.118 408 HD3 PRO 55 HD1 PRO 55 -28.764 -3.626 -2.846 409 H GLY 56 HN GLY 56 -27.296 -5.300 -0.115 410 HA2 GLY 56 HA2 GLY 56 -27.166 -6.086 2.039 411 HA3 GLY 56 HA1 GLY 56 -25.433 -6.260 1.802 412 H TYR 57 HN TYR 57 -25.345 -5.529 4.061 413 HA TYR 57 HA TYR 57 -25.492 -2.589 4.191 414 HB2 TYR 57 HB2 TYR 57 -26.982 -3.852 5.802 415 HB3 TYR 57 HB1 TYR 57 -25.520 -4.468 6.568 416 HD1 TYR 57 HD1 TYR 57 -26.541 -1.080 5.336 417 HD2 TYR 57 HD2 TYR 57 -25.200 -3.447 8.607 418 HE1 TYR 57 HE1 TYR 57 -26.451 0.929 6.751 419 HE2 TYR 57 HE2 TYR 57 -25.104 -1.445 10.026 420 HH TYR 57 HH TYR 57 -25.055 0.862 9.955 421 H GLY 58 HN GLY 58 -23.410 -4.613 3.278 422 HA2 GLY 58 HA2 GLY 58 -21.186 -3.715 4.984 423 HA3 GLY 58 HA1 GLY 58 -21.124 -5.062 3.852 424 H GLY 59 HN GLY 59 -20.906 -1.614 4.226 425 HA2 GLY 59 HA2 GLY 59 -20.568 -1.273 1.326 426 HA3 GLY 59 HA1 GLY 59 -20.858 0.018 2.483 427 H ALA 60 HN ALA 60 -18.750 -0.552 0.395 428 HA ALA 60 HA ALA 60 -16.601 0.051 0.063 429 HB1 ALA 60 HB1 ALA 60 -17.151 1.971 1.475 430 HB2 ALA 60 HB2 ALA 60 -15.473 1.467 1.677 431 HB3 ALA 60 HB3 ALA 60 -16.672 1.055 2.903 432 H ALA 61 HN ALA 61 -14.291 -0.119 1.241 433 HA ALA 61 HA ALA 61 -13.990 -2.460 2.882 434 HB1 ALA 61 HB1 ALA 61 -14.326 -3.511 0.706 435 HB2 ALA 61 HB2 ALA 61 -12.660 -3.719 1.243 436 HB3 ALA 61 HB3 ALA 61 -13.045 -2.518 0.012 437 H SER 62 HN SER 62 -11.882 -2.636 3.717 438 HA SER 62 HA SER 62 -10.459 -0.153 3.787 439 HB2 SER 62 HB2 SER 62 -8.912 -1.518 5.313 440 HB3 SER 62 HB1 SER 62 -10.581 -1.305 5.843 441 HG SER 62 HG SER 62 -9.229 -3.584 5.235 442 H ALA 63 HN ALA 63 -9.140 0.445 2.242 443 HA ALA 63 HA ALA 63 -7.655 -1.568 0.707 444 HB1 ALA 63 HB1 ALA 63 -8.998 0.059 -0.558 445 HB2 ALA 63 HB2 ALA 63 -7.278 0.202 -0.919 446 HB3 ALA 63 HB3 ALA 63 -8.053 1.373 0.147 447 H GLY 64 HN GLY 64 -5.376 -1.067 0.165 448 HA2 GLY 64 HA2 GLY 64 -4.020 0.659 2.098 449 HA3 GLY 64 HA1 GLY 64 -3.655 -1.058 2.170 450 H ALA 65 HN ALA 65 -3.006 1.900 0.632 451 HA ALA 65 HA ALA 65 -1.502 0.642 -1.530 452 HB1 ALA 65 HB1 ALA 65 -2.857 2.596 -2.080 453 HB2 ALA 65 HB2 ALA 65 -1.143 2.929 -2.328 454 HB3 ALA 65 HB3 ALA 65 -1.966 3.556 -0.900 455 H SER 66 HN SER 66 0.592 2.509 -1.754 456 HA SER 66 HA SER 66 2.468 1.432 0.046 457 HB2 SER 66 HB2 SER 66 2.695 3.932 -1.645 458 HB3 SER 66 HB1 SER 66 4.038 3.047 -0.920 459 HG SER 66 HG SER 66 3.158 2.652 -3.270 460 H VAL 67 HN VAL 67 2.536 1.812 2.147 461 HA VAL 67 HA VAL 67 1.742 4.460 3.148 462 HB VAL 67 HB VAL 67 1.644 3.316 5.393 463 HG11 VAL 67 HG11 VAL 67 -0.376 3.738 4.116 464 HG12 VAL 67 HG12 VAL 67 -0.492 2.177 4.929 465 HG13 VAL 67 HG13 VAL 67 -0.137 2.250 3.202 466 HG21 VAL 67 HG21 VAL 67 1.924 0.817 3.722 467 HG22 VAL 67 HG22 VAL 67 1.533 0.878 5.441 468 HG23 VAL 67 HG23 VAL 67 3.110 1.425 4.877 469 H PHE 68 HN PHE 68 4.113 4.549 1.998 470 HA PHE 68 HA PHE 68 6.218 5.329 2.287 471 HB2 PHE 68 HB2 PHE 68 5.493 6.520 4.280 472 HB3 PHE 68 HB1 PHE 68 5.634 5.056 5.245 473 HD1 PHE 68 HD2 PHE 68 7.580 7.528 3.296 474 HD2 PHE 68 HD1 PHE 68 7.676 4.450 6.239 475 HE1 PHE 68 HE2 PHE 68 9.914 8.104 3.819 476 HE2 PHE 68 HE1 PHE 68 10.012 5.021 6.762 477 HZ PHE 68 HZ PHE 68 11.131 6.845 5.555 478 H GLY 69 HN GLY 69 8.245 4.436 2.279 479 HA2 GLY 69 HA2 GLY 69 8.793 1.995 3.728 480 HA3 GLY 69 HA1 GLY 69 8.680 1.795 1.984 481 H ALA 70 HN ALA 70 11.017 1.241 3.369 482 HA ALA 70 HA ALA 70 12.808 3.492 3.068 483 HB1 ALA 70 HB1 ALA 70 13.138 1.866 4.880 484 HB2 ALA 70 HB2 ALA 70 14.544 1.967 3.821 485 HB3 ALA 70 HB3 ALA 70 13.433 0.605 3.683 486 H SER 71 HN SER 71 13.502 4.089 1.133 487 HA SER 71 HA SER 71 13.399 2.282 -1.124 488 HB2 SER 71 HB2 SER 71 14.399 5.136 -1.004 489 HB3 SER 71 HB1 SER 71 13.939 4.235 -2.451 490 HG SER 71 HG SER 71 12.391 5.681 -0.825 491 H GLY 72 HN GLY 72 15.228 1.281 0.661 492 HA2 GLY 72 HA2 GLY 72 17.365 0.446 0.730 493 HA3 GLY 72 HA1 GLY 72 17.550 1.024 -0.919 494 H LEU 73 HN LEU 73 17.741 1.978 2.473 495 HA LEU 73 HA LEU 73 19.138 4.431 1.757 496 HB2 LEU 73 HB2 LEU 73 18.006 3.329 4.294 497 HB3 LEU 73 HB1 LEU 73 19.212 4.597 4.367 498 HG LEU 73 HG LEU 73 16.985 5.543 4.528 499 HD11 LEU 73 HD11 LEU 73 18.705 6.851 3.419 500 HD12 LEU 73 HD12 LEU 73 17.119 7.166 2.713 501 HD13 LEU 73 HD13 LEU 73 18.270 6.130 1.868 502 HD21 LEU 73 HD21 LEU 73 15.308 5.303 2.889 503 HD22 LEU 73 HD22 LEU 73 15.909 3.673 3.201 504 HD23 LEU 73 HD23 LEU 73 16.421 4.534 1.754 505 H ASP 74 HN ASP 74 20.135 1.499 1.648 506 HA ASP 74 HA ASP 74 22.380 1.564 3.476 507 HB2 ASP 74 HB2 ASP 74 21.496 -0.494 1.447 508 HB3 ASP 74 HB1 ASP 74 22.886 -0.685 2.511 509 H ASN 75 HN ASN 75 24.221 2.457 2.990 510 HA ASN 75 HA ASN 75 25.182 2.403 0.220 511 HB2 ASN 75 HB2 ASN 75 26.017 4.693 0.419 512 HB3 ASN 75 HB1 ASN 75 24.275 4.663 0.659 513 HD21 ASN 75 HD21 ASN 75 26.420 6.549 1.512 514 HD22 ASN 75 HD22 ASN 75 26.201 6.732 3.224 515 H GLN 76 HN GLN 76 25.776 0.638 2.296 516 HA GLN 76 HA GLN 76 28.491 1.441 3.069 517 HB2 GLN 76 HB2 GLN 76 26.845 1.242 4.951 518 HB3 GLN 76 HB1 GLN 76 26.689 -0.465 4.557 519 HG2 GLN 76 HG2 GLN 76 29.199 -0.612 4.890 520 HG3 GLN 76 HG1 GLN 76 29.084 0.992 5.607 521 HE21 GLN 76 HE21 GLN 76 26.458 0.491 6.764 522 HE22 GLN 76 HE22 GLN 76 26.719 -0.559 8.114 523 HA PRO 77 HA PRO 77 30.052 -2.085 0.733 524 HB2 PRO 77 HB2 PRO 77 32.038 -1.924 2.955 525 HB3 PRO 77 HB1 PRO 77 32.312 -2.062 1.216 526 HG2 PRO 77 HG2 PRO 77 32.665 0.246 2.429 527 HG3 PRO 77 HG1 PRO 77 31.868 0.177 0.849 528 HD2 PRO 77 HD2 PRO 77 30.680 0.562 3.564 529 HD3 PRO 77 HD1 PRO 77 30.229 1.310 2.022 530 HA PRO 78 HA PRO 78 28.847 -5.708 2.942 531 HB2 PRO 78 HB2 PRO 78 30.842 -7.491 2.390 532 HB3 PRO 78 HB1 PRO 78 29.614 -7.018 1.208 533 HG2 PRO 78 HG2 PRO 78 32.392 -5.970 1.558 534 HG3 PRO 78 HG1 PRO 78 31.579 -6.452 0.063 535 HD2 PRO 78 HD2 PRO 78 31.797 -3.898 0.756 536 HD3 PRO 78 HD1 PRO 78 30.321 -4.510 -0.006 537 H GLU 79 HN GLU 79 28.876 -5.532 5.100 538 HA GLU 79 HA GLU 79 31.030 -4.805 6.692 539 HB2 GLU 79 HB2 GLU 79 29.690 -5.536 8.567 540 HB3 GLU 79 HB1 GLU 79 28.667 -4.714 7.401 541 HG2 GLU 79 HG2 GLU 79 28.141 -7.055 6.523 542 HG3 GLU 79 HG1 GLU 79 28.838 -7.636 8.030 543 H GLU 80 HN GLU 80 30.086 -7.911 5.457 544 HA GLU 80 HA GLU 80 31.694 -9.579 6.990 545 HB2 GLU 80 HB2 GLU 80 30.309 -10.755 5.593 546 HB3 GLU 80 HB1 GLU 80 30.532 -9.629 4.264 547 HG2 GLU 80 HG2 GLU 80 32.703 -10.567 3.782 548 HG3 GLU 80 HG1 GLU 80 32.561 -11.656 5.170 549 H ILE 81 HN ILE 81 32.442 -7.827 4.003 550 HA ILE 81 HA ILE 81 35.126 -8.808 3.951 551 HB ILE 81 HB ILE 81 33.734 -6.719 2.298 552 HG12 ILE 81 HG12 ILE 81 34.697 -9.513 1.657 553 HG13 ILE 81 HG11 ILE 81 33.022 -9.054 1.951 554 HG21 ILE 81 HG21 ILE 81 35.856 -7.159 0.831 555 HG22 ILE 81 HG22 ILE 81 36.576 -7.581 2.391 556 HG23 ILE 81 HG23 ILE 81 35.895 -5.975 2.139 557 HD11 ILE 81 HD11 ILE 81 34.763 -8.504 -0.396 558 HD12 ILE 81 HD12 ILE 81 33.475 -7.375 0.003 559 HD13 ILE 81 HD13 ILE 81 33.089 -9.065 -0.342 560 H VAL 82 HN VAL 82 33.595 -5.709 4.794 561 HA VAL 82 HA VAL 82 35.943 -4.257 5.184 562 HB VAL 82 HB VAL 82 34.741 -2.770 6.600 563 HG11 VAL 82 HG11 VAL 82 32.670 -2.347 5.310 564 HG12 VAL 82 HG12 VAL 82 32.917 -3.889 4.490 565 HG13 VAL 82 HG13 VAL 82 34.095 -2.591 4.300 566 HG21 VAL 82 HG21 VAL 82 33.459 -3.596 8.210 567 HG22 VAL 82 HG22 VAL 82 33.287 -5.137 7.369 568 HG23 VAL 82 HG23 VAL 82 32.196 -3.796 6.993 569 H ALA 83 HN ALA 83 34.220 -6.511 7.212 570 HA ALA 83 HA ALA 83 35.758 -6.405 9.546 571 HB1 ALA 83 HB1 ALA 83 34.908 -8.876 9.657 572 HB2 ALA 83 HB2 ALA 83 33.966 -8.392 8.233 573 HB3 ALA 83 HB3 ALA 83 33.768 -7.535 9.768 574 H ILE 84 HN ILE 84 36.009 -8.514 6.687 575 HA ILE 84 HA ILE 84 38.224 -10.015 7.515 576 HB ILE 84 HB ILE 84 37.320 -9.245 4.735 577 HG12 ILE 84 HG12 ILE 84 37.056 -11.976 5.905 578 HG13 ILE 84 HG11 ILE 84 35.956 -10.728 6.466 579 HG21 ILE 84 HG21 ILE 84 39.306 -11.364 5.548 580 HG22 ILE 84 HG22 ILE 84 39.689 -9.852 4.722 581 HG23 ILE 84 HG23 ILE 84 38.704 -11.075 3.914 582 HD11 ILE 84 HD11 ILE 84 36.326 -11.334 3.557 583 HD12 ILE 84 HD12 ILE 84 35.019 -10.443 4.350 584 HD13 ILE 84 HD13 ILE 84 35.163 -12.189 4.570 585 H ILE 85 HN ILE 85 38.011 -6.958 5.778 586 HA ILE 85 HA ILE 85 40.747 -6.716 5.158 587 HB ILE 85 HB ILE 85 38.649 -4.580 5.492 588 HG12 ILE 85 HG12 ILE 85 39.700 -5.936 3.007 589 HG13 ILE 85 HG11 ILE 85 38.205 -6.375 3.822 590 HG21 ILE 85 HG21 ILE 85 41.505 -4.457 4.841 591 HG22 ILE 85 HG22 ILE 85 40.404 -3.182 5.384 592 HG23 ILE 85 HG23 ILE 85 40.459 -3.639 3.681 593 HD11 ILE 85 HD11 ILE 85 37.913 -4.932 1.825 594 HD12 ILE 85 HD12 ILE 85 38.747 -3.647 2.693 595 HD13 ILE 85 HD13 ILE 85 37.219 -4.276 3.304 596 H THR 86 HN THR 86 38.823 -5.415 7.867 597 HA THR 86 HA THR 86 41.139 -4.235 9.055 598 HB THR 86 HB THR 86 39.175 -3.131 9.661 599 HG1 THR 86 HG1 THR 86 40.686 -3.629 11.431 600 HG21 THR 86 HG21 THR 86 37.336 -4.395 9.306 601 HG22 THR 86 HG22 THR 86 37.419 -4.524 11.073 602 HG23 THR 86 HG23 THR 86 38.036 -5.835 10.063 603 H SER 87 HN SER 87 39.742 -7.394 9.120 604 HA SER 87 HA SER 87 41.211 -8.356 11.375 605 HB2 SER 87 HB2 SER 87 40.095 -9.879 9.001 606 HB3 SER 87 HB1 SER 87 40.696 -10.608 10.489 607 HG SER 87 HG SER 87 38.540 -8.754 10.342 608 H MET 88 HN MET 88 41.914 -7.797 8.021 609 HA MET 88 HA MET 88 44.314 -9.297 7.839 610 HB2 MET 88 HB2 MET 88 43.347 -6.885 6.316 611 HB3 MET 88 HB1 MET 88 44.838 -7.734 5.930 612 HG2 MET 88 HG2 MET 88 42.072 -8.915 5.871 613 HG3 MET 88 HG1 MET 88 43.000 -8.386 4.472 614 HE1 MET 88 HE1 MET 88 43.008 -12.274 4.075 615 HE2 MET 88 HE2 MET 88 42.675 -10.732 3.283 616 HE3 MET 88 HE3 MET 88 41.695 -11.248 4.655 617 H GLY 89 HN GLY 89 43.498 -6.245 9.180 618 HA2 GLY 89 HA2 GLY 89 45.238 -5.569 10.903 619 HA3 GLY 89 HA1 GLY 89 46.333 -5.565 9.529 620 H PHE 90 HN PHE 90 43.588 -4.623 8.178 621 HA PHE 90 HA PHE 90 44.307 -1.821 8.328 622 HB2 PHE 90 HB2 PHE 90 42.261 -3.268 6.631 623 HB3 PHE 90 HB1 PHE 90 42.686 -1.568 6.463 624 HD1 PHE 90 HD2 PHE 90 45.523 -1.456 6.595 625 HD2 PHE 90 HD1 PHE 90 43.080 -4.468 4.857 626 HE1 PHE 90 HE2 PHE 90 47.374 -2.085 5.101 627 HE2 PHE 90 HE1 PHE 90 44.925 -5.107 3.359 628 HZ PHE 90 HZ PHE 90 47.072 -3.911 3.478 629 H GLN 91 HN GLN 91 41.987 -0.487 8.008 630 HA GLN 91 HA GLN 91 40.619 -0.967 10.550 631 HB2 GLN 91 HB2 GLN 91 41.654 1.210 10.382 632 HB3 GLN 91 HB1 GLN 91 40.894 1.501 8.825 633 HG2 GLN 91 HG2 GLN 91 38.718 1.545 9.887 634 HG3 GLN 91 HG1 GLN 91 39.463 1.214 11.452 635 HE21 GLN 91 HE21 GLN 91 40.658 2.819 12.467 636 HE22 GLN 91 HE22 GLN 91 40.541 4.484 12.001 637 H ARG 92 HN ARG 92 38.320 -0.998 10.634 638 HA ARG 92 HA ARG 92 37.001 -2.235 8.490 639 HB2 ARG 92 HB2 ARG 92 36.155 -2.321 10.788 640 HB3 ARG 92 HB1 ARG 92 35.790 -0.608 10.729 641 HG2 ARG 92 HG2 ARG 92 34.453 -1.401 8.567 642 HG3 ARG 92 HG1 ARG 92 34.371 -2.886 9.515 643 HD2 ARG 92 HD2 ARG 92 33.569 -0.166 10.504 644 HD3 ARG 92 HD1 ARG 92 32.451 -1.352 9.841 645 HE ARG 92 HE ARG 92 33.731 -2.684 11.853 646 HH11 ARG 92 HH11 ARG 92 31.951 0.329 11.650 647 HH12 ARG 92 HH12 ARG 92 31.299 0.197 13.254 648 HH21 ARG 92 HH21 ARG 92 32.874 -2.835 13.972 649 HH22 ARG 92 HH22 ARG 92 31.809 -1.594 14.555 650 H ASN 93 HN ASN 93 36.760 1.116 9.627 651 HA ASN 93 HA ASN 93 35.100 2.079 7.597 652 HB2 ASN 93 HB2 ASN 93 35.574 3.309 9.665 653 HB3 ASN 93 HB1 ASN 93 37.235 3.565 9.135 654 HD21 ASN 93 HD21 ASN 93 37.111 5.767 9.121 655 HD22 ASN 93 HD22 ASN 93 36.174 6.659 7.966 656 H GLN 94 HN GLN 94 38.613 1.831 7.751 657 HA GLN 94 HA GLN 94 39.170 3.126 5.315 658 HB2 GLN 94 HB2 GLN 94 41.010 2.864 6.723 659 HB3 GLN 94 HB1 GLN 94 40.645 1.175 7.033 660 HG2 GLN 94 HG2 GLN 94 41.720 0.453 5.188 661 HG3 GLN 94 HG1 GLN 94 41.302 1.890 4.248 662 HE21 GLN 94 HE21 GLN 94 43.591 0.475 6.453 663 HE22 GLN 94 HE22 GLN 94 44.802 1.698 6.290 664 H ALA 95 HN ALA 95 38.397 -0.170 6.182 665 HA ALA 95 HA ALA 95 38.717 -1.349 3.642 666 HB1 ALA 95 HB1 ALA 95 36.904 -2.090 5.940 667 HB2 ALA 95 HB2 ALA 95 38.572 -2.625 5.704 668 HB3 ALA 95 HB3 ALA 95 37.313 -3.131 4.572 669 H ILE 96 HN ILE 96 36.001 0.284 5.215 670 HA ILE 96 HA ILE 96 34.041 -0.217 3.293 671 HB ILE 96 HB ILE 96 34.411 1.937 5.330 672 HG12 ILE 96 HG12 ILE 96 31.832 0.719 5.279 673 HG13 ILE 96 HG11 ILE 96 33.046 -0.542 5.123 674 HG21 ILE 96 HG21 ILE 96 32.136 2.821 4.606 675 HG22 ILE 96 HG22 ILE 96 32.440 1.992 3.072 676 HG23 ILE 96 HG23 ILE 96 33.526 3.272 3.616 677 HD11 ILE 96 HD11 ILE 96 32.822 1.499 7.311 678 HD12 ILE 96 HD12 ILE 96 34.163 0.372 7.122 679 HD13 ILE 96 HD13 ILE 96 32.538 -0.240 7.428 680 H GLN 97 HN GLN 97 36.194 2.583 3.640 681 HA GLN 97 HA GLN 97 35.472 3.988 1.370 682 HB2 GLN 97 HB2 GLN 97 36.959 4.896 3.057 683 HB3 GLN 97 HB1 GLN 97 38.184 3.718 2.625 684 HG2 GLN 97 HG2 GLN 97 38.501 4.712 0.486 685 HG3 GLN 97 HG1 GLN 97 37.135 5.794 0.738 686 HE21 GLN 97 HE21 GLN 97 38.366 7.656 0.477 687 HE22 GLN 97 HE22 GLN 97 39.532 8.175 1.646 688 H ALA 98 HN ALA 98 37.923 1.495 1.752 689 HA ALA 98 HA ALA 98 38.906 1.503 -0.851 690 HB1 ALA 98 HB1 ALA 98 39.714 0.298 1.307 691 HB2 ALA 98 HB2 ALA 98 40.067 -0.411 -0.267 692 HB3 ALA 98 HB3 ALA 98 38.729 -1.035 0.708 693 H LEU 99 HN LEU 99 36.415 -0.629 0.588 694 HA LEU 99 HA LEU 99 35.819 -2.006 -1.776 695 HB2 LEU 99 HB2 LEU 99 34.067 -1.441 0.596 696 HB3 LEU 99 HB1 LEU 99 33.678 -2.584 -0.665 697 HG LEU 99 HG LEU 99 36.128 -2.814 1.064 698 HD11 LEU 99 HD11 LEU 99 33.536 -4.303 1.374 699 HD12 LEU 99 HD12 LEU 99 33.969 -2.889 2.330 700 HD13 LEU 99 HD13 LEU 99 34.948 -4.354 2.432 701 HD21 LEU 99 HD21 LEU 99 36.650 -4.420 -0.375 702 HD22 LEU 99 HD22 LEU 99 35.152 -4.157 -1.253 703 HD23 LEU 99 HD23 LEU 99 35.185 -5.278 0.104 704 H ARG 100 HN ARG 100 34.634 1.052 -0.518 705 HA ARG 100 HA ARG 100 32.463 1.483 -2.211 706 HB2 ARG 100 HB2 ARG 100 34.488 3.344 -0.994 707 HB3 ARG 100 HB1 ARG 100 33.217 3.949 -2.047 708 HG2 ARG 100 HG2 ARG 100 31.525 3.194 -0.565 709 HG3 ARG 100 HG1 ARG 100 32.703 2.318 0.418 710 HD2 ARG 100 HD2 ARG 100 33.649 4.283 1.244 711 HD3 ARG 100 HD1 ARG 100 32.897 5.278 -0.009 712 HE ARG 100 HE ARG 100 30.791 4.177 1.340 713 HH11 ARG 100 HH11 ARG 100 33.535 6.152 2.252 714 HH12 ARG 100 HH12 ARG 100 32.690 6.967 3.533 715 HH21 ARG 100 HH21 ARG 100 29.683 5.231 3.046 716 HH22 ARG 100 HH22 ARG 100 30.508 6.422 4.001 717 H ALA 101 HN ALA 101 35.861 2.248 -2.670 718 HA ALA 101 HA ALA 101 35.595 3.227 -5.318 719 HB1 ALA 101 HB1 ALA 101 38.142 2.829 -5.262 720 HB2 ALA 101 HB2 ALA 101 37.864 2.402 -3.565 721 HB3 ALA 101 HB3 ALA 101 37.438 4.011 -4.156 722 H THR 102 HN THR 102 36.456 0.072 -3.954 723 HA THR 102 HA THR 102 37.177 -1.033 -6.511 724 HB THR 102 HB THR 102 37.745 -3.013 -5.310 725 HG1 THR 102 HG1 THR 102 37.027 -3.387 -3.227 726 HG21 THR 102 HG21 THR 102 39.511 -1.947 -4.490 727 HG22 THR 102 HG22 THR 102 38.572 -1.337 -3.138 728 HG23 THR 102 HG23 THR 102 38.653 -0.424 -4.645 729 H ASN 103 HN ASN 103 34.268 -0.454 -5.088 730 HA ASN 103 HA ASN 103 32.132 -1.155 -5.365 731 HB2 ASN 103 HB2 ASN 103 32.835 -1.218 -7.807 732 HB3 ASN 103 HB1 ASN 103 33.107 -2.937 -7.588 733 HD21 ASN 103 HD21 ASN 103 31.352 -4.309 -7.265 734 HD22 ASN 103 HD22 ASN 103 29.726 -3.820 -7.607 735 H ASN 104 HN ASN 104 32.901 -2.162 -3.289 736 HA ASN 104 HA ASN 104 33.043 -3.835 -1.779 737 HB2 ASN 104 HB2 ASN 104 31.264 -5.521 -1.835 738 HB3 ASN 104 HB1 ASN 104 30.641 -3.922 -2.206 739 HD21 ASN 104 HD21 ASN 104 29.648 -3.564 -4.130 740 HD22 ASN 104 HD22 ASN 104 29.382 -4.792 -5.325 741 H ASN 105 HN ASN 105 34.760 -4.110 -4.268 742 HA ASN 105 HA ASN 105 35.258 -6.959 -4.343 743 HB2 ASN 105 HB2 ASN 105 36.615 -4.558 -5.537 744 HB3 ASN 105 HB1 ASN 105 37.454 -6.104 -5.486 745 HD21 ASN 105 HD21 ASN 105 33.982 -5.744 -5.920 746 HD22 ASN 105 HD22 ASN 105 33.949 -6.334 -7.543 747 H LEU 106 HN LEU 106 36.034 -7.921 -2.655 748 HA LEU 106 HA LEU 106 37.213 -6.754 -0.420 749 HB2 LEU 106 HB2 LEU 106 36.158 -8.931 -0.394 750 HB3 LEU 106 HB1 LEU 106 37.339 -9.574 -1.504 751 HG LEU 106 HG LEU 106 38.323 -8.558 1.118 752 HD11 LEU 106 HD11 LEU 106 37.204 -11.327 0.877 753 HD12 LEU 106 HD12 LEU 106 36.192 -9.986 1.399 754 HD13 LEU 106 HD13 LEU 106 37.621 -10.425 2.339 755 HD21 LEU 106 HD21 LEU 106 39.859 -10.443 0.880 756 HD22 LEU 106 HD22 LEU 106 39.886 -9.400 -0.545 757 HD23 LEU 106 HD23 LEU 106 39.022 -10.938 -0.594 758 H GLU 107 HN GLU 107 38.776 -8.783 -2.847 759 HA GLU 107 HA GLU 107 41.417 -8.495 -2.055 760 HB2 GLU 107 HB2 GLU 107 40.332 -8.842 -4.856 761 HB3 GLU 107 HB1 GLU 107 41.998 -9.125 -4.369 762 HG2 GLU 107 HG2 GLU 107 39.944 -10.567 -2.839 763 HG3 GLU 107 HG1 GLU 107 40.150 -11.051 -4.523 764 H ARG 108 HN ARG 108 39.618 -6.562 -4.424 765 HA ARG 108 HA ARG 108 41.814 -4.885 -5.055 766 HB2 ARG 108 HB2 ARG 108 39.715 -5.276 -6.431 767 HB3 ARG 108 HB1 ARG 108 38.921 -4.155 -5.351 768 HG2 ARG 108 HG2 ARG 108 40.494 -2.411 -5.988 769 HG3 ARG 108 HG1 ARG 108 41.284 -3.543 -7.096 770 HD2 ARG 108 HD2 ARG 108 38.367 -2.886 -7.201 771 HD3 ARG 108 HD1 ARG 108 39.579 -1.993 -8.134 772 HE ARG 108 HE ARG 108 39.900 -4.745 -8.628 773 HH11 ARG 108 HH11 ARG 108 37.579 -2.183 -9.281 774 HH12 ARG 108 HH12 ARG 108 37.032 -2.909 -10.762 775 HH21 ARG 108 HH21 ARG 108 39.170 -5.664 -10.592 776 HH22 ARG 108 HH22 ARG 108 37.919 -4.867 -11.497 777 H ALA 109 HN ALA 109 39.318 -4.787 -2.596 778 HA ALA 109 HA ALA 109 39.607 -2.105 -1.847 779 HB1 ALA 109 HB1 ALA 109 38.100 -4.237 -0.949 780 HB2 ALA 109 HB2 ALA 109 38.132 -2.629 -0.237 781 HB3 ALA 109 HB3 ALA 109 39.172 -3.897 0.409 782 H LEU 110 HN LEU 110 41.073 -5.060 -0.584 783 HA LEU 110 HA LEU 110 42.942 -3.928 1.151 784 HB2 LEU 110 HB2 LEU 110 43.224 -6.406 -0.544 785 HB3 LEU 110 HB1 LEU 110 44.132 -6.045 0.909 786 HG LEU 110 HG LEU 110 41.138 -6.313 0.935 787 HD11 LEU 110 HD11 LEU 110 43.175 -8.484 1.406 788 HD12 LEU 110 HD12 LEU 110 42.107 -8.353 0.007 789 HD13 LEU 110 HD13 LEU 110 41.427 -8.621 1.614 790 HD21 LEU 110 HD21 LEU 110 41.500 -6.750 3.295 791 HD22 LEU 110 HD22 LEU 110 42.218 -5.205 2.831 792 HD23 LEU 110 HD23 LEU 110 43.243 -6.621 3.069 793 H ASP 111 HN ASP 111 43.093 -4.677 -2.282 794 HA ASP 111 HA ASP 111 45.691 -3.899 -2.896 795 HB2 ASP 111 HB2 ASP 111 43.752 -4.846 -4.429 796 HB3 ASP 111 HB1 ASP 111 43.429 -3.141 -4.696 797 H TRP 112 HN TRP 112 42.743 -1.993 -2.876 798 HA TRP 112 HA TRP 112 43.835 0.483 -3.592 799 HB2 TRP 112 HB2 TRP 112 41.398 -0.280 -3.606 800 HB3 TRP 112 HB1 TRP 112 41.381 0.098 -1.888 801 HD1 TRP 112 HD1 TRP 112 41.616 2.732 -1.218 802 HE1 TRP 112 HE1 TRP 112 41.064 4.870 -2.553 803 HE3 TRP 112 HE3 TRP 112 41.391 0.713 -5.910 804 HZ2 TRP 112 HZ2 TRP 112 40.607 5.593 -5.249 805 HZ3 TRP 112 HZ3 TRP 112 40.900 2.194 -7.810 806 HH2 TRP 112 HH2 TRP 112 40.516 4.584 -7.485 807 H ILE 113 HN ILE 113 43.088 -0.948 -0.481 808 HA ILE 113 HA ILE 113 43.885 1.213 1.129 809 HB ILE 113 HB ILE 113 43.741 -1.741 1.731 810 HG12 ILE 113 HG12 ILE 113 41.811 0.539 2.221 811 HG13 ILE 113 HG11 ILE 113 41.590 -0.791 1.094 812 HG21 ILE 113 HG21 ILE 113 43.980 0.585 3.634 813 HG22 ILE 113 HG22 ILE 113 45.225 -0.615 3.297 814 HG23 ILE 113 HG23 ILE 113 43.723 -1.099 4.087 815 HD11 ILE 113 HD11 ILE 113 41.963 -1.384 3.980 816 HD12 ILE 113 HD12 ILE 113 41.080 -2.273 2.735 817 HD13 ILE 113 HD13 ILE 113 40.410 -0.786 3.399 818 H PHE 114 HN PHE 114 45.594 -1.687 0.047 819 HA PHE 114 HA PHE 114 47.994 -1.364 1.433 820 HB2 PHE 114 HB2 PHE 114 47.277 -3.402 0.192 821 HB3 PHE 114 HB1 PHE 114 47.591 -2.546 -1.317 822 HD1 PHE 114 HD2 PHE 114 49.246 -3.672 1.815 823 HD2 PHE 114 HD1 PHE 114 49.688 -2.633 -2.287 824 HE1 PHE 114 HE2 PHE 114 51.587 -4.427 1.880 825 HE2 PHE 114 HE1 PHE 114 52.029 -3.384 -2.228 826 HZ PHE 114 HZ PHE 114 52.980 -4.290 -0.143 827 H SER 115 HN SER 115 46.764 0.212 -1.372 828 HA SER 115 HA SER 115 49.256 1.226 -2.323 829 HB2 SER 115 HB2 SER 115 46.399 2.031 -2.860 830 HB3 SER 115 HB1 SER 115 47.792 2.669 -3.740 831 HG SER 115 HG SER 115 46.969 -0.058 -3.583 832 H HIS 116 HN HIS 116 47.622 1.863 0.431 833 HA HIS 116 HA HIS 116 49.202 4.328 0.707 834 HB2 HIS 116 HB2 HIS 116 46.544 3.725 2.027 835 HB3 HIS 116 HB1 HIS 116 47.602 5.055 2.488 836 HD1 HIS 116 HD1 HIS 116 48.177 6.702 0.281 837 HD2 HIS 116 HD2 HIS 116 44.658 4.477 0.264 838 HE1 HIS 116 HE1 HIS 116 46.668 7.828 -1.381 839 HE2 HIS 116 HE2 HIS 116 44.630 6.355 -1.520 840 HA PRO 117 HA PRO 117 51.027 0.596 2.795 841 HB2 PRO 117 HB2 PRO 117 53.243 2.216 3.468 842 HB3 PRO 117 HB1 PRO 117 53.131 1.072 2.130 843 HG2 PRO 117 HG2 PRO 117 52.615 4.025 2.161 844 HG3 PRO 117 HG1 PRO 117 53.406 3.030 0.907 845 HD2 PRO 117 HD2 PRO 117 50.931 3.802 0.482 846 HD3 PRO 117 HD1 PRO 117 51.334 2.089 0.222 847 H GLU 118 HN GLU 118 52.122 3.561 4.281 848 HA GLU 118 HA GLU 118 50.353 3.365 6.504 849 HB2 GLU 118 HB2 GLU 118 52.289 3.251 8.156 850 HB3 GLU 118 HB1 GLU 118 51.810 1.753 7.375 851 HG2 GLU 118 HG2 GLU 118 53.650 2.086 5.753 852 HG3 GLU 118 HG1 GLU 118 54.172 3.481 6.695 853 H PHE 119 HN PHE 119 53.312 4.786 5.160 854 HA PHE 119 HA PHE 119 52.261 7.379 5.993 855 HB2 PHE 119 HB2 PHE 119 54.018 6.558 7.607 856 HB3 PHE 119 HB1 PHE 119 55.175 6.656 6.287 857 HD1 PHE 119 HD1 PHE 119 52.611 8.807 7.947 858 HD2 PHE 119 HD2 PHE 119 56.472 8.545 6.172 859 HE1 PHE 119 HE1 PHE 119 53.022 11.168 8.507 860 HE2 PHE 119 HE2 PHE 119 56.890 10.905 6.730 861 HZ PHE 119 HZ PHE 119 55.167 12.219 7.899 862 H GLU 120 HN GLU 120 52.742 5.693 3.484 863 HA GLU 120 HA GLU 120 53.036 6.066 1.277 864 HB2 GLU 120 HB2 GLU 120 52.961 8.960 2.121 865 HB3 GLU 120 HB1 GLU 120 52.796 8.375 0.470 866 HG2 GLU 120 HG2 GLU 120 50.974 7.495 2.663 867 HG3 GLU 120 HG1 GLU 120 50.660 8.949 1.718 868 H GLU 121 HN GLU 121 55.008 5.305 0.683 869 HA GLU 121 HA GLU 121 57.390 6.690 1.619 870 HB2 GLU 121 HB2 GLU 121 58.641 4.770 0.903 871 HB3 GLU 121 HB1 GLU 121 57.222 4.212 1.772 872 HG2 GLU 121 HG2 GLU 121 57.323 4.371 -1.220 873 HG3 GLU 121 HG1 GLU 121 57.843 2.949 -0.324 874 H ASP 122 HN ASP 122 59.096 7.321 0.275 875 HA ASP 122 HA ASP 122 58.726 7.297 -2.605 876 HB2 ASP 122 HB2 ASP 122 57.752 9.459 -1.949 877 HB3 ASP 122 HB1 ASP 122 59.225 9.865 -1.073 878 H SER 123 HN SER 123 60.587 6.774 -3.543 879 HA SER 123 HA SER 123 62.851 6.328 -1.805 880 HB2 SER 123 HB2 SER 123 62.044 4.620 -3.444 881 HB3 SER 123 HB1 SER 123 62.570 5.684 -4.749 882 HG SER 123 HG SER 123 64.203 4.215 -4.332 883 H ASP 124 HN ASP 124 62.396 7.879 -4.993 884 HA ASP 124 HA ASP 124 63.596 9.446 -6.110 885 HB2 ASP 124 HB2 ASP 124 62.656 10.870 -4.339 886 HB3 ASP 124 HB1 ASP 124 64.074 10.568 -3.341 887 H PHE 125 HN PHE 125 65.120 7.792 -6.701 888 HA PHE 125 HA PHE 125 67.635 7.828 -5.182 889 HB2 PHE 125 HB2 PHE 125 66.569 5.623 -5.435 890 HB3 PHE 125 HB1 PHE 125 66.614 5.798 -7.184 891 HD1 PHE 125 HD1 PHE 125 68.741 5.506 -4.173 892 HD2 PHE 125 HD2 PHE 125 68.519 5.203 -8.410 893 HE1 PHE 125 HE1 PHE 125 70.973 4.472 -4.207 894 HE2 PHE 125 HE2 PHE 125 70.749 4.166 -8.453 895 HZ PHE 125 HZ PHE 125 71.989 3.821 -6.365 896 H VAL 126 HN VAL 126 69.340 8.802 -6.009 897 HA VAL 126 HA VAL 126 69.374 9.362 -8.896 898 HB VAL 126 HB VAL 126 70.823 10.879 -6.707 899 HG11 VAL 126 HG11 VAL 126 70.556 11.422 -9.662 900 HG12 VAL 126 HG12 VAL 126 72.022 10.930 -8.815 901 HG13 VAL 126 HG13 VAL 126 71.302 12.505 -8.487 902 HG21 VAL 126 HG21 VAL 126 68.380 11.632 -8.310 903 HG22 VAL 126 HG22 VAL 126 69.237 12.692 -7.191 904 HG23 VAL 126 HG23 VAL 126 68.421 11.249 -6.589 Start of MODEL 6 1 H1 ASP 1 HT1 ASP 1 -42.562 11.167 6.685 2 H2 ASP 1 HT2 ASP 1 -43.461 12.597 6.792 3 H3 ASP 1 HT3 ASP 1 -42.475 12.313 5.439 4 HA ASP 1 HA ASP 1 -44.910 10.798 6.196 5 HB2 ASP 1 HB2 ASP 1 -44.395 12.420 3.697 6 HB3 ASP 1 HB1 ASP 1 -45.922 11.729 4.234 7 H ILE 2 HN ILE 2 -42.666 11.355 3.495 8 HA ILE 2 HA ILE 2 -42.233 8.465 3.321 9 HB ILE 2 HB ILE 2 -42.628 10.210 0.877 10 HG12 ILE 2 HG12 ILE 2 -44.510 8.116 1.987 11 HG13 ILE 2 HG11 ILE 2 -44.758 9.854 2.129 12 HG21 ILE 2 HG21 ILE 2 -42.427 7.214 1.132 13 HG22 ILE 2 HG22 ILE 2 -41.100 8.279 0.678 14 HG23 ILE 2 HG23 ILE 2 -42.518 8.150 -0.362 15 HD11 ILE 2 HD11 ILE 2 -44.678 8.253 -0.418 16 HD12 ILE 2 HD12 ILE 2 -44.818 10.006 -0.326 17 HD13 ILE 2 HD13 ILE 2 -46.096 8.987 0.333 18 H ASP 3 HN ASP 3 -40.284 9.022 4.451 19 HA ASP 3 HA ASP 3 -38.436 10.921 3.439 20 HB2 ASP 3 HB2 ASP 3 -38.208 8.695 5.446 21 HB3 ASP 3 HB1 ASP 3 -36.787 9.596 4.929 22 H GLU 4 HN GLU 4 -38.215 10.507 1.284 23 HA GLU 4 HA GLU 4 -37.323 8.016 0.249 24 HB2 GLU 4 HB2 GLU 4 -37.338 10.797 -0.930 25 HB3 GLU 4 HB1 GLU 4 -36.921 9.339 -1.831 26 HG2 GLU 4 HG2 GLU 4 -39.104 8.436 -1.516 27 HG3 GLU 4 HG1 GLU 4 -39.543 9.741 -0.414 28 H SER 5 HN SER 5 -35.770 10.462 1.967 29 HA SER 5 HA SER 5 -33.140 10.248 1.081 30 HB2 SER 5 HB2 SER 5 -34.064 10.385 3.963 31 HB3 SER 5 HB1 SER 5 -32.491 10.879 3.339 32 HG SER 5 HG SER 5 -34.456 12.449 3.659 33 H SER 6 HN SER 6 -35.112 8.104 3.058 34 HA SER 6 HA SER 6 -33.163 6.281 3.907 35 HB2 SER 6 HB2 SER 6 -36.026 5.607 3.201 36 HB3 SER 6 HB1 SER 6 -34.997 4.815 4.394 37 HG SER 6 HG SER 6 -36.532 7.054 4.629 38 H VAL 7 HN VAL 7 -35.307 6.128 1.041 39 HA VAL 7 HA VAL 7 -34.132 3.751 0.064 40 HB VAL 7 HB VAL 7 -36.330 4.274 -0.695 41 HG11 VAL 7 HG11 VAL 7 -35.144 6.785 -1.836 42 HG12 VAL 7 HG12 VAL 7 -36.436 6.638 -0.641 43 HG13 VAL 7 HG13 VAL 7 -36.718 6.150 -2.311 44 HG21 VAL 7 HG21 VAL 7 -36.083 3.946 -3.072 45 HG22 VAL 7 HG22 VAL 7 -34.839 3.029 -2.209 46 HG23 VAL 7 HG23 VAL 7 -34.427 4.551 -3.006 47 H MET 8 HN MET 8 -33.558 7.163 -0.573 48 HA MET 8 HA MET 8 -31.689 6.809 -2.639 49 HB2 MET 8 HB2 MET 8 -32.222 9.035 -0.714 50 HB3 MET 8 HB1 MET 8 -30.830 9.107 -1.787 51 HG2 MET 8 HG2 MET 8 -32.250 8.933 -3.712 52 HG3 MET 8 HG1 MET 8 -33.669 8.717 -2.695 53 HE1 MET 8 HE1 MET 8 -30.854 11.177 -3.882 54 HE2 MET 8 HE2 MET 8 -30.631 11.158 -2.132 55 HE3 MET 8 HE3 MET 8 -31.210 12.618 -2.932 56 H GLN 9 HN GLN 9 -31.352 6.571 0.836 57 HA GLN 9 HA GLN 9 -28.538 6.445 0.947 58 HB2 GLN 9 HB2 GLN 9 -30.633 5.053 2.627 59 HB3 GLN 9 HB1 GLN 9 -28.916 5.014 2.986 60 HG2 GLN 9 HG2 GLN 9 -28.893 7.414 3.284 61 HG3 GLN 9 HG1 GLN 9 -30.598 7.502 2.843 62 HE21 GLN 9 HE21 GLN 9 -29.253 4.937 4.788 63 HE22 GLN 9 HE22 GLN 9 -30.037 5.379 6.263 64 H LEU 10 HN LEU 10 -30.947 3.807 0.667 65 HA LEU 10 HA LEU 10 -29.122 1.716 0.191 66 HB2 LEU 10 HB2 LEU 10 -31.726 1.863 -1.275 67 HB3 LEU 10 HB1 LEU 10 -30.890 0.449 -0.692 68 HG LEU 10 HG LEU 10 -32.524 2.411 0.883 69 HD11 LEU 10 HD11 LEU 10 -32.788 -0.553 0.523 70 HD12 LEU 10 HD12 LEU 10 -33.630 0.644 -0.463 71 HD13 LEU 10 HD13 LEU 10 -33.941 0.551 1.276 72 HD21 LEU 10 HD21 LEU 10 -32.044 0.734 2.771 73 HD22 LEU 10 HD22 LEU 10 -30.829 1.943 2.401 74 HD23 LEU 10 HD23 LEU 10 -30.621 0.293 1.825 75 H ALA 11 HN ALA 11 -30.742 3.933 -1.967 76 HA ALA 11 HA ALA 11 -29.975 2.808 -4.414 77 HB1 ALA 11 HB1 ALA 11 -30.411 5.735 -4.232 78 HB2 ALA 11 HB2 ALA 11 -31.729 4.680 -3.718 79 HB3 ALA 11 HB3 ALA 11 -31.083 4.558 -5.362 80 H GLU 12 HN GLU 12 -28.358 4.983 -2.262 81 HA GLU 12 HA GLU 12 -26.359 5.716 -4.202 82 HB2 GLU 12 HB2 GLU 12 -26.785 7.499 -2.839 83 HB3 GLU 12 HB1 GLU 12 -27.061 6.488 -1.433 84 HG2 GLU 12 HG2 GLU 12 -24.752 6.180 -1.099 85 HG3 GLU 12 HG1 GLU 12 -24.352 6.962 -2.632 86 H MET 13 HN MET 13 -26.434 3.847 -1.144 87 HA MET 13 HA MET 13 -23.647 3.076 -1.669 88 HB2 MET 13 HB2 MET 13 -23.495 2.468 0.679 89 HB3 MET 13 HB1 MET 13 -24.095 4.114 0.514 90 HG2 MET 13 HG2 MET 13 -26.331 3.404 0.984 91 HG3 MET 13 HG1 MET 13 -25.839 1.712 0.960 92 HE1 MET 13 HE1 MET 13 -25.312 5.166 2.833 93 HE2 MET 13 HE2 MET 13 -23.684 4.581 2.491 94 HE3 MET 13 HE3 MET 13 -24.260 4.651 4.155 95 H GLY 14 HN GLY 14 -26.054 1.832 -2.950 96 HA2 GLY 14 HA2 GLY 14 -25.151 -0.878 -2.652 97 HA3 GLY 14 HA1 GLY 14 -26.745 -0.619 -1.964 98 H PHE 15 HN PHE 15 -28.476 -0.120 -3.321 99 HA PHE 15 HA PHE 15 -28.040 -0.590 -6.191 100 HB2 PHE 15 HB2 PHE 15 -30.113 -2.063 -4.538 101 HB3 PHE 15 HB1 PHE 15 -29.813 -2.257 -6.259 102 HD1 PHE 15 HD2 PHE 15 -27.843 -3.451 -7.046 103 HD2 PHE 15 HD1 PHE 15 -28.724 -3.119 -2.899 104 HE1 PHE 15 HE2 PHE 15 -26.278 -5.292 -6.568 105 HE2 PHE 15 HE1 PHE 15 -27.166 -4.954 -2.411 106 HZ PHE 15 HZ PHE 15 -25.941 -6.045 -4.243 107 HA PRO 16 HA PRO 16 -31.262 2.518 -6.620 108 HB2 PRO 16 HB2 PRO 16 -32.373 1.624 -8.969 109 HB3 PRO 16 HB1 PRO 16 -30.911 2.610 -8.876 110 HG2 PRO 16 HG2 PRO 16 -31.191 -0.344 -9.239 111 HG3 PRO 16 HG1 PRO 16 -30.053 0.781 -10.003 112 HD2 PRO 16 HD2 PRO 16 -29.333 -0.833 -7.962 113 HD3 PRO 16 HD1 PRO 16 -28.638 0.786 -8.182 114 H LEU 17 HN LEU 17 -32.257 1.421 -4.719 115 HA LEU 17 HA LEU 17 -34.198 -0.656 -5.271 116 HB2 LEU 17 HB2 LEU 17 -33.222 0.568 -2.685 117 HB3 LEU 17 HB1 LEU 17 -34.377 -0.755 -2.795 118 HG LEU 17 HG LEU 17 -31.574 -0.885 -3.918 119 HD11 LEU 17 HD11 LEU 17 -31.018 -2.288 -2.010 120 HD12 LEU 17 HD12 LEU 17 -32.625 -2.024 -1.334 121 HD13 LEU 17 HD13 LEU 17 -31.499 -0.674 -1.484 122 HD21 LEU 17 HD21 LEU 17 -33.162 -2.376 -5.003 123 HD22 LEU 17 HD22 LEU 17 -33.652 -3.016 -3.434 124 HD23 LEU 17 HD23 LEU 17 -32.014 -3.289 -4.026 125 H GLU 18 HN GLU 18 -35.316 1.274 -6.568 126 HA GLU 18 HA GLU 18 -36.908 3.119 -5.246 127 HB2 GLU 18 HB2 GLU 18 -36.614 2.586 -7.815 128 HB3 GLU 18 HB1 GLU 18 -38.073 1.635 -7.555 129 HG2 GLU 18 HG2 GLU 18 -39.044 3.743 -6.462 130 HG3 GLU 18 HG1 GLU 18 -37.678 4.573 -7.210 131 H ALA 19 HN ALA 19 -37.214 -0.330 -5.471 132 HA ALA 19 HA ALA 19 -39.852 -0.708 -4.664 133 HB1 ALA 19 HB1 ALA 19 -37.592 -2.398 -3.641 134 HB2 ALA 19 HB2 ALA 19 -38.092 -2.441 -5.326 135 HB3 ALA 19 HB3 ALA 19 -39.236 -2.888 -4.059 136 H CYS 20 HN CYS 20 -37.020 0.238 -2.892 137 HA CYS 20 HA CYS 20 -38.182 0.069 -0.274 138 HB2 CYS 20 HB2 CYS 20 -35.693 0.139 -0.713 139 HB3 CYS 20 HB1 CYS 20 -35.886 1.827 -1.149 140 HG CYS 20 HG CYS 20 -36.098 0.397 1.921 141 H ARG 21 HN ARG 21 -37.617 2.622 -2.642 142 HA ARG 21 HA ARG 21 -38.677 4.798 -1.293 143 HB2 ARG 21 HB2 ARG 21 -37.634 5.145 -3.396 144 HB3 ARG 21 HB1 ARG 21 -38.709 4.019 -4.206 145 HG2 ARG 21 HG2 ARG 21 -40.472 5.529 -4.217 146 HG3 ARG 21 HG1 ARG 21 -39.717 6.569 -2.999 147 HD2 ARG 21 HD2 ARG 21 -37.917 7.056 -4.654 148 HD3 ARG 21 HD1 ARG 21 -38.827 6.131 -5.847 149 HE ARG 21 HE ARG 21 -39.852 8.583 -4.543 150 HH11 ARG 21 HH11 ARG 21 -39.380 6.579 -7.376 151 HH12 ARG 21 HH12 ARG 21 -40.374 7.553 -8.407 152 HH21 ARG 21 HH21 ARG 21 -41.135 9.893 -5.885 153 HH22 ARG 21 HH22 ARG 21 -41.401 9.451 -7.542 154 H LYS 22 HN LYS 22 -40.394 2.466 -3.315 155 HA LYS 22 HA LYS 22 -42.995 3.439 -2.689 156 HB2 LYS 22 HB2 LYS 22 -42.014 0.852 -3.920 157 HB3 LYS 22 HB1 LYS 22 -43.715 1.297 -3.804 158 HG2 LYS 22 HG2 LYS 22 -43.449 3.119 -5.271 159 HG3 LYS 22 HG1 LYS 22 -41.693 3.070 -5.143 160 HD2 LYS 22 HD2 LYS 22 -43.338 0.864 -6.377 161 HD3 LYS 22 HD1 LYS 22 -42.643 2.198 -7.298 162 HE2 LYS 22 HE2 LYS 22 -40.443 1.388 -5.996 163 HE3 LYS 22 HE1 LYS 22 -41.329 -0.137 -6.035 164 HZ1 LYS 22 HZ1 LYS 22 -40.685 1.533 -8.413 165 HZ2 LYS 22 HZ2 LYS 22 -41.512 0.051 -8.433 166 HZ3 LYS 22 HZ3 LYS 22 -39.883 0.104 -7.968 167 H ALA 23 HN ALA 23 -40.800 1.242 -1.187 168 HA ALA 23 HA ALA 23 -42.661 -0.103 0.505 169 HB1 ALA 23 HB1 ALA 23 -40.726 -0.906 1.702 170 HB2 ALA 23 HB2 ALA 23 -39.708 0.306 0.918 171 HB3 ALA 23 HB3 ALA 23 -40.422 -0.998 -0.037 172 H VAL 24 HN VAL 24 -40.565 2.725 0.882 173 HA VAL 24 HA VAL 24 -41.121 3.286 3.562 174 HB VAL 24 HB VAL 24 -40.628 5.276 1.328 175 HG11 VAL 24 HG11 VAL 24 -39.940 6.826 3.064 176 HG12 VAL 24 HG12 VAL 24 -40.309 5.629 4.307 177 HG13 VAL 24 HG13 VAL 24 -41.609 6.313 3.331 178 HG21 VAL 24 HG21 VAL 24 -38.298 5.241 2.088 179 HG22 VAL 24 HG22 VAL 24 -38.824 3.651 1.530 180 HG23 VAL 24 HG23 VAL 24 -38.702 3.982 3.258 181 H TYR 25 HN TYR 25 -42.774 4.431 0.620 182 HA TYR 25 HA TYR 25 -44.896 5.752 1.876 183 HB2 TYR 25 HB2 TYR 25 -44.561 6.016 -0.483 184 HB3 TYR 25 HB1 TYR 25 -44.752 4.288 -0.765 185 HD1 TYR 25 HD2 TYR 25 -46.666 7.180 0.632 186 HD2 TYR 25 HD1 TYR 25 -46.791 3.549 -1.585 187 HE1 TYR 25 HE2 TYR 25 -49.062 7.530 0.205 188 HE2 TYR 25 HE1 TYR 25 -49.187 3.888 -2.014 189 HH TYR 25 HH TYR 25 -50.752 6.830 -1.481 190 H PHE 26 HN PHE 26 -44.424 2.325 1.211 191 HA PHE 26 HA PHE 26 -47.069 1.545 1.968 192 HB2 PHE 26 HB2 PHE 26 -45.576 0.247 0.430 193 HB3 PHE 26 HB1 PHE 26 -44.590 -0.178 1.823 194 HD1 PHE 26 HD2 PHE 26 -47.923 -0.575 0.286 195 HD2 PHE 26 HD1 PHE 26 -45.226 -1.906 3.297 196 HE1 PHE 26 HE2 PHE 26 -49.382 -2.502 0.733 197 HE2 PHE 26 HE1 PHE 26 -46.681 -3.842 3.747 198 HZ PHE 26 HZ PHE 26 -48.758 -4.151 2.421 199 H THR 27 HN THR 27 -43.910 1.468 3.606 200 HA THR 27 HA THR 27 -44.745 0.141 5.931 201 HB THR 27 HB THR 27 -42.730 1.226 7.021 202 HG1 THR 27 HG1 THR 27 -42.121 2.091 4.385 203 HG21 THR 27 HG21 THR 27 -42.170 -0.159 4.403 204 HG22 THR 27 HG22 THR 27 -42.713 -0.986 5.862 205 HG23 THR 27 HG23 THR 27 -41.160 -0.152 5.848 206 H GLY 28 HN GLY 28 -45.089 3.421 4.909 207 HA2 GLY 28 HA2 GLY 28 -46.613 4.958 5.794 208 HA3 GLY 28 HA1 GLY 28 -46.728 3.977 7.247 209 H ASN 29 HN ASN 29 -43.684 4.936 5.858 210 HA ASN 29 HA ASN 29 -41.960 6.203 6.626 211 HB2 ASN 29 HB2 ASN 29 -43.723 8.022 6.440 212 HB3 ASN 29 HB1 ASN 29 -43.995 7.814 8.168 213 HD21 ASN 29 HD21 ASN 29 -43.312 9.833 8.743 214 HD22 ASN 29 HD22 ASN 29 -41.655 10.345 8.633 215 H MET 30 HN MET 30 -41.773 4.041 7.856 216 HA MET 30 HA MET 30 -42.060 4.379 10.737 217 HB2 MET 30 HB2 MET 30 -41.251 2.036 9.022 218 HB3 MET 30 HB1 MET 30 -41.119 2.011 10.775 219 HG2 MET 30 HG2 MET 30 -43.677 2.498 9.269 220 HG3 MET 30 HG1 MET 30 -43.165 0.933 9.895 221 HE1 MET 30 HE1 MET 30 -42.899 0.383 12.482 222 HE2 MET 30 HE2 MET 30 -43.129 1.573 13.760 223 HE3 MET 30 HE3 MET 30 -41.780 1.738 12.635 224 H GLY 31 HN GLY 31 -39.763 4.961 8.364 225 HA2 GLY 31 HA2 GLY 31 -37.835 6.257 9.285 226 HA3 GLY 31 HA1 GLY 31 -37.596 4.892 10.365 227 H ALA 32 HN ALA 32 -35.615 5.877 8.722 228 HA ALA 32 HA ALA 32 -35.250 4.682 6.248 229 HB1 ALA 32 HB1 ALA 32 -33.123 5.267 8.307 230 HB2 ALA 32 HB2 ALA 32 -33.810 6.445 7.188 231 HB3 ALA 32 HB3 ALA 32 -32.881 5.078 6.572 232 H GLU 33 HN GLU 33 -34.425 3.439 9.471 233 HA GLU 33 HA GLU 33 -33.055 1.143 8.583 234 HB2 GLU 33 HB2 GLU 33 -34.477 1.681 11.195 235 HB3 GLU 33 HB1 GLU 33 -33.437 0.293 10.901 236 HG2 GLU 33 HG2 GLU 33 -32.589 3.176 10.760 237 HG3 GLU 33 HG1 GLU 33 -32.278 2.076 12.103 238 H VAL 34 HN VAL 34 -36.447 1.673 9.409 239 HA VAL 34 HA VAL 34 -37.248 -1.019 9.327 240 HB VAL 34 HB VAL 34 -38.876 1.467 8.792 241 HG11 VAL 34 HG11 VAL 34 -39.713 -1.396 9.180 242 HG12 VAL 34 HG12 VAL 34 -40.145 -0.297 7.868 243 HG13 VAL 34 HG13 VAL 34 -40.800 -0.042 9.486 244 HG21 VAL 34 HG21 VAL 34 -38.474 -0.180 11.284 245 HG22 VAL 34 HG22 VAL 34 -39.627 1.142 11.117 246 HG23 VAL 34 HG23 VAL 34 -37.897 1.465 10.997 247 H ALA 35 HN ALA 35 -37.181 1.469 6.785 248 HA ALA 35 HA ALA 35 -38.291 -0.333 4.843 249 HB1 ALA 35 HB1 ALA 35 -38.546 2.170 4.792 250 HB2 ALA 35 HB2 ALA 35 -38.100 1.388 3.277 251 HB3 ALA 35 HB3 ALA 35 -36.873 2.235 4.222 252 H PHE 36 HN PHE 36 -35.072 0.675 5.810 253 HA PHE 36 HA PHE 36 -33.554 -0.562 3.805 254 HB2 PHE 36 HB2 PHE 36 -32.408 0.760 5.420 255 HB3 PHE 36 HB1 PHE 36 -33.069 -0.163 6.765 256 HD1 PHE 36 HD2 PHE 36 -30.779 -0.407 3.860 257 HD2 PHE 36 HD1 PHE 36 -31.890 -1.955 7.662 258 HE1 PHE 36 HE2 PHE 36 -28.763 -1.815 3.871 259 HE2 PHE 36 HE1 PHE 36 -29.877 -3.368 7.681 260 HZ PHE 36 HZ PHE 36 -28.311 -3.297 5.784 261 H ASN 37 HN ASN 37 -35.009 -1.864 6.775 262 HA ASN 37 HA ASN 37 -34.180 -4.539 6.387 263 HB2 ASN 37 HB2 ASN 37 -36.472 -3.360 7.961 264 HB3 ASN 37 HB1 ASN 37 -36.037 -5.061 8.000 265 HD21 ASN 37 HD21 ASN 37 -33.163 -4.497 7.818 266 HD22 ASN 37 HD22 ASN 37 -32.698 -3.915 9.376 267 H TRP 38 HN TRP 38 -37.084 -2.746 5.432 268 HA TRP 38 HA TRP 38 -38.584 -4.938 4.534 269 HB2 TRP 38 HB2 TRP 38 -39.359 -2.497 4.843 270 HB3 TRP 38 HB1 TRP 38 -38.681 -2.202 3.248 271 HD1 TRP 38 HD1 TRP 38 -39.950 -3.269 1.143 272 HE1 TRP 38 HE1 TRP 38 -42.333 -4.209 0.857 273 HE3 TRP 38 HE3 TRP 38 -41.214 -3.795 6.080 274 HZ2 TRP 38 HZ2 TRP 38 -44.455 -5.062 2.509 275 HZ3 TRP 38 HZ3 TRP 38 -43.442 -4.687 6.634 276 HH2 TRP 38 HH2 TRP 38 -45.024 -5.306 4.884 277 H ILE 39 HN ILE 39 -36.090 -3.009 2.989 278 HA ILE 39 HA ILE 39 -36.555 -4.101 0.398 279 HB ILE 39 HB ILE 39 -35.405 -1.850 1.047 280 HG12 ILE 39 HG12 ILE 39 -34.365 -1.795 -1.156 281 HG13 ILE 39 HG11 ILE 39 -34.351 -3.557 -1.214 282 HG21 ILE 39 HG21 ILE 39 -32.980 -3.615 0.789 283 HG22 ILE 39 HG22 ILE 39 -33.547 -2.931 2.311 284 HG23 ILE 39 HG23 ILE 39 -33.001 -1.865 1.012 285 HD11 ILE 39 HD11 ILE 39 -36.139 -2.557 -2.563 286 HD12 ILE 39 HD12 ILE 39 -36.825 -1.851 -1.098 287 HD13 ILE 39 HD13 ILE 39 -36.758 -3.604 -1.286 288 H ILE 40 HN ILE 40 -34.304 -4.845 3.025 289 HA ILE 40 HA ILE 40 -32.753 -6.605 1.418 290 HB ILE 40 HB ILE 40 -31.736 -7.405 3.494 291 HG12 ILE 40 HG12 ILE 40 -32.409 -5.923 5.569 292 HG13 ILE 40 HG11 ILE 40 -33.967 -5.864 4.749 293 HG21 ILE 40 HG21 ILE 40 -31.090 -4.960 4.275 294 HG22 ILE 40 HG22 ILE 40 -31.973 -4.529 2.814 295 HG23 ILE 40 HG23 ILE 40 -30.579 -5.606 2.718 296 HD11 ILE 40 HD11 ILE 40 -32.502 -8.310 5.705 297 HD12 ILE 40 HD12 ILE 40 -33.966 -8.347 4.723 298 HD13 ILE 40 HD13 ILE 40 -34.007 -7.641 6.341 299 H VAL 41 HN VAL 41 -35.689 -6.988 3.196 300 HA VAL 41 HA VAL 41 -35.738 -9.850 2.903 301 HB VAL 41 HB VAL 41 -38.037 -7.950 3.429 302 HG11 VAL 41 HG11 VAL 41 -38.808 -10.082 2.562 303 HG12 VAL 41 HG12 VAL 41 -39.198 -9.940 4.277 304 HG13 VAL 41 HG13 VAL 41 -37.840 -10.941 3.761 305 HG21 VAL 41 HG21 VAL 41 -36.334 -7.823 5.172 306 HG22 VAL 41 HG22 VAL 41 -36.382 -9.575 5.358 307 HG23 VAL 41 HG23 VAL 41 -37.795 -8.606 5.775 308 H HIS 42 HN HIS 42 -36.803 -7.087 1.010 309 HA HIS 42 HA HIS 42 -38.252 -8.842 -0.847 310 HB2 HIS 42 HB2 HIS 42 -39.219 -6.693 0.161 311 HB3 HIS 42 HB1 HIS 42 -38.144 -5.832 -0.932 312 HD1 HIS 42 HD1 HIS 42 -40.028 -4.817 -2.316 313 HD2 HIS 42 HD2 HIS 42 -40.158 -8.969 -2.138 314 HE1 HIS 42 HE1 HIS 42 -41.709 -5.518 -4.045 315 HE2 HIS 42 HE2 HIS 42 -41.968 -7.999 -3.716 316 H MET 43 HN MET 43 -35.164 -7.961 -0.577 317 HA MET 43 HA MET 43 -34.569 -6.851 -3.121 318 HB2 MET 43 HB2 MET 43 -32.235 -7.278 -2.614 319 HB3 MET 43 HB1 MET 43 -33.044 -6.583 -1.219 320 HG2 MET 43 HG2 MET 43 -33.173 -8.783 -0.186 321 HG3 MET 43 HG1 MET 43 -32.393 -9.498 -1.598 322 HE1 MET 43 HE1 MET 43 -31.319 -9.936 1.380 323 HE2 MET 43 HE2 MET 43 -29.585 -9.749 1.123 324 HE3 MET 43 HE3 MET 43 -30.561 -10.630 -0.053 325 H GLU 44 HN GLU 44 -35.196 -10.028 -2.061 326 HA GLU 44 HA GLU 44 -33.853 -11.608 -3.902 327 HB2 GLU 44 HB2 GLU 44 -35.772 -13.208 -3.560 328 HB3 GLU 44 HB1 GLU 44 -34.981 -12.649 -2.093 329 HG2 GLU 44 HG2 GLU 44 -36.779 -11.043 -1.726 330 HG3 GLU 44 HG1 GLU 44 -37.569 -11.586 -3.203 331 H GLU 45 HN GLU 45 -36.422 -9.399 -4.440 332 HA GLU 45 HA GLU 45 -37.229 -10.544 -6.971 333 HB2 GLU 45 HB2 GLU 45 -37.870 -7.857 -5.750 334 HB3 GLU 45 HB1 GLU 45 -38.622 -8.534 -7.184 335 HG2 GLU 45 HG2 GLU 45 -38.811 -9.616 -4.386 336 HG3 GLU 45 HG1 GLU 45 -40.067 -8.751 -5.266 337 HA PRO 46 HA PRO 46 -33.524 -8.868 -8.922 338 HB2 PRO 46 HB2 PRO 46 -34.490 -9.486 -11.459 339 HB3 PRO 46 HB1 PRO 46 -33.530 -10.571 -10.439 340 HG2 PRO 46 HG2 PRO 46 -36.489 -10.439 -10.840 341 HG3 PRO 46 HG1 PRO 46 -35.442 -11.864 -10.665 342 HD2 PRO 46 HD2 PRO 46 -36.951 -11.034 -8.642 343 HD3 PRO 46 HD1 PRO 46 -35.297 -11.620 -8.354 344 H ASP 47 HN ASP 47 -36.792 -8.314 -10.109 345 HA ASP 47 HA ASP 47 -35.841 -6.047 -11.683 346 HB2 ASP 47 HB2 ASP 47 -36.995 -7.704 -12.928 347 HB3 ASP 47 HB1 ASP 47 -38.308 -7.771 -11.768 348 H PHE 48 HN PHE 48 -37.194 -6.576 -8.696 349 HA PHE 48 HA PHE 48 -38.841 -4.209 -8.648 350 HB2 PHE 48 HB2 PHE 48 -38.176 -6.345 -6.724 351 HB3 PHE 48 HB1 PHE 48 -38.410 -4.746 -6.013 352 HD1 PHE 48 HD1 PHE 48 -40.566 -3.632 -6.133 353 HD2 PHE 48 HD2 PHE 48 -39.984 -7.509 -7.787 354 HE1 PHE 48 HE1 PHE 48 -43.005 -3.943 -6.257 355 HE2 PHE 48 HE2 PHE 48 -42.418 -7.825 -7.919 356 HZ PHE 48 HZ PHE 48 -43.938 -5.983 -7.188 357 H ALA 49 HN ALA 49 -35.529 -4.919 -8.342 358 HA ALA 49 HA ALA 49 -35.007 -2.181 -7.433 359 HB1 ALA 49 HB1 ALA 49 -33.618 -3.857 -6.372 360 HB2 ALA 49 HB2 ALA 49 -32.645 -2.835 -7.430 361 HB3 ALA 49 HB3 ALA 49 -33.093 -4.462 -7.944 362 H GLU 50 HN GLU 50 -35.864 -1.249 -9.247 363 HA GLU 50 HA GLU 50 -35.442 -2.019 -11.880 364 HB2 GLU 50 HB2 GLU 50 -36.201 0.651 -10.710 365 HB3 GLU 50 HB1 GLU 50 -36.248 0.290 -12.434 366 HG2 GLU 50 HG2 GLU 50 -38.261 -0.595 -12.203 367 HG3 GLU 50 HG1 GLU 50 -37.611 -1.792 -11.087 368 HA PRO 51 HA PRO 51 -31.276 -0.915 -12.590 369 HB2 PRO 51 HB2 PRO 51 -31.265 -1.038 -15.295 370 HB3 PRO 51 HB1 PRO 51 -31.343 -2.473 -14.266 371 HG2 PRO 51 HG2 PRO 51 -33.549 -1.055 -15.710 372 HG3 PRO 51 HG1 PRO 51 -33.261 -2.796 -15.531 373 HD2 PRO 51 HD2 PRO 51 -35.071 -1.429 -14.032 374 HD3 PRO 51 HD1 PRO 51 -34.210 -2.865 -13.444 375 H LEU 52 HN LEU 52 -31.871 1.295 -11.780 376 HA LEU 52 HA LEU 52 -31.474 3.233 -13.958 377 HB2 LEU 52 HB2 LEU 52 -33.674 3.498 -12.901 378 HB3 LEU 52 HB1 LEU 52 -32.912 3.646 -11.330 379 HG LEU 52 HG LEU 52 -31.801 5.733 -12.114 380 HD11 LEU 52 HD11 LEU 52 -32.585 6.805 -14.150 381 HD12 LEU 52 HD12 LEU 52 -33.579 5.397 -14.514 382 HD13 LEU 52 HD13 LEU 52 -31.826 5.254 -14.508 383 HD21 LEU 52 HD21 LEU 52 -34.806 5.734 -12.338 384 HD22 LEU 52 HD22 LEU 52 -33.782 7.124 -11.976 385 HD23 LEU 52 HD23 LEU 52 -33.890 5.787 -10.833 386 H THR 53 HN THR 53 -29.367 3.627 -13.940 387 HA THR 53 HA THR 53 -27.293 4.224 -13.297 388 HB THR 53 HB THR 53 -27.089 5.967 -11.539 389 HG1 THR 53 HG1 THR 53 -29.413 4.991 -10.709 390 HG21 THR 53 HG21 THR 53 -29.305 6.408 -13.535 391 HG22 THR 53 HG22 THR 53 -27.577 6.561 -13.854 392 HG23 THR 53 HG23 THR 53 -28.372 7.670 -12.734 393 H MET 54 HN MET 54 -26.680 2.113 -12.788 394 HA MET 54 HA MET 54 -26.947 1.070 -10.118 395 HB2 MET 54 HB2 MET 54 -26.937 -0.382 -12.111 396 HB3 MET 54 HB1 MET 54 -25.283 0.112 -12.451 397 HG2 MET 54 HG2 MET 54 -25.263 -2.049 -11.428 398 HG3 MET 54 HG1 MET 54 -24.576 -0.878 -10.307 399 HE1 MET 54 HE1 MET 54 -24.849 -2.747 -8.379 400 HE2 MET 54 HE2 MET 54 -25.567 -3.840 -9.565 401 HE3 MET 54 HE3 MET 54 -26.382 -3.546 -8.029 402 HA PRO 55 HA PRO 55 -23.114 3.141 -8.941 403 HB2 PRO 55 HB2 PRO 55 -23.844 3.723 -6.458 404 HB3 PRO 55 HB1 PRO 55 -24.631 4.519 -7.826 405 HG2 PRO 55 HG2 PRO 55 -25.655 2.387 -6.035 406 HG3 PRO 55 HG1 PRO 55 -26.545 3.647 -6.906 407 HD2 PRO 55 HD2 PRO 55 -26.134 0.918 -7.682 408 HD3 PRO 55 HD1 PRO 55 -26.994 2.185 -8.577 409 H GLY 56 HN GLY 56 -22.074 3.002 -6.454 410 HA2 GLY 56 HA2 GLY 56 -21.959 0.243 -5.539 411 HA3 GLY 56 HA1 GLY 56 -20.480 0.868 -6.254 412 H TYR 57 HN TYR 57 -20.514 3.472 -5.346 413 HA TYR 57 HA TYR 57 -19.751 4.731 -3.621 414 HB2 TYR 57 HB2 TYR 57 -22.166 4.554 -3.020 415 HB3 TYR 57 HB1 TYR 57 -21.772 3.189 -1.984 416 HD1 TYR 57 HD1 TYR 57 -20.959 6.795 -2.499 417 HD2 TYR 57 HD2 TYR 57 -21.229 3.562 0.255 418 HE1 TYR 57 HE1 TYR 57 -20.505 8.345 -0.644 419 HE2 TYR 57 HE2 TYR 57 -20.779 5.104 2.117 420 HH TYR 57 HH TYR 57 -20.775 8.539 1.714 421 H GLY 58 HN GLY 58 -17.677 3.738 -3.689 422 HA2 GLY 58 HA2 GLY 58 -16.175 3.216 -1.716 423 HA3 GLY 58 HA1 GLY 58 -17.197 1.799 -1.519 424 H GLY 59 HN GLY 59 -14.471 3.100 -3.069 425 HA2 GLY 59 HA2 GLY 59 -14.200 0.628 -4.657 426 HA3 GLY 59 HA1 GLY 59 -13.814 2.199 -5.350 427 H ALA 60 HN ALA 60 -13.146 0.883 -2.147 428 HA ALA 60 HA ALA 60 -11.251 0.304 -1.055 429 HB1 ALA 60 HB1 ALA 60 -10.629 -0.986 -3.030 430 HB2 ALA 60 HB2 ALA 60 -9.221 -0.253 -2.258 431 HB3 ALA 60 HB3 ALA 60 -9.883 0.451 -3.735 432 H ALA 61 HN ALA 61 -9.929 1.422 0.203 433 HA ALA 61 HA ALA 61 -9.342 4.194 -0.549 434 HB1 ALA 61 HB1 ALA 61 -10.430 3.835 1.612 435 HB2 ALA 61 HB2 ALA 61 -8.822 4.529 1.816 436 HB3 ALA 61 HB3 ALA 61 -9.088 2.813 2.124 437 H SER 62 HN SER 62 -7.810 1.200 0.475 438 HA SER 62 HA SER 62 -5.156 2.296 0.020 439 HB2 SER 62 HB2 SER 62 -4.813 -0.382 0.515 440 HB3 SER 62 HB1 SER 62 -4.839 0.875 1.754 441 HG SER 62 HG SER 62 -6.580 -1.145 1.354 442 H ALA 63 HN ALA 63 -3.846 1.749 -1.686 443 HA ALA 63 HA ALA 63 -5.299 0.637 -3.985 444 HB1 ALA 63 HB1 ALA 63 -2.830 2.367 -3.896 445 HB2 ALA 63 HB2 ALA 63 -4.477 2.922 -4.209 446 HB3 ALA 63 HB3 ALA 63 -3.675 1.847 -5.357 447 H GLY 64 HN GLY 64 -3.435 -0.635 -1.742 448 HA2 GLY 64 HA2 GLY 64 -2.908 -3.021 -2.683 449 HA3 GLY 64 HA1 GLY 64 -1.669 -2.120 -3.548 450 H ALA 65 HN ALA 65 -1.865 -4.184 -1.225 451 HA ALA 65 HA ALA 65 -0.336 -2.762 0.819 452 HB1 ALA 65 HB1 ALA 65 -2.137 -4.288 1.519 453 HB2 ALA 65 HB2 ALA 65 -0.562 -4.775 2.143 454 HB3 ALA 65 HB3 ALA 65 -1.268 -5.630 0.772 455 H SER 66 HN SER 66 1.813 -2.799 0.879 456 HA SER 66 HA SER 66 3.279 -5.097 -0.128 457 HB2 SER 66 HB2 SER 66 3.783 -2.300 -1.191 458 HB3 SER 66 HB1 SER 66 4.756 -3.727 -1.550 459 HG SER 66 HG SER 66 2.194 -4.288 -2.059 460 H VAL 67 HN VAL 67 5.256 -5.363 0.892 461 HA VAL 67 HA VAL 67 5.864 -3.379 2.980 462 HB VAL 67 HB VAL 67 4.925 -5.399 3.983 463 HG11 VAL 67 HG11 VAL 67 7.199 -6.862 2.653 464 HG12 VAL 67 HG12 VAL 67 5.486 -7.018 2.273 465 HG13 VAL 67 HG13 VAL 67 6.094 -7.553 3.841 466 HG21 VAL 67 HG21 VAL 67 6.606 -4.188 5.246 467 HG22 VAL 67 HG22 VAL 67 7.889 -5.124 4.476 468 HG23 VAL 67 HG23 VAL 67 6.740 -5.921 5.551 469 H PHE 68 HN PHE 68 7.920 -2.706 3.188 470 HA PHE 68 HA PHE 68 9.935 -3.949 1.439 471 HB2 PHE 68 HB2 PHE 68 9.655 -1.067 2.190 472 HB3 PHE 68 HB1 PHE 68 10.977 -1.722 1.248 473 HD1 PHE 68 HD1 PHE 68 7.430 -0.818 1.247 474 HD2 PHE 68 HD2 PHE 68 10.668 -2.356 -1.051 475 HE1 PHE 68 HE1 PHE 68 6.133 -0.465 -0.812 476 HE2 PHE 68 HE2 PHE 68 9.372 -2.011 -3.112 477 HZ PHE 68 HZ PHE 68 7.102 -1.061 -2.996 478 H GLY 69 HN GLY 69 12.197 -3.682 2.202 479 HA2 GLY 69 HA2 GLY 69 13.831 -3.625 3.830 480 HA3 GLY 69 HA1 GLY 69 12.669 -2.874 4.913 481 H ALA 70 HN ALA 70 13.794 -5.941 3.606 482 HA ALA 70 HA ALA 70 12.925 -7.216 6.111 483 HB1 ALA 70 HB1 ALA 70 12.103 -9.167 4.933 484 HB2 ALA 70 HB2 ALA 70 12.513 -8.435 3.381 485 HB3 ALA 70 HB3 ALA 70 11.244 -7.729 4.382 486 H SER 71 HN SER 71 14.403 -8.572 6.974 487 HA SER 71 HA SER 71 17.026 -8.655 5.865 488 HB2 SER 71 HB2 SER 71 15.903 -10.232 8.191 489 HB3 SER 71 HB1 SER 71 17.609 -9.932 7.850 490 HG SER 71 HG SER 71 16.793 -7.578 7.927 491 H GLY 72 HN GLY 72 16.701 -9.628 3.871 492 HA2 GLY 72 HA2 GLY 72 17.252 -12.235 3.423 493 HA3 GLY 72 HA1 GLY 72 15.506 -12.250 3.657 494 H LEU 73 HN LEU 73 14.734 -9.925 2.538 495 HA LEU 73 HA LEU 73 15.196 -10.266 -0.285 496 HB2 LEU 73 HB2 LEU 73 13.518 -8.384 1.351 497 HB3 LEU 73 HB1 LEU 73 13.772 -8.097 -0.356 498 HG LEU 73 HG LEU 73 11.639 -9.200 0.018 499 HD11 LEU 73 HD11 LEU 73 13.676 -11.008 -1.273 500 HD12 LEU 73 HD12 LEU 73 12.793 -9.692 -2.050 501 HD13 LEU 73 HD13 LEU 73 11.928 -11.122 -1.482 502 HD21 LEU 73 HD21 LEU 73 11.379 -11.281 1.069 503 HD22 LEU 73 HD22 LEU 73 12.464 -10.372 2.124 504 HD23 LEU 73 HD23 LEU 73 13.111 -11.606 1.045 505 H ASP 74 HN ASP 74 15.721 -7.778 2.161 506 HA ASP 74 HA ASP 74 17.677 -6.407 0.492 507 HB2 ASP 74 HB2 ASP 74 16.741 -5.788 3.309 508 HB3 ASP 74 HB1 ASP 74 17.730 -4.747 2.292 509 H ASN 75 HN ASN 75 19.754 -7.032 0.564 510 HA ASN 75 HA ASN 75 20.779 -8.018 3.142 511 HB2 ASN 75 HB2 ASN 75 22.147 -9.646 2.109 512 HB3 ASN 75 HB1 ASN 75 20.579 -9.810 1.332 513 HD21 ASN 75 HD21 ASN 75 23.371 -10.453 0.516 514 HD22 ASN 75 HD22 ASN 75 23.575 -9.705 -1.034 515 H GLN 76 HN GLN 76 20.650 -5.383 2.028 516 HA GLN 76 HA GLN 76 23.232 -4.592 1.117 517 HB2 GLN 76 HB2 GLN 76 21.153 -3.302 0.655 518 HB3 GLN 76 HB1 GLN 76 21.044 -2.918 2.367 519 HG2 GLN 76 HG2 GLN 76 23.393 -1.921 2.078 520 HG3 GLN 76 HG1 GLN 76 23.036 -1.972 0.354 521 HE21 GLN 76 HE21 GLN 76 23.406 0.302 2.223 522 HE22 GLN 76 HE22 GLN 76 21.982 1.270 2.051 523 HA PRO 77 HA PRO 77 25.447 -4.530 4.991 524 HB2 PRO 77 HB2 PRO 77 26.775 -2.228 3.652 525 HB3 PRO 77 HB1 PRO 77 27.494 -3.635 4.436 526 HG2 PRO 77 HG2 PRO 77 27.438 -3.464 1.808 527 HG3 PRO 77 HG1 PRO 77 27.095 -5.004 2.615 528 HD2 PRO 77 HD2 PRO 77 25.209 -3.045 1.374 529 HD3 PRO 77 HD1 PRO 77 25.176 -4.818 1.339 530 HA PRO 78 HA PRO 78 23.622 -1.375 7.425 531 HB2 PRO 78 HB2 PRO 78 25.638 -0.677 9.127 532 HB3 PRO 78 HB1 PRO 78 24.730 -2.188 9.267 533 HG2 PRO 78 HG2 PRO 78 27.384 -1.699 7.981 534 HG3 PRO 78 HG1 PRO 78 26.920 -3.006 9.082 535 HD2 PRO 78 HD2 PRO 78 27.051 -3.387 6.451 536 HD3 PRO 78 HD1 PRO 78 25.774 -4.139 7.415 537 H GLU 79 HN GLU 79 23.140 0.437 6.412 538 HA GLU 79 HA GLU 79 24.856 2.058 4.961 539 HB2 GLU 79 HB2 GLU 79 22.999 3.830 5.410 540 HB3 GLU 79 HB1 GLU 79 22.659 2.402 4.448 541 HG2 GLU 79 HG2 GLU 79 22.139 2.296 7.365 542 HG3 GLU 79 HG1 GLU 79 21.019 3.193 6.339 543 H GLU 80 HN GLU 80 24.202 2.025 8.377 544 HA GLU 80 HA GLU 80 25.371 4.463 9.085 545 HB2 GLU 80 HB2 GLU 80 24.384 3.460 10.900 546 HB3 GLU 80 HB1 GLU 80 24.916 1.853 10.431 547 HG2 GLU 80 HG2 GLU 80 27.136 2.287 11.215 548 HG3 GLU 80 HG1 GLU 80 26.733 3.976 11.541 549 H ILE 81 HN ILE 81 26.803 1.253 8.653 550 HA ILE 81 HA ILE 81 29.423 2.193 9.272 551 HB ILE 81 HB ILE 81 28.459 -0.443 8.195 552 HG12 ILE 81 HG12 ILE 81 29.621 0.375 10.866 553 HG13 ILE 81 HG11 ILE 81 27.912 0.097 10.547 554 HG21 ILE 81 HG21 ILE 81 30.900 -1.073 8.936 555 HG22 ILE 81 HG22 ILE 81 31.206 0.634 8.575 556 HG23 ILE 81 HG23 ILE 81 30.574 -0.437 7.325 557 HD11 ILE 81 HD11 ILE 81 30.150 -1.853 10.752 558 HD12 ILE 81 HD12 ILE 81 28.742 -2.249 9.773 559 HD13 ILE 81 HD13 ILE 81 28.549 -1.897 11.494 560 H VAL 82 HN VAL 82 27.727 1.324 6.255 561 HA VAL 82 HA VAL 82 29.937 1.569 4.554 562 HB VAL 82 HB VAL 82 28.436 1.916 2.736 563 HG11 VAL 82 HG11 VAL 82 26.749 0.144 3.068 564 HG12 VAL 82 HG12 VAL 82 27.153 0.131 4.785 565 HG13 VAL 82 HG13 VAL 82 28.369 -0.319 3.588 566 HG21 VAL 82 HG21 VAL 82 26.778 3.375 2.918 567 HG22 VAL 82 HG22 VAL 82 26.837 3.303 4.681 568 HG23 VAL 82 HG23 VAL 82 25.859 2.137 3.779 569 H ALA 83 HN ALA 83 27.743 3.921 5.925 570 HA ALA 83 HA ALA 83 28.650 6.272 4.726 571 HB1 ALA 83 HB1 ALA 83 27.823 7.220 7.019 572 HB2 ALA 83 HB2 ALA 83 27.268 5.552 7.265 573 HB3 ALA 83 HB3 ALA 83 26.675 6.491 5.890 574 H ILE 84 HN ILE 84 29.620 4.700 7.771 575 HA ILE 84 HA ILE 84 31.556 6.567 8.560 576 HB ILE 84 HB ILE 84 31.371 3.596 9.093 577 HG12 ILE 84 HG12 ILE 84 30.818 5.714 11.119 578 HG13 ILE 84 HG11 ILE 84 29.614 5.423 9.874 579 HG21 ILE 84 HG21 ILE 84 33.089 5.647 10.483 580 HG22 ILE 84 HG22 ILE 84 33.668 4.376 9.403 581 HG23 ILE 84 HG23 ILE 84 32.915 3.951 10.943 582 HD11 ILE 84 HD11 ILE 84 30.711 3.223 11.582 583 HD12 ILE 84 HD12 ILE 84 29.249 3.233 10.585 584 HD13 ILE 84 HD13 ILE 84 29.325 4.204 12.057 585 H ILE 85 HN ILE 85 31.776 3.705 6.517 586 HA ILE 85 HA ILE 85 34.577 3.683 6.268 587 HB ILE 85 HB ILE 85 32.465 2.579 4.427 588 HG12 ILE 85 HG12 ILE 85 34.111 1.229 6.571 589 HG13 ILE 85 HG11 ILE 85 32.454 1.777 6.784 590 HG21 ILE 85 HG21 ILE 85 35.389 2.618 4.275 591 HG22 ILE 85 HG22 ILE 85 34.184 2.292 3.028 592 HG23 ILE 85 HG23 ILE 85 34.679 1.010 4.130 593 HD11 ILE 85 HD11 ILE 85 32.697 -0.654 6.327 594 HD12 ILE 85 HD12 ILE 85 33.288 -0.234 4.720 595 HD13 ILE 85 HD13 ILE 85 31.650 0.202 5.197 596 H THR 86 HN THR 86 32.035 5.031 4.145 597 HA THR 86 HA THR 86 33.967 6.110 2.345 598 HB THR 86 HB THR 86 31.918 5.744 1.311 599 HG1 THR 86 HG1 THR 86 32.877 7.855 0.851 600 HG21 THR 86 HG21 THR 86 30.225 5.511 2.773 601 HG22 THR 86 HG22 THR 86 29.861 7.155 2.218 602 HG23 THR 86 HG23 THR 86 30.717 6.906 3.743 603 H SER 87 HN SER 87 32.628 7.188 5.337 604 HA SER 87 HA SER 87 33.515 9.894 5.102 605 HB2 SER 87 HB2 SER 87 32.969 8.243 7.578 606 HB3 SER 87 HB1 SER 87 33.211 9.989 7.550 607 HG SER 87 HG SER 87 31.122 8.535 6.273 608 H MET 88 HN MET 88 34.988 6.861 5.992 609 HA MET 88 HA MET 88 37.376 7.871 7.122 610 HB2 MET 88 HB2 MET 88 36.813 5.285 5.674 611 HB3 MET 88 HB1 MET 88 38.355 5.645 6.439 612 HG2 MET 88 HG2 MET 88 35.685 5.413 7.806 613 HG3 MET 88 HG1 MET 88 37.001 4.241 7.863 614 HE1 MET 88 HE1 MET 88 39.539 6.178 8.085 615 HE2 MET 88 HE2 MET 88 39.352 4.722 9.066 616 HE3 MET 88 HE3 MET 88 39.749 6.258 9.836 617 H GLY 89 HN GLY 89 36.218 7.570 3.904 618 HA2 GLY 89 HA2 GLY 89 37.462 9.242 2.425 619 HA3 GLY 89 HA1 GLY 89 38.857 8.249 2.816 620 H PHE 90 HN PHE 90 36.640 6.012 2.807 621 HA PHE 90 HA PHE 90 37.228 5.168 0.109 622 HB2 PHE 90 HB2 PHE 90 35.661 3.827 2.325 623 HB3 PHE 90 HB1 PHE 90 36.127 3.060 0.806 624 HD1 PHE 90 HD1 PHE 90 38.853 3.716 0.376 625 HD2 PHE 90 HD2 PHE 90 36.876 3.003 4.077 626 HE1 PHE 90 HE1 PHE 90 40.988 3.022 1.382 627 HE2 PHE 90 HE2 PHE 90 39.011 2.319 5.088 628 HZ PHE 90 HZ PHE 90 41.107 2.434 3.736 629 H GLN 91 HN GLN 91 35.114 3.853 -0.795 630 HA GLN 91 HA GLN 91 33.141 5.967 -1.209 631 HB2 GLN 91 HB2 GLN 91 34.235 5.067 -3.207 632 HB3 GLN 91 HB1 GLN 91 33.726 3.445 -2.767 633 HG2 GLN 91 HG2 GLN 91 31.385 4.182 -2.971 634 HG3 GLN 91 HG1 GLN 91 31.954 5.754 -3.523 635 HE21 GLN 91 HE21 GLN 91 30.264 3.911 -4.919 636 HE22 GLN 91 HE22 GLN 91 31.088 3.452 -6.373 637 H ARG 92 HN ARG 92 30.891 5.532 -0.957 638 HA ARG 92 HA ARG 92 30.137 3.860 1.153 639 HB2 ARG 92 HB2 ARG 92 28.726 5.695 0.347 640 HB3 ARG 92 HB1 ARG 92 28.419 4.815 -1.136 641 HG2 ARG 92 HG2 ARG 92 27.666 2.959 0.628 642 HG3 ARG 92 HG1 ARG 92 27.310 4.415 1.561 643 HD2 ARG 92 HD2 ARG 92 26.347 3.921 -1.245 644 HD3 ARG 92 HD1 ARG 92 25.417 3.523 0.194 645 HE ARG 92 HE ARG 92 26.265 6.274 0.104 646 HH11 ARG 92 HH11 ARG 92 23.874 3.991 -1.026 647 HH12 ARG 92 HH12 ARG 92 22.590 5.152 -1.102 648 HH21 ARG 92 HH21 ARG 92 24.571 7.835 0.013 649 HH22 ARG 92 HH22 ARG 92 22.991 7.340 -0.534 650 H ASN 93 HN ASN 93 29.623 3.346 -2.327 651 HA ASN 93 HA ASN 93 28.578 0.763 -2.192 652 HB2 ASN 93 HB2 ASN 93 28.533 2.187 -4.197 653 HB3 ASN 93 HB1 ASN 93 30.267 1.955 -4.402 654 HD21 ASN 93 HD21 ASN 93 30.106 0.985 -6.389 655 HD22 ASN 93 HD22 ASN 93 29.417 -0.589 -6.625 656 H GLN 94 HN GLN 94 31.908 1.857 -2.311 657 HA GLN 94 HA GLN 94 33.126 -0.674 -2.578 658 HB2 GLN 94 HB2 GLN 94 34.529 1.097 -3.084 659 HB3 GLN 94 HB1 GLN 94 33.992 2.044 -1.712 660 HG2 GLN 94 HG2 GLN 94 35.356 0.854 -0.216 661 HG3 GLN 94 HG1 GLN 94 35.657 -0.431 -1.382 662 HE21 GLN 94 HE21 GLN 94 37.099 -0.047 -3.095 663 HE22 GLN 94 HE22 GLN 94 38.235 1.263 -3.041 664 H ALA 95 HN ALA 95 32.148 1.290 0.160 665 HA ALA 95 HA ALA 95 33.040 -0.396 2.226 666 HB1 ALA 95 HB1 ALA 95 30.698 1.505 2.137 667 HB2 ALA 95 HB2 ALA 95 32.360 1.922 2.569 668 HB3 ALA 95 HB3 ALA 95 31.423 0.828 3.597 669 H ILE 96 HN ILE 96 30.066 -0.321 0.313 670 HA ILE 96 HA ILE 96 28.613 -2.218 1.757 671 HB ILE 96 HB ILE 96 28.474 -1.245 -1.060 672 HG12 ILE 96 HG12 ILE 96 25.990 -1.324 0.337 673 HG13 ILE 96 HG11 ILE 96 27.219 -0.693 1.427 674 HG21 ILE 96 HG21 ILE 96 26.443 -2.735 -1.340 675 HG22 ILE 96 HG22 ILE 96 27.080 -3.670 0.022 676 HG23 ILE 96 HG23 ILE 96 28.020 -3.516 -1.464 677 HD11 ILE 96 HD11 ILE 96 26.453 0.365 -1.272 678 HD12 ILE 96 HD12 ILE 96 27.848 0.918 -0.351 679 HD13 ILE 96 HD13 ILE 96 26.223 1.142 0.297 680 H GLN 97 HN GLN 97 30.613 -2.673 -1.154 681 HA GLN 97 HA GLN 97 30.406 -5.437 -1.340 682 HB2 GLN 97 HB2 GLN 97 31.451 -4.081 -3.080 683 HB3 GLN 97 HB1 GLN 97 32.799 -3.742 -2.010 684 HG2 GLN 97 HG2 GLN 97 33.459 -6.033 -1.990 685 HG3 GLN 97 HG1 GLN 97 32.020 -6.500 -2.885 686 HE21 GLN 97 HE21 GLN 97 32.205 -4.194 -4.685 687 HE22 GLN 97 HE22 GLN 97 33.507 -4.554 -5.775 688 H ALA 98 HN ALA 98 32.712 -3.477 0.450 689 HA ALA 98 HA ALA 98 34.296 -5.540 1.444 690 HB1 ALA 98 HB1 ALA 98 34.584 -2.966 1.556 691 HB2 ALA 98 HB2 ALA 98 35.245 -3.960 2.853 692 HB3 ALA 98 HB3 ALA 98 33.711 -3.112 3.082 693 H LEU 99 HN LEU 99 31.517 -3.911 3.009 694 HA LEU 99 HA LEU 99 31.485 -5.532 5.288 695 HB2 LEU 99 HB2 LEU 99 29.234 -4.065 3.962 696 HB3 LEU 99 HB1 LEU 99 29.136 -4.783 5.549 697 HG LEU 99 HG LEU 99 31.113 -2.630 4.832 698 HD11 LEU 99 HD11 LEU 99 28.533 -2.285 6.322 699 HD12 LEU 99 HD12 LEU 99 28.715 -1.942 4.606 700 HD13 LEU 99 HD13 LEU 99 29.658 -1.033 5.788 701 HD21 LEU 99 HD21 LEU 99 31.967 -3.169 6.805 702 HD22 LEU 99 HD22 LEU 99 30.665 -4.310 7.106 703 HD23 LEU 99 HD23 LEU 99 30.463 -2.616 7.541 704 H ARG 100 HN ARG 100 30.001 -5.973 2.119 705 HA ARG 100 HA ARG 100 28.299 -8.111 2.672 706 HB2 ARG 100 HB2 ARG 100 29.951 -7.429 0.252 707 HB3 ARG 100 HB1 ARG 100 28.938 -8.867 0.291 708 HG2 ARG 100 HG2 ARG 100 26.960 -7.588 0.490 709 HG3 ARG 100 HG1 ARG 100 27.869 -6.107 0.816 710 HD2 ARG 100 HD2 ARG 100 28.695 -6.025 -1.398 711 HD3 ARG 100 HD1 ARG 100 28.121 -7.657 -1.754 712 HE ARG 100 HE ARG 100 25.858 -6.265 -1.125 713 HH11 ARG 100 HH11 ARG 100 28.435 -5.867 -3.470 714 HH12 ARG 100 HH12 ARG 100 27.441 -5.011 -4.602 715 HH21 ARG 100 HH21 ARG 100 24.544 -5.175 -2.632 716 HH22 ARG 100 HH22 ARG 100 25.226 -4.615 -4.131 717 H ALA 101 HN ALA 101 31.719 -8.094 1.880 718 HA ALA 101 HA ALA 101 32.084 -10.913 2.077 719 HB1 ALA 101 HB1 ALA 101 34.547 -10.144 2.177 720 HB2 ALA 101 HB2 ALA 101 33.873 -8.533 1.880 721 HB3 ALA 101 HB3 ALA 101 33.610 -9.831 0.715 722 H THR 102 HN THR 102 32.515 -8.195 4.297 723 HA THR 102 HA THR 102 33.794 -9.825 6.304 724 HB THR 102 HB THR 102 34.059 -7.805 7.549 725 HG1 THR 102 HG1 THR 102 32.898 -5.936 7.040 726 HG21 THR 102 HG21 THR 102 35.611 -7.195 6.064 727 HG22 THR 102 HG22 THR 102 34.390 -6.364 5.112 728 HG23 THR 102 HG23 THR 102 34.757 -8.059 4.796 729 H ASN 103 HN ASN 103 30.675 -9.676 5.420 730 HA ASN 103 HA ASN 103 28.659 -10.049 6.351 731 HB2 ASN 103 HB2 ASN 103 30.378 -11.039 8.620 732 HB3 ASN 103 HB1 ASN 103 28.626 -11.123 8.630 733 HD21 ASN 103 HD21 ASN 103 27.568 -12.515 7.212 734 HD22 ASN 103 HD22 ASN 103 28.407 -13.817 6.428 735 H ASN 104 HN ASN 104 29.437 -7.491 6.350 736 HA ASN 104 HA ASN 104 28.793 -5.455 7.103 737 HB2 ASN 104 HB2 ASN 104 27.181 -6.941 9.190 738 HB3 ASN 104 HB1 ASN 104 26.982 -5.257 8.707 739 HD21 ASN 104 HD21 ASN 104 27.438 -5.948 5.862 740 HD22 ASN 104 HD22 ASN 104 25.966 -6.682 5.320 741 H ASN 105 HN ASN 105 31.067 -7.027 8.306 742 HA ASN 105 HA ASN 105 31.351 -5.771 10.909 743 HB2 ASN 105 HB2 ASN 105 32.312 -8.066 10.317 744 HB3 ASN 105 HB1 ASN 105 33.499 -7.206 9.340 745 HD21 ASN 105 HD21 ASN 105 32.389 -7.875 12.567 746 HD22 ASN 105 HD22 ASN 105 33.776 -7.239 13.394 747 H LEU 106 HN LEU 106 31.869 -3.760 11.062 748 HA LEU 106 HA LEU 106 32.470 -2.056 8.940 749 HB2 LEU 106 HB2 LEU 106 31.453 -1.317 11.001 750 HB3 LEU 106 HB1 LEU 106 32.866 -1.762 11.919 751 HG LEU 106 HG LEU 106 33.186 0.307 9.797 752 HD11 LEU 106 HD11 LEU 106 32.199 1.043 12.527 753 HD12 LEU 106 HD12 LEU 106 31.077 0.720 11.211 754 HD13 LEU 106 HD13 LEU 106 32.249 2.033 11.065 755 HD21 LEU 106 HD21 LEU 106 34.745 1.243 11.438 756 HD22 LEU 106 HD22 LEU 106 35.124 -0.434 11.046 757 HD23 LEU 106 HD23 LEU 106 34.319 -0.046 12.567 758 H GLU 107 HN GLU 107 34.547 -3.001 11.608 759 HA GLU 107 HA GLU 107 36.930 -1.877 10.753 760 HB2 GLU 107 HB2 GLU 107 36.518 -4.379 12.396 761 HB3 GLU 107 HB1 GLU 107 37.996 -3.432 12.325 762 HG2 GLU 107 HG2 GLU 107 35.471 -2.075 13.090 763 HG3 GLU 107 HG1 GLU 107 36.267 -3.117 14.270 764 H ARG 108 HN ARG 108 35.737 -5.183 10.204 765 HA ARG 108 HA ARG 108 38.002 -6.031 8.732 766 HB2 ARG 108 HB2 ARG 108 36.229 -7.483 9.839 767 HB3 ARG 108 HB1 ARG 108 35.217 -7.129 8.460 768 HG2 ARG 108 HG2 ARG 108 36.897 -8.137 6.989 769 HG3 ARG 108 HG1 ARG 108 37.858 -8.556 8.415 770 HD2 ARG 108 HD2 ARG 108 35.000 -9.365 8.058 771 HD3 ARG 108 HD1 ARG 108 36.344 -10.376 7.518 772 HE ARG 108 HE ARG 108 37.045 -10.083 10.025 773 HH11 ARG 108 HH11 ARG 108 33.778 -10.530 8.807 774 HH12 ARG 108 HH12 ARG 108 33.219 -11.357 10.222 775 HH21 ARG 108 HH21 ARG 108 36.310 -11.151 11.899 776 HH22 ARG 108 HH22 ARG 108 34.659 -11.699 11.999 777 H ALA 109 HN ALA 109 35.055 -4.338 7.859 778 HA ALA 109 HA ALA 109 35.169 -4.744 5.082 779 HB1 ALA 109 HB1 ALA 109 33.509 -3.357 6.811 780 HB2 ALA 109 HB2 ALA 109 33.364 -3.401 5.054 781 HB3 ALA 109 HB3 ALA 109 34.245 -2.089 5.830 782 H LEU 110 HN LEU 110 36.348 -2.101 7.137 783 HA LEU 110 HA LEU 110 37.781 -0.681 5.196 784 HB2 LEU 110 HB2 LEU 110 38.418 -1.010 8.123 785 HB3 LEU 110 HB1 LEU 110 38.973 0.290 7.089 786 HG LEU 110 HG LEU 110 36.049 -0.186 7.574 787 HD11 LEU 110 HD11 LEU 110 37.930 1.510 9.210 788 HD12 LEU 110 HD12 LEU 110 37.087 0.056 9.751 789 HD13 LEU 110 HD13 LEU 110 36.171 1.507 9.341 790 HD21 LEU 110 HD21 LEU 110 35.887 2.169 6.980 791 HD22 LEU 110 HD22 LEU 110 36.681 1.242 5.704 792 HD23 LEU 110 HD23 LEU 110 37.640 2.250 6.789 793 H ASP 111 HN ASP 111 38.649 -3.336 7.304 794 HA ASP 111 HA ASP 111 41.321 -3.762 6.678 795 HB2 ASP 111 HB2 ASP 111 39.713 -5.074 8.286 796 HB3 ASP 111 HB1 ASP 111 39.380 -6.039 6.860 797 H TRP 112 HN TRP 112 38.448 -5.047 5.134 798 HA TRP 112 HA TRP 112 39.692 -6.473 3.065 799 HB2 TRP 112 HB2 TRP 112 37.332 -6.697 3.957 800 HB3 TRP 112 HB1 TRP 112 36.929 -5.273 3.008 801 HD1 TRP 112 HD1 TRP 112 36.185 -5.710 0.567 802 HE1 TRP 112 HE1 TRP 112 36.205 -7.744 -1.019 803 HE3 TRP 112 HE3 TRP 112 38.890 -8.958 3.448 804 HZ2 TRP 112 HZ2 TRP 112 37.240 -10.361 -1.043 805 HZ3 TRP 112 HZ3 TRP 112 39.350 -11.210 2.564 806 HH2 TRP 112 HH2 TRP 112 38.542 -11.895 0.367 807 H ILE 113 HN ILE 113 38.232 -3.279 3.170 808 HA ILE 113 HA ILE 113 38.666 -2.598 0.484 809 HB ILE 113 HB ILE 113 38.325 -0.834 2.915 810 HG12 ILE 113 HG12 ILE 113 36.393 -1.825 0.802 811 HG13 ILE 113 HG11 ILE 113 36.405 -2.271 2.501 812 HG21 ILE 113 HG21 ILE 113 38.143 -0.120 -0.013 813 HG22 ILE 113 HG22 ILE 113 39.426 0.374 1.089 814 HG23 ILE 113 HG23 ILE 113 37.780 0.953 1.338 815 HD11 ILE 113 HD11 ILE 113 36.060 0.579 1.715 816 HD12 ILE 113 HD12 ILE 113 35.520 -0.276 3.163 817 HD13 ILE 113 HD13 ILE 113 34.709 -0.545 1.626 818 H PHE 114 HN PHE 114 40.647 -2.174 3.376 819 HA PHE 114 HA PHE 114 42.641 -0.544 2.220 820 HB2 PHE 114 HB2 PHE 114 42.255 -0.986 4.691 821 HB3 PHE 114 HB1 PHE 114 43.036 -2.547 4.440 822 HD1 PHE 114 HD1 PHE 114 43.563 1.111 4.293 823 HD2 PHE 114 HD2 PHE 114 45.392 -2.735 4.370 824 HE1 PHE 114 HE1 PHE 114 45.759 2.165 4.631 825 HE2 PHE 114 HE2 PHE 114 47.593 -1.682 4.707 826 HZ PHE 114 HZ PHE 114 47.775 0.770 4.841 827 H SER 115 HN SER 115 42.009 -3.926 2.139 828 HA SER 115 HA SER 115 44.586 -4.716 1.162 829 HB2 SER 115 HB2 SER 115 41.919 -6.139 1.163 830 HB3 SER 115 HB1 SER 115 43.472 -6.896 0.804 831 HG SER 115 HG SER 115 42.666 -5.693 3.259 832 H HIS 116 HN HIS 116 42.105 -2.987 -0.121 833 HA HIS 116 HA HIS 116 43.201 -3.397 -2.806 834 HB2 HIS 116 HB2 HIS 116 40.993 -4.535 -2.715 835 HB3 HIS 116 HB1 HIS 116 40.249 -3.028 -2.198 836 HD1 HIS 116 HD1 HIS 116 42.583 -3.867 -5.101 837 HD2 HIS 116 HD2 HIS 116 38.942 -2.003 -4.325 838 HE1 HIS 116 HE1 HIS 116 41.768 -3.000 -7.321 839 HE2 HIS 116 HE2 HIS 116 39.513 -1.978 -6.849 840 HA PRO 117 HA PRO 117 43.850 0.698 -0.603 841 HB2 PRO 117 HB2 PRO 117 45.684 1.329 -2.670 842 HB3 PRO 117 HB1 PRO 117 46.061 0.796 -1.032 843 HG2 PRO 117 HG2 PRO 117 45.811 -0.793 -3.553 844 HG3 PRO 117 HG1 PRO 117 46.934 -1.015 -2.185 845 HD2 PRO 117 HD2 PRO 117 44.892 -2.659 -2.411 846 HD3 PRO 117 HD1 PRO 117 45.237 -1.942 -0.820 847 H GLU 118 HN GLU 118 44.335 0.840 -4.059 848 HA GLU 118 HA GLU 118 41.880 2.045 -4.699 849 HB2 GLU 118 HB2 GLU 118 42.925 4.222 -5.493 850 HB3 GLU 118 HB1 GLU 118 42.658 4.059 -3.768 851 HG2 GLU 118 HG2 GLU 118 45.035 3.422 -3.526 852 HG3 GLU 118 HG1 GLU 118 45.262 3.764 -5.240 853 H PHE 119 HN PHE 119 45.261 1.564 -5.523 854 HA PHE 119 HA PHE 119 44.396 0.702 -8.186 855 HB2 PHE 119 HB2 PHE 119 46.458 1.580 -9.145 856 HB3 PHE 119 HB1 PHE 119 45.589 2.866 -8.320 857 HD1 PHE 119 HD1 PHE 119 46.365 3.522 -5.990 858 HD2 PHE 119 HD2 PHE 119 48.675 1.094 -8.603 859 HE1 PHE 119 HE1 PHE 119 48.389 4.062 -4.698 860 HE2 PHE 119 HE2 PHE 119 50.702 1.625 -7.318 861 HZ PHE 119 HZ PHE 119 50.562 3.111 -5.361 862 H GLU 120 HN GLU 120 45.043 -0.630 -5.541 863 HA GLU 120 HA GLU 120 45.885 -2.593 -4.831 864 HB2 GLU 120 HB2 GLU 120 46.575 -2.882 -7.738 865 HB3 GLU 120 HB1 GLU 120 47.053 -4.081 -6.550 866 HG2 GLU 120 HG2 GLU 120 44.226 -3.200 -6.973 867 HG3 GLU 120 HG1 GLU 120 44.945 -4.601 -7.767 868 H GLU 121 HN GLU 121 47.863 -3.632 -4.227 869 HA GLU 121 HA GLU 121 49.805 -3.437 -3.114 870 HB2 GLU 121 HB2 GLU 121 51.775 -3.295 -4.563 871 HB3 GLU 121 HB1 GLU 121 50.564 -4.387 -5.183 872 HG2 GLU 121 HG2 GLU 121 50.490 -1.640 -6.220 873 HG3 GLU 121 HG1 GLU 121 51.887 -2.610 -6.673 874 H ASP 122 HN ASP 122 52.074 -1.956 -3.330 875 HA ASP 122 HA ASP 122 51.305 0.852 -3.164 876 HB2 ASP 122 HB2 ASP 122 52.277 1.180 -0.990 877 HB3 ASP 122 HB1 ASP 122 51.121 -0.140 -0.861 878 H SER 123 HN SER 123 52.816 2.153 -4.015 879 HA SER 123 HA SER 123 55.468 0.982 -4.510 880 HB2 SER 123 HB2 SER 123 54.000 2.924 -6.313 881 HB3 SER 123 HB1 SER 123 55.544 2.138 -6.642 882 HG SER 123 HG SER 123 53.978 0.165 -6.144 883 H ASP 124 HN ASP 124 54.080 4.254 -4.901 884 HA ASP 124 HA ASP 124 56.055 5.223 -2.956 885 HB2 ASP 124 HB2 ASP 124 57.120 5.612 -5.064 886 HB3 ASP 124 HB1 ASP 124 55.647 6.294 -5.749 887 H PHE 125 HN PHE 125 54.892 6.092 -1.395 888 HA PHE 125 HA PHE 125 52.866 8.078 -2.148 889 HB2 PHE 125 HB2 PHE 125 51.770 5.918 -1.450 890 HB3 PHE 125 HB1 PHE 125 52.507 6.124 0.136 891 HD1 PHE 125 HD2 PHE 125 50.075 7.567 -2.245 892 HD2 PHE 125 HD1 PHE 125 51.591 7.597 1.733 893 HE1 PHE 125 HE2 PHE 125 48.162 8.944 -1.528 894 HE2 PHE 125 HE1 PHE 125 49.688 8.973 2.453 895 HZ PHE 125 HZ PHE 125 47.966 9.665 0.781 896 H VAL 126 HN VAL 126 54.153 9.790 -1.674 897 HA VAL 126 HA VAL 126 55.061 10.022 1.123 898 HB VAL 126 HB VAL 126 56.275 11.379 -1.292 899 HG11 VAL 126 HG11 VAL 126 56.494 12.682 0.750 900 HG12 VAL 126 HG12 VAL 126 58.056 12.029 0.260 901 HG13 VAL 126 HG13 VAL 126 57.169 11.283 1.586 902 HG21 VAL 126 HG21 VAL 126 58.179 9.892 -0.991 903 HG22 VAL 126 HG22 VAL 126 56.712 8.967 -1.312 904 HG23 VAL 126 HG23 VAL 126 57.350 9.072 0.330 Start of MODEL 7 1 H1 ASP 1 HT1 ASP 1 -34.591 13.576 -9.690 2 H2 ASP 1 HT2 ASP 1 -33.703 12.322 -8.973 3 H3 ASP 1 HT3 ASP 1 -34.411 13.519 -8.003 4 HA ASP 1 HA ASP 1 -36.591 12.792 -8.534 5 HB2 ASP 1 HB2 ASP 1 -36.226 12.125 -10.848 6 HB3 ASP 1 HB1 ASP 1 -35.191 10.797 -10.329 7 H ILE 2 HN ILE 2 -34.121 10.243 -8.584 8 HA ILE 2 HA ILE 2 -35.486 8.636 -6.698 9 HB ILE 2 HB ILE 2 -32.627 8.508 -7.675 10 HG12 ILE 2 HG12 ILE 2 -35.082 6.976 -8.560 11 HG13 ILE 2 HG11 ILE 2 -34.373 8.325 -9.439 12 HG21 ILE 2 HG21 ILE 2 -32.738 6.144 -6.943 13 HG22 ILE 2 HG22 ILE 2 -34.296 6.491 -6.193 14 HG23 ILE 2 HG23 ILE 2 -32.841 7.292 -5.608 15 HD11 ILE 2 HD11 ILE 2 -32.953 5.744 -8.835 16 HD12 ILE 2 HD12 ILE 2 -32.372 7.065 -9.849 17 HD13 ILE 2 HD13 ILE 2 -33.769 6.115 -10.354 18 H ASP 3 HN ASP 3 -35.577 8.892 -4.575 19 HA ASP 3 HA ASP 3 -33.858 10.700 -3.170 20 HB2 ASP 3 HB2 ASP 3 -36.192 10.281 -2.431 21 HB3 ASP 3 HB1 ASP 3 -35.735 8.626 -2.013 22 H GLU 4 HN GLU 4 -31.829 9.821 -3.740 23 HA GLU 4 HA GLU 4 -31.045 7.227 -2.890 24 HB2 GLU 4 HB2 GLU 4 -29.419 9.646 -3.681 25 HB3 GLU 4 HB1 GLU 4 -28.742 8.046 -3.379 26 HG2 GLU 4 HG2 GLU 4 -30.139 7.121 -5.156 27 HG3 GLU 4 HG1 GLU 4 -30.791 8.727 -5.474 28 H SER 5 HN SER 5 -31.806 9.898 -1.130 29 HA SER 5 HA SER 5 -29.922 10.032 0.904 30 HB2 SER 5 HB2 SER 5 -32.875 10.190 1.449 31 HB3 SER 5 HB1 SER 5 -31.571 11.153 2.142 32 HG SER 5 HG SER 5 -33.096 11.704 0.034 33 H SER 6 HN SER 6 -32.653 7.830 0.431 34 HA SER 6 HA SER 6 -32.443 6.482 2.906 35 HB2 SER 6 HB2 SER 6 -33.737 4.674 1.647 36 HB3 SER 6 HB1 SER 6 -34.479 6.273 1.721 37 HG SER 6 HG SER 6 -34.155 6.544 -0.373 38 H VAL 7 HN VAL 7 -31.250 5.556 -0.340 39 HA VAL 7 HA VAL 7 -30.053 3.172 0.548 40 HB VAL 7 HB VAL 7 -30.538 3.450 -1.794 41 HG11 VAL 7 HG11 VAL 7 -28.441 5.606 -1.768 42 HG12 VAL 7 HG12 VAL 7 -30.157 5.784 -2.139 43 HG13 VAL 7 HG13 VAL 7 -29.110 4.879 -3.230 44 HG21 VAL 7 HG21 VAL 7 -28.537 2.509 -2.706 45 HG22 VAL 7 HG22 VAL 7 -28.703 1.949 -1.037 46 HG23 VAL 7 HG23 VAL 7 -27.558 3.235 -1.428 47 H MET 8 HN MET 8 -28.765 6.438 0.196 48 HA MET 8 HA MET 8 -26.094 5.812 0.811 49 HB2 MET 8 HB2 MET 8 -27.655 8.347 1.264 50 HB3 MET 8 HB1 MET 8 -25.922 8.212 1.532 51 HG2 MET 8 HG2 MET 8 -25.675 7.536 -0.843 52 HG3 MET 8 HG1 MET 8 -27.392 7.856 -1.067 53 HE1 MET 8 HE1 MET 8 -25.830 10.872 -2.947 54 HE2 MET 8 HE2 MET 8 -26.948 9.510 -3.026 55 HE3 MET 8 HE3 MET 8 -25.212 9.220 -2.898 56 H GLN 9 HN GLN 9 -28.882 6.433 2.880 57 HA GLN 9 HA GLN 9 -27.504 6.512 5.318 58 HB2 GLN 9 HB2 GLN 9 -30.309 5.776 4.579 59 HB3 GLN 9 HB1 GLN 9 -29.738 5.526 6.225 60 HG2 GLN 9 HG2 GLN 9 -29.162 7.890 6.384 61 HG3 GLN 9 HG1 GLN 9 -29.737 8.138 4.735 62 HE21 GLN 9 HE21 GLN 9 -31.920 8.211 4.336 63 HE22 GLN 9 HE22 GLN 9 -33.101 8.323 5.599 64 H LEU 10 HN LEU 10 -28.766 3.752 3.469 65 HA LEU 10 HA LEU 10 -27.877 1.753 5.290 66 HB2 LEU 10 HB2 LEU 10 -27.903 1.378 2.320 67 HB3 LEU 10 HB1 LEU 10 -28.172 0.173 3.554 68 HG LEU 10 HG LEU 10 -30.055 2.274 2.544 69 HD11 LEU 10 HD11 LEU 10 -30.295 -0.708 2.760 70 HD12 LEU 10 HD12 LEU 10 -29.801 0.165 1.308 71 HD13 LEU 10 HD13 LEU 10 -31.420 0.399 1.975 72 HD21 LEU 10 HD21 LEU 10 -31.566 0.916 4.282 73 HD22 LEU 10 HD22 LEU 10 -30.753 2.422 4.667 74 HD23 LEU 10 HD23 LEU 10 -30.027 0.891 5.149 75 H ALA 11 HN ALA 11 -26.498 3.231 2.438 76 HA ALA 11 HA ALA 11 -24.295 1.527 2.136 77 HB1 ALA 11 HB1 ALA 11 -24.293 4.352 1.151 78 HB2 ALA 11 HB2 ALA 11 -25.403 3.161 0.473 79 HB3 ALA 11 HB3 ALA 11 -23.656 2.899 0.376 80 H GLU 12 HN GLU 12 -24.454 4.785 3.565 81 HA GLU 12 HA GLU 12 -21.663 5.022 3.939 82 HB2 GLU 12 HB2 GLU 12 -23.894 6.479 5.337 83 HB3 GLU 12 HB1 GLU 12 -22.205 6.953 5.357 84 HG2 GLU 12 HG2 GLU 12 -24.019 6.865 2.956 85 HG3 GLU 12 HG1 GLU 12 -23.448 8.307 3.795 86 H MET 13 HN MET 13 -24.090 3.434 5.825 87 HA MET 13 HA MET 13 -22.354 3.485 8.186 88 HB2 MET 13 HB2 MET 13 -24.233 2.762 9.481 89 HB3 MET 13 HB1 MET 13 -24.752 4.099 8.463 90 HG2 MET 13 HG2 MET 13 -25.861 2.614 6.964 91 HG3 MET 13 HG1 MET 13 -25.186 1.208 7.784 92 HE1 MET 13 HE1 MET 13 -25.456 1.889 10.819 93 HE2 MET 13 HE2 MET 13 -25.966 0.339 10.148 94 HE3 MET 13 HE3 MET 13 -27.052 1.241 11.206 95 H GLY 14 HN GLY 14 -22.783 1.543 5.543 96 HA2 GLY 14 HA2 GLY 14 -21.506 -0.679 6.817 97 HA3 GLY 14 HA1 GLY 14 -23.194 -1.013 6.477 98 H PHE 15 HN PHE 15 -23.885 -1.165 4.309 99 HA PHE 15 HA PHE 15 -21.649 -1.847 2.507 100 HB2 PHE 15 HB2 PHE 15 -24.400 -3.110 2.502 101 HB3 PHE 15 HB1 PHE 15 -22.967 -3.660 1.642 102 HD1 PHE 15 HD2 PHE 15 -20.977 -4.422 3.068 103 HD2 PHE 15 HD1 PHE 15 -24.929 -3.985 4.578 104 HE1 PHE 15 HE2 PHE 15 -20.415 -5.907 4.947 105 HE2 PHE 15 HE1 PHE 15 -24.378 -5.468 6.461 106 HZ PHE 15 HZ PHE 15 -22.155 -6.447 6.644 107 HA PRO 16 HA PRO 16 -23.470 0.980 -0.463 108 HB2 PRO 16 HB2 PRO 16 -22.385 -0.152 -2.708 109 HB3 PRO 16 HB1 PRO 16 -21.503 0.944 -1.637 110 HG2 PRO 16 HG2 PRO 16 -21.452 -2.044 -1.769 111 HG3 PRO 16 HG1 PRO 16 -20.108 -0.909 -1.538 112 HD2 PRO 16 HD2 PRO 16 -21.202 -2.286 0.508 113 HD3 PRO 16 HD1 PRO 16 -20.557 -0.646 0.712 114 H LEU 17 HN LEU 17 -25.553 -0.033 0.117 115 HA LEU 17 HA LEU 17 -26.431 -2.334 -1.353 116 HB2 LEU 17 HB2 LEU 17 -27.868 -0.487 0.568 117 HB3 LEU 17 HB1 LEU 17 -28.601 -1.904 -0.165 118 HG LEU 17 HG LEU 17 -26.139 -1.996 1.582 119 HD11 LEU 17 HD11 LEU 17 -27.576 -2.885 3.315 120 HD12 LEU 17 HD12 LEU 17 -28.988 -2.690 2.275 121 HD13 LEU 17 HD13 LEU 17 -28.110 -1.271 2.846 122 HD21 LEU 17 HD21 LEU 17 -26.589 -4.401 1.637 123 HD22 LEU 17 HD22 LEU 17 -26.282 -3.833 -0.004 124 HD23 LEU 17 HD23 LEU 17 -27.931 -4.173 0.516 125 H GLU 18 HN GLU 18 -25.879 -1.022 -3.439 126 HA GLU 18 HA GLU 18 -27.657 0.846 -4.469 127 HB2 GLU 18 HB2 GLU 18 -25.490 -0.270 -5.496 128 HB3 GLU 18 HB1 GLU 18 -26.679 -1.304 -6.284 129 HG2 GLU 18 HG2 GLU 18 -27.829 0.975 -6.872 130 HG3 GLU 18 HG1 GLU 18 -26.215 1.611 -6.567 131 H ALA 19 HN ALA 19 -28.151 -2.476 -3.763 132 HA ALA 19 HA ALA 19 -30.378 -3.085 -5.316 133 HB1 ALA 19 HB1 ALA 19 -30.139 -3.840 -2.415 134 HB2 ALA 19 HB2 ALA 19 -29.113 -4.557 -3.653 135 HB3 ALA 19 HB3 ALA 19 -30.863 -4.761 -3.736 136 H CYS 20 HN CYS 20 -30.042 -1.176 -2.406 137 HA CYS 20 HA CYS 20 -32.832 -0.613 -2.060 138 HB2 CYS 20 HB2 CYS 20 -30.996 -0.370 -0.281 139 HB3 CYS 20 HB1 CYS 20 -30.543 1.108 -1.112 140 HG CYS 20 HG CYS 20 -33.520 0.490 0.450 141 H ARG 21 HN ARG 21 -30.073 0.989 -3.516 142 HA ARG 21 HA ARG 21 -31.178 3.398 -4.297 143 HB2 ARG 21 HB2 ARG 21 -28.804 2.698 -4.506 144 HB3 ARG 21 HB1 ARG 21 -29.246 1.675 -5.860 145 HG2 ARG 21 HG2 ARG 21 -29.708 3.515 -7.233 146 HG3 ARG 21 HG1 ARG 21 -29.679 4.644 -5.870 147 HD2 ARG 21 HD2 ARG 21 -27.258 3.939 -5.544 148 HD3 ARG 21 HD1 ARG 21 -27.378 3.151 -7.114 149 HE ARG 21 HE ARG 21 -27.813 6.050 -6.735 150 HH11 ARG 21 HH11 ARG 21 -26.364 3.366 -8.488 151 HH12 ARG 21 HH12 ARG 21 -25.634 4.389 -9.684 152 HH21 ARG 21 HH21 ARG 21 -26.845 7.374 -8.271 153 HH22 ARG 21 HH22 ARG 21 -25.910 6.683 -9.567 154 H LYS 22 HN LYS 22 -31.098 0.389 -6.204 155 HA LYS 22 HA LYS 22 -32.836 1.384 -8.235 156 HB2 LYS 22 HB2 LYS 22 -32.844 -0.911 -9.072 157 HB3 LYS 22 HB1 LYS 22 -31.212 -0.404 -8.667 158 HG2 LYS 22 HG2 LYS 22 -31.552 -1.585 -6.449 159 HG3 LYS 22 HG1 LYS 22 -32.996 -2.294 -7.169 160 HD2 LYS 22 HD2 LYS 22 -31.305 -3.892 -7.493 161 HD3 LYS 22 HD1 LYS 22 -31.468 -3.085 -9.052 162 HE2 LYS 22 HE2 LYS 22 -29.443 -2.183 -7.026 163 HE3 LYS 22 HE1 LYS 22 -29.101 -3.519 -8.127 164 HZ1 LYS 22 HZ1 LYS 22 -29.457 -2.047 -9.999 165 HZ2 LYS 22 HZ2 LYS 22 -28.274 -1.394 -8.970 166 HZ3 LYS 22 HZ3 LYS 22 -29.844 -0.760 -8.964 167 H ALA 23 HN ALA 23 -33.304 -0.130 -5.164 168 HA ALA 23 HA ALA 23 -36.001 -0.955 -5.498 169 HB1 ALA 23 HB1 ALA 23 -36.062 -1.026 -3.048 170 HB2 ALA 23 HB2 ALA 23 -34.503 -0.196 -2.993 171 HB3 ALA 23 HB3 ALA 23 -34.619 -1.814 -3.689 172 H VAL 24 HN VAL 24 -34.490 1.991 -4.233 173 HA VAL 24 HA VAL 24 -36.775 3.405 -3.533 174 HB VAL 24 HB VAL 24 -34.260 4.524 -4.810 175 HG11 VAL 24 HG11 VAL 24 -34.848 6.635 -3.754 176 HG12 VAL 24 HG12 VAL 24 -36.335 5.922 -3.125 177 HG13 VAL 24 HG13 VAL 24 -36.121 6.120 -4.864 178 HG21 VAL 24 HG21 VAL 24 -33.527 4.957 -2.518 179 HG22 VAL 24 HG22 VAL 24 -33.775 3.235 -2.808 180 HG23 VAL 24 HG23 VAL 24 -34.976 4.161 -1.904 181 H TYR 25 HN TYR 25 -35.129 3.242 -6.686 182 HA TYR 25 HA TYR 25 -36.993 4.750 -8.140 183 HB2 TYR 25 HB2 TYR 25 -34.857 4.089 -9.106 184 HB3 TYR 25 HB1 TYR 25 -35.321 2.391 -9.037 185 HD1 TYR 25 HD2 TYR 25 -36.129 5.632 -10.651 186 HD2 TYR 25 HD1 TYR 25 -36.553 1.401 -10.790 187 HE1 TYR 25 HE2 TYR 25 -37.091 5.809 -12.905 188 HE2 TYR 25 HE1 TYR 25 -37.524 1.566 -13.043 189 HH TYR 25 HH TYR 25 -38.718 3.263 -14.412 190 H PHE 26 HN PHE 26 -36.893 1.242 -7.535 191 HA PHE 26 HA PHE 26 -39.169 0.574 -9.029 192 HB2 PHE 26 HB2 PHE 26 -37.534 -1.097 -8.327 193 HB3 PHE 26 HB1 PHE 26 -37.965 -0.838 -6.641 194 HD1 PHE 26 HD2 PHE 26 -39.404 -1.915 -9.895 195 HD2 PHE 26 HD1 PHE 26 -39.609 -2.143 -5.649 196 HE1 PHE 26 HE2 PHE 26 -41.131 -3.659 -10.074 197 HE2 PHE 26 HE1 PHE 26 -41.330 -3.890 -5.822 198 HZ PHE 26 HZ PHE 26 -42.084 -4.661 -8.015 199 H THR 27 HN THR 27 -38.848 1.519 -5.636 200 HA THR 27 HA THR 27 -41.519 0.880 -4.915 201 HB THR 27 HB THR 27 -41.119 2.306 -2.908 202 HG1 THR 27 HG1 THR 27 -38.451 2.551 -3.829 203 HG21 THR 27 HG21 THR 27 -38.892 0.368 -3.497 204 HG22 THR 27 HG22 THR 27 -40.510 -0.094 -2.972 205 HG23 THR 27 HG23 THR 27 -39.472 0.852 -1.905 206 H GLY 28 HN GLY 28 -40.211 3.390 -6.754 207 HA2 GLY 28 HA2 GLY 28 -41.322 5.142 -7.805 208 HA3 GLY 28 HA1 GLY 28 -42.729 4.813 -6.801 209 H ASN 29 HN ASN 29 -39.547 5.207 -5.462 210 HA ASN 29 HA ASN 29 -38.683 6.654 -3.958 211 HB2 ASN 29 HB2 ASN 29 -40.343 8.613 -5.545 212 HB3 ASN 29 HB1 ASN 29 -39.273 9.104 -4.237 213 HD21 ASN 29 HD21 ASN 29 -39.495 8.078 -7.507 214 HD22 ASN 29 HD22 ASN 29 -37.815 8.228 -7.886 215 H MET 30 HN MET 30 -40.153 5.251 -2.585 216 HA MET 30 HA MET 30 -42.314 6.772 -1.343 217 HB2 MET 30 HB2 MET 30 -41.469 3.889 -1.183 218 HB3 MET 30 HB1 MET 30 -42.641 4.577 -0.067 219 HG2 MET 30 HG2 MET 30 -42.910 4.519 -3.065 220 HG3 MET 30 HG1 MET 30 -43.698 3.412 -1.942 221 HE1 MET 30 HE1 MET 30 -45.626 4.056 -0.311 222 HE2 MET 30 HE2 MET 30 -46.186 5.707 -0.041 223 HE3 MET 30 HE3 MET 30 -44.563 5.231 0.462 224 H GLY 31 HN GLY 31 -39.600 7.608 -0.961 225 HA2 GLY 31 HA2 GLY 31 -38.526 8.624 0.795 226 HA3 GLY 31 HA1 GLY 31 -39.747 7.961 1.866 227 H ALA 32 HN ALA 32 -37.519 7.986 3.044 228 HA ALA 32 HA ALA 32 -35.654 5.937 2.438 229 HB1 ALA 32 HB1 ALA 32 -36.101 7.383 5.044 230 HB2 ALA 32 HB2 ALA 32 -35.079 7.944 3.721 231 HB3 ALA 32 HB3 ALA 32 -34.664 6.466 4.591 232 H GLU 33 HN GLU 33 -38.449 6.108 4.557 233 HA GLU 33 HA GLU 33 -37.954 3.868 6.139 234 HB2 GLU 33 HB2 GLU 33 -40.607 5.026 5.270 235 HB3 GLU 33 HB1 GLU 33 -40.381 3.893 6.597 236 HG2 GLU 33 HG2 GLU 33 -39.206 6.660 6.433 237 HG3 GLU 33 HG1 GLU 33 -40.616 6.192 7.383 238 H VAL 34 HN VAL 34 -39.915 4.106 3.178 239 HA VAL 34 HA VAL 34 -40.651 1.378 3.197 240 HB VAL 34 HB VAL 34 -40.721 3.411 0.968 241 HG11 VAL 34 HG11 VAL 34 -41.887 0.631 1.062 242 HG12 VAL 34 HG12 VAL 34 -40.652 1.227 -0.048 243 HG13 VAL 34 HG13 VAL 34 -42.299 1.852 -0.141 244 HG21 VAL 34 HG21 VAL 34 -42.874 2.321 2.780 245 HG22 VAL 34 HG22 VAL 34 -43.117 3.467 1.461 246 HG23 VAL 34 HG23 VAL 34 -42.155 3.929 2.864 247 H ALA 35 HN ALA 35 -37.996 3.114 1.599 248 HA ALA 35 HA ALA 35 -37.246 0.797 0.077 249 HB1 ALA 35 HB1 ALA 35 -36.816 3.203 -0.586 250 HB2 ALA 35 HB2 ALA 35 -35.518 2.036 -0.828 251 HB3 ALA 35 HB3 ALA 35 -35.457 3.150 0.541 252 H PHE 36 HN PHE 36 -36.180 2.243 3.125 253 HA PHE 36 HA PHE 36 -34.054 0.467 3.664 254 HB2 PHE 36 HB2 PHE 36 -34.367 2.369 5.097 255 HB3 PHE 36 HB1 PHE 36 -36.007 1.874 5.508 256 HD1 PHE 36 HD2 PHE 36 -32.442 0.957 5.888 257 HD2 PHE 36 HD1 PHE 36 -36.411 0.474 7.345 258 HE1 PHE 36 HE2 PHE 36 -31.569 -0.233 7.857 259 HE2 PHE 36 HE1 PHE 36 -35.549 -0.721 9.315 260 HZ PHE 36 HZ PHE 36 -33.129 -1.045 9.591 261 H ASN 37 HN ASN 37 -37.547 0.259 4.142 262 HA ASN 37 HA ASN 37 -37.646 -2.327 5.255 263 HB2 ASN 37 HB2 ASN 37 -39.596 -0.982 5.423 264 HB3 ASN 37 HB1 ASN 37 -39.625 -0.669 3.692 265 HD21 ASN 37 HD21 ASN 37 -40.618 -2.063 2.352 266 HD22 ASN 37 HD22 ASN 37 -41.497 -3.458 2.877 267 H TRP 38 HN TRP 38 -37.597 -1.187 1.904 268 HA TRP 38 HA TRP 38 -38.139 -3.726 0.776 269 HB2 TRP 38 HB2 TRP 38 -38.244 -1.358 -0.345 270 HB3 TRP 38 HB1 TRP 38 -36.542 -1.649 -0.699 271 HD1 TRP 38 HD1 TRP 38 -36.057 -2.973 -2.851 272 HE1 TRP 38 HE1 TRP 38 -37.428 -4.447 -4.465 273 HE3 TRP 38 HE3 TRP 38 -40.457 -3.107 -0.263 274 HZ2 TRP 38 HZ2 TRP 38 -40.032 -5.522 -4.603 275 HZ3 TRP 38 HZ3 TRP 38 -42.338 -4.386 -1.200 276 HH2 TRP 38 HH2 TRP 38 -42.127 -5.567 -3.324 277 H ILE 39 HN ILE 39 -35.222 -2.162 1.896 278 HA ILE 39 HA ILE 39 -33.489 -4.042 0.602 279 HB ILE 39 HB ILE 39 -32.936 -1.617 1.389 280 HG12 ILE 39 HG12 ILE 39 -30.561 -2.202 1.371 281 HG13 ILE 39 HG11 ILE 39 -30.961 -3.884 1.713 282 HG21 ILE 39 HG21 ILE 39 -32.183 -3.212 3.829 283 HG22 ILE 39 HG22 ILE 39 -33.349 -1.890 3.752 284 HG23 ILE 39 HG23 ILE 39 -31.634 -1.573 3.479 285 HD11 ILE 39 HD11 ILE 39 -30.409 -3.509 -0.642 286 HD12 ILE 39 HD12 ILE 39 -31.759 -2.379 -0.769 287 HD13 ILE 39 HD13 ILE 39 -32.063 -4.083 -0.430 288 H ILE 40 HN ILE 40 -34.941 -3.776 3.812 289 HA ILE 40 HA ILE 40 -33.457 -5.947 4.888 290 HB ILE 40 HB ILE 40 -35.055 -6.079 6.674 291 HG12 ILE 40 HG12 ILE 40 -36.899 -4.185 6.504 292 HG13 ILE 40 HG11 ILE 40 -36.823 -4.627 4.804 293 HG21 ILE 40 HG21 ILE 40 -34.777 -3.173 6.011 294 HG22 ILE 40 HG22 ILE 40 -33.445 -4.183 6.526 295 HG23 ILE 40 HG23 ILE 40 -34.803 -3.931 7.605 296 HD11 ILE 40 HD11 ILE 40 -37.493 -6.423 7.121 297 HD12 ILE 40 HD12 ILE 40 -37.213 -6.989 5.473 298 HD13 ILE 40 HD13 ILE 40 -38.560 -5.899 5.816 299 H VAL 41 HN VAL 41 -36.285 -5.726 2.914 300 HA VAL 41 HA VAL 41 -36.917 -8.504 2.908 301 HB VAL 41 HB VAL 41 -37.387 -6.437 0.744 302 HG11 VAL 41 HG11 VAL 41 -39.117 -7.980 -0.069 303 HG12 VAL 41 HG12 VAL 41 -38.605 -9.167 1.130 304 HG13 VAL 41 HG13 VAL 41 -37.504 -8.688 -0.161 305 HG21 VAL 41 HG21 VAL 41 -38.459 -5.851 2.850 306 HG22 VAL 41 HG22 VAL 41 -39.201 -7.449 2.928 307 HG23 VAL 41 HG23 VAL 41 -39.657 -6.326 1.647 308 H HIS 42 HN HIS 42 -34.665 -6.503 1.092 309 HA HIS 42 HA HIS 42 -33.776 -8.842 -0.443 310 HB2 HIS 42 HB2 HIS 42 -33.517 -5.890 -0.919 311 HB3 HIS 42 HB1 HIS 42 -32.439 -7.022 -1.728 312 HD1 HIS 42 HD1 HIS 42 -33.335 -8.247 -3.749 313 HD2 HIS 42 HD2 HIS 42 -36.292 -6.210 -1.638 314 HE1 HIS 42 HE1 HIS 42 -35.390 -8.340 -5.193 315 HE2 HIS 42 HE2 HIS 42 -37.213 -7.311 -3.792 316 H MET 43 HN MET 43 -33.054 -7.995 2.431 317 HA MET 43 HA MET 43 -30.320 -7.495 2.571 318 HB2 MET 43 HB2 MET 43 -30.379 -8.563 4.783 319 HB3 MET 43 HB1 MET 43 -31.745 -7.483 4.550 320 HG2 MET 43 HG2 MET 43 -33.157 -9.427 4.022 321 HG3 MET 43 HG1 MET 43 -31.785 -10.484 4.346 322 HE1 MET 43 HE1 MET 43 -34.293 -10.979 7.383 323 HE2 MET 43 HE2 MET 43 -33.466 -11.792 6.052 324 HE3 MET 43 HE3 MET 43 -34.726 -10.607 5.713 325 H GLU 44 HN GLU 44 -31.985 -10.283 1.527 326 HA GLU 44 HA GLU 44 -29.851 -12.171 1.911 327 HB2 GLU 44 HB2 GLU 44 -31.362 -13.617 0.475 328 HB3 GLU 44 HB1 GLU 44 -32.064 -13.037 1.982 329 HG2 GLU 44 HG2 GLU 44 -33.331 -11.380 0.850 330 HG3 GLU 44 HG1 GLU 44 -32.468 -11.664 -0.659 331 H GLU 45 HN GLU 45 -29.670 -9.645 0.068 332 HA GLU 45 HA GLU 45 -28.830 -11.025 -2.398 333 HB2 GLU 45 HB2 GLU 45 -29.237 -8.056 -2.030 334 HB3 GLU 45 HB1 GLU 45 -29.053 -8.930 -3.541 335 HG2 GLU 45 HG2 GLU 45 -31.345 -9.459 -1.715 336 HG3 GLU 45 HG1 GLU 45 -31.378 -8.122 -2.848 337 HA PRO 46 HA PRO 46 -24.682 -10.108 -0.539 338 HB2 PRO 46 HB2 PRO 46 -23.531 -11.797 -2.434 339 HB3 PRO 46 HB1 PRO 46 -23.967 -12.268 -0.784 340 HG2 PRO 46 HG2 PRO 46 -25.427 -12.682 -3.351 341 HG3 PRO 46 HG1 PRO 46 -25.301 -13.757 -1.942 342 HD2 PRO 46 HD2 PRO 46 -27.517 -12.341 -2.431 343 HD3 PRO 46 HD1 PRO 46 -26.939 -12.610 -0.771 344 H ASP 47 HN ASP 47 -25.475 -10.655 -3.920 345 HA ASP 47 HA ASP 47 -23.209 -9.100 -4.791 346 HB2 ASP 47 HB2 ASP 47 -23.545 -11.219 -5.799 347 HB3 ASP 47 HB1 ASP 47 -25.224 -10.862 -6.162 348 H PHE 48 HN PHE 48 -26.544 -8.566 -4.306 349 HA PHE 48 HA PHE 48 -26.838 -6.473 -6.235 350 HB2 PHE 48 HB2 PHE 48 -28.510 -7.497 -3.973 351 HB3 PHE 48 HB1 PHE 48 -28.839 -5.888 -4.623 352 HD1 PHE 48 HD2 PHE 48 -28.572 -9.463 -5.519 353 HD2 PHE 48 HD1 PHE 48 -29.989 -5.618 -6.670 354 HE1 PHE 48 HE2 PHE 48 -29.864 -10.485 -7.348 355 HE2 PHE 48 HE1 PHE 48 -31.280 -6.636 -8.495 356 HZ PHE 48 HZ PHE 48 -31.186 -9.031 -8.883 357 H ALA 49 HN ALA 49 -25.204 -6.708 -3.345 358 HA ALA 49 HA ALA 49 -25.121 -3.817 -2.992 359 HB1 ALA 49 HB1 ALA 49 -25.452 -5.103 -0.932 360 HB2 ALA 49 HB2 ALA 49 -23.893 -4.275 -0.923 361 HB3 ALA 49 HB3 ALA 49 -23.970 -6.007 -1.255 362 H GLU 50 HN GLU 50 -23.845 -3.090 -4.513 363 HA GLU 50 HA GLU 50 -21.958 -4.176 -6.060 364 HB2 GLU 50 HB2 GLU 50 -21.965 -1.406 -4.906 365 HB3 GLU 50 HB1 GLU 50 -20.888 -1.913 -6.201 366 HG2 GLU 50 HG2 GLU 50 -23.893 -1.943 -6.290 367 HG3 GLU 50 HG1 GLU 50 -22.837 -0.766 -7.053 368 HA PRO 51 HA PRO 51 -18.902 -5.333 -2.965 369 HB2 PRO 51 HB2 PRO 51 -17.831 -7.129 -4.947 370 HB3 PRO 51 HB1 PRO 51 -18.740 -7.525 -3.488 371 HG2 PRO 51 HG2 PRO 51 -19.702 -7.901 -6.020 372 HG3 PRO 51 HG1 PRO 51 -20.733 -7.622 -4.605 373 HD2 PRO 51 HD2 PRO 51 -19.849 -5.688 -6.717 374 HD3 PRO 51 HD1 PRO 51 -21.445 -5.872 -5.954 375 H LEU 52 HN LEU 52 -18.184 -3.045 -3.689 376 HA LEU 52 HA LEU 52 -15.465 -3.341 -4.753 377 HB2 LEU 52 HB2 LEU 52 -16.849 -2.361 -6.521 378 HB3 LEU 52 HB1 LEU 52 -17.395 -1.113 -5.416 379 HG LEU 52 HG LEU 52 -15.052 -0.290 -5.252 380 HD11 LEU 52 HD11 LEU 52 -13.890 -2.353 -5.836 381 HD12 LEU 52 HD12 LEU 52 -13.414 -1.032 -6.904 382 HD13 LEU 52 HD13 LEU 52 -14.539 -2.265 -7.473 383 HD21 LEU 52 HD21 LEU 52 -16.205 -0.397 -8.036 384 HD22 LEU 52 HD22 LEU 52 -15.024 0.773 -7.447 385 HD23 LEU 52 HD23 LEU 52 -16.653 0.747 -6.772 386 H THR 53 HN THR 53 -14.307 -3.074 -2.954 387 HA THR 53 HA THR 53 -13.341 -2.073 -1.158 388 HB THR 53 HB THR 53 -14.919 0.417 -1.831 389 HG1 THR 53 HG1 THR 53 -12.920 -0.838 -3.206 390 HG21 THR 53 HG21 THR 53 -12.267 0.021 -0.434 391 HG22 THR 53 HG22 THR 53 -13.792 0.420 0.355 392 HG23 THR 53 HG23 THR 53 -13.046 1.570 -0.755 393 H MET 54 HN MET 54 -14.497 -3.520 0.191 394 HA MET 54 HA MET 54 -17.073 -2.887 1.242 395 HB2 MET 54 HB2 MET 54 -14.958 -4.767 2.312 396 HB3 MET 54 HB1 MET 54 -16.637 -4.717 2.829 397 HG2 MET 54 HG2 MET 54 -15.657 -5.417 0.072 398 HG3 MET 54 HG1 MET 54 -16.223 -6.556 1.293 399 HE1 MET 54 HE1 MET 54 -18.682 -4.960 2.552 400 HE2 MET 54 HE2 MET 54 -18.735 -6.675 2.144 401 HE3 MET 54 HE3 MET 54 -20.013 -5.596 1.581 402 HA PRO 55 HA PRO 55 -15.271 0.028 4.092 403 HB2 PRO 55 HB2 PRO 55 -17.453 1.586 4.293 404 HB3 PRO 55 HB1 PRO 55 -16.452 1.549 2.838 405 HG2 PRO 55 HG2 PRO 55 -19.159 0.501 3.258 406 HG3 PRO 55 HG1 PRO 55 -18.315 0.850 1.745 407 HD2 PRO 55 HD2 PRO 55 -18.647 -1.701 3.102 408 HD3 PRO 55 HD1 PRO 55 -17.987 -1.374 1.488 409 H GLY 56 HN GLY 56 -16.506 1.308 6.034 410 HA2 GLY 56 HA2 GLY 56 -18.252 -0.256 7.650 411 HA3 GLY 56 HA1 GLY 56 -16.587 -0.364 8.216 412 H TYR 57 HN TYR 57 -18.446 0.734 9.878 413 HA TYR 57 HA TYR 57 -18.522 3.602 9.511 414 HB2 TYR 57 HB2 TYR 57 -20.394 2.239 10.534 415 HB3 TYR 57 HB1 TYR 57 -19.365 2.019 11.945 416 HD1 TYR 57 HD1 TYR 57 -20.037 5.027 9.823 417 HD2 TYR 57 HD2 TYR 57 -20.290 3.242 13.678 418 HE1 TYR 57 HE1 TYR 57 -20.846 7.155 10.753 419 HE2 TYR 57 HE2 TYR 57 -21.095 5.365 14.614 420 HH TYR 57 HH TYR 57 -21.823 8.127 12.548 421 H GLY 58 HN GLY 58 -17.224 5.077 10.476 422 HA2 GLY 58 HA2 GLY 58 -15.749 5.702 12.318 423 HA3 GLY 58 HA1 GLY 58 -15.180 4.039 12.345 424 H GLY 59 HN GLY 59 -15.729 5.337 9.245 425 HA2 GLY 59 HA2 GLY 59 -12.836 5.462 8.781 426 HA3 GLY 59 HA1 GLY 59 -14.078 5.334 7.543 427 H ALA 60 HN ALA 60 -12.419 7.486 9.735 428 HA ALA 60 HA ALA 60 -13.861 9.834 9.128 429 HB1 ALA 60 HB1 ALA 60 -12.010 11.022 10.171 430 HB2 ALA 60 HB2 ALA 60 -11.019 9.565 10.102 431 HB3 ALA 60 HB3 ALA 60 -12.457 9.605 11.122 432 H ALA 61 HN ALA 61 -10.844 8.495 7.811 433 HA ALA 61 HA ALA 61 -11.182 10.269 5.489 434 HB1 ALA 61 HB1 ALA 61 -8.788 10.759 5.453 435 HB2 ALA 61 HB2 ALA 61 -8.574 9.842 6.944 436 HB3 ALA 61 HB3 ALA 61 -9.535 11.320 6.949 437 H SER 62 HN SER 62 -9.961 7.288 6.840 438 HA SER 62 HA SER 62 -9.162 6.378 4.172 439 HB2 SER 62 HB2 SER 62 -7.515 6.113 6.003 440 HB3 SER 62 HB1 SER 62 -8.661 5.089 6.865 441 HG SER 62 HG SER 62 -7.265 3.762 5.739 442 H ALA 63 HN ALA 63 -10.759 5.473 3.055 443 HA ALA 63 HA ALA 63 -12.704 3.765 4.429 444 HB1 ALA 63 HB1 ALA 63 -13.562 5.365 2.781 445 HB2 ALA 63 HB2 ALA 63 -13.875 3.702 2.283 446 HB3 ALA 63 HB3 ALA 63 -12.566 4.612 1.533 447 H GLY 64 HN GLY 64 -10.111 3.695 2.078 448 HA2 GLY 64 HA2 GLY 64 -9.615 0.905 2.674 449 HA3 GLY 64 HA1 GLY 64 -10.099 1.228 1.014 450 H ALA 65 HN ALA 65 -8.157 3.344 3.051 451 HA ALA 65 HA ALA 65 -6.115 3.346 0.965 452 HB1 ALA 65 HB1 ALA 65 -7.022 5.495 1.714 453 HB2 ALA 65 HB2 ALA 65 -5.289 5.374 2.019 454 HB3 ALA 65 HB3 ALA 65 -6.436 5.169 3.344 455 H SER 66 HN SER 66 -6.433 1.146 2.933 456 HA SER 66 HA SER 66 -4.026 1.345 4.548 457 HB2 SER 66 HB2 SER 66 -4.719 -0.951 5.306 458 HB3 SER 66 HB1 SER 66 -5.936 0.296 5.589 459 HG SER 66 HG SER 66 -6.228 -1.964 4.269 460 H VAL 67 HN VAL 67 -4.873 0.421 1.432 461 HA VAL 67 HA VAL 67 -2.872 -1.670 1.179 462 HB VAL 67 HB VAL 67 -4.611 -0.475 -0.989 463 HG11 VAL 67 HG11 VAL 67 -3.048 -3.052 -0.843 464 HG12 VAL 67 HG12 VAL 67 -2.700 -1.662 -1.871 465 HG13 VAL 67 HG13 VAL 67 -4.158 -2.614 -2.139 466 HG21 VAL 67 HG21 VAL 67 -5.118 -2.916 0.713 467 HG22 VAL 67 HG22 VAL 67 -6.100 -2.386 -0.654 468 HG23 VAL 67 HG23 VAL 67 -5.998 -1.391 0.799 469 H PHE 68 HN PHE 68 -1.006 -0.385 1.622 470 HA PHE 68 HA PHE 68 -0.062 0.866 -0.843 471 HB2 PHE 68 HB2 PHE 68 1.150 2.613 0.449 472 HB3 PHE 68 HB1 PHE 68 -0.596 2.763 0.553 473 HD1 PHE 68 HD1 PHE 68 -1.752 1.975 2.654 474 HD2 PHE 68 HD2 PHE 68 2.476 2.406 2.378 475 HE1 PHE 68 HE1 PHE 68 -1.600 2.019 5.107 476 HE2 PHE 68 HE2 PHE 68 2.632 2.449 4.833 477 HZ PHE 68 HZ PHE 68 0.606 2.275 6.199 478 H GLY 69 HN GLY 69 1.557 -0.277 -1.548 479 HA2 GLY 69 HA2 GLY 69 2.920 -2.164 0.107 480 HA3 GLY 69 HA1 GLY 69 3.270 -1.816 -1.580 481 H ALA 70 HN ALA 70 4.444 -1.679 1.496 482 HA ALA 70 HA ALA 70 6.019 0.666 1.455 483 HB1 ALA 70 HB1 ALA 70 7.288 -0.381 3.255 484 HB2 ALA 70 HB2 ALA 70 6.538 -1.936 2.897 485 HB3 ALA 70 HB3 ALA 70 5.558 -0.602 3.507 486 H SER 71 HN SER 71 8.051 1.051 0.751 487 HA SER 71 HA SER 71 8.922 -0.343 -1.539 488 HB2 SER 71 HB2 SER 71 10.469 1.674 0.104 489 HB3 SER 71 HB1 SER 71 10.727 1.269 -1.594 490 HG SER 71 HG SER 71 9.302 2.728 -2.047 491 H GLY 72 HN GLY 72 9.622 -0.726 1.806 492 HA2 GLY 72 HA2 GLY 72 11.243 -3.047 1.220 493 HA3 GLY 72 HA1 GLY 72 12.098 -1.748 2.042 494 H LEU 73 HN LEU 73 9.736 -4.256 2.320 495 HA LEU 73 HA LEU 73 9.193 -3.587 5.118 496 HB2 LEU 73 HB2 LEU 73 7.532 -4.510 3.248 497 HB3 LEU 73 HB1 LEU 73 8.144 -6.052 3.810 498 HG LEU 73 HG LEU 73 6.052 -5.526 4.920 499 HD11 LEU 73 HD11 LEU 73 8.299 -5.170 6.892 500 HD12 LEU 73 HD12 LEU 73 7.837 -6.713 6.179 501 HD13 LEU 73 HD13 LEU 73 6.695 -5.841 7.200 502 HD21 LEU 73 HD21 LEU 73 5.838 -3.591 6.405 503 HD22 LEU 73 HD22 LEU 73 6.128 -3.099 4.736 504 HD23 LEU 73 HD23 LEU 73 7.440 -3.038 5.910 505 H ASP 74 HN ASP 74 11.224 -3.973 6.016 506 HA ASP 74 HA ASP 74 13.017 -5.098 6.814 507 HB2 ASP 74 HB2 ASP 74 11.453 -6.417 8.076 508 HB3 ASP 74 HB1 ASP 74 11.078 -7.415 6.672 509 H ASN 75 HN ASN 75 14.135 -4.601 4.903 510 HA ASN 75 HA ASN 75 14.797 -6.995 3.331 511 HB2 ASN 75 HB2 ASN 75 13.353 -5.358 2.030 512 HB3 ASN 75 HB1 ASN 75 14.677 -4.203 2.164 513 HD21 ASN 75 HD21 ASN 75 13.533 -7.088 0.651 514 HD22 ASN 75 HD22 ASN 75 14.812 -7.239 -0.504 515 H GLN 76 HN GLN 76 16.415 -7.039 5.084 516 HA GLN 76 HA GLN 76 18.448 -4.983 5.014 517 HB2 GLN 76 HB2 GLN 76 17.725 -6.242 7.107 518 HB3 GLN 76 HB1 GLN 76 18.571 -7.639 6.450 519 HG2 GLN 76 HG2 GLN 76 20.625 -6.168 6.329 520 HG3 GLN 76 HG1 GLN 76 19.728 -5.002 7.297 521 HE21 GLN 76 HE21 GLN 76 18.341 -7.138 8.788 522 HE22 GLN 76 HE22 GLN 76 19.513 -7.760 9.901 523 HA PRO 77 HA PRO 77 20.944 -6.789 1.777 524 HB2 PRO 77 HB2 PRO 77 23.087 -5.689 3.535 525 HB3 PRO 77 HB1 PRO 77 22.868 -5.513 1.791 526 HG2 PRO 77 HG2 PRO 77 22.270 -3.516 3.383 527 HG3 PRO 77 HG1 PRO 77 21.189 -3.932 2.040 528 HD2 PRO 77 HD2 PRO 77 20.905 -4.514 4.961 529 HD3 PRO 77 HD1 PRO 77 19.669 -4.022 3.789 530 HA PRO 78 HA PRO 78 22.446 -10.617 3.322 531 HB2 PRO 78 HB2 PRO 78 24.707 -11.007 1.849 532 HB3 PRO 78 HB1 PRO 78 23.078 -11.201 1.191 533 HG2 PRO 78 HG2 PRO 78 24.925 -8.858 1.005 534 HG3 PRO 78 HG1 PRO 78 23.948 -9.596 -0.277 535 HD2 PRO 78 HD2 PRO 78 23.186 -7.361 0.963 536 HD3 PRO 78 HD1 PRO 78 22.008 -8.589 0.480 537 H GLU 79 HN GLU 79 23.146 -10.587 5.364 538 HA GLU 79 HA GLU 79 25.095 -8.948 6.459 539 HB2 GLU 79 HB2 GLU 79 25.051 -10.414 8.374 540 HB3 GLU 79 HB1 GLU 79 23.417 -10.214 7.767 541 HG2 GLU 79 HG2 GLU 79 23.756 -12.384 6.541 542 HG3 GLU 79 HG1 GLU 79 25.231 -12.587 7.477 543 H GLU 80 HN GLU 80 25.366 -11.933 4.744 544 HA GLU 80 HA GLU 80 27.988 -12.651 5.266 545 HB2 GLU 80 HB2 GLU 80 26.808 -14.188 3.999 546 HB3 GLU 80 HB1 GLU 80 26.070 -12.947 3.006 547 HG2 GLU 80 HG2 GLU 80 27.492 -14.139 1.590 548 HG3 GLU 80 HG1 GLU 80 28.322 -12.621 1.940 549 H ILE 81 HN ILE 81 26.717 -10.526 2.732 550 HA ILE 81 HA ILE 81 29.324 -9.848 1.803 551 HB ILE 81 HB ILE 81 26.608 -8.769 1.119 552 HG12 ILE 81 HG12 ILE 81 28.566 -10.464 -0.434 553 HG13 ILE 81 HG11 ILE 81 27.157 -11.084 0.417 554 HG21 ILE 81 HG21 ILE 81 28.031 -7.849 -0.886 555 HG22 ILE 81 HG22 ILE 81 29.325 -7.883 0.319 556 HG23 ILE 81 HG23 ILE 81 27.868 -6.934 0.612 557 HD11 ILE 81 HD11 ILE 81 27.309 -9.469 -2.081 558 HD12 ILE 81 HD12 ILE 81 25.875 -9.380 -1.067 559 HD13 ILE 81 HD13 ILE 81 26.380 -10.932 -1.740 560 H VAL 82 HN VAL 82 26.869 -8.164 3.772 561 HA VAL 82 HA VAL 82 28.167 -5.692 3.892 562 HB VAL 82 HB VAL 82 26.947 -5.196 5.879 563 HG11 VAL 82 HG11 VAL 82 24.642 -5.909 5.314 564 HG12 VAL 82 HG12 VAL 82 25.323 -7.010 4.116 565 HG13 VAL 82 HG13 VAL 82 25.545 -5.269 3.940 566 HG21 VAL 82 HG21 VAL 82 26.886 -6.677 7.529 567 HG22 VAL 82 HG22 VAL 82 27.257 -8.003 6.426 568 HG23 VAL 82 HG23 VAL 82 25.580 -7.488 6.657 569 H ALA 83 HN ALA 83 28.607 -8.677 5.658 570 HA ALA 83 HA ALA 83 30.553 -7.923 7.515 571 HB1 ALA 83 HB1 ALA 83 31.190 -10.450 7.132 572 HB2 ALA 83 HB2 ALA 83 29.675 -10.450 6.206 573 HB3 ALA 83 HB3 ALA 83 29.676 -9.998 7.918 574 H ILE 84 HN ILE 84 30.857 -9.265 4.244 575 HA ILE 84 HA ILE 84 33.653 -9.323 4.110 576 HB ILE 84 HB ILE 84 31.593 -9.006 1.915 577 HG12 ILE 84 HG12 ILE 84 33.161 -11.491 2.421 578 HG13 ILE 84 HG11 ILE 84 31.845 -11.103 3.516 579 HG21 ILE 84 HG21 ILE 84 34.524 -9.697 1.673 580 HG22 ILE 84 HG22 ILE 84 33.766 -8.191 1.150 581 HG23 ILE 84 HG23 ILE 84 33.346 -9.713 0.358 582 HD11 ILE 84 HD11 ILE 84 31.470 -11.200 0.549 583 HD12 ILE 84 HD12 ILE 84 30.245 -11.254 1.827 584 HD13 ILE 84 HD13 ILE 84 31.323 -12.628 1.573 585 H ILE 85 HN ILE 85 31.330 -6.808 3.232 586 HA ILE 85 HA ILE 85 33.165 -5.041 2.048 587 HB ILE 85 HB ILE 85 30.535 -4.453 3.393 588 HG12 ILE 85 HG12 ILE 85 31.205 -4.844 0.471 589 HG13 ILE 85 HG11 ILE 85 30.523 -6.090 1.509 590 HG21 ILE 85 HG21 ILE 85 32.516 -2.732 2.099 591 HG22 ILE 85 HG22 ILE 85 31.172 -2.314 3.167 592 HG23 ILE 85 HG23 ILE 85 30.888 -2.568 1.444 593 HD11 ILE 85 HD11 ILE 85 28.887 -4.921 0.042 594 HD12 ILE 85 HD12 ILE 85 29.187 -3.457 0.976 595 HD13 ILE 85 HD13 ILE 85 28.501 -4.876 1.759 596 H THR 86 HN THR 86 31.885 -5.169 5.379 597 HA THR 86 HA THR 86 33.527 -2.979 6.174 598 HB THR 86 HB THR 86 31.635 -3.206 7.511 599 HG1 THR 86 HG1 THR 86 33.664 -2.820 8.656 600 HG21 THR 86 HG21 THR 86 30.718 -5.261 7.374 601 HG22 THR 86 HG22 THR 86 31.470 -5.408 8.974 602 HG23 THR 86 HG23 THR 86 32.267 -6.097 7.556 603 H SER 87 HN SER 87 34.081 -6.372 5.832 604 HA SER 87 HA SER 87 36.512 -6.416 7.347 605 HB2 SER 87 HB2 SER 87 35.552 -8.283 5.164 606 HB3 SER 87 HB1 SER 87 36.922 -8.579 6.237 607 HG SER 87 HG SER 87 34.163 -8.522 6.826 608 H MET 88 HN MET 88 35.590 -5.400 4.172 609 HA MET 88 HA MET 88 38.183 -5.330 3.003 610 HB2 MET 88 HB2 MET 88 35.672 -3.772 2.396 611 HB3 MET 88 HB1 MET 88 37.140 -3.645 1.441 612 HG2 MET 88 HG2 MET 88 35.497 -6.135 1.834 613 HG3 MET 88 HG1 MET 88 35.510 -5.113 0.401 614 HE1 MET 88 HE1 MET 88 38.624 -4.385 0.141 615 HE2 MET 88 HE2 MET 88 37.576 -4.833 -1.205 616 HE3 MET 88 HE3 MET 88 39.125 -5.648 -0.983 617 H GLY 89 HN GLY 89 36.449 -3.347 5.205 618 HA2 GLY 89 HA2 GLY 89 38.005 -1.909 6.569 619 HA3 GLY 89 HA1 GLY 89 38.512 -1.260 5.018 620 H PHE 90 HN PHE 90 35.275 -1.967 4.876 621 HA PHE 90 HA PHE 90 34.565 0.839 5.298 622 HB2 PHE 90 HB2 PHE 90 33.109 -1.386 3.850 623 HB3 PHE 90 HB1 PHE 90 32.525 0.270 3.977 624 HD1 PHE 90 HD2 PHE 90 34.733 1.952 3.427 625 HD2 PHE 90 HD1 PHE 90 33.839 -1.849 1.733 626 HE1 PHE 90 HE2 PHE 90 36.011 2.552 1.415 627 HE2 PHE 90 HE1 PHE 90 35.115 -1.254 -0.285 628 HZ PHE 90 HZ PHE 90 36.250 0.931 -0.423 629 H GLN 91 HN GLN 91 32.013 0.889 5.931 630 HA GLN 91 HA GLN 91 31.837 -0.379 8.523 631 HB2 GLN 91 HB2 GLN 91 30.141 1.600 7.024 632 HB3 GLN 91 HB1 GLN 91 29.581 0.853 8.505 633 HG2 GLN 91 HG2 GLN 91 31.386 1.812 9.728 634 HG3 GLN 91 HG1 GLN 91 32.099 2.467 8.255 635 HE21 GLN 91 HE21 GLN 91 31.213 3.859 10.653 636 HE22 GLN 91 HE22 GLN 91 30.001 4.987 10.141 637 H ARG 92 HN ARG 92 30.145 -1.796 9.140 638 HA ARG 92 HA ARG 92 29.081 -3.566 7.189 639 HB2 ARG 92 HB2 ARG 92 29.286 -4.186 9.549 640 HB3 ARG 92 HB1 ARG 92 28.119 -2.959 9.985 641 HG2 ARG 92 HG2 ARG 92 26.667 -4.303 8.203 642 HG3 ARG 92 HG1 ARG 92 27.709 -5.608 8.777 643 HD2 ARG 92 HD2 ARG 92 26.030 -3.799 10.496 644 HD3 ARG 92 HD1 ARG 92 25.624 -5.456 10.055 645 HE ARG 92 HE ARG 92 28.161 -5.432 11.269 646 HH11 ARG 92 HH11 ARG 92 24.781 -4.982 12.094 647 HH12 ARG 92 HH12 ARG 92 25.020 -5.349 13.774 648 HH21 ARG 92 HH21 ARG 92 28.454 -5.944 13.468 649 HH22 ARG 92 HH22 ARG 92 27.096 -5.902 14.551 650 H ASN 93 HN ASN 93 27.610 -0.959 9.091 651 HA ASN 93 HA ASN 93 25.111 -0.936 7.836 652 HB2 ASN 93 HB2 ASN 93 25.586 0.217 9.940 653 HB3 ASN 93 HB1 ASN 93 26.614 1.370 9.088 654 HD21 ASN 93 HD21 ASN 93 25.691 3.019 7.934 655 HD22 ASN 93 HD22 ASN 93 23.999 3.366 7.958 656 H GLN 94 HN GLN 94 28.111 0.771 7.027 657 HA GLN 94 HA GLN 94 27.040 2.261 4.874 658 HB2 GLN 94 HB2 GLN 94 29.106 3.009 5.641 659 HB3 GLN 94 HB1 GLN 94 29.787 1.394 5.661 660 HG2 GLN 94 HG2 GLN 94 30.260 1.411 3.412 661 HG3 GLN 94 HG1 GLN 94 29.029 2.626 3.054 662 HE21 GLN 94 HE21 GLN 94 32.248 2.069 4.231 663 HE22 GLN 94 HE22 GLN 94 32.778 3.712 4.193 664 H ALA 95 HN ALA 95 28.412 -0.952 5.144 665 HA ALA 95 HA ALA 95 28.324 -1.645 2.414 666 HB1 ALA 95 HB1 ALA 95 28.060 -3.410 4.853 667 HB2 ALA 95 HB2 ALA 95 29.578 -2.895 4.104 668 HB3 ALA 95 HB3 ALA 95 28.462 -3.944 3.217 669 H ILE 96 HN ILE 96 25.948 -1.911 5.042 670 HA ILE 96 HA ILE 96 23.938 -3.243 3.654 671 HB ILE 96 HB ILE 96 23.914 -1.375 5.985 672 HG12 ILE 96 HG12 ILE 96 22.404 -3.767 6.320 673 HG13 ILE 96 HG11 ILE 96 23.923 -4.177 5.535 674 HG21 ILE 96 HG21 ILE 96 21.395 -1.841 6.118 675 HG22 ILE 96 HG22 ILE 96 21.514 -2.191 4.387 676 HG23 ILE 96 HG23 ILE 96 21.946 -0.592 4.999 677 HD11 ILE 96 HD11 ILE 96 23.554 -2.741 8.147 678 HD12 ILE 96 HD12 ILE 96 25.103 -2.962 7.334 679 HD13 ILE 96 HD13 ILE 96 24.196 -4.367 7.895 680 H GLN 97 HN GLN 97 24.443 0.244 4.057 681 HA GLN 97 HA GLN 97 22.305 1.114 2.497 682 HB2 GLN 97 HB2 GLN 97 23.611 2.587 3.952 683 HB3 GLN 97 HB1 GLN 97 24.972 2.449 2.853 684 HG2 GLN 97 HG2 GLN 97 23.894 3.638 1.166 685 HG3 GLN 97 HG1 GLN 97 22.317 3.453 1.922 686 HE21 GLN 97 HE21 GLN 97 21.887 5.616 1.920 687 HE22 GLN 97 HE22 GLN 97 22.707 6.748 2.949 688 H ALA 98 HN ALA 98 25.645 0.442 1.591 689 HA ALA 98 HA ALA 98 25.479 1.165 -1.092 690 HB1 ALA 98 HB1 ALA 98 27.519 0.521 0.347 691 HB2 ALA 98 HB2 ALA 98 27.542 0.132 -1.374 692 HB3 ALA 98 HB3 ALA 98 27.174 -1.126 -0.184 693 H LEU 99 HN LEU 99 25.105 -2.070 0.386 694 HA LEU 99 HA LEU 99 24.440 -3.403 -1.975 695 HB2 LEU 99 HB2 LEU 99 23.628 -4.030 0.841 696 HB3 LEU 99 HB1 LEU 99 23.422 -5.119 -0.506 697 HG LEU 99 HG LEU 99 26.098 -4.083 0.382 698 HD11 LEU 99 HD11 LEU 99 24.890 -6.759 1.003 699 HD12 LEU 99 HD12 LEU 99 24.889 -5.399 2.119 700 HD13 LEU 99 HD13 LEU 99 26.418 -6.098 1.589 701 HD21 LEU 99 HD21 LEU 99 26.780 -5.021 -1.506 702 HD22 LEU 99 HD22 LEU 99 25.166 -5.631 -1.835 703 HD23 LEU 99 HD23 LEU 99 26.276 -6.580 -0.850 704 H ARG 100 HN ARG 100 22.419 -1.592 0.271 705 HA ARG 100 HA ARG 100 19.892 -2.327 -0.645 706 HB2 ARG 100 HB2 ARG 100 20.987 0.268 0.408 707 HB3 ARG 100 HB1 ARG 100 19.307 0.129 -0.095 708 HG2 ARG 100 HG2 ARG 100 18.847 -1.481 1.585 709 HG3 ARG 100 HG1 ARG 100 20.562 -1.658 1.971 710 HD2 ARG 100 HD2 ARG 100 20.682 0.491 2.905 711 HD3 ARG 100 HD1 ARG 100 19.133 0.971 2.213 712 HE ARG 100 HE ARG 100 18.934 -1.215 4.078 713 HH11 ARG 100 HH11 ARG 100 18.949 2.257 3.666 714 HH12 ARG 100 HH12 ARG 100 18.178 2.585 5.192 715 HH21 ARG 100 HH21 ARG 100 17.892 -0.824 6.064 716 HH22 ARG 100 HH22 ARG 100 17.548 0.808 6.563 717 H ALA 101 HN ALA 101 22.063 0.187 -1.802 718 HA ALA 101 HA ALA 101 20.415 1.029 -3.959 719 HB1 ALA 101 HB1 ALA 101 22.680 2.050 -4.701 720 HB2 ALA 101 HB2 ALA 101 23.248 1.468 -3.129 721 HB3 ALA 101 HB3 ALA 101 21.916 2.621 -3.216 722 H THR 102 HN THR 102 23.129 -1.221 -3.671 723 HA THR 102 HA THR 102 23.314 -1.646 -6.511 724 HB THR 102 HB THR 102 25.162 -3.077 -6.025 725 HG1 THR 102 HG1 THR 102 25.541 -3.867 -3.956 726 HG21 THR 102 HG21 THR 102 26.313 -1.227 -5.530 727 HG22 THR 102 HG22 THR 102 25.880 -1.413 -3.839 728 HG23 THR 102 HG23 THR 102 24.857 -0.459 -4.912 729 H ASN 103 HN ASN 103 21.110 -2.687 -4.375 730 HA ASN 103 HA ASN 103 19.706 -4.429 -4.124 731 HB2 ASN 103 HB2 ASN 103 20.537 -5.017 -6.972 732 HB3 ASN 103 HB1 ASN 103 19.206 -5.797 -6.132 733 HD21 ASN 103 HD21 ASN 103 18.434 -3.340 -4.741 734 HD22 ASN 103 HD22 ASN 103 17.653 -2.348 -5.932 735 H ASN 104 HN ASN 104 21.622 -4.946 -2.682 736 HA ASN 104 HA ASN 104 23.069 -6.361 -1.701 737 HB2 ASN 104 HB2 ASN 104 22.410 -8.776 -1.687 738 HB3 ASN 104 HB1 ASN 104 21.130 -7.659 -1.239 739 HD21 ASN 104 HD21 ASN 104 22.319 -9.783 -3.772 740 HD22 ASN 104 HD22 ASN 104 20.799 -9.975 -4.579 741 H ASN 105 HN ASN 105 23.870 -5.526 -4.345 742 HA ASN 105 HA ASN 105 25.439 -7.817 -5.268 743 HB2 ASN 105 HB2 ASN 105 24.385 -6.168 -6.900 744 HB3 ASN 105 HB1 ASN 105 25.556 -4.986 -6.323 745 HD21 ASN 105 HD21 ASN 105 25.138 -7.982 -8.066 746 HD22 ASN 105 HD22 ASN 105 26.707 -8.000 -8.799 747 H LEU 106 HN LEU 106 27.224 -8.242 -4.283 748 HA LEU 106 HA LEU 106 28.387 -6.743 -2.245 749 HB2 LEU 106 HB2 LEU 106 28.668 -9.132 -2.470 750 HB3 LEU 106 HB1 LEU 106 29.508 -8.945 -3.985 751 HG LEU 106 HG LEU 106 30.724 -7.691 -1.569 752 HD11 LEU 106 HD11 LEU 106 31.189 -10.588 -2.166 753 HD12 LEU 106 HD12 LEU 106 29.893 -10.085 -1.087 754 HD13 LEU 106 HD13 LEU 106 31.566 -9.681 -0.695 755 HD21 LEU 106 HD21 LEU 106 32.794 -8.387 -2.676 756 HD22 LEU 106 HD22 LEU 106 31.782 -7.398 -3.726 757 HD23 LEU 106 HD23 LEU 106 31.847 -9.147 -3.957 758 H GLU 107 HN GLU 107 29.760 -7.416 -5.439 759 HA GLU 107 HA GLU 107 31.948 -5.707 -5.253 760 HB2 GLU 107 HB2 GLU 107 30.420 -6.647 -7.674 761 HB3 GLU 107 HB1 GLU 107 31.947 -5.779 -7.762 762 HG2 GLU 107 HG2 GLU 107 31.644 -8.287 -6.175 763 HG3 GLU 107 HG1 GLU 107 32.019 -8.317 -7.898 764 H ARG 108 HN ARG 108 28.744 -5.048 -6.636 765 HA ARG 108 HA ARG 108 29.351 -2.396 -7.410 766 HB2 ARG 108 HB2 ARG 108 27.382 -3.832 -8.159 767 HB3 ARG 108 HB1 ARG 108 26.618 -3.380 -6.651 768 HG2 ARG 108 HG2 ARG 108 26.746 -1.031 -7.287 769 HG3 ARG 108 HG1 ARG 108 27.483 -1.499 -8.826 770 HD2 ARG 108 HD2 ARG 108 24.847 -2.526 -7.856 771 HD3 ARG 108 HD1 ARG 108 24.998 -1.105 -8.897 772 HE ARG 108 HE ARG 108 26.327 -2.906 -10.329 773 HH11 ARG 108 HH11 ARG 108 23.208 -3.132 -8.726 774 HH12 ARG 108 HH12 ARG 108 22.633 -4.394 -9.769 775 HH21 ARG 108 HH21 ARG 108 25.532 -4.544 -11.720 776 HH22 ARG 108 HH22 ARG 108 23.935 -5.191 -11.455 777 H ALA 109 HN ALA 109 28.316 -3.811 -4.373 778 HA ALA 109 HA ALA 109 27.460 -1.452 -3.116 779 HB1 ALA 109 HB1 ALA 109 27.697 -4.108 -2.381 780 HB2 ALA 109 HB2 ALA 109 27.156 -2.793 -1.342 781 HB3 ALA 109 HB3 ALA 109 28.851 -3.277 -1.335 782 H LEU 110 HN LEU 110 30.578 -3.140 -3.058 783 HA LEU 110 HA LEU 110 32.085 -1.187 -1.738 784 HB2 LEU 110 HB2 LEU 110 32.986 -3.037 -3.948 785 HB3 LEU 110 HB1 LEU 110 34.008 -2.284 -2.743 786 HG LEU 110 HG LEU 110 31.810 -4.182 -1.969 787 HD11 LEU 110 HD11 LEU 110 34.673 -4.855 -2.650 788 HD12 LEU 110 HD12 LEU 110 33.237 -5.341 -3.556 789 HD13 LEU 110 HD13 LEU 110 33.499 -5.955 -1.922 790 HD21 LEU 110 HD21 LEU 110 33.197 -4.455 0.021 791 HD22 LEU 110 HD22 LEU 110 32.755 -2.767 -0.230 792 HD23 LEU 110 HD23 LEU 110 34.376 -3.323 -0.643 793 H ASP 111 HN ASP 111 31.287 -1.666 -5.121 794 HA ASP 111 HA ASP 111 32.697 0.417 -6.321 795 HB2 ASP 111 HB2 ASP 111 31.086 -1.442 -7.323 796 HB3 ASP 111 HB1 ASP 111 29.891 -0.171 -7.162 797 H TRP 112 HN TRP 112 29.496 0.376 -4.878 798 HA TRP 112 HA TRP 112 28.818 3.066 -5.369 799 HB2 TRP 112 HB2 TRP 112 27.252 1.151 -4.850 800 HB3 TRP 112 HB1 TRP 112 27.750 1.306 -3.170 801 HD1 TRP 112 HD1 TRP 112 26.912 3.474 -1.823 802 HE1 TRP 112 HE1 TRP 112 25.015 5.157 -2.267 803 HE3 TRP 112 HE3 TRP 112 25.949 2.333 -6.715 804 HZ2 TRP 112 HZ2 TRP 112 23.323 5.883 -4.402 805 HZ3 TRP 112 HZ3 TRP 112 24.170 3.569 -7.881 806 HH2 TRP 112 HH2 TRP 112 22.886 5.307 -6.747 807 H ILE 113 HN ILE 113 30.046 1.372 -2.543 808 HA ILE 113 HA ILE 113 30.191 3.550 -0.802 809 HB ILE 113 HB ILE 113 31.866 1.036 -0.908 810 HG12 ILE 113 HG12 ILE 113 29.378 1.776 0.660 811 HG13 ILE 113 HG11 ILE 113 29.492 0.573 -0.613 812 HG21 ILE 113 HG21 ILE 113 31.546 3.033 1.335 813 HG22 ILE 113 HG22 ILE 113 32.998 2.773 0.372 814 HG23 ILE 113 HG23 ILE 113 32.409 1.498 1.433 815 HD11 ILE 113 HD11 ILE 113 31.279 0.176 1.685 816 HD12 ILE 113 HD12 ILE 113 30.331 -0.986 0.746 817 HD13 ILE 113 HD13 ILE 113 29.553 -0.004 1.984 818 H PHE 114 HN PHE 114 32.493 2.269 -3.149 819 HA PHE 114 HA PHE 114 34.597 4.089 -2.568 820 HB2 PHE 114 HB2 PHE 114 34.908 1.912 -3.745 821 HB3 PHE 114 HB1 PHE 114 34.039 2.564 -5.124 822 HD1 PHE 114 HD2 PHE 114 37.090 3.036 -3.063 823 HD2 PHE 114 HD1 PHE 114 35.153 3.758 -6.785 824 HE1 PHE 114 HE2 PHE 114 39.201 3.892 -3.995 825 HE2 PHE 114 HE1 PHE 114 37.259 4.614 -7.720 826 HZ PHE 114 HZ PHE 114 39.288 4.685 -6.322 827 H SER 115 HN SER 115 31.686 4.327 -4.365 828 HA SER 115 HA SER 115 32.521 6.518 -6.027 829 HB2 SER 115 HB2 SER 115 30.656 4.813 -6.507 830 HB3 SER 115 HB1 SER 115 29.675 5.748 -5.391 831 HG SER 115 HG SER 115 30.296 7.614 -6.808 832 H HIS 116 HN HIS 116 31.839 6.208 -2.801 833 HA HIS 116 HA HIS 116 31.552 9.111 -2.604 834 HB2 HIS 116 HB2 HIS 116 29.266 8.065 -2.370 835 HB3 HIS 116 HB1 HIS 116 29.851 7.258 -0.921 836 HD1 HIS 116 HD1 HIS 116 29.729 8.557 1.231 837 HD2 HIS 116 HD2 HIS 116 29.248 10.973 -2.127 838 HE1 HIS 116 HE1 HIS 116 29.087 10.831 2.106 839 HE2 HIS 116 HE2 HIS 116 29.011 12.316 0.069 840 HA PRO 117 HA PRO 117 35.052 7.418 -0.012 841 HB2 PRO 117 HB2 PRO 117 36.312 9.882 -0.436 842 HB3 PRO 117 HB1 PRO 117 36.686 8.370 -1.260 843 HG2 PRO 117 HG2 PRO 117 34.964 10.642 -2.138 844 HG3 PRO 117 HG1 PRO 117 36.037 9.599 -3.099 845 HD2 PRO 117 HD2 PRO 117 33.402 9.252 -3.169 846 HD3 PRO 117 HD1 PRO 117 34.494 7.855 -3.133 847 H GLU 118 HN GLU 118 34.317 10.842 -0.174 848 HA GLU 118 HA GLU 118 32.932 10.840 2.331 849 HB2 GLU 118 HB2 GLU 118 34.376 12.682 3.252 850 HB3 GLU 118 HB1 GLU 118 35.101 11.083 3.255 851 HG2 GLU 118 HG2 GLU 118 36.370 11.641 1.277 852 HG3 GLU 118 HG1 GLU 118 35.619 13.233 1.218 853 H PHE 119 HN PHE 119 34.562 12.974 0.029 854 HA PHE 119 HA PHE 119 31.987 14.260 -0.521 855 HB2 PHE 119 HB2 PHE 119 33.498 15.639 1.014 856 HB3 PHE 119 HB1 PHE 119 34.601 15.777 -0.349 857 HD1 PHE 119 HD1 PHE 119 31.049 16.411 0.579 858 HD2 PHE 119 HD2 PHE 119 34.391 17.547 -1.801 859 HE1 PHE 119 HE1 PHE 119 29.798 18.365 -0.236 860 HE2 PHE 119 HE2 PHE 119 33.146 19.506 -2.618 861 HZ PHE 119 HZ PHE 119 30.844 19.926 -1.810 862 H GLU 120 HN GLU 120 33.985 12.255 -1.684 863 HA GLU 120 HA GLU 120 34.681 11.538 -3.699 864 HB2 GLU 120 HB2 GLU 120 32.799 13.700 -4.597 865 HB3 GLU 120 HB1 GLU 120 33.707 12.719 -5.737 866 HG2 GLU 120 HG2 GLU 120 32.692 10.712 -4.907 867 HG3 GLU 120 HG1 GLU 120 31.865 11.622 -3.647 868 H GLU 121 HN GLU 121 35.771 12.407 -5.845 869 HA GLU 121 HA GLU 121 37.617 14.552 -5.077 870 HB2 GLU 121 HB2 GLU 121 38.787 12.458 -5.063 871 HB3 GLU 121 HB1 GLU 121 38.026 11.978 -6.577 872 HG2 GLU 121 HG2 GLU 121 39.223 13.623 -7.771 873 HG3 GLU 121 HG1 GLU 121 39.960 14.248 -6.297 874 H ASP 122 HN ASP 122 37.751 16.201 -6.516 875 HA ASP 122 HA ASP 122 37.140 15.632 -9.280 876 HB2 ASP 122 HB2 ASP 122 35.614 17.525 -9.544 877 HB3 ASP 122 HB1 ASP 122 34.987 16.380 -8.365 878 H SER 123 HN SER 123 38.036 18.227 -7.025 879 HA SER 123 HA SER 123 39.306 20.103 -7.318 880 HB2 SER 123 HB2 SER 123 41.656 19.577 -8.056 881 HB3 SER 123 HB1 SER 123 41.047 18.562 -6.753 882 HG SER 123 HG SER 123 40.500 17.505 -9.198 883 H ASP 124 HN ASP 124 37.498 20.459 -9.048 884 HA ASP 124 HA ASP 124 38.421 20.369 -11.782 885 HB2 ASP 124 HB2 ASP 124 36.122 19.753 -11.301 886 HB3 ASP 124 HB1 ASP 124 35.817 21.334 -10.589 887 H PHE 125 HN PHE 125 39.019 22.011 -13.000 888 HA PHE 125 HA PHE 125 39.632 24.058 -13.715 889 HB2 PHE 125 HB2 PHE 125 37.350 24.770 -13.122 890 HB3 PHE 125 HB1 PHE 125 37.891 25.130 -11.487 891 HD1 PHE 125 HD2 PHE 125 38.651 25.997 -15.030 892 HD2 PHE 125 HD1 PHE 125 38.546 27.283 -10.973 893 HE1 PHE 125 HE2 PHE 125 39.255 28.271 -15.742 894 HE2 PHE 125 HE1 PHE 125 39.154 29.562 -11.679 895 HZ PHE 125 HZ PHE 125 39.509 30.058 -14.065 896 H VAL 126 HN VAL 126 41.712 23.353 -12.996 897 HA VAL 126 HA VAL 126 42.778 25.172 -10.958 898 HB VAL 126 HB VAL 126 43.677 22.297 -11.269 899 HG11 VAL 126 HG11 VAL 126 45.484 23.808 -10.643 900 HG12 VAL 126 HG12 VAL 126 45.055 22.751 -9.298 901 HG13 VAL 126 HG13 VAL 126 44.514 24.429 -9.306 902 HG21 VAL 126 HG21 VAL 126 41.503 22.394 -10.179 903 HG22 VAL 126 HG22 VAL 126 42.118 23.587 -9.032 904 HG23 VAL 126 HG23 VAL 126 42.760 21.944 -9.028 Start of MODEL 8 1 H1 ASP 1 HT1 ASP 1 -48.878 8.679 5.461 2 H2 ASP 1 HT2 ASP 1 -48.237 8.946 3.913 3 H3 ASP 1 HT3 ASP 1 -47.209 8.928 5.260 4 HA ASP 1 HA ASP 1 -47.631 6.614 5.639 5 HB2 ASP 1 HB2 ASP 1 -49.988 6.850 4.548 6 HB3 ASP 1 HB1 ASP 1 -49.143 6.530 3.036 7 H ILE 2 HN ILE 2 -46.654 4.847 4.115 8 HA ILE 2 HA ILE 2 -44.549 4.332 3.395 9 HB ILE 2 HB ILE 2 -45.258 6.221 1.138 10 HG12 ILE 2 HG12 ILE 2 -45.787 3.737 0.178 11 HG13 ILE 2 HG11 ILE 2 -46.271 3.539 1.854 12 HG21 ILE 2 HG21 ILE 2 -43.804 4.699 -0.182 13 HG22 ILE 2 HG22 ILE 2 -43.370 3.883 1.322 14 HG23 ILE 2 HG23 ILE 2 -42.948 5.578 1.086 15 HD11 ILE 2 HD11 ILE 2 -47.285 5.704 0.037 16 HD12 ILE 2 HD12 ILE 2 -47.850 5.321 1.664 17 HD13 ILE 2 HD13 ILE 2 -48.113 4.178 0.350 18 H ASP 3 HN ASP 3 -43.638 5.529 5.230 19 HA ASP 3 HA ASP 3 -42.795 8.206 5.012 20 HB2 ASP 3 HB2 ASP 3 -41.699 5.972 6.733 21 HB3 ASP 3 HB1 ASP 3 -41.248 7.666 6.894 22 H GLU 4 HN GLU 4 -41.716 8.710 3.220 23 HA GLU 4 HA GLU 4 -39.677 7.094 2.097 24 HB2 GLU 4 HB2 GLU 4 -40.798 9.790 1.527 25 HB3 GLU 4 HB1 GLU 4 -39.253 9.344 0.804 26 HG2 GLU 4 HG2 GLU 4 -40.168 7.650 -0.449 27 HG3 GLU 4 HG1 GLU 4 -41.558 7.466 0.615 28 H SER 5 HN SER 5 -39.634 9.123 4.767 29 HA SER 5 HA SER 5 -37.016 10.069 4.784 30 HB2 SER 5 HB2 SER 5 -38.645 10.504 6.605 31 HB3 SER 5 HB1 SER 5 -38.538 8.812 7.091 32 HG SER 5 HG SER 5 -36.706 9.201 8.059 33 H SER 6 HN SER 6 -38.317 6.846 5.199 34 HA SER 6 HA SER 6 -35.983 5.541 6.080 35 HB2 SER 6 HB2 SER 6 -38.165 4.296 4.402 36 HB3 SER 6 HB1 SER 6 -37.157 3.521 5.626 37 HG SER 6 HG SER 6 -39.516 4.673 5.958 38 H VAL 7 HN VAL 7 -37.399 5.818 2.803 39 HA VAL 7 HA VAL 7 -35.258 4.425 1.576 40 HB VAL 7 HB VAL 7 -37.320 4.406 0.404 41 HG11 VAL 7 HG11 VAL 7 -37.154 7.401 0.418 42 HG12 VAL 7 HG12 VAL 7 -38.427 6.381 1.096 43 HG13 VAL 7 HG13 VAL 7 -38.225 6.501 -0.652 44 HG21 VAL 7 HG21 VAL 7 -36.632 5.014 -1.797 45 HG22 VAL 7 HG22 VAL 7 -35.197 4.479 -0.909 46 HG23 VAL 7 HG23 VAL 7 -35.492 6.202 -1.163 47 H MET 8 HN MET 8 -36.002 7.856 1.943 48 HA MET 8 HA MET 8 -33.872 8.848 0.439 49 HB2 MET 8 HB2 MET 8 -35.302 10.021 2.814 50 HB3 MET 8 HB1 MET 8 -34.075 10.898 1.907 51 HG2 MET 8 HG2 MET 8 -35.446 10.540 -0.144 52 HG3 MET 8 HG1 MET 8 -36.704 9.864 0.883 53 HE1 MET 8 HE1 MET 8 -37.016 12.351 -1.170 54 HE2 MET 8 HE2 MET 8 -38.063 13.407 -0.221 55 HE3 MET 8 HE3 MET 8 -38.360 11.668 -0.254 56 H GLN 9 HN GLN 9 -33.988 7.729 3.784 57 HA GLN 9 HA GLN 9 -31.366 8.482 4.479 58 HB2 GLN 9 HB2 GLN 9 -33.263 6.407 5.500 59 HB3 GLN 9 HB1 GLN 9 -31.588 6.380 6.038 60 HG2 GLN 9 HG2 GLN 9 -33.468 8.721 6.295 61 HG3 GLN 9 HG1 GLN 9 -33.043 7.599 7.587 62 HE21 GLN 9 HE21 GLN 9 -30.263 7.393 6.734 63 HE22 GLN 9 HE22 GLN 9 -29.505 8.876 7.192 64 H LEU 10 HN LEU 10 -32.607 5.490 2.972 65 HA LEU 10 HA LEU 10 -30.099 4.205 2.738 66 HB2 LEU 10 HB2 LEU 10 -32.223 4.009 0.632 67 HB3 LEU 10 HB1 LEU 10 -31.051 2.801 1.095 68 HG LEU 10 HG LEU 10 -33.547 3.610 2.554 69 HD11 LEU 10 HD11 LEU 10 -32.632 0.962 1.472 70 HD12 LEU 10 HD12 LEU 10 -33.679 2.088 0.603 71 HD13 LEU 10 HD13 LEU 10 -34.223 1.367 2.124 72 HD21 LEU 10 HD21 LEU 10 -32.941 1.898 4.225 73 HD22 LEU 10 HD22 LEU 10 -31.824 3.258 4.230 74 HD23 LEU 10 HD23 LEU 10 -31.356 1.743 3.468 75 H ALA 11 HN ALA 11 -31.859 6.389 0.630 76 HA ALA 11 HA ALA 11 -30.097 6.354 -1.552 77 HB1 ALA 11 HB1 ALA 11 -31.722 8.767 -0.876 78 HB2 ALA 11 HB2 ALA 11 -32.525 7.251 -1.279 79 HB3 ALA 11 HB3 ALA 11 -31.433 8.011 -2.446 80 H GLU 12 HN GLU 12 -30.170 8.293 1.373 81 HA GLU 12 HA GLU 12 -28.110 10.098 0.791 82 HB2 GLU 12 HB2 GLU 12 -28.894 8.824 3.403 83 HB3 GLU 12 HB1 GLU 12 -27.705 10.105 3.278 84 HG2 GLU 12 HG2 GLU 12 -30.589 10.324 2.441 85 HG3 GLU 12 HG1 GLU 12 -29.922 10.909 3.965 86 H MET 13 HN MET 13 -28.055 6.727 1.658 87 HA MET 13 HA MET 13 -25.170 6.729 2.025 88 HB2 MET 13 HB2 MET 13 -27.098 4.409 2.189 89 HB3 MET 13 HB1 MET 13 -25.434 4.444 2.758 90 HG2 MET 13 HG2 MET 13 -26.089 6.212 4.370 91 HG3 MET 13 HG1 MET 13 -27.760 5.999 3.862 92 HE1 MET 13 HE1 MET 13 -24.648 4.236 5.523 93 HE2 MET 13 HE2 MET 13 -25.074 3.158 4.194 94 HE3 MET 13 HE3 MET 13 -25.307 2.633 5.860 95 H GLY 14 HN GLY 14 -26.985 6.799 -0.650 96 HA2 GLY 14 HA2 GLY 14 -25.097 6.299 -2.450 97 HA3 GLY 14 HA1 GLY 14 -25.607 4.675 -2.048 98 H PHE 15 HN PHE 15 -27.473 3.875 -2.893 99 HA PHE 15 HA PHE 15 -28.227 5.210 -5.338 100 HB2 PHE 15 HB2 PHE 15 -28.986 2.496 -4.246 101 HB3 PHE 15 HB1 PHE 15 -29.354 3.079 -5.864 102 HD1 PHE 15 HD2 PHE 15 -27.543 3.408 -7.504 103 HD2 PHE 15 HD1 PHE 15 -26.825 1.676 -3.682 104 HE1 PHE 15 HE2 PHE 15 -25.387 2.533 -8.308 105 HE2 PHE 15 HE1 PHE 15 -24.673 0.796 -4.481 106 HZ PHE 15 HZ PHE 15 -23.947 1.239 -6.799 107 HA PRO 16 HA PRO 16 -32.295 6.585 -4.041 108 HB2 PRO 16 HB2 PRO 16 -33.451 6.638 -6.508 109 HB3 PRO 16 HB1 PRO 16 -32.329 7.887 -5.950 110 HG2 PRO 16 HG2 PRO 16 -31.800 5.508 -7.696 111 HG3 PRO 16 HG1 PRO 16 -31.256 7.187 -7.898 112 HD2 PRO 16 HD2 PRO 16 -29.642 5.283 -6.891 113 HD3 PRO 16 HD1 PRO 16 -29.579 6.963 -6.315 114 H LEU 17 HN LEU 17 -32.785 4.635 -2.919 115 HA LEU 17 HA LEU 17 -33.461 2.273 -4.396 116 HB2 LEU 17 HB2 LEU 17 -33.456 2.822 -1.423 117 HB3 LEU 17 HB1 LEU 17 -33.729 1.248 -2.162 118 HG LEU 17 HG LEU 17 -31.194 2.877 -2.417 119 HD11 LEU 17 HD11 LEU 17 -30.165 1.129 -1.078 120 HD12 LEU 17 HD12 LEU 17 -31.732 0.339 -0.894 121 HD13 LEU 17 HD13 LEU 17 -31.460 1.933 -0.191 122 HD21 LEU 17 HD21 LEU 17 -31.623 1.563 -4.415 123 HD22 LEU 17 HD22 LEU 17 -31.866 0.120 -3.430 124 HD23 LEU 17 HD23 LEU 17 -30.276 0.883 -3.500 125 H GLU 18 HN GLU 18 -35.318 3.508 -5.485 126 HA GLU 18 HA GLU 18 -37.749 3.957 -4.242 127 HB2 GLU 18 HB2 GLU 18 -36.841 4.076 -6.774 128 HB3 GLU 18 HB1 GLU 18 -37.807 2.610 -6.870 129 HG2 GLU 18 HG2 GLU 18 -39.017 5.010 -5.616 130 HG3 GLU 18 HG1 GLU 18 -38.818 4.967 -7.365 131 H ALA 19 HN ALA 19 -36.143 0.959 -4.975 132 HA ALA 19 HA ALA 19 -38.241 -0.853 -4.642 133 HB1 ALA 19 HB1 ALA 19 -35.523 -1.401 -3.520 134 HB2 ALA 19 HB2 ALA 19 -35.747 -1.228 -5.256 135 HB3 ALA 19 HB3 ALA 19 -36.617 -2.489 -4.380 136 H CYS 20 HN CYS 20 -36.424 1.027 -2.366 137 HA CYS 20 HA CYS 20 -37.464 -0.206 0.004 138 HB2 CYS 20 HB2 CYS 20 -35.362 1.220 -0.052 139 HB3 CYS 20 HB1 CYS 20 -36.407 2.612 -0.278 140 HG CYS 20 HG CYS 20 -36.176 0.633 2.491 141 H ARG 21 HN ARG 21 -38.216 2.645 -1.921 142 HA ARG 21 HA ARG 21 -40.217 3.819 -0.427 143 HB2 ARG 21 HB2 ARG 21 -39.143 4.448 -2.715 144 HB3 ARG 21 HB1 ARG 21 -40.446 3.506 -3.413 145 HG2 ARG 21 HG2 ARG 21 -40.922 5.821 -1.558 146 HG3 ARG 21 HG1 ARG 21 -40.787 5.994 -3.307 147 HD2 ARG 21 HD2 ARG 21 -42.810 4.312 -1.833 148 HD3 ARG 21 HD1 ARG 21 -43.123 5.863 -2.611 149 HE ARG 21 HE ARG 21 -42.030 3.864 -4.389 150 HH11 ARG 21 HH11 ARG 21 -44.925 5.318 -3.056 151 HH12 ARG 21 HH12 ARG 21 -45.982 4.637 -4.260 152 HH21 ARG 21 HH21 ARG 21 -43.396 2.975 -5.984 153 HH22 ARG 21 HH22 ARG 21 -45.109 3.293 -5.933 154 H LYS 22 HN LYS 22 -40.687 1.383 -2.992 155 HA LYS 22 HA LYS 22 -43.416 0.924 -2.400 156 HB2 LYS 22 HB2 LYS 22 -43.255 -0.953 -3.915 157 HB3 LYS 22 HB1 LYS 22 -42.343 0.394 -4.576 158 HG2 LYS 22 HG2 LYS 22 -40.286 -0.686 -3.570 159 HG3 LYS 22 HG1 LYS 22 -41.293 -2.108 -3.301 160 HD2 LYS 22 HD2 LYS 22 -40.175 -2.445 -5.365 161 HD3 LYS 22 HD1 LYS 22 -41.847 -2.041 -5.760 162 HE2 LYS 22 HE2 LYS 22 -41.163 0.292 -6.168 163 HE3 LYS 22 HE1 LYS 22 -39.490 -0.151 -5.816 164 HZ1 LYS 22 HZ1 LYS 22 -39.585 -1.719 -7.683 165 HZ2 LYS 22 HZ2 LYS 22 -39.852 -0.120 -8.182 166 HZ3 LYS 22 HZ3 LYS 22 -41.154 -1.194 -8.046 167 H ALA 23 HN ALA 23 -40.434 -0.498 -1.218 168 HA ALA 23 HA ALA 23 -41.528 -2.743 0.092 169 HB1 ALA 23 HB1 ALA 23 -39.451 -2.813 1.342 170 HB2 ALA 23 HB2 ALA 23 -39.071 -1.169 0.826 171 HB3 ALA 23 HB3 ALA 23 -39.129 -2.474 -0.361 172 H VAL 24 HN VAL 24 -40.889 0.562 1.174 173 HA VAL 24 HA VAL 24 -41.614 0.275 3.844 174 HB VAL 24 HB VAL 24 -42.001 2.685 2.041 175 HG11 VAL 24 HG11 VAL 24 -42.171 4.016 4.071 176 HG12 VAL 24 HG12 VAL 24 -42.076 2.552 5.052 177 HG13 VAL 24 HG13 VAL 24 -43.465 2.819 4.002 178 HG21 VAL 24 HG21 VAL 24 -39.961 3.510 3.151 179 HG22 VAL 24 HG22 VAL 24 -39.681 2.019 2.252 180 HG23 VAL 24 HG23 VAL 24 -39.827 1.975 4.009 181 H TYR 25 HN TYR 25 -43.679 1.004 1.013 182 HA TYR 25 HA TYR 25 -46.079 0.975 2.546 183 HB2 TYR 25 HB2 TYR 25 -46.087 1.977 0.329 184 HB3 TYR 25 HB1 TYR 25 -45.703 0.419 -0.408 185 HD1 TYR 25 HD2 TYR 25 -48.221 1.834 1.956 186 HD2 TYR 25 HD1 TYR 25 -47.492 -0.717 -1.367 187 HE1 TYR 25 HE2 TYR 25 -50.614 1.310 1.841 188 HE2 TYR 25 HE1 TYR 25 -49.890 -1.256 -1.483 189 HH TYR 25 HH TYR 25 -52.254 0.449 0.426 190 H PHE 26 HN PHE 26 -44.334 -1.540 0.776 191 HA PHE 26 HA PHE 26 -46.252 -3.576 1.048 192 HB2 PHE 26 HB2 PHE 26 -44.381 -3.658 -0.553 193 HB3 PHE 26 HB1 PHE 26 -43.252 -3.844 0.783 194 HD1 PHE 26 HD2 PHE 26 -46.117 -5.458 -0.927 195 HD2 PHE 26 HD1 PHE 26 -42.780 -5.955 1.666 196 HE1 PHE 26 HE2 PHE 26 -46.394 -7.900 -1.039 197 HE2 PHE 26 HE1 PHE 26 -43.054 -8.399 1.561 198 HZ PHE 26 HZ PHE 26 -44.880 -9.373 0.202 199 H THR 27 HN THR 27 -43.544 -2.641 3.132 200 HA THR 27 HA THR 27 -43.719 -4.819 4.911 201 HB THR 27 HB THR 27 -42.506 -3.326 6.530 202 HG1 THR 27 HG1 THR 27 -42.264 -1.480 4.401 203 HG21 THR 27 HG21 THR 27 -41.339 -3.423 3.754 204 HG22 THR 27 HG22 THR 27 -41.338 -4.769 4.894 205 HG23 THR 27 HG23 THR 27 -40.440 -3.296 5.264 206 H GLY 28 HN GLY 28 -45.609 -1.986 4.515 207 HA2 GLY 28 HA2 GLY 28 -47.730 -1.701 5.547 208 HA3 GLY 28 HA1 GLY 28 -47.165 -2.669 6.905 209 H ASN 29 HN ASN 29 -45.171 -0.193 5.526 210 HA ASN 29 HA ASN 29 -44.319 1.755 6.316 211 HB2 ASN 29 HB2 ASN 29 -46.902 2.237 6.280 212 HB3 ASN 29 HB1 ASN 29 -46.748 2.177 8.031 213 HD21 ASN 29 HD21 ASN 29 -47.188 4.320 8.360 214 HD22 ASN 29 HD22 ASN 29 -46.127 5.599 7.870 215 H MET 30 HN MET 30 -42.998 -0.008 7.458 216 HA MET 30 HA MET 30 -43.514 -0.098 10.343 217 HB2 MET 30 HB2 MET 30 -41.859 -1.876 8.553 218 HB3 MET 30 HB1 MET 30 -41.905 -2.031 10.303 219 HG2 MET 30 HG2 MET 30 -44.243 -2.329 8.430 220 HG3 MET 30 HG1 MET 30 -43.373 -3.635 9.234 221 HE1 MET 30 HE1 MET 30 -43.446 -4.079 11.861 222 HE2 MET 30 HE2 MET 30 -44.271 -3.011 12.999 223 HE3 MET 30 HE3 MET 30 -42.856 -2.437 12.116 224 H GLY 31 HN GLY 31 -42.045 2.087 8.765 225 HA2 GLY 31 HA2 GLY 31 -40.548 3.620 9.696 226 HA3 GLY 31 HA1 GLY 31 -40.006 2.382 10.818 227 H ALA 32 HN ALA 32 -38.031 3.745 9.951 228 HA ALA 32 HA ALA 32 -37.034 3.122 7.366 229 HB1 ALA 32 HB1 ALA 32 -35.586 4.220 9.769 230 HB2 ALA 32 HB2 ALA 32 -36.412 5.168 8.531 231 HB3 ALA 32 HB3 ALA 32 -34.987 4.218 8.111 232 H GLU 33 HN GLU 33 -36.357 1.865 10.600 233 HA GLU 33 HA GLU 33 -34.079 0.378 9.969 234 HB2 GLU 33 HB2 GLU 33 -36.154 -0.125 12.102 235 HB3 GLU 33 HB1 GLU 33 -34.572 -0.892 12.037 236 HG2 GLU 33 HG2 GLU 33 -35.081 2.060 12.321 237 HG3 GLU 33 HG1 GLU 33 -34.611 0.959 13.616 238 H VAL 34 HN VAL 34 -37.489 -0.580 9.941 239 HA VAL 34 HA VAL 34 -36.976 -3.301 9.324 240 HB VAL 34 HB VAL 34 -39.485 -1.655 8.973 241 HG11 VAL 34 HG11 VAL 34 -39.055 -4.626 8.684 242 HG12 VAL 34 HG12 VAL 34 -39.658 -3.502 7.462 243 HG13 VAL 34 HG13 VAL 34 -40.637 -3.874 8.880 244 HG21 VAL 34 HG21 VAL 34 -40.219 -2.844 10.994 245 HG22 VAL 34 HG22 VAL 34 -38.769 -1.881 11.280 246 HG23 VAL 34 HG23 VAL 34 -38.645 -3.631 11.092 247 H ALA 35 HN ALA 35 -37.636 -0.452 7.324 248 HA ALA 35 HA ALA 35 -37.786 -1.998 4.910 249 HB1 ALA 35 HB1 ALA 35 -38.974 0.163 5.232 250 HB2 ALA 35 HB2 ALA 35 -38.022 0.050 3.753 251 HB3 ALA 35 HB3 ALA 35 -37.411 0.978 5.125 252 H PHE 36 HN PHE 36 -35.267 -0.193 6.591 253 HA PHE 36 HA PHE 36 -33.250 -0.318 4.652 254 HB2 PHE 36 HB2 PHE 36 -32.896 0.901 6.719 255 HB3 PHE 36 HB1 PHE 36 -33.072 -0.570 7.668 256 HD1 PHE 36 HD2 PHE 36 -30.886 1.246 5.328 257 HD2 PHE 36 HD1 PHE 36 -31.243 -2.058 7.985 258 HE1 PHE 36 HE2 PHE 36 -28.453 0.897 5.216 259 HE2 PHE 36 HE1 PHE 36 -28.812 -2.412 7.880 260 HZ PHE 36 HZ PHE 36 -27.415 -0.936 6.493 261 H ASN 37 HN ASN 37 -34.315 -2.666 7.065 262 HA ASN 37 HA ASN 37 -32.547 -4.750 6.376 263 HB2 ASN 37 HB2 ASN 37 -33.864 -4.729 8.459 264 HB3 ASN 37 HB1 ASN 37 -35.344 -4.917 7.525 265 HD21 ASN 37 HD21 ASN 37 -35.970 -6.849 8.331 266 HD22 ASN 37 HD22 ASN 37 -35.086 -8.321 8.102 267 H TRP 38 HN TRP 38 -35.778 -3.870 5.213 268 HA TRP 38 HA TRP 38 -36.200 -6.188 3.667 269 HB2 TRP 38 HB2 TRP 38 -37.848 -4.241 4.396 270 HB3 TRP 38 HB1 TRP 38 -37.407 -3.584 2.822 271 HD1 TRP 38 HD1 TRP 38 -38.574 -4.627 0.732 272 HE1 TRP 38 HE1 TRP 38 -40.258 -6.542 0.380 273 HE3 TRP 38 HE3 TRP 38 -38.496 -6.655 5.426 274 HZ2 TRP 38 HZ2 TRP 38 -41.398 -8.637 1.894 275 HZ3 TRP 38 HZ3 TRP 38 -39.905 -8.615 5.892 276 HH2 TRP 38 HH2 TRP 38 -41.330 -9.585 4.157 277 H ILE 39 HN ILE 39 -34.555 -3.167 3.001 278 HA ILE 39 HA ILE 39 -34.465 -3.598 0.174 279 HB ILE 39 HB ILE 39 -34.306 -1.334 1.425 280 HG12 ILE 39 HG12 ILE 39 -33.076 -0.366 -0.467 281 HG13 ILE 39 HG11 ILE 39 -32.466 -1.964 -0.886 282 HG21 ILE 39 HG21 ILE 39 -31.369 -1.980 1.305 283 HG22 ILE 39 HG22 ILE 39 -32.318 -1.974 2.791 284 HG23 ILE 39 HG23 ILE 39 -32.111 -0.482 1.868 285 HD11 ILE 39 HD11 ILE 39 -34.312 -1.305 -2.319 286 HD12 ILE 39 HD12 ILE 39 -35.349 -1.120 -0.904 287 HD13 ILE 39 HD13 ILE 39 -34.733 -2.713 -1.343 288 H ILE 40 HN ILE 40 -32.229 -4.129 2.857 289 HA ILE 40 HA ILE 40 -30.058 -4.837 1.162 290 HB ILE 40 HB ILE 40 -28.943 -5.674 3.139 291 HG12 ILE 40 HG12 ILE 40 -30.299 -5.178 5.368 292 HG13 ILE 40 HG11 ILE 40 -31.669 -5.554 4.329 293 HG21 ILE 40 HG21 ILE 40 -29.408 -3.486 4.573 294 HG22 ILE 40 HG22 ILE 40 -30.270 -3.030 3.107 295 HG23 ILE 40 HG23 ILE 40 -28.556 -3.442 3.032 296 HD11 ILE 40 HD11 ILE 40 -29.346 -7.332 5.009 297 HD12 ILE 40 HD12 ILE 40 -30.532 -7.704 3.759 298 HD13 ILE 40 HD13 ILE 40 -31.043 -7.550 5.445 299 H VAL 41 HN VAL 41 -32.785 -6.549 2.386 300 HA VAL 41 HA VAL 41 -31.888 -9.139 1.551 301 HB VAL 41 HB VAL 41 -34.701 -8.110 2.008 302 HG11 VAL 41 HG11 VAL 41 -35.351 -10.465 2.119 303 HG12 VAL 41 HG12 VAL 41 -33.708 -10.940 1.691 304 HG13 VAL 41 HG13 VAL 41 -34.700 -10.050 0.534 305 HG21 VAL 41 HG21 VAL 41 -33.319 -8.050 4.016 306 HG22 VAL 41 HG22 VAL 41 -32.877 -9.739 3.776 307 HG23 VAL 41 HG23 VAL 41 -34.548 -9.309 4.142 308 H HIS 42 HN HIS 42 -33.949 -6.621 0.122 309 HA HIS 42 HA HIS 42 -34.438 -8.198 -2.255 310 HB2 HIS 42 HB2 HIS 42 -36.088 -6.630 -1.073 311 HB3 HIS 42 HB1 HIS 42 -35.194 -5.312 -1.815 312 HD1 HIS 42 HD1 HIS 42 -37.546 -8.117 -2.614 313 HD2 HIS 42 HD2 HIS 42 -35.688 -4.929 -4.548 314 HE1 HIS 42 HE1 HIS 42 -38.709 -7.894 -4.832 315 HE2 HIS 42 HE2 HIS 42 -37.582 -5.966 -5.990 316 H MET 43 HN MET 43 -31.824 -6.532 -1.323 317 HA MET 43 HA MET 43 -31.306 -4.811 -3.504 318 HB2 MET 43 HB2 MET 43 -29.081 -4.580 -2.632 319 HB3 MET 43 HB1 MET 43 -30.212 -4.601 -1.289 320 HG2 MET 43 HG2 MET 43 -28.525 -5.934 -0.501 321 HG3 MET 43 HG1 MET 43 -29.636 -7.121 -1.176 322 HE1 MET 43 HE1 MET 43 -27.316 -4.723 -3.231 323 HE2 MET 43 HE2 MET 43 -25.858 -5.697 -3.422 324 HE3 MET 43 HE3 MET 43 -26.310 -5.089 -1.830 325 H GLU 44 HN GLU 44 -31.042 -8.218 -3.189 326 HA GLU 44 HA GLU 44 -28.858 -8.640 -4.945 327 HB2 GLU 44 HB2 GLU 44 -29.600 -10.980 -5.017 328 HB3 GLU 44 HB1 GLU 44 -29.527 -10.361 -3.373 329 HG2 GLU 44 HG2 GLU 44 -31.870 -10.227 -3.215 330 HG3 GLU 44 HG1 GLU 44 -32.073 -10.449 -4.954 331 H GLU 45 HN GLU 45 -32.003 -7.614 -5.584 332 HA GLU 45 HA GLU 45 -32.444 -8.826 -8.111 333 HB2 GLU 45 HB2 GLU 45 -33.456 -6.176 -7.067 334 HB3 GLU 45 HB1 GLU 45 -34.109 -7.057 -8.440 335 HG2 GLU 45 HG2 GLU 45 -34.150 -7.918 -5.561 336 HG3 GLU 45 HG1 GLU 45 -35.519 -7.368 -6.525 337 HA PRO 46 HA PRO 46 -29.548 -6.710 -10.703 338 HB2 PRO 46 HB2 PRO 46 -31.053 -6.703 -13.008 339 HB3 PRO 46 HB1 PRO 46 -30.115 -8.091 -12.439 340 HG2 PRO 46 HG2 PRO 46 -33.036 -7.511 -12.143 341 HG3 PRO 46 HG1 PRO 46 -32.232 -9.050 -12.524 342 HD2 PRO 46 HD2 PRO 46 -33.151 -8.533 -10.068 343 HD3 PRO 46 HD1 PRO 46 -31.633 -9.422 -10.312 344 H ASP 47 HN ASP 47 -32.932 -5.722 -10.836 345 HA ASP 47 HA ASP 47 -32.082 -3.028 -11.661 346 HB2 ASP 47 HB2 ASP 47 -33.236 -4.262 -13.425 347 HB3 ASP 47 HB1 ASP 47 -34.597 -4.565 -12.361 348 H PHE 48 HN PHE 48 -32.397 -4.083 -8.952 349 HA PHE 48 HA PHE 48 -34.826 -3.427 -7.753 350 HB2 PHE 48 HB2 PHE 48 -33.673 -3.491 -5.644 351 HB3 PHE 48 HB1 PHE 48 -32.990 -4.735 -6.679 352 HD1 PHE 48 HD2 PHE 48 -30.914 -3.799 -8.141 353 HD2 PHE 48 HD1 PHE 48 -32.177 -2.307 -4.362 354 HE1 PHE 48 HE2 PHE 48 -28.663 -2.887 -7.750 355 HE2 PHE 48 HE1 PHE 48 -29.930 -1.393 -3.966 356 HZ PHE 48 HZ PHE 48 -28.162 -1.720 -5.615 357 H ALA 49 HN ALA 49 -32.215 -1.348 -8.740 358 HA ALA 49 HA ALA 49 -33.838 0.964 -8.188 359 HB1 ALA 49 HB1 ALA 49 -32.642 0.771 -6.091 360 HB2 ALA 49 HB2 ALA 49 -32.035 2.153 -7.001 361 HB3 ALA 49 HB3 ALA 49 -31.103 0.657 -6.948 362 H GLU 50 HN GLU 50 -33.843 1.849 -10.139 363 HA GLU 50 HA GLU 50 -31.918 1.630 -12.129 364 HB2 GLU 50 HB2 GLU 50 -33.827 3.923 -11.624 365 HB3 GLU 50 HB1 GLU 50 -32.982 3.616 -13.136 366 HG2 GLU 50 HG2 GLU 50 -34.161 1.482 -13.358 367 HG3 GLU 50 HG1 GLU 50 -35.013 1.800 -11.850 368 HA PRO 51 HA PRO 51 -28.696 3.972 -10.142 369 HB2 PRO 51 HB2 PRO 51 -27.154 3.553 -12.570 370 HB3 PRO 51 HB1 PRO 51 -26.890 2.893 -10.955 371 HG2 PRO 51 HG2 PRO 51 -27.687 1.366 -13.051 372 HG3 PRO 51 HG1 PRO 51 -28.146 1.015 -11.375 373 HD2 PRO 51 HD2 PRO 51 -29.735 2.343 -13.539 374 HD3 PRO 51 HD1 PRO 51 -30.254 1.149 -12.329 375 H LEU 52 HN LEU 52 -30.240 5.853 -10.658 376 HA LEU 52 HA LEU 52 -29.404 7.555 -12.831 377 HB2 LEU 52 HB2 LEU 52 -31.733 7.504 -11.834 378 HB3 LEU 52 HB1 LEU 52 -31.069 8.300 -10.421 379 HG LEU 52 HG LEU 52 -30.367 10.192 -11.906 380 HD11 LEU 52 HD11 LEU 52 -30.295 9.016 -14.016 381 HD12 LEU 52 HD12 LEU 52 -31.442 10.352 -14.111 382 HD13 LEU 52 HD13 LEU 52 -32.025 8.698 -13.927 383 HD21 LEU 52 HD21 LEU 52 -32.599 11.145 -12.090 384 HD22 LEU 52 HD22 LEU 52 -32.400 10.297 -10.557 385 HD23 LEU 52 HD23 LEU 52 -33.310 9.547 -11.869 386 H THR 53 HN THR 53 -27.173 7.687 -12.423 387 HA THR 53 HA THR 53 -25.258 8.587 -11.618 388 HB THR 53 HB THR 53 -27.048 10.301 -9.877 389 HG1 THR 53 HG1 THR 53 -27.091 10.476 -12.313 390 HG21 THR 53 HG21 THR 53 -24.778 10.133 -8.976 391 HG22 THR 53 HG22 THR 53 -25.072 11.741 -9.638 392 HG23 THR 53 HG23 THR 53 -24.113 10.575 -10.549 393 H MET 54 HN MET 54 -24.367 6.850 -10.674 394 HA MET 54 HA MET 54 -25.248 5.963 -8.063 395 HB2 MET 54 HB2 MET 54 -23.532 4.180 -8.352 396 HB3 MET 54 HB1 MET 54 -24.728 4.223 -9.637 397 HG2 MET 54 HG2 MET 54 -22.000 5.468 -9.858 398 HG3 MET 54 HG1 MET 54 -22.366 3.819 -10.359 399 HE1 MET 54 HE1 MET 54 -21.050 6.017 -12.235 400 HE2 MET 54 HE2 MET 54 -21.938 5.785 -13.740 401 HE3 MET 54 HE3 MET 54 -21.411 4.387 -12.803 402 HA PRO 55 HA PRO 55 -22.083 8.587 -6.241 403 HB2 PRO 55 HB2 PRO 55 -23.469 8.281 -3.744 404 HB3 PRO 55 HB1 PRO 55 -23.408 9.702 -4.791 405 HG2 PRO 55 HG2 PRO 55 -25.673 8.213 -4.335 406 HG3 PRO 55 HG1 PRO 55 -25.405 9.206 -5.779 407 HD2 PRO 55 HD2 PRO 55 -25.067 6.250 -5.421 408 HD3 PRO 55 HD1 PRO 55 -25.751 7.150 -6.795 409 H GLY 56 HN GLY 56 -20.250 8.044 -5.211 410 HA2 GLY 56 HA2 GLY 56 -19.998 5.318 -4.203 411 HA3 GLY 56 HA1 GLY 56 -18.683 6.446 -4.501 412 H TYR 57 HN TYR 57 -21.122 5.406 -2.254 413 HA TYR 57 HA TYR 57 -20.431 7.341 -0.240 414 HB2 TYR 57 HB2 TYR 57 -22.716 6.277 -0.523 415 HB3 TYR 57 HB1 TYR 57 -22.023 4.797 0.127 416 HD1 TYR 57 HD1 TYR 57 -22.620 8.376 0.952 417 HD2 TYR 57 HD2 TYR 57 -21.939 4.451 2.443 418 HE1 TYR 57 HE1 TYR 57 -23.111 9.163 3.228 419 HE2 TYR 57 HE2 TYR 57 -22.431 5.225 4.723 420 HH TYR 57 HH TYR 57 -22.352 7.402 5.979 421 H GLY 58 HN GLY 58 -18.103 6.688 -0.565 422 HA2 GLY 58 HA2 GLY 58 -17.157 5.362 1.721 423 HA3 GLY 58 HA1 GLY 58 -17.076 4.246 0.363 424 H GLY 59 HN GLY 59 -16.161 5.404 -1.706 425 HA2 GLY 59 HA2 GLY 59 -14.610 7.575 -1.867 426 HA3 GLY 59 HA1 GLY 59 -13.577 6.504 -0.934 427 H ALA 60 HN ALA 60 -12.266 7.044 -2.943 428 HA ALA 60 HA ALA 60 -12.926 5.647 -5.360 429 HB1 ALA 60 HB1 ALA 60 -11.577 7.618 -5.518 430 HB2 ALA 60 HB2 ALA 60 -10.590 6.240 -6.008 431 HB3 ALA 60 HB3 ALA 60 -10.382 6.950 -4.407 432 H ALA 61 HN ALA 61 -10.169 5.269 -3.140 433 HA ALA 61 HA ALA 61 -8.897 3.495 -2.551 434 HB1 ALA 61 HB1 ALA 61 -11.025 2.913 -1.423 435 HB2 ALA 61 HB2 ALA 61 -10.049 1.512 -1.848 436 HB3 ALA 61 HB3 ALA 61 -11.458 1.925 -2.820 437 H SER 62 HN SER 62 -8.345 4.047 -5.044 438 HA SER 62 HA SER 62 -8.663 1.653 -6.676 439 HB2 SER 62 HB2 SER 62 -7.421 3.100 -8.380 440 HB3 SER 62 HB1 SER 62 -9.028 3.647 -7.903 441 HG SER 62 HG SER 62 -6.495 4.668 -7.131 442 H ALA 63 HN ALA 63 -6.921 0.435 -7.452 443 HA ALA 63 HA ALA 63 -4.247 0.985 -6.482 444 HB1 ALA 63 HB1 ALA 63 -3.991 -1.140 -5.314 445 HB2 ALA 63 HB2 ALA 63 -5.690 -1.516 -5.605 446 HB3 ALA 63 HB3 ALA 63 -5.253 -0.160 -4.566 447 H GLY 64 HN GLY 64 -2.688 0.020 -7.704 448 HA2 GLY 64 HA2 GLY 64 -3.396 -2.106 -9.564 449 HA3 GLY 64 HA1 GLY 64 -2.949 -0.567 -10.291 450 H ALA 65 HN ALA 65 -1.768 -3.478 -9.660 451 HA ALA 65 HA ALA 65 0.288 -4.415 -9.498 452 HB1 ALA 65 HB1 ALA 65 0.867 -2.847 -11.302 453 HB2 ALA 65 HB2 ALA 65 2.229 -3.156 -10.226 454 HB3 ALA 65 HB3 ALA 65 1.330 -1.646 -10.095 455 H SER 66 HN SER 66 -0.960 -3.763 -7.173 456 HA SER 66 HA SER 66 0.983 -2.486 -5.423 457 HB2 SER 66 HB2 SER 66 -1.477 -2.065 -5.190 458 HB3 SER 66 HB1 SER 66 -1.680 -3.751 -4.725 459 HG SER 66 HG SER 66 0.113 -2.037 -3.355 460 H VAL 67 HN VAL 67 1.686 -3.575 -3.445 461 HA VAL 67 HA VAL 67 2.795 -5.233 -2.370 462 HB VAL 67 HB VAL 67 0.808 -7.133 -3.632 463 HG11 VAL 67 HG11 VAL 67 2.389 -7.329 -1.070 464 HG12 VAL 67 HG12 VAL 67 2.728 -8.213 -2.557 465 HG13 VAL 67 HG13 VAL 67 1.233 -8.520 -1.671 466 HG21 VAL 67 HG21 VAL 67 -0.397 -5.330 -2.540 467 HG22 VAL 67 HG22 VAL 67 0.568 -5.546 -1.079 468 HG23 VAL 67 HG23 VAL 67 -0.540 -6.815 -1.600 469 H PHE 68 HN PHE 68 4.411 -4.591 -4.062 470 HA PHE 68 HA PHE 68 4.921 -6.383 -6.222 471 HB2 PHE 68 HB2 PHE 68 7.088 -5.158 -6.399 472 HB3 PHE 68 HB1 PHE 68 5.683 -4.102 -6.414 473 HD1 PHE 68 HD1 PHE 68 5.173 -2.693 -4.463 474 HD2 PHE 68 HD2 PHE 68 8.698 -5.074 -4.635 475 HE1 PHE 68 HE1 PHE 68 6.141 -1.388 -2.617 476 HE2 PHE 68 HE2 PHE 68 9.674 -3.770 -2.793 477 HZ PHE 68 HZ PHE 68 8.389 -1.918 -1.783 478 H GLY 69 HN GLY 69 6.379 -8.029 -6.384 479 HA2 GLY 69 HA2 GLY 69 6.942 -9.420 -3.942 480 HA3 GLY 69 HA1 GLY 69 7.367 -9.945 -5.563 481 H ALA 70 HN ALA 70 8.377 -8.130 -2.775 482 HA ALA 70 HA ALA 70 10.986 -7.566 -3.891 483 HB1 ALA 70 HB1 ALA 70 11.481 -6.488 -1.826 484 HB2 ALA 70 HB2 ALA 70 10.126 -7.268 -1.017 485 HB3 ALA 70 HB3 ALA 70 9.827 -6.048 -2.256 486 H SER 71 HN SER 71 11.754 -9.622 -4.386 487 HA SER 71 HA SER 71 11.914 -11.662 -2.346 488 HB2 SER 71 HB2 SER 71 13.205 -11.681 -5.077 489 HB3 SER 71 HB1 SER 71 12.753 -13.066 -4.082 490 HG SER 71 HG SER 71 10.548 -12.398 -4.345 491 H GLY 72 HN GLY 72 14.071 -9.436 -4.024 492 HA2 GLY 72 HA2 GLY 72 16.200 -10.242 -2.140 493 HA3 GLY 72 HA1 GLY 72 16.521 -9.789 -3.807 494 H LEU 73 HN LEU 73 15.467 -8.605 -0.667 495 HA LEU 73 HA LEU 73 15.441 -5.864 -1.319 496 HB2 LEU 73 HB2 LEU 73 15.712 -7.404 1.226 497 HB3 LEU 73 HB1 LEU 73 16.060 -5.687 1.238 498 HG LEU 73 HG LEU 73 13.768 -6.107 1.943 499 HD11 LEU 73 HD11 LEU 73 13.903 -4.838 -0.786 500 HD12 LEU 73 HD12 LEU 73 14.247 -4.040 0.748 501 HD13 LEU 73 HD13 LEU 73 12.617 -4.615 0.399 502 HD21 LEU 73 HD21 LEU 73 13.665 -7.631 -0.617 503 HD22 LEU 73 HD22 LEU 73 12.205 -6.861 -0.006 504 HD23 LEU 73 HD23 LEU 73 13.043 -8.064 0.977 505 H ASP 74 HN ASP 74 17.908 -7.711 0.456 506 HA ASP 74 HA ASP 74 20.096 -7.040 -1.109 507 HB2 ASP 74 HB2 ASP 74 19.622 -4.703 -0.332 508 HB3 ASP 74 HB1 ASP 74 19.905 -5.242 1.322 509 H ASN 75 HN ASN 75 21.999 -7.982 -0.302 510 HA ASN 75 HA ASN 75 21.609 -9.691 2.033 511 HB2 ASN 75 HB2 ASN 75 22.549 -10.742 -0.017 512 HB3 ASN 75 HB1 ASN 75 23.907 -9.621 0.046 513 HD21 ASN 75 HD21 ASN 75 25.402 -11.287 0.242 514 HD22 ASN 75 HD22 ASN 75 25.592 -12.188 1.705 515 H GLN 76 HN GLN 76 21.601 -7.867 3.444 516 HA GLN 76 HA GLN 76 23.551 -5.864 3.281 517 HB2 GLN 76 HB2 GLN 76 21.267 -5.646 4.337 518 HB3 GLN 76 HB1 GLN 76 21.915 -6.498 5.734 519 HG2 GLN 76 HG2 GLN 76 23.725 -4.701 5.774 520 HG3 GLN 76 HG1 GLN 76 22.684 -3.809 4.665 521 HE21 GLN 76 HE21 GLN 76 20.714 -3.020 5.386 522 HE22 GLN 76 HE22 GLN 76 20.335 -2.864 7.068 523 HA PRO 77 HA PRO 77 27.077 -7.679 5.315 524 HB2 PRO 77 HB2 PRO 77 27.539 -4.761 5.707 525 HB3 PRO 77 HB1 PRO 77 28.642 -5.998 5.083 526 HG2 PRO 77 HG2 PRO 77 27.527 -4.321 3.410 527 HG3 PRO 77 HG1 PRO 77 27.573 -6.046 2.999 528 HD2 PRO 77 HD2 PRO 77 25.309 -4.422 4.091 529 HD3 PRO 77 HD1 PRO 77 25.301 -5.617 2.777 530 HA PRO 78 HA PRO 78 26.324 -7.383 9.663 531 HB2 PRO 78 HB2 PRO 78 28.850 -7.327 10.688 532 HB3 PRO 78 HB1 PRO 78 28.112 -8.787 10.015 533 HG2 PRO 78 HG2 PRO 78 29.999 -6.862 8.742 534 HG3 PRO 78 HG1 PRO 78 30.029 -8.631 8.702 535 HD2 PRO 78 HD2 PRO 78 29.088 -7.173 6.662 536 HD3 PRO 78 HD1 PRO 78 28.376 -8.736 7.102 537 H GLU 79 HN GLU 79 25.428 -5.533 10.298 538 HA GLU 79 HA GLU 79 26.289 -2.944 9.940 539 HB2 GLU 79 HB2 GLU 79 24.769 -2.354 11.744 540 HB3 GLU 79 HB1 GLU 79 24.042 -3.568 10.706 541 HG2 GLU 79 HG2 GLU 79 24.880 -5.267 12.397 542 HG3 GLU 79 HG1 GLU 79 25.179 -3.901 13.458 543 H GLU 80 HN GLU 80 27.230 -5.239 12.383 544 HA GLU 80 HA GLU 80 28.563 -3.577 14.160 545 HB2 GLU 80 HB2 GLU 80 28.355 -5.738 14.909 546 HB3 GLU 80 HB1 GLU 80 28.716 -6.425 13.338 547 HG2 GLU 80 HG2 GLU 80 31.075 -5.950 13.635 548 HG3 GLU 80 HG1 GLU 80 30.732 -5.206 15.209 549 H ILE 81 HN ILE 81 29.751 -5.250 11.278 550 HA ILE 81 HA ILE 81 32.371 -4.159 11.546 551 HB ILE 81 HB ILE 81 31.076 -5.730 9.330 552 HG12 ILE 81 HG12 ILE 81 33.217 -6.422 11.351 553 HG13 ILE 81 HG11 ILE 81 31.534 -6.931 11.441 554 HG21 ILE 81 HG21 ILE 81 33.606 -5.942 8.669 555 HG22 ILE 81 HG22 ILE 81 33.719 -4.381 9.497 556 HG23 ILE 81 HG23 ILE 81 32.636 -4.574 8.119 557 HD11 ILE 81 HD11 ILE 81 33.687 -7.816 9.572 558 HD12 ILE 81 HD12 ILE 81 31.994 -7.977 9.124 559 HD13 ILE 81 HD13 ILE 81 32.602 -8.788 10.571 560 H VAL 82 HN VAL 82 29.562 -3.448 9.467 561 HA VAL 82 HA VAL 82 30.820 -1.563 7.832 562 HB VAL 82 HB VAL 82 28.699 -0.668 7.290 563 HG11 VAL 82 HG11 VAL 82 27.312 -2.646 6.871 564 HG12 VAL 82 HG12 VAL 82 28.338 -3.569 7.969 565 HG13 VAL 82 HG13 VAL 82 29.012 -2.911 6.478 566 HG21 VAL 82 HG21 VAL 82 27.344 -0.078 8.953 567 HG22 VAL 82 HG22 VAL 82 28.043 -1.278 10.040 568 HG23 VAL 82 HG23 VAL 82 26.759 -1.745 8.919 569 H ALA 83 HN ALA 83 29.413 -1.335 11.024 570 HA ALA 83 HA ALA 83 29.735 1.388 11.552 571 HB1 ALA 83 HB1 ALA 83 29.961 0.411 13.975 572 HB2 ALA 83 HB2 ALA 83 29.531 -1.107 13.162 573 HB3 ALA 83 HB3 ALA 83 28.440 0.283 13.090 574 H ILE 84 HN ILE 84 31.893 -1.368 12.203 575 HA ILE 84 HA ILE 84 33.989 0.062 13.392 576 HB ILE 84 HB ILE 84 34.015 -2.508 11.798 577 HG12 ILE 84 HG12 ILE 84 34.425 -2.344 14.746 578 HG13 ILE 84 HG11 ILE 84 32.799 -2.114 14.123 579 HG21 ILE 84 HG21 ILE 84 36.198 -1.369 13.542 580 HG22 ILE 84 HG22 ILE 84 36.240 -1.487 11.782 581 HG23 ILE 84 HG23 ILE 84 36.208 -2.953 12.764 582 HD11 ILE 84 HD11 ILE 84 34.488 -4.492 13.444 583 HD12 ILE 84 HD12 ILE 84 32.752 -4.264 13.183 584 HD13 ILE 84 HD13 ILE 84 33.385 -4.438 14.820 585 H ILE 85 HN ILE 85 33.297 -0.684 10.023 586 HA ILE 85 HA ILE 85 35.740 0.251 8.967 587 HB ILE 85 HB ILE 85 33.050 -0.033 7.641 588 HG12 ILE 85 HG12 ILE 85 35.445 -1.875 7.659 589 HG13 ILE 85 HG11 ILE 85 34.027 -2.075 8.678 590 HG21 ILE 85 HG21 ILE 85 35.646 0.911 6.669 591 HG22 ILE 85 HG22 ILE 85 34.035 1.100 5.978 592 HG23 ILE 85 HG23 ILE 85 34.941 -0.387 5.705 593 HD11 ILE 85 HD11 ILE 85 34.070 -3.510 6.652 594 HD12 ILE 85 HD12 ILE 85 33.921 -2.044 5.683 595 HD13 ILE 85 HD13 ILE 85 32.639 -2.493 6.805 596 H THR 86 HN THR 86 32.533 1.814 9.233 597 HA THR 86 HA THR 86 33.520 4.273 8.185 598 HB THR 86 HB THR 86 31.222 4.087 7.915 599 HG1 THR 86 HG1 THR 86 32.032 6.153 8.936 600 HG21 THR 86 HG21 THR 86 30.309 2.509 9.233 601 HG22 THR 86 HG22 THR 86 29.773 3.932 10.142 602 HG23 THR 86 HG23 THR 86 31.195 3.027 10.673 603 H SER 87 HN SER 87 33.620 2.825 11.317 604 HA SER 87 HA SER 87 34.349 5.218 12.700 605 HB2 SER 87 HB2 SER 87 34.887 2.331 13.424 606 HB3 SER 87 HB1 SER 87 35.079 3.714 14.504 607 HG SER 87 HG SER 87 32.650 2.905 13.261 608 H MET 88 HN MET 88 36.007 2.899 10.727 609 HA MET 88 HA MET 88 38.671 3.521 11.488 610 HB2 MET 88 HB2 MET 88 37.531 2.360 8.949 611 HB3 MET 88 HB1 MET 88 39.254 2.571 9.213 612 HG2 MET 88 HG2 MET 88 37.407 0.828 10.828 613 HG3 MET 88 HG1 MET 88 38.593 0.289 9.636 614 HE1 MET 88 HE1 MET 88 38.553 -0.981 12.490 615 HE2 MET 88 HE2 MET 88 40.261 -0.941 12.928 616 HE3 MET 88 HE3 MET 88 39.783 -1.369 11.287 617 H GLY 89 HN GLY 89 36.334 5.018 9.459 618 HA2 GLY 89 HA2 GLY 89 36.925 7.476 9.149 619 HA3 GLY 89 HA1 GLY 89 38.363 6.838 8.368 620 H PHE 90 HN PHE 90 36.077 4.671 7.647 621 HA PHE 90 HA PHE 90 35.623 5.857 5.031 622 HB2 PHE 90 HB2 PHE 90 35.107 3.056 6.050 623 HB3 PHE 90 HB1 PHE 90 34.871 3.583 4.385 624 HD1 PHE 90 HD2 PHE 90 37.147 5.073 3.659 625 HD2 PHE 90 HD1 PHE 90 36.949 1.713 6.259 626 HE1 PHE 90 HE2 PHE 90 39.501 4.556 3.163 627 HE2 PHE 90 HE1 PHE 90 39.299 1.187 5.767 628 HZ PHE 90 HZ PHE 90 40.598 2.649 4.248 629 H GLN 91 HN GLN 91 33.336 4.831 4.169 630 HA GLN 91 HA GLN 91 31.344 6.108 5.873 631 HB2 GLN 91 HB2 GLN 91 31.829 6.517 3.306 632 HB3 GLN 91 HB1 GLN 91 30.764 5.134 3.129 633 HG2 GLN 91 HG2 GLN 91 29.021 6.291 4.364 634 HG3 GLN 91 HG1 GLN 91 30.092 7.673 4.566 635 HE21 GLN 91 HE21 GLN 91 31.198 7.449 1.885 636 HE22 GLN 91 HE22 GLN 91 29.969 8.015 0.801 637 H ARG 92 HN ARG 92 29.403 5.035 6.466 638 HA ARG 92 HA ARG 92 29.564 2.308 7.083 639 HB2 ARG 92 HB2 ARG 92 27.990 3.851 8.167 640 HB3 ARG 92 HB1 ARG 92 27.084 3.975 6.675 641 HG2 ARG 92 HG2 ARG 92 27.077 1.317 6.974 642 HG3 ARG 92 HG1 ARG 92 27.150 1.813 8.666 643 HD2 ARG 92 HD2 ARG 92 25.134 2.797 6.663 644 HD3 ARG 92 HD1 ARG 92 24.848 1.496 7.815 645 HE ARG 92 HE ARG 92 25.593 3.540 9.413 646 HH11 ARG 92 HH11 ARG 92 23.287 3.335 6.796 647 HH12 ARG 92 HH12 ARG 92 22.197 4.498 7.483 648 HH21 ARG 92 HH21 ARG 92 24.127 5.022 10.365 649 HH22 ARG 92 HH22 ARG 92 22.649 5.421 9.538 650 H ASN 93 HN ASN 93 27.647 3.867 4.509 651 HA ASN 93 HA ASN 93 26.746 1.497 3.303 652 HB2 ASN 93 HB2 ASN 93 25.748 3.679 2.849 653 HB3 ASN 93 HB1 ASN 93 27.220 4.198 2.039 654 HD21 ASN 93 HD21 ASN 93 24.428 2.136 1.872 655 HD22 ASN 93 HD22 ASN 93 24.536 1.794 0.172 656 H GLN 94 HN GLN 94 29.652 3.370 2.827 657 HA GLN 94 HA GLN 94 30.652 1.991 0.579 658 HB2 GLN 94 HB2 GLN 94 31.688 4.024 0.969 659 HB3 GLN 94 HB1 GLN 94 31.792 3.749 2.695 660 HG2 GLN 94 HG2 GLN 94 33.675 2.374 2.477 661 HG3 GLN 94 HG1 GLN 94 33.455 2.201 0.737 662 HE21 GLN 94 HE21 GLN 94 34.097 3.890 -0.623 663 HE22 GLN 94 HE22 GLN 94 35.085 5.196 -0.071 664 H ALA 95 HN ALA 95 30.963 1.543 4.045 665 HA ALA 95 HA ALA 95 32.627 -0.726 4.024 666 HB1 ALA 95 HB1 ALA 95 30.494 0.091 6.000 667 HB2 ALA 95 HB2 ALA 95 32.181 0.619 6.010 668 HB3 ALA 95 HB3 ALA 95 31.785 -1.082 6.288 669 H ILE 96 HN ILE 96 29.108 -0.348 3.871 670 HA ILE 96 HA ILE 96 28.407 -3.043 3.911 671 HB ILE 96 HB ILE 96 27.075 -0.604 2.823 672 HG12 ILE 96 HG12 ILE 96 25.452 -2.294 4.456 673 HG13 ILE 96 HG11 ILE 96 27.032 -2.126 5.211 674 HG21 ILE 96 HG21 ILE 96 25.098 -2.129 2.290 675 HG22 ILE 96 HG22 ILE 96 26.291 -3.435 2.243 676 HG23 ILE 96 HG23 ILE 96 26.426 -2.072 1.129 677 HD11 ILE 96 HD11 ILE 96 25.151 0.072 4.416 678 HD12 ILE 96 HD12 ILE 96 26.802 0.320 4.985 679 HD13 ILE 96 HD13 ILE 96 25.605 -0.418 6.050 680 H GLN 97 HN GLN 97 28.948 -0.927 1.101 681 HA GLN 97 HA GLN 97 28.679 -2.783 -0.925 682 HB2 GLN 97 HB2 GLN 97 28.984 -0.425 -1.384 683 HB3 GLN 97 HB1 GLN 97 30.614 -0.488 -0.735 684 HG2 GLN 97 HG2 GLN 97 31.326 -1.929 -2.520 685 HG3 GLN 97 HG1 GLN 97 29.682 -2.016 -3.139 686 HE21 GLN 97 HE21 GLN 97 29.156 0.816 -2.663 687 HE22 GLN 97 HE22 GLN 97 30.037 1.669 -3.885 688 H ALA 98 HN ALA 98 31.554 -1.945 0.920 689 HA ALA 98 HA ALA 98 33.353 -3.621 -0.384 690 HB1 ALA 98 HB1 ALA 98 33.706 -1.752 1.382 691 HB2 ALA 98 HB2 ALA 98 34.850 -3.091 1.295 692 HB3 ALA 98 HB3 ALA 98 33.594 -3.078 2.540 693 H LEU 99 HN LEU 99 31.554 -4.204 2.656 694 HA LEU 99 HA LEU 99 32.461 -6.826 3.006 695 HB2 LEU 99 HB2 LEU 99 29.901 -5.578 3.930 696 HB3 LEU 99 HB1 LEU 99 30.522 -7.105 4.502 697 HG LEU 99 HG LEU 99 31.999 -4.508 4.806 698 HD11 LEU 99 HD11 LEU 99 30.362 -5.912 6.890 699 HD12 LEU 99 HD12 LEU 99 29.775 -4.550 5.939 700 HD13 LEU 99 HD13 LEU 99 31.159 -4.342 7.014 701 HD21 LEU 99 HD21 LEU 99 33.637 -5.895 5.365 702 HD22 LEU 99 HD22 LEU 99 32.552 -7.276 5.363 703 HD23 LEU 99 HD23 LEU 99 32.693 -6.276 6.807 704 H ARG 100 HN ARG 100 29.784 -5.545 1.121 705 HA ARG 100 HA ARG 100 28.408 -7.907 0.557 706 HB2 ARG 100 HB2 ARG 100 28.938 -5.437 -1.078 707 HB3 ARG 100 HB1 ARG 100 28.019 -6.781 -1.738 708 HG2 ARG 100 HG2 ARG 100 26.295 -6.512 -0.146 709 HG3 ARG 100 HG1 ARG 100 27.273 -5.412 0.830 710 HD2 ARG 100 HD2 ARG 100 27.154 -3.706 -0.823 711 HD3 ARG 100 HD1 ARG 100 26.432 -4.807 -2.001 712 HE ARG 100 HE ARG 100 24.631 -4.828 0.005 713 HH11 ARG 100 HH11 ARG 100 26.161 -2.212 -1.766 714 HH12 ARG 100 HH12 ARG 100 24.844 -1.110 -1.511 715 HH21 ARG 100 HH21 ARG 100 22.922 -3.386 0.347 716 HH22 ARG 100 HH22 ARG 100 22.991 -1.782 -0.344 717 H ALA 101 HN ALA 101 31.211 -6.471 -1.005 718 HA ALA 101 HA ALA 101 31.582 -8.618 -2.859 719 HB1 ALA 101 HB1 ALA 101 33.812 -7.378 -3.183 720 HB2 ALA 101 HB2 ALA 101 33.111 -6.178 -2.084 721 HB3 ALA 101 HB3 ALA 101 32.311 -6.555 -3.611 722 H THR 102 HN THR 102 32.965 -7.775 0.286 723 HA THR 102 HA THR 102 35.062 -9.745 0.090 724 HB THR 102 HB THR 102 35.766 -9.004 2.260 725 HG1 THR 102 HG1 THR 102 34.437 -7.744 3.568 726 HG21 THR 102 HG21 THR 102 36.506 -7.321 0.939 727 HG22 THR 102 HG22 THR 102 35.311 -6.375 1.816 728 HG23 THR 102 HG23 THR 102 34.923 -7.029 0.226 729 H ASN 103 HN ASN 103 31.858 -9.997 0.653 730 HA ASN 103 HA ASN 103 30.474 -11.585 1.480 731 HB2 ASN 103 HB2 ASN 103 32.319 -13.126 0.576 732 HB3 ASN 103 HB1 ASN 103 32.852 -13.258 2.246 733 HD21 ASN 103 HD21 ASN 103 29.535 -13.014 1.054 734 HD22 ASN 103 HD22 ASN 103 29.038 -14.578 1.610 735 H ASN 104 HN ASN 104 31.227 -9.449 3.058 736 HA ASN 104 HA ASN 104 30.825 -8.665 5.154 737 HB2 ASN 104 HB2 ASN 104 30.271 -11.568 5.829 738 HB3 ASN 104 HB1 ASN 104 30.085 -10.240 6.969 739 HD21 ASN 104 HD21 ASN 104 29.261 -9.877 3.591 740 HD22 ASN 104 HD22 ASN 104 27.548 -9.826 3.814 741 H ASN 105 HN ASN 105 33.438 -9.966 4.155 742 HA ASN 105 HA ASN 105 34.826 -10.472 6.645 743 HB2 ASN 105 HB2 ASN 105 35.492 -11.504 4.419 744 HB3 ASN 105 HB1 ASN 105 36.062 -9.908 3.944 745 HD21 ASN 105 HD21 ASN 105 36.578 -12.611 6.094 746 HD22 ASN 105 HD22 ASN 105 38.185 -12.159 6.578 747 H LEU 106 HN LEU 106 35.380 -8.937 7.953 748 HA LEU 106 HA LEU 106 34.995 -6.208 7.521 749 HB2 LEU 106 HB2 LEU 106 34.991 -7.225 9.709 750 HB3 LEU 106 HB1 LEU 106 36.662 -7.697 9.552 751 HG LEU 106 HG LEU 106 36.034 -4.786 9.434 752 HD11 LEU 106 HD11 LEU 106 36.330 -6.160 12.081 753 HD12 LEU 106 HD12 LEU 106 34.743 -5.964 11.343 754 HD13 LEU 106 HD13 LEU 106 35.713 -4.539 11.733 755 HD21 LEU 106 HD21 LEU 106 38.160 -4.616 10.611 756 HD22 LEU 106 HD22 LEU 106 38.326 -5.575 9.136 757 HD23 LEU 106 HD23 LEU 106 38.256 -6.376 10.710 758 H GLU 107 HN GLU 107 38.085 -7.882 7.989 759 HA GLU 107 HA GLU 107 39.805 -5.806 7.361 760 HB2 GLU 107 HB2 GLU 107 40.139 -8.768 6.934 761 HB3 GLU 107 HB1 GLU 107 41.435 -7.603 6.729 762 HG2 GLU 107 HG2 GLU 107 39.899 -7.810 9.270 763 HG3 GLU 107 HG1 GLU 107 41.294 -8.840 8.945 764 H ARG 108 HN ARG 108 38.618 -8.319 5.137 765 HA ARG 108 HA ARG 108 39.903 -7.295 2.857 766 HB2 ARG 108 HB2 ARG 108 38.843 -9.567 3.092 767 HB3 ARG 108 HB1 ARG 108 37.296 -8.794 2.867 768 HG2 ARG 108 HG2 ARG 108 38.017 -8.000 0.666 769 HG3 ARG 108 HG1 ARG 108 39.552 -8.847 0.887 770 HD2 ARG 108 HD2 ARG 108 36.942 -10.274 1.156 771 HD3 ARG 108 HD1 ARG 108 37.671 -10.019 -0.434 772 HE ARG 108 HE ARG 108 39.712 -11.142 0.735 773 HH11 ARG 108 HH11 ARG 108 36.348 -11.987 1.281 774 HH12 ARG 108 HH12 ARG 108 36.682 -13.670 1.538 775 HH21 ARG 108 HH21 ARG 108 40.148 -13.340 1.052 776 HH22 ARG 108 HH22 ARG 108 38.849 -14.452 1.389 777 H ALA 109 HN ALA 109 36.902 -6.399 4.430 778 HA ALA 109 HA ALA 109 35.754 -5.017 2.269 779 HB1 ALA 109 HB1 ALA 109 35.054 -5.505 4.912 780 HB2 ALA 109 HB2 ALA 109 34.116 -4.575 3.743 781 HB3 ALA 109 HB3 ALA 109 35.235 -3.754 4.835 782 H LEU 110 HN LEU 110 37.717 -3.926 4.999 783 HA LEU 110 HA LEU 110 38.140 -1.274 4.214 784 HB2 LEU 110 HB2 LEU 110 40.053 -3.100 5.660 785 HB3 LEU 110 HB1 LEU 110 40.036 -1.349 5.725 786 HG LEU 110 HG LEU 110 37.684 -2.967 6.655 787 HD11 LEU 110 HD11 LEU 110 40.115 -2.161 8.248 788 HD12 LEU 110 HD12 LEU 110 39.582 -3.805 7.884 789 HD13 LEU 110 HD13 LEU 110 38.609 -2.772 8.932 790 HD21 LEU 110 HD21 LEU 110 37.237 -0.971 7.971 791 HD22 LEU 110 HD22 LEU 110 37.367 -0.583 6.254 792 HD23 LEU 110 HD23 LEU 110 38.705 -0.215 7.345 793 H ASP 111 HN ASP 111 39.823 -4.255 3.477 794 HA ASP 111 HA ASP 111 41.922 -3.346 1.889 795 HB2 ASP 111 HB2 ASP 111 41.229 -5.787 2.615 796 HB3 ASP 111 HB1 ASP 111 40.328 -5.755 1.114 797 H TRP 112 HN TRP 112 38.677 -4.309 0.969 798 HA TRP 112 HA TRP 112 38.829 -3.800 -1.778 799 HB2 TRP 112 HB2 TRP 112 37.118 -5.191 -0.626 800 HB3 TRP 112 HB1 TRP 112 36.405 -3.718 0.012 801 HD1 TRP 112 HD1 TRP 112 34.835 -2.316 -1.568 802 HE1 TRP 112 HE1 TRP 112 33.850 -2.735 -3.912 803 HE3 TRP 112 HE3 TRP 112 37.699 -6.323 -2.945 804 HZ2 TRP 112 HZ2 TRP 112 34.241 -4.532 -6.059 805 HZ3 TRP 112 HZ3 TRP 112 37.327 -7.335 -5.157 806 HH2 TRP 112 HH2 TRP 112 35.634 -6.458 -6.679 807 H ILE 113 HN ILE 113 37.558 -1.884 0.880 808 HA ILE 113 HA ILE 113 36.734 0.351 -0.575 809 HB ILE 113 HB ILE 113 37.680 0.123 2.285 810 HG12 ILE 113 HG12 ILE 113 34.929 0.097 1.027 811 HG13 ILE 113 HG11 ILE 113 35.737 -1.246 1.815 812 HG21 ILE 113 HG21 ILE 113 36.178 2.372 0.951 813 HG22 ILE 113 HG22 ILE 113 37.850 2.422 1.506 814 HG23 ILE 113 HG23 ILE 113 36.543 2.249 2.672 815 HD11 ILE 113 HD11 ILE 113 35.320 1.197 3.416 816 HD12 ILE 113 HD12 ILE 113 35.247 -0.506 3.880 817 HD13 ILE 113 HD13 ILE 113 33.904 0.229 3.012 818 H PHE 114 HN PHE 114 39.832 -0.421 0.949 819 HA PHE 114 HA PHE 114 41.068 2.056 0.383 820 HB2 PHE 114 HB2 PHE 114 41.844 0.344 2.078 821 HB3 PHE 114 HB1 PHE 114 42.424 -0.622 0.727 822 HD1 PHE 114 HD2 PHE 114 42.848 2.618 2.463 823 HD2 PHE 114 HD1 PHE 114 44.489 -0.196 -0.277 824 HE1 PHE 114 HE2 PHE 114 44.987 3.834 2.500 825 HE2 PHE 114 HE1 PHE 114 46.628 1.016 -0.246 826 HZ PHE 114 HZ PHE 114 46.869 3.054 1.159 827 H SER 115 HN SER 115 40.610 -0.855 -1.424 828 HA SER 115 HA SER 115 42.452 -0.074 -3.514 829 HB2 SER 115 HB2 SER 115 40.455 -2.342 -3.422 830 HB3 SER 115 HB1 SER 115 41.759 -2.153 -4.588 831 HG SER 115 HG SER 115 41.955 -2.645 -1.797 832 H HIS 116 HN HIS 116 39.522 0.975 -2.629 833 HA HIS 116 HA HIS 116 38.953 1.884 -5.343 834 HB2 HIS 116 HB2 HIS 116 36.964 0.410 -3.621 835 HB3 HIS 116 HB1 HIS 116 36.449 1.519 -4.886 836 HD1 HIS 116 HD1 HIS 116 37.327 0.863 -7.372 837 HD2 HIS 116 HD2 HIS 116 37.507 -2.113 -4.474 838 HE1 HIS 116 HE1 HIS 116 37.538 -1.300 -8.635 839 HE2 HIS 116 HE2 HIS 116 37.873 -3.057 -6.854 840 HA PRO 117 HA PRO 117 39.034 5.331 -2.184 841 HB2 PRO 117 HB2 PRO 117 39.784 6.972 -4.339 842 HB3 PRO 117 HB1 PRO 117 40.845 6.363 -3.073 843 HG2 PRO 117 HG2 PRO 117 40.355 5.320 -5.819 844 HG3 PRO 117 HG1 PRO 117 41.855 5.326 -4.865 845 HD2 PRO 117 HD2 PRO 117 40.460 3.080 -5.168 846 HD3 PRO 117 HD1 PRO 117 41.183 3.477 -3.599 847 H GLU 118 HN GLU 118 37.944 5.160 -5.506 848 HA GLU 118 HA GLU 118 35.276 5.607 -5.000 849 HB2 GLU 118 HB2 GLU 118 35.039 7.829 -6.144 850 HB3 GLU 118 HB1 GLU 118 35.672 7.892 -4.509 851 HG2 GLU 118 HG2 GLU 118 37.921 8.118 -5.415 852 HG3 GLU 118 HG1 GLU 118 37.264 8.089 -7.050 853 H PHE 119 HN PHE 119 37.715 6.538 -7.388 854 HA PHE 119 HA PHE 119 36.754 4.439 -9.125 855 HB2 PHE 119 HB2 PHE 119 35.542 6.601 -9.711 856 HB3 PHE 119 HB1 PHE 119 37.104 7.254 -10.182 857 HD1 PHE 119 HD1 PHE 119 34.904 4.319 -10.853 858 HD2 PHE 119 HD2 PHE 119 37.731 7.105 -12.386 859 HE1 PHE 119 HE1 PHE 119 34.586 3.394 -13.112 860 HE2 PHE 119 HE2 PHE 119 37.421 6.185 -14.646 861 HZ PHE 119 HZ PHE 119 35.845 4.327 -15.010 862 H GLU 120 HN GLU 120 39.090 5.543 -7.483 863 HA GLU 120 HA GLU 120 41.331 5.286 -7.441 864 HB2 GLU 120 HB2 GLU 120 40.761 3.378 -9.710 865 HB3 GLU 120 HB1 GLU 120 42.226 3.406 -8.743 866 HG2 GLU 120 HG2 GLU 120 41.024 1.693 -7.780 867 HG3 GLU 120 HG1 GLU 120 40.622 3.072 -6.776 868 H GLU 121 HN GLU 121 43.216 4.828 -9.502 869 HA GLU 121 HA GLU 121 43.199 7.411 -10.788 870 HB2 GLU 121 HB2 GLU 121 45.339 6.755 -11.770 871 HB3 GLU 121 HB1 GLU 121 45.343 6.594 -10.019 872 HG2 GLU 121 HG2 GLU 121 44.946 4.315 -11.936 873 HG3 GLU 121 HG1 GLU 121 46.504 4.774 -11.257 874 H ASP 122 HN ASP 122 43.421 7.703 -13.066 875 HA ASP 122 HA ASP 122 41.715 5.856 -14.479 876 HB2 ASP 122 HB2 ASP 122 41.317 8.296 -14.659 877 HB3 ASP 122 HB1 ASP 122 42.889 8.465 -15.440 878 H SER 123 HN SER 123 42.615 4.149 -15.292 879 HA SER 123 HA SER 123 45.364 3.872 -15.823 880 HB2 SER 123 HB2 SER 123 44.379 1.734 -17.034 881 HB3 SER 123 HB1 SER 123 44.349 1.872 -15.274 882 HG SER 123 HG SER 123 42.298 1.554 -16.912 883 H ASP 124 HN ASP 124 46.350 3.309 -17.868 884 HA ASP 124 HA ASP 124 45.821 5.177 -19.916 885 HB2 ASP 124 HB2 ASP 124 47.539 2.706 -19.855 886 HB3 ASP 124 HB1 ASP 124 47.439 3.780 -21.245 887 H PHE 125 HN PHE 125 44.269 5.132 -21.378 888 HA PHE 125 HA PHE 125 42.944 2.612 -22.000 889 HB2 PHE 125 HB2 PHE 125 41.329 3.994 -23.254 890 HB3 PHE 125 HB1 PHE 125 41.505 4.536 -21.592 891 HD1 PHE 125 HD2 PHE 125 42.261 5.324 -25.107 892 HD2 PHE 125 HD1 PHE 125 42.359 6.711 -21.081 893 HE1 PHE 125 HE2 PHE 125 42.731 7.606 -25.904 894 HE2 PHE 125 HE1 PHE 125 42.827 8.990 -21.875 895 HZ PHE 125 HZ PHE 125 42.941 9.452 -24.298 896 H VAL 126 HN VAL 126 45.459 4.498 -23.152 897 HA VAL 126 HA VAL 126 45.506 2.943 -25.633 898 HB VAL 126 HB VAL 126 44.791 5.164 -26.293 899 HG11 VAL 126 HG11 VAL 126 46.218 7.138 -25.938 900 HG12 VAL 126 HG12 VAL 126 47.271 6.171 -24.907 901 HG13 VAL 126 HG13 VAL 126 45.600 6.469 -24.427 902 HG21 VAL 126 HG21 VAL 126 47.680 4.682 -27.003 903 HG22 VAL 126 HG22 VAL 126 46.557 5.707 -27.895 904 HG23 VAL 126 HG23 VAL 126 46.279 3.969 -27.798 Start of MODEL 9 1 H1 ASP 1 HT1 ASP 1 -47.672 11.367 7.640 2 H2 ASP 1 HT2 ASP 1 -48.614 12.723 7.269 3 H3 ASP 1 HT3 ASP 1 -46.988 12.664 6.791 4 HA ASP 1 HA ASP 1 -49.136 10.869 5.823 5 HB2 ASP 1 HB2 ASP 1 -47.707 13.151 4.439 6 HB3 ASP 1 HB1 ASP 1 -48.816 12.032 3.651 7 H ILE 2 HN ILE 2 -47.911 10.585 3.299 8 HA ILE 2 HA ILE 2 -46.289 8.367 3.765 9 HB ILE 2 HB ILE 2 -46.398 10.013 1.233 10 HG12 ILE 2 HG12 ILE 2 -48.119 7.660 2.030 11 HG13 ILE 2 HG11 ILE 2 -48.645 9.340 2.100 12 HG21 ILE 2 HG21 ILE 2 -45.863 7.876 0.135 13 HG22 ILE 2 HG22 ILE 2 -45.716 7.119 1.721 14 HG23 ILE 2 HG23 ILE 2 -44.592 8.392 1.244 15 HD11 ILE 2 HD11 ILE 2 -47.806 7.862 -0.384 16 HD12 ILE 2 HD12 ILE 2 -48.369 9.531 -0.308 17 HD13 ILE 2 HD13 ILE 2 -49.464 8.212 0.102 18 H ASP 3 HN ASP 3 -44.322 8.413 4.654 19 HA ASP 3 HA ASP 3 -42.511 10.616 4.194 20 HB2 ASP 3 HB2 ASP 3 -42.244 8.045 5.752 21 HB3 ASP 3 HB1 ASP 3 -40.899 9.155 5.527 22 H GLU 4 HN GLU 4 -42.346 10.472 1.941 23 HA GLU 4 HA GLU 4 -41.304 8.165 0.642 24 HB2 GLU 4 HB2 GLU 4 -41.614 11.033 -0.243 25 HB3 GLU 4 HB1 GLU 4 -41.009 9.756 -1.294 26 HG2 GLU 4 HG2 GLU 4 -43.068 8.573 -1.193 27 HG3 GLU 4 HG1 GLU 4 -43.661 9.610 0.107 28 H SER 5 HN SER 5 -39.844 10.394 2.661 29 HA SER 5 HA SER 5 -37.231 10.430 1.652 30 HB2 SER 5 HB2 SER 5 -37.991 11.688 3.674 31 HB3 SER 5 HB1 SER 5 -38.068 10.164 4.557 32 HG SER 5 HG SER 5 -35.777 11.432 3.448 33 H SER 6 HN SER 6 -39.108 7.965 3.309 34 HA SER 6 HA SER 6 -37.103 6.127 3.925 35 HB2 SER 6 HB2 SER 6 -39.903 5.413 3.046 36 HB3 SER 6 HB1 SER 6 -38.858 4.520 4.153 37 HG SER 6 HG SER 6 -40.420 6.772 4.596 38 H VAL 7 HN VAL 7 -39.124 6.360 0.986 39 HA VAL 7 HA VAL 7 -37.963 4.123 -0.264 40 HB VAL 7 HB VAL 7 -40.073 4.794 -1.104 41 HG11 VAL 7 HG11 VAL 7 -38.836 7.462 -1.678 42 HG12 VAL 7 HG12 VAL 7 -40.190 7.102 -0.607 43 HG13 VAL 7 HG13 VAL 7 -40.377 6.936 -2.350 44 HG21 VAL 7 HG21 VAL 7 -39.664 4.947 -3.481 45 HG22 VAL 7 HG22 VAL 7 -38.499 3.851 -2.727 46 HG23 VAL 7 HG23 VAL 7 -38.013 5.488 -3.182 47 H MET 8 HN MET 8 -37.247 7.560 -0.421 48 HA MET 8 HA MET 8 -35.232 7.380 -2.375 49 HB2 MET 8 HB2 MET 8 -35.823 9.384 -0.227 50 HB3 MET 8 HB1 MET 8 -34.405 9.550 -1.254 51 HG2 MET 8 HG2 MET 8 -35.727 9.731 -3.201 52 HG3 MET 8 HG1 MET 8 -37.185 9.246 -2.343 53 HE1 MET 8 HE1 MET 8 -35.018 13.276 -1.687 54 HE2 MET 8 HE2 MET 8 -34.498 12.068 -2.863 55 HE3 MET 8 HE3 MET 8 -34.377 11.728 -1.136 56 H GLN 9 HN GLN 9 -35.169 6.791 1.087 57 HA GLN 9 HA GLN 9 -32.366 6.725 1.372 58 HB2 GLN 9 HB2 GLN 9 -34.511 5.256 2.908 59 HB3 GLN 9 HB1 GLN 9 -32.814 5.275 3.364 60 HG2 GLN 9 HG2 GLN 9 -34.679 7.631 3.231 61 HG3 GLN 9 HG1 GLN 9 -34.001 6.884 4.678 62 HE21 GLN 9 HE21 GLN 9 -33.825 9.638 3.622 63 HE22 GLN 9 HE22 GLN 9 -32.133 9.987 3.515 64 H LEU 10 HN LEU 10 -34.713 4.152 0.595 65 HA LEU 10 HA LEU 10 -32.752 2.119 0.223 66 HB2 LEU 10 HB2 LEU 10 -35.335 2.282 -1.293 67 HB3 LEU 10 HB1 LEU 10 -34.435 0.848 -0.870 68 HG LEU 10 HG LEU 10 -36.107 2.564 0.940 69 HD11 LEU 10 HD11 LEU 10 -36.317 -0.328 0.171 70 HD12 LEU 10 HD12 LEU 10 -37.220 0.988 -0.583 71 HD13 LEU 10 HD13 LEU 10 -37.467 0.612 1.127 72 HD21 LEU 10 HD21 LEU 10 -35.547 0.876 2.687 73 HD22 LEU 10 HD22 LEU 10 -34.197 1.900 2.220 74 HD23 LEU 10 HD23 LEU 10 -34.293 0.251 1.614 75 H ALA 11 HN ALA 11 -34.272 4.482 -1.845 76 HA ALA 11 HA ALA 11 -33.412 3.538 -4.329 77 HB1 ALA 11 HB1 ALA 11 -33.823 6.456 -3.769 78 HB2 ALA 11 HB2 ALA 11 -35.180 5.331 -3.755 79 HB3 ALA 11 HB3 ALA 11 -34.217 5.539 -5.224 80 H GLU 12 HN GLU 12 -31.976 6.039 -2.251 81 HA GLU 12 HA GLU 12 -29.885 6.648 -4.071 82 HB2 GLU 12 HB2 GLU 12 -30.192 7.247 -1.143 83 HB3 GLU 12 HB1 GLU 12 -28.902 7.890 -2.145 84 HG2 GLU 12 HG2 GLU 12 -31.852 8.376 -2.502 85 HG3 GLU 12 HG1 GLU 12 -30.668 9.519 -1.868 86 H MET 13 HN MET 13 -30.256 4.135 -1.755 87 HA MET 13 HA MET 13 -27.360 3.699 -1.682 88 HB2 MET 13 HB2 MET 13 -27.692 2.213 0.141 89 HB3 MET 13 HB1 MET 13 -28.666 3.641 0.456 90 HG2 MET 13 HG2 MET 13 -30.663 2.480 -0.233 91 HG3 MET 13 HG1 MET 13 -29.711 1.067 -0.684 92 HE1 MET 13 HE1 MET 13 -28.416 -0.190 2.794 93 HE2 MET 13 HE2 MET 13 -27.589 0.935 1.718 94 HE3 MET 13 HE3 MET 13 -28.430 -0.464 1.051 95 H GLY 14 HN GLY 14 -29.907 2.802 -3.586 96 HA2 GLY 14 HA2 GLY 14 -28.413 0.677 -4.785 97 HA3 GLY 14 HA1 GLY 14 -29.790 0.072 -3.881 98 H PHE 15 HN PHE 15 -31.847 0.347 -4.670 99 HA PHE 15 HA PHE 15 -31.967 1.303 -7.462 100 HB2 PHE 15 HB2 PHE 15 -33.362 -1.068 -6.201 101 HB3 PHE 15 HB1 PHE 15 -33.660 -0.492 -7.837 102 HD1 PHE 15 HD2 PHE 15 -31.826 -0.602 -9.525 103 HD2 PHE 15 HD1 PHE 15 -31.524 -2.446 -5.700 104 HE1 PHE 15 HE2 PHE 15 -29.994 -2.014 -10.357 105 HE2 PHE 15 HE1 PHE 15 -29.693 -3.865 -6.527 106 HZ PHE 15 HZ PHE 15 -28.903 -3.626 -8.847 107 HA PRO 16 HA PRO 16 -35.425 3.810 -6.324 108 HB2 PRO 16 HB2 PRO 16 -36.942 3.737 -8.574 109 HB3 PRO 16 HB1 PRO 16 -35.423 4.635 -8.473 110 HG2 PRO 16 HG2 PRO 16 -35.971 1.952 -9.669 111 HG3 PRO 16 HG1 PRO 16 -34.942 3.262 -10.280 112 HD2 PRO 16 HD2 PRO 16 -33.962 1.071 -8.991 113 HD3 PRO 16 HD1 PRO 16 -33.172 2.658 -8.944 114 H LEU 17 HN LEU 17 -36.116 2.184 -4.717 115 HA LEU 17 HA LEU 17 -38.099 0.249 -5.391 116 HB2 LEU 17 HB2 LEU 17 -37.011 1.324 -2.805 117 HB3 LEU 17 HB1 LEU 17 -38.491 0.391 -2.797 118 HG LEU 17 HG LEU 17 -36.614 -1.020 -2.247 119 HD11 LEU 17 HD11 LEU 17 -37.647 -1.628 -5.005 120 HD12 LEU 17 HD12 LEU 17 -38.466 -1.997 -3.487 121 HD13 LEU 17 HD13 LEU 17 -36.935 -2.781 -3.876 122 HD21 LEU 17 HD21 LEU 17 -34.835 0.191 -3.360 123 HD22 LEU 17 HD22 LEU 17 -35.489 -0.258 -4.934 124 HD23 LEU 17 HD23 LEU 17 -34.842 -1.501 -3.862 125 H GLU 18 HN GLU 18 -39.411 2.095 -6.642 126 HA GLU 18 HA GLU 18 -41.057 3.779 -5.167 127 HB2 GLU 18 HB2 GLU 18 -40.933 3.377 -7.765 128 HB3 GLU 18 HB1 GLU 18 -42.281 2.286 -7.438 129 HG2 GLU 18 HG2 GLU 18 -43.299 4.257 -6.137 130 HG3 GLU 18 HG1 GLU 18 -42.095 5.231 -6.987 131 H ALA 19 HN ALA 19 -41.080 0.325 -5.465 132 HA ALA 19 HA ALA 19 -43.577 -0.289 -4.374 133 HB1 ALA 19 HB1 ALA 19 -42.293 -2.313 -3.416 134 HB2 ALA 19 HB2 ALA 19 -40.904 -1.654 -4.291 135 HB3 ALA 19 HB3 ALA 19 -42.365 -2.114 -5.166 136 H CYS 20 HN CYS 20 -40.650 0.938 -2.922 137 HA CYS 20 HA CYS 20 -41.422 0.611 -0.197 138 HB2 CYS 20 HB2 CYS 20 -39.061 1.098 -0.930 139 HB3 CYS 20 HB1 CYS 20 -39.584 2.724 -1.343 140 HG CYS 20 HG CYS 20 -40.592 2.322 1.675 141 H ARG 21 HN ARG 21 -41.601 3.263 -2.532 142 HA ARG 21 HA ARG 21 -42.925 5.144 -0.964 143 HB2 ARG 21 HB2 ARG 21 -42.267 5.953 -3.037 144 HB3 ARG 21 HB1 ARG 21 -42.869 4.544 -3.897 145 HG2 ARG 21 HG2 ARG 21 -45.112 5.294 -3.712 146 HG3 ARG 21 HG1 ARG 21 -44.649 6.614 -2.634 147 HD2 ARG 21 HD2 ARG 21 -43.756 6.321 -5.501 148 HD3 ARG 21 HD1 ARG 21 -45.105 7.312 -4.961 149 HE ARG 21 HE ARG 21 -43.362 8.530 -3.591 150 HH11 ARG 21 HH11 ARG 21 -42.603 6.966 -6.635 151 HH12 ARG 21 HH12 ARG 21 -41.398 8.138 -7.073 152 HH21 ARG 21 HH21 ARG 21 -41.813 10.069 -4.183 153 HH22 ARG 21 HH22 ARG 21 -40.938 9.886 -5.678 154 H LYS 22 HN LYS 22 -44.332 2.586 -2.990 155 HA LYS 22 HA LYS 22 -47.023 2.960 -2.264 156 HB2 LYS 22 HB2 LYS 22 -45.775 0.289 -2.916 157 HB3 LYS 22 HB1 LYS 22 -47.429 0.811 -3.206 158 HG2 LYS 22 HG2 LYS 22 -46.749 2.242 -4.973 159 HG3 LYS 22 HG1 LYS 22 -45.040 2.024 -4.570 160 HD2 LYS 22 HD2 LYS 22 -45.623 -0.512 -4.945 161 HD3 LYS 22 HD1 LYS 22 -46.933 0.157 -5.920 162 HE2 LYS 22 HE2 LYS 22 -44.045 0.929 -6.255 163 HE3 LYS 22 HE1 LYS 22 -44.803 -0.386 -7.147 164 HZ1 LYS 22 HZ1 LYS 22 -45.495 2.498 -7.269 165 HZ2 LYS 22 HZ2 LYS 22 -46.436 1.284 -7.980 166 HZ3 LYS 22 HZ3 LYS 22 -44.844 1.542 -8.508 167 H ALA 23 HN ALA 23 -44.434 1.031 -0.869 168 HA ALA 23 HA ALA 23 -45.930 -0.396 1.038 169 HB1 ALA 23 HB1 ALA 23 -43.805 -0.938 2.051 170 HB2 ALA 23 HB2 ALA 23 -43.022 0.374 1.166 171 HB3 ALA 23 HB3 ALA 23 -43.662 -1.019 0.293 172 H VAL 24 HN VAL 24 -44.110 2.638 1.277 173 HA VAL 24 HA VAL 24 -44.431 3.069 4.003 174 HB VAL 24 HB VAL 24 -44.309 5.099 1.754 175 HG11 VAL 24 HG11 VAL 24 -43.815 6.794 3.376 176 HG12 VAL 24 HG12 VAL 24 -43.889 5.619 4.694 177 HG13 VAL 24 HG13 VAL 24 -45.355 6.044 3.806 178 HG21 VAL 24 HG21 VAL 24 -41.980 5.358 2.455 179 HG22 VAL 24 HG22 VAL 24 -42.328 3.702 1.958 180 HG23 VAL 24 HG23 VAL 24 -42.209 4.102 3.672 181 H TYR 25 HN TYR 25 -46.554 4.062 1.310 182 HA TYR 25 HA TYR 25 -48.556 5.176 2.983 183 HB2 TYR 25 HB2 TYR 25 -48.358 5.647 0.549 184 HB3 TYR 25 HB1 TYR 25 -48.884 3.999 0.212 185 HD1 TYR 25 HD2 TYR 25 -49.999 7.001 2.128 186 HD2 TYR 25 HD1 TYR 25 -51.126 3.660 -0.245 187 HE1 TYR 25 HE2 TYR 25 -52.330 7.769 2.172 188 HE2 TYR 25 HE1 TYR 25 -53.466 4.418 -0.207 189 HH TYR 25 HH TYR 25 -54.933 5.842 1.188 190 H PHE 26 HN PHE 26 -47.972 1.929 1.763 191 HA PHE 26 HA PHE 26 -50.466 0.826 2.532 192 HB2 PHE 26 HB2 PHE 26 -48.958 -0.193 0.838 193 HB3 PHE 26 HB1 PHE 26 -47.830 -0.604 2.124 194 HD1 PHE 26 HD2 PHE 26 -51.154 -1.307 0.707 195 HD2 PHE 26 HD1 PHE 26 -48.206 -2.467 3.550 196 HE1 PHE 26 HE2 PHE 26 -52.338 -3.431 1.070 197 HE2 PHE 26 HE1 PHE 26 -49.385 -4.595 3.911 198 HZ PHE 26 HZ PHE 26 -51.464 -5.074 2.669 199 H THR 27 HN THR 27 -47.273 0.877 4.091 200 HA THR 27 HA THR 27 -47.914 -0.753 6.272 201 HB THR 27 HB THR 27 -45.981 0.363 7.429 202 HG1 THR 27 HG1 THR 27 -45.586 1.681 4.941 203 HG21 THR 27 HG21 THR 27 -45.364 -0.506 4.617 204 HG22 THR 27 HG22 THR 27 -45.785 -1.625 5.912 205 HG23 THR 27 HG23 THR 27 -44.324 -0.645 6.034 206 H GLY 28 HN GLY 28 -48.567 2.573 5.609 207 HA2 GLY 28 HA2 GLY 28 -50.286 3.754 6.784 208 HA3 GLY 28 HA1 GLY 28 -49.881 2.834 8.229 209 H ASN 29 HN ASN 29 -47.439 4.189 6.164 210 HA ASN 29 HA ASN 29 -45.803 5.725 6.502 211 HB2 ASN 29 HB2 ASN 29 -47.845 7.181 8.195 212 HB3 ASN 29 HB1 ASN 29 -46.430 7.878 7.416 213 HD21 ASN 29 HD21 ASN 29 -49.278 8.524 7.171 214 HD22 ASN 29 HD22 ASN 29 -49.656 8.377 5.490 215 H MET 30 HN MET 30 -45.391 3.609 7.978 216 HA MET 30 HA MET 30 -45.360 4.185 10.797 217 HB2 MET 30 HB2 MET 30 -44.520 1.810 9.164 218 HB3 MET 30 HB1 MET 30 -44.208 1.895 10.890 219 HG2 MET 30 HG2 MET 30 -46.647 2.227 11.249 220 HG3 MET 30 HG1 MET 30 -46.887 1.960 9.525 221 HE1 MET 30 HE1 MET 30 -44.323 0.185 11.935 222 HE2 MET 30 HE2 MET 30 -45.237 -1.246 12.413 223 HE3 MET 30 HE3 MET 30 -45.764 0.352 12.940 224 H GLY 31 HN GLY 31 -42.958 4.014 8.209 225 HA2 GLY 31 HA2 GLY 31 -41.235 5.859 9.024 226 HA3 GLY 31 HA1 GLY 31 -40.828 4.552 10.123 227 H ALA 32 HN ALA 32 -38.894 5.513 8.569 228 HA ALA 32 HA ALA 32 -38.581 4.364 6.030 229 HB1 ALA 32 HB1 ALA 32 -36.454 5.192 7.996 230 HB2 ALA 32 HB2 ALA 32 -37.250 6.248 6.827 231 HB3 ALA 32 HB3 ALA 32 -36.224 4.926 6.268 232 H GLU 33 HN GLU 33 -37.678 3.191 9.247 233 HA GLU 33 HA GLU 33 -36.160 0.966 8.334 234 HB2 GLU 33 HB2 GLU 33 -37.610 1.304 10.965 235 HB3 GLU 33 HB1 GLU 33 -36.327 0.150 10.629 236 HG2 GLU 33 HG2 GLU 33 -34.750 1.973 10.321 237 HG3 GLU 33 HG1 GLU 33 -36.037 3.146 10.615 238 H VAL 34 HN VAL 34 -39.510 1.458 9.243 239 HA VAL 34 HA VAL 34 -40.316 -1.240 9.215 240 HB VAL 34 HB VAL 34 -41.944 1.261 8.749 241 HG11 VAL 34 HG11 VAL 34 -42.773 -1.582 9.270 242 HG12 VAL 34 HG12 VAL 34 -43.239 -0.532 7.929 243 HG13 VAL 34 HG13 VAL 34 -43.836 -0.203 9.552 244 HG21 VAL 34 HG21 VAL 34 -42.529 1.059 11.110 245 HG22 VAL 34 HG22 VAL 34 -40.787 1.231 10.898 246 HG23 VAL 34 HG23 VAL 34 -41.478 -0.350 11.256 247 H ALA 35 HN ALA 35 -40.306 1.261 6.704 248 HA ALA 35 HA ALA 35 -41.472 -0.484 4.753 249 HB1 ALA 35 HB1 ALA 35 -41.687 1.998 4.706 250 HB2 ALA 35 HB2 ALA 35 -41.170 1.259 3.191 251 HB3 ALA 35 HB3 ALA 35 -39.991 2.076 4.219 252 H PHE 36 HN PHE 36 -38.192 0.487 5.638 253 HA PHE 36 HA PHE 36 -36.752 -0.723 3.586 254 HB2 PHE 36 HB2 PHE 36 -35.609 0.577 5.261 255 HB3 PHE 36 HB1 PHE 36 -36.141 -0.503 6.546 256 HD1 PHE 36 HD2 PHE 36 -33.917 -0.196 3.620 257 HD2 PHE 36 HD1 PHE 36 -34.927 -2.478 7.067 258 HE1 PHE 36 HE2 PHE 36 -31.837 -1.484 3.372 259 HE2 PHE 36 HE1 PHE 36 -32.845 -3.770 6.826 260 HZ PHE 36 HZ PHE 36 -31.297 -3.272 4.976 261 H ASN 37 HN ASN 37 -38.099 -2.093 6.564 262 HA ASN 37 HA ASN 37 -37.275 -4.762 6.081 263 HB2 ASN 37 HB2 ASN 37 -37.950 -3.904 8.312 264 HB3 ASN 37 HB1 ASN 37 -39.612 -3.793 7.745 265 HD21 ASN 37 HD21 ASN 37 -40.822 -5.680 7.502 266 HD22 ASN 37 HD22 ASN 37 -40.299 -7.208 8.129 267 H TRP 38 HN TRP 38 -40.140 -2.917 5.185 268 HA TRP 38 HA TRP 38 -41.674 -5.122 4.298 269 HB2 TRP 38 HB2 TRP 38 -42.409 -2.640 4.726 270 HB3 TRP 38 HB1 TRP 38 -41.924 -2.393 3.054 271 HD1 TRP 38 HD1 TRP 38 -43.640 -3.018 1.230 272 HE1 TRP 38 HE1 TRP 38 -45.949 -4.165 1.213 273 HE3 TRP 38 HE3 TRP 38 -43.775 -4.619 6.084 274 HZ2 TRP 38 HZ2 TRP 38 -47.593 -5.575 3.023 275 HZ3 TRP 38 HZ3 TRP 38 -45.752 -5.862 6.859 276 HH2 TRP 38 HH2 TRP 38 -47.620 -6.328 5.361 277 H ILE 39 HN ILE 39 -39.190 -3.160 2.823 278 HA ILE 39 HA ILE 39 -39.599 -4.193 0.189 279 HB ILE 39 HB ILE 39 -37.774 -2.252 1.427 280 HG12 ILE 39 HG12 ILE 39 -38.309 -1.010 -0.611 281 HG13 ILE 39 HG11 ILE 39 -39.070 -2.444 -1.296 282 HG21 ILE 39 HG21 ILE 39 -36.919 -3.750 -1.050 283 HG22 ILE 39 HG22 ILE 39 -36.100 -3.763 0.512 284 HG23 ILE 39 HG23 ILE 39 -36.175 -2.275 -0.435 285 HD11 ILE 39 HD11 ILE 39 -40.713 -0.862 -0.453 286 HD12 ILE 39 HD12 ILE 39 -40.000 -0.976 1.156 287 HD13 ILE 39 HD13 ILE 39 -40.772 -2.386 0.430 288 H ILE 40 HN ILE 40 -37.362 -4.995 2.846 289 HA ILE 40 HA ILE 40 -35.806 -6.779 1.317 290 HB ILE 40 HB ILE 40 -34.997 -7.731 3.356 291 HG12 ILE 40 HG12 ILE 40 -35.959 -6.554 5.528 292 HG13 ILE 40 HG11 ILE 40 -37.427 -6.478 4.562 293 HG21 ILE 40 HG21 ILE 40 -33.999 -5.701 2.768 294 HG22 ILE 40 HG22 ILE 40 -34.355 -5.589 4.484 295 HG23 ILE 40 HG23 ILE 40 -35.382 -4.764 3.333 296 HD11 ILE 40 HD11 ILE 40 -35.902 -8.953 5.333 297 HD12 ILE 40 HD12 ILE 40 -37.297 -8.921 4.254 298 HD13 ILE 40 HD13 ILE 40 -37.476 -8.435 5.941 299 H VAL 41 HN VAL 41 -38.823 -7.109 2.997 300 HA VAL 41 HA VAL 41 -39.220 -9.875 2.473 301 HB VAL 41 HB VAL 41 -41.315 -7.706 2.753 302 HG11 VAL 41 HG11 VAL 41 -42.186 -9.760 1.744 303 HG12 VAL 41 HG12 VAL 41 -42.821 -9.530 3.371 304 HG13 VAL 41 HG13 VAL 41 -41.533 -10.701 3.086 305 HG21 VAL 41 HG21 VAL 41 -41.456 -8.411 5.096 306 HG22 VAL 41 HG22 VAL 41 -39.854 -7.789 4.702 307 HG23 VAL 41 HG23 VAL 41 -40.115 -9.527 4.839 308 H HIS 42 HN HIS 42 -40.251 -6.941 0.738 309 HA HIS 42 HA HIS 42 -41.455 -8.520 -1.375 310 HB2 HIS 42 HB2 HIS 42 -41.347 -5.585 -0.760 311 HB3 HIS 42 HB1 HIS 42 -41.867 -6.143 -2.345 312 HD1 HIS 42 HD1 HIS 42 -44.326 -6.154 -2.481 313 HD2 HIS 42 HD2 HIS 42 -42.979 -7.231 1.308 314 HE1 HIS 42 HE1 HIS 42 -46.395 -6.635 -1.131 315 HE2 HIS 42 HE2 HIS 42 -45.540 -7.501 1.079 316 H MET 43 HN MET 43 -38.354 -8.067 -0.891 317 HA MET 43 HA MET 43 -37.447 -6.852 -3.283 318 HB2 MET 43 HB2 MET 43 -35.266 -7.782 -2.780 319 HB3 MET 43 HB1 MET 43 -35.993 -7.136 -1.318 320 HG2 MET 43 HG2 MET 43 -36.587 -9.371 -0.597 321 HG3 MET 43 HG1 MET 43 -35.927 -10.043 -2.089 322 HE1 MET 43 HE1 MET 43 -33.416 -11.140 0.771 323 HE2 MET 43 HE2 MET 43 -34.531 -11.711 -0.470 324 HE3 MET 43 HE3 MET 43 -35.151 -10.890 0.963 325 H GLU 44 HN GLU 44 -38.717 -9.964 -2.614 326 HA GLU 44 HA GLU 44 -37.584 -11.203 -4.968 327 HB2 GLU 44 HB2 GLU 44 -39.115 -13.113 -4.291 328 HB3 GLU 44 HB1 GLU 44 -37.856 -12.677 -3.145 329 HG2 GLU 44 HG2 GLU 44 -39.532 -11.353 -1.890 330 HG3 GLU 44 HG1 GLU 44 -40.771 -11.959 -2.989 331 H GLU 45 HN GLU 45 -39.776 -8.908 -4.713 332 HA GLU 45 HA GLU 45 -41.857 -9.881 -6.436 333 HB2 GLU 45 HB2 GLU 45 -41.017 -7.150 -5.478 334 HB3 GLU 45 HB1 GLU 45 -42.292 -7.355 -6.670 335 HG2 GLU 45 HG2 GLU 45 -42.402 -8.788 -4.056 336 HG3 GLU 45 HG1 GLU 45 -42.914 -7.107 -4.189 337 HA PRO 46 HA PRO 46 -39.742 -9.457 -10.364 338 HB2 PRO 46 HB2 PRO 46 -42.052 -8.839 -11.783 339 HB3 PRO 46 HB1 PRO 46 -41.456 -10.476 -11.471 340 HG2 PRO 46 HG2 PRO 46 -43.574 -8.909 -10.065 341 HG3 PRO 46 HG1 PRO 46 -43.517 -10.645 -10.439 342 HD2 PRO 46 HD2 PRO 46 -43.028 -9.731 -7.972 343 HD3 PRO 46 HD1 PRO 46 -42.131 -11.113 -8.640 344 H ASP 47 HN ASP 47 -42.074 -7.174 -9.142 345 HA ASP 47 HA ASP 47 -40.975 -5.056 -10.858 346 HB2 ASP 47 HB2 ASP 47 -43.213 -5.654 -11.506 347 HB3 ASP 47 HB1 ASP 47 -43.779 -5.581 -9.850 348 H PHE 48 HN PHE 48 -40.129 -5.945 -8.137 349 HA PHE 48 HA PHE 48 -41.126 -4.264 -6.130 350 HB2 PHE 48 HB2 PHE 48 -39.292 -4.957 -4.781 351 HB3 PHE 48 HB1 PHE 48 -39.719 -6.334 -5.788 352 HD1 PHE 48 HD2 PHE 48 -38.362 -6.324 -8.129 353 HD2 PHE 48 HD1 PHE 48 -37.046 -4.570 -4.478 354 HE1 PHE 48 HE2 PHE 48 -36.029 -6.490 -8.889 355 HE2 PHE 48 HE1 PHE 48 -34.713 -4.735 -5.235 356 HZ PHE 48 HZ PHE 48 -34.185 -5.682 -7.396 357 H ALA 49 HN ALA 49 -38.517 -3.766 -8.436 358 HA ALA 49 HA ALA 49 -38.470 -0.952 -7.624 359 HB1 ALA 49 HB1 ALA 49 -36.465 -2.033 -6.718 360 HB2 ALA 49 HB2 ALA 49 -36.058 -0.861 -7.974 361 HB3 ALA 49 HB3 ALA 49 -36.033 -2.589 -8.335 362 H GLU 50 HN GLU 50 -39.626 -0.220 -9.297 363 HA GLU 50 HA GLU 50 -39.544 -1.130 -11.936 364 HB2 GLU 50 HB2 GLU 50 -40.338 1.599 -10.888 365 HB3 GLU 50 HB1 GLU 50 -40.727 0.965 -12.484 366 HG2 GLU 50 HG2 GLU 50 -42.014 -0.841 -11.465 367 HG3 GLU 50 HG1 GLU 50 -41.618 -0.226 -9.866 368 HA PRO 51 HA PRO 51 -35.568 0.341 -13.093 369 HB2 PRO 51 HB2 PRO 51 -36.288 -0.292 -15.842 370 HB3 PRO 51 HB1 PRO 51 -35.129 -1.094 -14.783 371 HG2 PRO 51 HG2 PRO 51 -37.456 -2.251 -15.537 372 HG3 PRO 51 HG1 PRO 51 -36.691 -2.568 -13.968 373 HD2 PRO 51 HD2 PRO 51 -38.985 -0.752 -14.627 374 HD3 PRO 51 HD1 PRO 51 -38.783 -1.857 -13.249 375 H LEU 52 HN LEU 52 -36.830 2.533 -12.665 376 HA LEU 52 HA LEU 52 -36.427 4.120 -15.107 377 HB2 LEU 52 HB2 LEU 52 -38.860 3.849 -14.294 378 HB3 LEU 52 HB1 LEU 52 -38.390 4.877 -12.954 379 HG LEU 52 HG LEU 52 -38.024 5.769 -15.805 380 HD11 LEU 52 HD11 LEU 52 -40.374 5.134 -15.507 381 HD12 LEU 52 HD12 LEU 52 -40.177 6.878 -15.681 382 HD13 LEU 52 HD13 LEU 52 -40.469 6.178 -14.089 383 HD21 LEU 52 HD21 LEU 52 -38.160 7.990 -14.798 384 HD22 LEU 52 HD22 LEU 52 -36.860 7.039 -14.083 385 HD23 LEU 52 HD23 LEU 52 -38.375 7.259 -13.206 386 H THR 53 HN THR 53 -34.598 5.146 -14.830 387 HA THR 53 HA THR 53 -32.825 6.204 -13.957 388 HB THR 53 HB THR 53 -33.208 7.949 -12.200 389 HG1 THR 53 HG1 THR 53 -35.376 6.605 -11.655 390 HG21 THR 53 HG21 THR 53 -34.602 9.390 -13.632 391 HG22 THR 53 HG22 THR 53 -35.039 7.975 -14.592 392 HG23 THR 53 HG23 THR 53 -33.362 8.521 -14.534 393 H MET 54 HN MET 54 -32.157 4.049 -13.357 394 HA MET 54 HA MET 54 -32.335 3.334 -10.545 395 HB2 MET 54 HB2 MET 54 -30.932 1.963 -12.847 396 HB3 MET 54 HB1 MET 54 -31.118 1.302 -11.229 397 HG2 MET 54 HG2 MET 54 -33.536 1.272 -11.505 398 HG3 MET 54 HG1 MET 54 -33.367 1.962 -13.118 399 HE1 MET 54 HE1 MET 54 -30.784 0.427 -14.200 400 HE2 MET 54 HE2 MET 54 -32.241 0.691 -15.158 401 HE3 MET 54 HE3 MET 54 -31.543 -0.925 -15.041 402 HA PRO 55 HA PRO 55 -28.486 5.512 -9.718 403 HB2 PRO 55 HB2 PRO 55 -28.830 4.286 -7.055 404 HB3 PRO 55 HB1 PRO 55 -28.710 5.992 -7.498 405 HG2 PRO 55 HG2 PRO 55 -31.032 4.932 -6.699 406 HG3 PRO 55 HG1 PRO 55 -30.970 6.158 -7.980 407 HD2 PRO 55 HD2 PRO 55 -31.243 3.179 -8.225 408 HD3 PRO 55 HD1 PRO 55 -32.131 4.462 -9.077 409 H GLY 56 HN GLY 56 -28.965 2.315 -8.154 410 HA2 GLY 56 HA2 GLY 56 -27.598 0.465 -8.064 411 HA3 GLY 56 HA1 GLY 56 -26.838 1.056 -9.537 412 H TYR 57 HN TYR 57 -26.986 1.850 -6.079 413 HA TYR 57 HA TYR 57 -24.520 3.301 -6.253 414 HB2 TYR 57 HB2 TYR 57 -26.480 3.905 -4.773 415 HB3 TYR 57 HB1 TYR 57 -26.005 2.561 -3.738 416 HD1 TYR 57 HD2 TYR 57 -24.045 5.231 -5.488 417 HD2 TYR 57 HD1 TYR 57 -25.065 3.362 -1.806 418 HE1 TYR 57 HE2 TYR 57 -22.436 6.676 -4.314 419 HE2 TYR 57 HE1 TYR 57 -23.463 4.800 -0.624 420 HH TYR 57 HH TYR 57 -21.452 6.080 -1.101 421 H GLY 58 HN GLY 58 -22.583 2.514 -6.088 422 HA2 GLY 58 HA2 GLY 58 -21.909 0.570 -4.068 423 HA3 GLY 58 HA1 GLY 58 -21.711 -0.013 -5.718 424 H GLY 59 HN GLY 59 -19.691 0.570 -3.596 425 HA2 GLY 59 HA2 GLY 59 -18.120 2.561 -5.122 426 HA3 GLY 59 HA1 GLY 59 -18.086 2.482 -3.366 427 H ALA 60 HN ALA 60 -18.280 -0.463 -5.101 428 HA ALA 60 HA ALA 60 -16.939 -2.269 -5.255 429 HB1 ALA 60 HB1 ALA 60 -15.746 -0.866 -6.863 430 HB2 ALA 60 HB2 ALA 60 -14.651 -1.953 -6.009 431 HB3 ALA 60 HB3 ALA 60 -14.724 -0.247 -5.567 432 H ALA 61 HN ALA 61 -14.428 -0.324 -3.733 433 HA ALA 61 HA ALA 61 -14.866 -1.554 -1.150 434 HB1 ALA 61 HB1 ALA 61 -13.543 -3.257 -2.296 435 HB2 ALA 61 HB2 ALA 61 -12.617 -2.502 -1.001 436 HB3 ALA 61 HB3 ALA 61 -12.311 -2.055 -2.679 437 H SER 62 HN SER 62 -14.565 -0.014 0.302 438 HA SER 62 HA SER 62 -13.110 2.399 -0.405 439 HB2 SER 62 HB2 SER 62 -14.555 1.692 2.168 440 HB3 SER 62 HB1 SER 62 -13.999 3.295 1.683 441 HG SER 62 HG SER 62 -15.580 3.442 0.227 442 H ALA 63 HN ALA 63 -11.133 0.968 -0.563 443 HA ALA 63 HA ALA 63 -9.903 0.529 2.077 444 HB1 ALA 63 HB1 ALA 63 -9.284 -0.872 -0.523 445 HB2 ALA 63 HB2 ALA 63 -10.271 -1.528 0.782 446 HB3 ALA 63 HB3 ALA 63 -8.556 -1.212 1.047 447 H GLY 64 HN GLY 64 -8.870 2.462 2.384 448 HA2 GLY 64 HA2 GLY 64 -7.160 3.536 0.282 449 HA3 GLY 64 HA1 GLY 64 -7.473 4.269 1.850 450 H ALA 65 HN ALA 65 -5.093 2.989 0.066 451 HA ALA 65 HA ALA 65 -3.479 2.379 2.396 452 HB1 ALA 65 HB1 ALA 65 -3.849 0.310 0.229 453 HB2 ALA 65 HB2 ALA 65 -4.518 0.211 1.856 454 HB3 ALA 65 HB3 ALA 65 -2.770 0.188 1.619 455 H SER 66 HN SER 66 -1.248 2.447 1.967 456 HA SER 66 HA SER 66 -0.567 3.855 -0.500 457 HB2 SER 66 HB2 SER 66 1.064 3.398 2.008 458 HB3 SER 66 HB1 SER 66 1.516 4.432 0.651 459 HG SER 66 HG SER 66 -0.981 4.910 1.782 460 H VAL 67 HN VAL 67 0.339 2.808 -2.134 461 HA VAL 67 HA VAL 67 1.094 0.016 -1.703 462 HB VAL 67 HB VAL 67 0.956 -0.203 -4.163 463 HG11 VAL 67 HG11 VAL 67 -1.447 1.028 -2.818 464 HG12 VAL 67 HG12 VAL 67 -1.004 -0.681 -2.839 465 HG13 VAL 67 HG13 VAL 67 -1.488 0.123 -4.331 466 HG21 VAL 67 HG21 VAL 67 0.093 2.690 -4.073 467 HG22 VAL 67 HG22 VAL 67 0.018 1.638 -5.487 468 HG23 VAL 67 HG23 VAL 67 1.579 2.068 -4.792 469 H PHE 68 HN PHE 68 2.644 2.984 -2.044 470 HA PHE 68 HA PHE 68 5.072 1.649 -3.042 471 HB2 PHE 68 HB2 PHE 68 4.167 3.434 -4.554 472 HB3 PHE 68 HB1 PHE 68 4.424 4.598 -3.261 473 HD1 PHE 68 HD1 PHE 68 6.221 2.119 -5.370 474 HD2 PHE 68 HD2 PHE 68 6.458 5.679 -3.053 475 HE1 PHE 68 HE1 PHE 68 8.532 2.461 -6.141 476 HE2 PHE 68 HE2 PHE 68 8.770 6.029 -3.820 477 HZ PHE 68 HZ PHE 68 9.815 4.397 -5.356 478 H GLY 69 HN GLY 69 6.941 1.881 -1.902 479 HA2 GLY 69 HA2 GLY 69 6.964 3.648 0.427 480 HA3 GLY 69 HA1 GLY 69 7.160 1.925 0.712 481 H ALA 70 HN ALA 70 9.205 1.408 1.038 482 HA ALA 70 HA ALA 70 11.306 3.049 -0.162 483 HB1 ALA 70 HB1 ALA 70 11.413 2.673 2.250 484 HB2 ALA 70 HB2 ALA 70 12.803 1.962 1.432 485 HB3 ALA 70 HB3 ALA 70 11.483 0.930 1.979 486 H SER 71 HN SER 71 12.586 2.343 -1.766 487 HA SER 71 HA SER 71 11.997 -0.222 -2.960 488 HB2 SER 71 HB2 SER 71 13.670 0.617 -4.699 489 HB3 SER 71 HB1 SER 71 12.200 1.570 -4.489 490 HG SER 71 HG SER 71 14.048 2.898 -4.546 491 H GLY 72 HN GLY 72 13.316 -0.301 -0.397 492 HA2 GLY 72 HA2 GLY 72 14.760 -2.243 0.064 493 HA3 GLY 72 HA1 GLY 72 15.829 -1.636 -1.194 494 H LEU 73 HN LEU 73 16.753 0.539 -0.821 495 HA LEU 73 HA LEU 73 18.068 1.937 0.380 496 HB2 LEU 73 HB2 LEU 73 15.776 1.542 2.265 497 HB3 LEU 73 HB1 LEU 73 17.161 2.495 2.751 498 HG LEU 73 HG LEU 73 15.336 3.910 1.940 499 HD11 LEU 73 HD11 LEU 73 17.706 3.878 0.082 500 HD12 LEU 73 HD12 LEU 73 17.631 4.668 1.657 501 HD13 LEU 73 HD13 LEU 73 16.606 5.233 0.339 502 HD21 LEU 73 HD21 LEU 73 14.522 3.855 -0.276 503 HD22 LEU 73 HD22 LEU 73 14.466 2.193 0.312 504 HD23 LEU 73 HD23 LEU 73 15.754 2.695 -0.776 505 H ASP 74 HN ASP 74 18.964 -0.622 0.297 506 HA ASP 74 HA ASP 74 20.473 -0.813 2.775 507 HB2 ASP 74 HB2 ASP 74 18.486 -2.306 3.068 508 HB3 ASP 74 HB1 ASP 74 18.998 -3.208 1.646 509 H ASN 75 HN ASN 75 22.518 -0.743 2.081 510 HA ASN 75 HA ASN 75 23.474 -2.526 0.074 511 HB2 ASN 75 HB2 ASN 75 24.263 -0.754 -1.500 512 HB3 ASN 75 HB1 ASN 75 22.515 -0.919 -1.450 513 HD21 ASN 75 HD21 ASN 75 25.161 1.181 -1.089 514 HD22 ASN 75 HD22 ASN 75 24.283 2.589 -0.580 515 H GLN 76 HN GLN 76 24.467 -2.821 2.274 516 HA GLN 76 HA GLN 76 26.887 -1.157 2.440 517 HB2 GLN 76 HB2 GLN 76 25.303 -0.707 4.309 518 HB3 GLN 76 HB1 GLN 76 25.408 -2.402 4.765 519 HG2 GLN 76 HG2 GLN 76 27.921 -2.010 4.973 520 HG3 GLN 76 HG1 GLN 76 27.529 -0.294 4.907 521 HE21 GLN 76 HE21 GLN 76 28.661 -1.969 7.066 522 HE22 GLN 76 HE22 GLN 76 27.628 -1.725 8.438 523 HA PRO 77 HA PRO 77 29.217 -5.017 2.086 524 HB2 PRO 77 HB2 PRO 77 31.017 -3.484 3.904 525 HB3 PRO 77 HB1 PRO 77 31.406 -4.363 2.419 526 HG2 PRO 77 HG2 PRO 77 31.297 -1.736 2.406 527 HG3 PRO 77 HG1 PRO 77 30.600 -2.664 1.069 528 HD2 PRO 77 HD2 PRO 77 29.233 -1.306 3.356 529 HD3 PRO 77 HD1 PRO 77 28.746 -1.397 1.653 530 HA PRO 78 HA PRO 78 28.432 -7.262 5.796 531 HB2 PRO 78 HB2 PRO 78 30.672 -8.791 6.090 532 HB3 PRO 78 HB1 PRO 78 29.433 -9.116 4.870 533 HG2 PRO 78 HG2 PRO 78 32.026 -7.656 4.578 534 HG3 PRO 78 HG1 PRO 78 31.339 -8.897 3.522 535 HD2 PRO 78 HD2 PRO 78 31.177 -6.315 2.911 536 HD3 PRO 78 HD1 PRO 78 29.828 -7.414 2.584 537 H GLU 79 HN GLU 79 28.360 -6.163 7.631 538 HA GLU 79 HA GLU 79 30.304 -4.420 8.596 539 HB2 GLU 79 HB2 GLU 79 29.023 -4.355 10.626 540 HB3 GLU 79 HB1 GLU 79 27.915 -4.419 9.267 541 HG2 GLU 79 HG2 GLU 79 27.748 -6.875 9.651 542 HG3 GLU 79 HG1 GLU 79 28.665 -6.642 11.135 543 H GLU 80 HN GLU 80 29.875 -7.853 9.024 544 HA GLU 80 HA GLU 80 31.653 -8.348 11.100 545 HB2 GLU 80 HB2 GLU 80 30.570 -10.264 10.468 546 HB3 GLU 80 HB1 GLU 80 30.598 -9.837 8.767 547 HG2 GLU 80 HG2 GLU 80 33.037 -10.407 8.761 548 HG3 GLU 80 HG1 GLU 80 32.814 -11.053 10.391 549 H ILE 81 HN ILE 81 32.251 -8.096 7.618 550 HA ILE 81 HA ILE 81 35.050 -8.563 7.944 551 HB ILE 81 HB ILE 81 33.439 -7.741 5.540 552 HG12 ILE 81 HG12 ILE 81 34.826 -10.322 6.280 553 HG13 ILE 81 HG11 ILE 81 33.093 -10.034 6.396 554 HG21 ILE 81 HG21 ILE 81 35.675 -8.515 4.407 555 HG22 ILE 81 HG22 ILE 81 36.371 -8.018 5.959 556 HG23 ILE 81 HG23 ILE 81 35.476 -6.859 4.977 557 HD11 ILE 81 HD11 ILE 81 34.807 -10.415 3.994 558 HD12 ILE 81 HD12 ILE 81 33.334 -9.460 3.865 559 HD13 ILE 81 HD13 ILE 81 33.248 -11.143 4.394 560 H VAL 82 HN VAL 82 33.046 -5.697 7.252 561 HA VAL 82 HA VAL 82 35.134 -3.898 6.836 562 HB VAL 82 HB VAL 82 33.656 -2.117 7.400 563 HG11 VAL 82 HG11 VAL 82 31.599 -2.687 6.138 564 HG12 VAL 82 HG12 VAL 82 32.127 -4.370 6.130 565 HG13 VAL 82 HG13 VAL 82 33.094 -3.137 5.317 566 HG21 VAL 82 HG21 VAL 82 32.413 -2.238 9.229 567 HG22 VAL 82 HG22 VAL 82 32.549 -3.997 9.269 568 HG23 VAL 82 HG23 VAL 82 31.275 -3.229 8.312 569 H ALA 83 HN ALA 83 33.658 -5.141 9.749 570 HA ALA 83 HA ALA 83 35.041 -3.706 11.708 571 HB1 ALA 83 HB1 ALA 83 34.588 -5.935 13.002 572 HB2 ALA 83 HB2 ALA 83 33.652 -6.340 11.548 573 HB3 ALA 83 HB3 ALA 83 33.244 -4.906 12.504 574 H ILE 84 HN ILE 84 35.750 -6.839 10.192 575 HA ILE 84 HA ILE 84 38.121 -7.414 11.575 576 HB ILE 84 HB ILE 84 37.222 -8.216 8.800 577 HG12 ILE 84 HG12 ILE 84 37.328 -10.050 11.154 578 HG13 ILE 84 HG11 ILE 84 36.025 -8.877 11.066 579 HG21 ILE 84 HG21 ILE 84 39.479 -9.367 10.439 580 HG22 ILE 84 HG22 ILE 84 39.660 -8.385 8.983 581 HG23 ILE 84 HG23 ILE 84 38.903 -9.979 8.889 582 HD11 ILE 84 HD11 ILE 84 36.641 -10.769 8.831 583 HD12 ILE 84 HD12 ILE 84 35.183 -9.799 9.091 584 HD13 ILE 84 HD13 ILE 84 35.542 -11.164 10.154 585 H ILE 85 HN ILE 85 37.530 -5.650 8.586 586 HA ILE 85 HA ILE 85 40.220 -5.300 7.856 587 HB ILE 85 HB ILE 85 37.802 -3.637 7.180 588 HG12 ILE 85 HG12 ILE 85 39.178 -5.822 5.609 589 HG13 ILE 85 HG11 ILE 85 37.733 -6.059 6.585 590 HG21 ILE 85 HG21 ILE 85 40.636 -3.408 6.438 591 HG22 ILE 85 HG22 ILE 85 39.344 -2.204 6.410 592 HG23 ILE 85 HG23 ILE 85 39.501 -3.359 5.089 593 HD11 ILE 85 HD11 ILE 85 37.275 -5.814 4.173 594 HD12 ILE 85 HD12 ILE 85 37.908 -4.170 4.255 595 HD13 ILE 85 HD13 ILE 85 36.470 -4.606 5.171 596 H THR 86 HN THR 86 37.972 -3.128 9.600 597 HA THR 86 HA THR 86 40.020 -1.207 10.044 598 HB THR 86 HB THR 86 37.909 -0.249 10.170 599 HG1 THR 86 HG1 THR 86 39.466 -0.175 12.288 600 HG21 THR 86 HG21 THR 86 36.296 -1.809 10.463 601 HG22 THR 86 HG22 THR 86 36.303 -1.093 12.084 602 HG23 THR 86 HG23 THR 86 37.152 -2.613 11.788 603 H SER 87 HN SER 87 39.188 -4.158 11.629 604 HA SER 87 HA SER 87 40.708 -3.643 14.004 605 HB2 SER 87 HB2 SER 87 39.817 -6.265 12.786 606 HB3 SER 87 HB1 SER 87 40.507 -6.076 14.397 607 HG SER 87 HG SER 87 38.092 -4.905 13.441 608 H MET 88 HN MET 88 41.434 -4.634 10.777 609 HA MET 88 HA MET 88 44.017 -5.732 11.266 610 HB2 MET 88 HB2 MET 88 42.761 -4.513 8.816 611 HB3 MET 88 HB1 MET 88 44.381 -5.192 8.816 612 HG2 MET 88 HG2 MET 88 41.843 -6.683 9.429 613 HG3 MET 88 HG1 MET 88 42.743 -6.748 7.917 614 HE1 MET 88 HE1 MET 88 45.742 -6.741 8.879 615 HE2 MET 88 HE2 MET 88 45.134 -7.851 7.649 616 HE3 MET 88 HE3 MET 88 46.078 -8.468 9.002 617 H GLY 89 HN GLY 89 42.722 -2.580 11.072 618 HA2 GLY 89 HA2 GLY 89 44.238 -0.900 12.192 619 HA3 GLY 89 HA1 GLY 89 45.403 -1.388 10.970 620 H PHE 90 HN PHE 90 42.467 -1.582 9.537 621 HA PHE 90 HA PHE 90 42.865 0.969 8.195 622 HB2 PHE 90 HB2 PHE 90 41.105 -1.389 7.484 623 HB3 PHE 90 HB1 PHE 90 41.345 0.035 6.480 624 HD1 PHE 90 HD2 PHE 90 44.105 0.563 6.418 625 HD2 PHE 90 HD1 PHE 90 42.180 -3.221 6.628 626 HE1 PHE 90 HE2 PHE 90 46.076 -0.486 5.389 627 HE2 PHE 90 HE1 PHE 90 44.150 -4.282 5.597 628 HZ PHE 90 HZ PHE 90 46.118 -2.904 5.006 629 H GLN 91 HN GLN 91 40.456 1.668 7.298 630 HA GLN 91 HA GLN 91 39.008 2.364 9.744 631 HB2 GLN 91 HB2 GLN 91 39.759 4.222 8.390 632 HB3 GLN 91 HB1 GLN 91 39.029 3.528 6.955 633 HG2 GLN 91 HG2 GLN 91 36.817 3.803 8.028 634 HG3 GLN 91 HG1 GLN 91 37.618 4.655 9.349 635 HE21 GLN 91 HE21 GLN 91 38.554 6.682 8.944 636 HE22 GLN 91 HE22 GLN 91 38.142 7.619 7.547 637 H ARG 92 HN ARG 92 36.722 1.989 9.917 638 HA ARG 92 HA ARG 92 35.721 -0.342 8.698 639 HB2 ARG 92 HB2 ARG 92 34.738 0.553 10.762 640 HB3 ARG 92 HB1 ARG 92 34.143 1.947 9.878 641 HG2 ARG 92 HG2 ARG 92 33.092 -0.002 8.383 642 HG3 ARG 92 HG1 ARG 92 33.132 -0.819 9.945 643 HD2 ARG 92 HD2 ARG 92 31.944 1.913 9.563 644 HD3 ARG 92 HD1 ARG 92 31.009 0.439 9.338 645 HE ARG 92 HE ARG 92 32.371 0.668 11.889 646 HH11 ARG 92 HH11 ARG 92 29.415 1.202 10.073 647 HH12 ARG 92 HH12 ARG 92 28.398 1.227 11.483 648 HH21 ARG 92 HH21 ARG 92 31.035 0.710 13.749 649 HH22 ARG 92 HH22 ARG 92 29.321 0.952 13.577 650 H ASN 93 HN ASN 93 34.900 3.049 8.069 651 HA ASN 93 HA ASN 93 33.245 2.639 5.855 652 HB2 ASN 93 HB2 ASN 93 33.347 4.755 7.024 653 HB3 ASN 93 HB1 ASN 93 35.022 4.986 6.532 654 HD21 ASN 93 HD21 ASN 93 35.481 5.719 4.505 655 HD22 ASN 93 HD22 ASN 93 34.275 6.254 3.382 656 H GLN 94 HN GLN 94 36.725 3.006 6.055 657 HA GLN 94 HA GLN 94 37.288 3.040 3.292 658 HB2 GLN 94 HB2 GLN 94 39.054 3.729 4.620 659 HB3 GLN 94 HB1 GLN 94 38.809 2.440 5.782 660 HG2 GLN 94 HG2 GLN 94 39.871 0.854 4.397 661 HG3 GLN 94 HG1 GLN 94 39.884 1.955 3.021 662 HE21 GLN 94 HE21 GLN 94 41.409 3.615 2.957 663 HE22 GLN 94 HE22 GLN 94 42.782 3.640 4.022 664 H ALA 95 HN ALA 95 36.983 0.479 5.673 665 HA ALA 95 HA ALA 95 37.514 -1.722 4.018 666 HB1 ALA 95 HB1 ALA 95 35.723 -1.492 6.433 667 HB2 ALA 95 HB2 ALA 95 37.454 -1.851 6.438 668 HB3 ALA 95 HB3 ALA 95 36.310 -3.000 5.730 669 H ILE 96 HN ILE 96 34.540 0.088 4.665 670 HA ILE 96 HA ILE 96 32.748 -1.554 3.290 671 HB ILE 96 HB ILE 96 32.719 1.341 4.028 672 HG12 ILE 96 HG12 ILE 96 30.356 -0.110 4.684 673 HG13 ILE 96 HG11 ILE 96 31.746 -1.112 5.088 674 HG21 ILE 96 HG21 ILE 96 30.364 1.417 3.064 675 HG22 ILE 96 HG22 ILE 96 30.838 0.009 2.107 676 HG23 ILE 96 HG23 ILE 96 31.702 1.536 1.920 677 HD11 ILE 96 HD11 ILE 96 31.189 1.678 6.046 678 HD12 ILE 96 HD12 ILE 96 32.663 0.769 6.375 679 HD13 ILE 96 HD13 ILE 96 31.114 0.188 6.992 680 H GLN 97 HN GLN 97 34.438 1.360 2.174 681 HA GLN 97 HA GLN 97 33.614 1.345 -0.470 682 HB2 GLN 97 HB2 GLN 97 34.865 3.185 0.510 683 HB3 GLN 97 HB1 GLN 97 36.284 2.162 0.638 684 HG2 GLN 97 HG2 GLN 97 36.539 2.045 -1.705 685 HG3 GLN 97 HG1 GLN 97 34.969 2.791 -1.975 686 HE21 GLN 97 HE21 GLN 97 35.399 4.773 0.134 687 HE22 GLN 97 HE22 GLN 97 36.514 5.924 -0.516 688 H ALA 98 HN ALA 98 36.369 -0.256 1.013 689 HA ALA 98 HA ALA 98 37.477 -1.363 -1.292 690 HB1 ALA 98 HB1 ALA 98 38.345 -1.240 1.152 691 HB2 ALA 98 HB2 ALA 98 38.851 -2.574 0.120 692 HB3 ALA 98 HB3 ALA 98 37.569 -2.816 1.317 693 H LEU 99 HN LEU 99 35.234 -2.857 1.068 694 HA LEU 99 HA LEU 99 34.926 -5.272 -0.328 695 HB2 LEU 99 HB2 LEU 99 33.026 -3.909 1.551 696 HB3 LEU 99 HB1 LEU 99 32.845 -5.551 0.988 697 HG LEU 99 HG LEU 99 35.240 -4.609 2.537 698 HD11 LEU 99 HD11 LEU 99 32.866 -6.087 3.625 699 HD12 LEU 99 HD12 LEU 99 33.070 -4.343 3.753 700 HD13 LEU 99 HD13 LEU 99 34.239 -5.423 4.517 701 HD21 LEU 99 HD21 LEU 99 36.020 -6.632 2.089 702 HD22 LEU 99 HD22 LEU 99 34.571 -6.987 1.153 703 HD23 LEU 99 HD23 LEU 99 34.610 -7.342 2.878 704 H ARG 100 HN ARG 100 33.305 -2.184 -0.666 705 HA ARG 100 HA ARG 100 31.146 -2.935 -2.274 706 HB2 ARG 100 HB2 ARG 100 32.841 -0.460 -2.138 707 HB3 ARG 100 HB1 ARG 100 31.567 -0.606 -3.342 708 HG2 ARG 100 HG2 ARG 100 29.893 -0.783 -1.668 709 HG3 ARG 100 HG1 ARG 100 31.105 -0.928 -0.392 710 HD2 ARG 100 HD2 ARG 100 31.787 1.309 -0.650 711 HD3 ARG 100 HD1 ARG 100 30.909 1.484 -2.172 712 HE ARG 100 HE ARG 100 29.071 0.835 -0.155 713 HH11 ARG 100 HH11 ARG 100 31.137 3.487 -1.155 714 HH12 ARG 100 HH12 ARG 100 30.132 4.706 -0.429 715 HH21 ARG 100 HH21 ARG 100 27.745 2.450 0.794 716 HH22 ARG 100 HH22 ARG 100 28.213 4.118 0.688 717 H ALA 101 HN ALA 101 34.409 -1.991 -3.196 718 HA ALA 101 HA ALA 101 34.109 -2.441 -5.971 719 HB1 ALA 101 HB1 ALA 101 36.693 -2.520 -5.795 720 HB2 ALA 101 HB2 ALA 101 36.409 -2.080 -4.103 721 HB3 ALA 101 HB3 ALA 101 35.841 -1.027 -5.399 722 H THR 102 HN THR 102 35.322 -4.439 -3.316 723 HA THR 102 HA THR 102 36.203 -6.546 -5.061 724 HB THR 102 HB THR 102 36.968 -7.630 -3.081 725 HG1 THR 102 HG1 THR 102 36.301 -6.982 -1.037 726 HG21 THR 102 HG21 THR 102 38.574 -6.114 -2.814 727 HG22 THR 102 HG22 THR 102 37.476 -4.938 -2.115 728 HG23 THR 102 HG23 THR 102 37.643 -5.064 -3.868 729 H ASN 103 HN ASN 103 33.210 -5.683 -3.945 730 HA ASN 103 HA ASN 103 31.205 -6.659 -3.613 731 HB2 ASN 103 HB2 ASN 103 31.637 -7.631 -5.835 732 HB3 ASN 103 HB1 ASN 103 32.366 -9.039 -5.072 733 HD21 ASN 103 HD21 ASN 103 30.904 -10.504 -5.797 734 HD22 ASN 103 HD22 ASN 103 29.248 -10.535 -5.295 735 H ASN 104 HN ASN 104 32.139 -6.555 -1.468 736 HA ASN 104 HA ASN 104 32.402 -7.274 0.650 737 HB2 ASN 104 HB2 ASN 104 30.790 -8.790 1.489 738 HB3 ASN 104 HB1 ASN 104 30.027 -7.964 0.144 739 HD21 ASN 104 HD21 ASN 104 29.340 -9.131 -1.599 740 HD22 ASN 104 HD22 ASN 104 29.382 -10.859 -1.669 741 H ASN 105 HN ASN 105 34.239 -8.462 -1.456 742 HA ASN 105 HA ASN 105 35.122 -10.909 -0.189 743 HB2 ASN 105 HB2 ASN 105 36.066 -9.258 -2.507 744 HB3 ASN 105 HB1 ASN 105 37.200 -10.365 -1.741 745 HD21 ASN 105 HD21 ASN 105 34.315 -10.092 -3.651 746 HD22 ASN 105 HD22 ASN 105 34.205 -11.770 -4.079 747 H LEU 106 HN LEU 106 36.041 -10.834 1.688 748 HA LEU 106 HA LEU 106 36.914 -8.574 3.052 749 HB2 LEU 106 HB2 LEU 106 36.213 -10.612 4.149 750 HB3 LEU 106 HB1 LEU 106 37.537 -11.501 3.446 751 HG LEU 106 HG LEU 106 38.216 -9.201 5.215 752 HD11 LEU 106 HD11 LEU 106 37.534 -11.874 6.383 753 HD12 LEU 106 HD12 LEU 106 36.326 -10.605 6.228 754 HD13 LEU 106 HD13 LEU 106 37.765 -10.330 7.213 755 HD21 LEU 106 HD21 LEU 106 40.025 -10.709 5.892 756 HD22 LEU 106 HD22 LEU 106 39.984 -10.465 4.145 757 HD23 LEU 106 HD23 LEU 106 39.363 -11.964 4.841 758 H GLU 107 HN GLU 107 38.921 -11.236 1.869 759 HA GLU 107 HA GLU 107 41.400 -10.068 2.347 760 HB2 GLU 107 HB2 GLU 107 40.613 -12.081 0.242 761 HB3 GLU 107 HB1 GLU 107 42.275 -11.671 0.649 762 HG2 GLU 107 HG2 GLU 107 40.321 -12.650 2.690 763 HG3 GLU 107 HG1 GLU 107 41.300 -13.752 1.721 764 H ARG 108 HN ARG 108 39.463 -9.999 -0.626 765 HA ARG 108 HA ARG 108 41.315 -8.473 -2.109 766 HB2 ARG 108 HB2 ARG 108 39.272 -9.815 -2.917 767 HB3 ARG 108 HB1 ARG 108 38.350 -8.374 -2.543 768 HG2 ARG 108 HG2 ARG 108 39.677 -7.092 -4.105 769 HG3 ARG 108 HG1 ARG 108 40.639 -8.531 -4.477 770 HD2 ARG 108 HD2 ARG 108 37.670 -8.338 -4.764 771 HD3 ARG 108 HD1 ARG 108 38.806 -8.108 -6.105 772 HE ARG 108 HE ARG 108 39.359 -10.559 -4.839 773 HH11 ARG 108 HH11 ARG 108 36.881 -9.123 -6.869 774 HH12 ARG 108 HH12 ARG 108 36.376 -10.649 -7.535 775 HH21 ARG 108 HH21 ARG 108 38.697 -12.529 -5.687 776 HH22 ARG 108 HH22 ARG 108 37.408 -12.602 -6.852 777 H ALA 109 HN ALA 109 38.811 -7.588 0.176 778 HA ALA 109 HA ALA 109 38.659 -4.871 -0.478 779 HB1 ALA 109 HB1 ALA 109 37.484 -6.513 1.403 780 HB2 ALA 109 HB2 ALA 109 37.241 -4.774 1.266 781 HB3 ALA 109 HB3 ALA 109 38.449 -5.405 2.381 782 H LEU 110 HN LEU 110 40.558 -6.604 1.953 783 HA LEU 110 HA LEU 110 42.191 -4.497 2.802 784 HB2 LEU 110 HB2 LEU 110 42.905 -7.410 2.540 785 HB3 LEU 110 HB1 LEU 110 43.678 -6.247 3.595 786 HG LEU 110 HG LEU 110 40.762 -6.923 3.875 787 HD11 LEU 110 HD11 LEU 110 43.105 -8.286 5.198 788 HD12 LEU 110 HD12 LEU 110 42.014 -9.005 4.012 789 HD13 LEU 110 HD13 LEU 110 41.406 -8.534 5.601 790 HD21 LEU 110 HD21 LEU 110 41.110 -6.113 6.136 791 HD22 LEU 110 HD22 LEU 110 41.606 -4.897 4.959 792 HD23 LEU 110 HD23 LEU 110 42.822 -5.857 5.799 793 H ASP 111 HN ASP 111 42.481 -6.792 0.163 794 HA ASP 111 HA ASP 111 44.912 -6.112 -0.985 795 HB2 ASP 111 HB2 ASP 111 43.143 -7.850 -1.745 796 HB3 ASP 111 HB1 ASP 111 42.402 -6.510 -2.590 797 H TRP 112 HN TRP 112 41.744 -4.769 -1.618 798 HA TRP 112 HA TRP 112 42.466 -2.747 -3.408 799 HB2 TRP 112 HB2 TRP 112 40.187 -3.665 -3.042 800 HB3 TRP 112 HB1 TRP 112 40.134 -2.829 -1.498 801 HD1 TRP 112 HD1 TRP 112 39.797 -0.179 -1.519 802 HE1 TRP 112 HE1 TRP 112 38.942 1.436 -3.333 803 HE3 TRP 112 HE3 TRP 112 40.166 -3.253 -5.592 804 HZ2 TRP 112 HZ2 TRP 112 38.481 1.411 -6.110 805 HZ3 TRP 112 HZ3 TRP 112 39.491 -2.375 -7.790 806 HH2 TRP 112 HH2 TRP 112 38.666 -0.093 -8.042 807 H ILE 113 HN ILE 113 41.955 -2.724 0.064 808 HA ILE 113 HA ILE 113 42.381 0.033 0.435 809 HB ILE 113 HB ILE 113 42.593 -2.265 2.380 810 HG12 ILE 113 HG12 ILE 113 40.375 -0.311 1.722 811 HG13 ILE 113 HG11 ILE 113 40.372 -2.044 1.427 812 HG21 ILE 113 HG21 ILE 113 42.444 0.706 2.920 813 HG22 ILE 113 HG22 ILE 113 43.845 -0.328 3.187 814 HG23 ILE 113 HG23 ILE 113 42.382 -0.566 4.139 815 HD11 ILE 113 HD11 ILE 113 40.679 -1.040 4.207 816 HD12 ILE 113 HD12 ILE 113 39.981 -2.548 3.607 817 HD13 ILE 113 HD13 ILE 113 39.095 -1.039 3.438 818 H PHE 114 HN PHE 114 44.518 -2.768 0.573 819 HA PHE 114 HA PHE 114 46.791 -1.419 1.581 820 HB2 PHE 114 HB2 PHE 114 46.398 -3.928 1.554 821 HB3 PHE 114 HB1 PHE 114 46.835 -3.893 -0.150 822 HD1 PHE 114 HD2 PHE 114 48.095 -3.081 3.240 823 HD2 PHE 114 HD1 PHE 114 49.075 -3.980 -0.801 824 HE1 PHE 114 HE2 PHE 114 50.468 -3.265 3.866 825 HE2 PHE 114 HE1 PHE 114 51.451 -4.165 -0.184 826 HZ PHE 114 HZ PHE 114 52.150 -3.806 2.146 827 H SER 115 HN SER 115 45.362 -1.605 -1.536 828 HA SER 115 HA SER 115 47.580 -0.794 -3.103 829 HB2 SER 115 HB2 SER 115 45.405 -1.739 -3.966 830 HB3 SER 115 HB1 SER 115 44.656 -0.188 -3.601 831 HG SER 115 HG SER 115 46.937 0.102 -5.054 832 H HIS 116 HN HIS 116 45.674 0.786 -0.775 833 HA HIS 116 HA HIS 116 47.109 3.292 -1.388 834 HB2 HIS 116 HB2 HIS 116 44.326 3.009 -0.220 835 HB3 HIS 116 HB1 HIS 116 45.236 4.516 -0.258 836 HD1 HIS 116 HD1 HIS 116 46.196 4.863 -2.985 837 HD2 HIS 116 HD2 HIS 116 42.523 3.044 -2.225 838 HE1 HIS 116 HE1 HIS 116 44.859 5.100 -5.107 839 HE2 HIS 116 HE2 HIS 116 42.666 3.948 -4.655 840 HA PRO 117 HA PRO 117 48.654 0.807 2.271 841 HB2 PRO 117 HB2 PRO 117 50.869 2.584 2.272 842 HB3 PRO 117 HB1 PRO 117 50.829 0.914 1.706 843 HG2 PRO 117 HG2 PRO 117 50.526 3.459 0.195 844 HG3 PRO 117 HG1 PRO 117 51.236 1.914 -0.326 845 HD2 PRO 117 HD2 PRO 117 48.859 2.630 -1.227 846 HD3 PRO 117 HD1 PRO 117 49.130 0.955 -0.694 847 H GLU 118 HN GLU 118 49.487 4.210 2.167 848 HA GLU 118 HA GLU 118 48.059 4.960 4.490 849 HB2 GLU 118 HB2 GLU 118 50.175 5.389 5.831 850 HB3 GLU 118 HB1 GLU 118 49.663 3.710 5.727 851 HG2 GLU 118 HG2 GLU 118 51.298 3.734 3.647 852 HG3 GLU 118 HG1 GLU 118 52.019 5.070 4.540 853 H PHE 119 HN PHE 119 50.889 5.476 2.490 854 HA PHE 119 HA PHE 119 49.945 8.140 1.838 855 HB2 PHE 119 HB2 PHE 119 51.606 8.263 3.775 856 HB3 PHE 119 HB1 PHE 119 52.817 7.657 2.656 857 HD1 PHE 119 HD1 PHE 119 50.256 10.373 2.816 858 HD2 PHE 119 HD2 PHE 119 54.177 9.199 1.656 859 HE1 PHE 119 HE1 PHE 119 50.711 12.669 2.064 860 HE2 PHE 119 HE2 PHE 119 54.642 11.499 0.903 861 HZ PHE 119 HZ PHE 119 52.929 13.246 1.155 862 H GLU 120 HN GLU 120 49.977 5.599 0.532 863 HA GLU 120 HA GLU 120 50.485 4.561 -1.400 864 HB2 GLU 120 HB2 GLU 120 51.619 7.257 -2.139 865 HB3 GLU 120 HB1 GLU 120 51.434 5.914 -3.260 866 HG2 GLU 120 HG2 GLU 120 49.165 7.094 -1.716 867 HG3 GLU 120 HG1 GLU 120 49.617 7.645 -3.327 868 H GLU 121 HN GLU 121 52.815 4.703 -3.048 869 HA GLU 121 HA GLU 121 54.737 3.629 -1.145 870 HB2 GLU 121 HB2 GLU 121 56.066 2.975 -3.151 871 HB3 GLU 121 HB1 GLU 121 54.467 2.263 -3.075 872 HG2 GLU 121 HG2 GLU 121 55.059 4.707 -4.705 873 HG3 GLU 121 HG1 GLU 121 55.273 3.076 -5.334 874 H ASP 122 HN ASP 122 56.178 4.835 -0.240 875 HA ASP 122 HA ASP 122 57.469 6.950 -1.808 876 HB2 ASP 122 HB2 ASP 122 55.719 7.931 -0.281 877 HB3 ASP 122 HB1 ASP 122 56.641 7.306 1.080 878 H SER 123 HN SER 123 59.482 6.329 -1.977 879 HA SER 123 HA SER 123 60.680 4.326 -0.459 880 HB2 SER 123 HB2 SER 123 61.337 5.136 -2.765 881 HB3 SER 123 HB1 SER 123 62.175 6.468 -1.969 882 HG SER 123 HG SER 123 63.123 4.094 -2.455 883 H ASP 124 HN ASP 124 61.339 4.354 1.580 884 HA ASP 124 HA ASP 124 61.952 6.893 2.868 885 HB2 ASP 124 HB2 ASP 124 60.414 5.285 3.964 886 HB3 ASP 124 HB1 ASP 124 61.751 4.146 4.114 887 H PHE 125 HN PHE 125 63.959 7.470 2.261 888 HA PHE 125 HA PHE 125 66.086 5.546 2.029 889 HB2 PHE 125 HB2 PHE 125 66.137 8.568 1.881 890 HB3 PHE 125 HB1 PHE 125 67.485 7.510 1.481 891 HD1 PHE 125 HD1 PHE 125 67.221 5.906 -0.452 892 HD2 PHE 125 HD2 PHE 125 64.495 9.088 0.296 893 HE1 PHE 125 HE1 PHE 125 66.417 5.760 -2.772 894 HE2 PHE 125 HE2 PHE 125 63.689 8.949 -2.024 895 HZ PHE 125 HZ PHE 125 64.651 7.284 -3.560 896 H VAL 126 HN VAL 126 66.523 4.672 4.012 897 HA VAL 126 HA VAL 126 66.870 6.259 6.366 898 HB VAL 126 HB VAL 126 67.857 3.444 5.857 899 HG11 VAL 126 HG11 VAL 126 67.820 3.237 8.299 900 HG12 VAL 126 HG12 VAL 126 67.332 4.927 8.432 901 HG13 VAL 126 HG13 VAL 126 68.915 4.516 7.773 902 HG21 VAL 126 HG21 VAL 126 65.241 4.377 7.043 903 HG22 VAL 126 HG22 VAL 126 65.798 2.703 6.980 904 HG23 VAL 126 HG23 VAL 126 65.454 3.575 5.486 Start of MODEL 10 1 H1 ASP 1 HT1 ASP 1 -43.377 16.169 0.669 2 H2 ASP 1 HT2 ASP 1 -42.081 15.090 0.528 3 H3 ASP 1 HT3 ASP 1 -43.235 14.870 1.750 4 HA ASP 1 HA ASP 1 -44.943 14.420 0.110 5 HB2 ASP 1 HB2 ASP 1 -42.671 14.479 -1.908 6 HB3 ASP 1 HB1 ASP 1 -44.374 14.155 -2.231 7 H ILE 2 HN ILE 2 -41.574 13.414 0.006 8 HA ILE 2 HA ILE 2 -42.389 10.614 0.254 9 HB ILE 2 HB ILE 2 -40.188 11.802 -1.455 10 HG12 ILE 2 HG12 ILE 2 -42.465 10.120 -2.445 11 HG13 ILE 2 HG11 ILE 2 -42.694 11.842 -2.184 12 HG21 ILE 2 HG21 ILE 2 -39.951 9.403 -2.231 13 HG22 ILE 2 HG22 ILE 2 -40.891 8.972 -0.803 14 HG23 ILE 2 HG23 ILE 2 -39.339 9.777 -0.621 15 HD11 ILE 2 HD11 ILE 2 -42.107 11.171 -4.518 16 HD12 ILE 2 HD12 ILE 2 -40.516 10.723 -3.906 17 HD13 ILE 2 HD13 ILE 2 -41.061 12.391 -3.796 18 H ASP 3 HN ASP 3 -41.742 10.059 2.303 19 HA ASP 3 HA ASP 3 -39.471 11.233 3.563 20 HB2 ASP 3 HB2 ASP 3 -41.253 8.932 4.253 21 HB3 ASP 3 HB1 ASP 3 -39.706 9.083 5.068 22 H GLU 4 HN GLU 4 -37.875 11.016 2.004 23 HA GLU 4 HA GLU 4 -36.959 8.491 1.088 24 HB2 GLU 4 HB2 GLU 4 -35.587 11.178 1.182 25 HB3 GLU 4 HB1 GLU 4 -34.998 9.771 0.300 26 HG2 GLU 4 HG2 GLU 4 -36.863 9.780 -1.152 27 HG3 GLU 4 HG1 GLU 4 -37.709 10.970 -0.163 28 H SER 5 HN SER 5 -36.807 9.986 4.057 29 HA SER 5 HA SER 5 -34.453 9.031 5.180 30 HB2 SER 5 HB2 SER 5 -37.148 8.976 6.551 31 HB3 SER 5 HB1 SER 5 -35.566 9.265 7.275 32 HG SER 5 HG SER 5 -37.035 11.151 6.784 33 H SER 6 HN SER 6 -37.509 7.433 4.420 34 HA SER 6 HA SER 6 -36.993 4.954 5.655 35 HB2 SER 6 HB2 SER 6 -38.622 5.340 3.139 36 HB3 SER 6 HB1 SER 6 -38.861 4.151 4.423 37 HG SER 6 HG SER 6 -39.652 6.787 4.282 38 H VAL 7 HN VAL 7 -36.546 5.976 2.251 39 HA VAL 7 HA VAL 7 -35.513 3.494 1.412 40 HB VAL 7 HB VAL 7 -36.399 4.948 -0.263 41 HG11 VAL 7 HG11 VAL 7 -34.247 6.877 0.530 42 HG12 VAL 7 HG12 VAL 7 -35.994 7.116 0.600 43 HG13 VAL 7 HG13 VAL 7 -35.178 7.009 -0.959 44 HG21 VAL 7 HG21 VAL 7 -34.678 4.823 -1.934 45 HG22 VAL 7 HG22 VAL 7 -34.559 3.406 -0.882 46 HG23 VAL 7 HG23 VAL 7 -33.431 4.750 -0.691 47 H MET 8 HN MET 8 -33.958 6.423 2.566 48 HA MET 8 HA MET 8 -31.318 5.580 2.021 49 HB2 MET 8 HB2 MET 8 -32.427 7.626 3.918 50 HB3 MET 8 HB1 MET 8 -30.700 7.328 3.758 51 HG2 MET 8 HG2 MET 8 -32.506 8.057 1.476 52 HG3 MET 8 HG1 MET 8 -31.549 9.224 2.391 53 HE1 MET 8 HE1 MET 8 -30.560 10.011 0.012 54 HE2 MET 8 HE2 MET 8 -31.454 8.748 -0.838 55 HE3 MET 8 HE3 MET 8 -29.718 8.928 -1.098 56 H GLN 9 HN GLN 9 -33.453 5.033 4.760 57 HA GLN 9 HA GLN 9 -31.538 3.910 6.486 58 HB2 GLN 9 HB2 GLN 9 -34.509 3.501 6.216 59 HB3 GLN 9 HB1 GLN 9 -33.566 2.624 7.410 60 HG2 GLN 9 HG2 GLN 9 -33.655 5.621 7.209 61 HG3 GLN 9 HG1 GLN 9 -34.700 4.671 8.259 62 HE21 GLN 9 HE21 GLN 9 -33.881 5.679 10.084 63 HE22 GLN 9 HE22 GLN 9 -32.306 5.329 10.707 64 H LEU 10 HN LEU 10 -33.511 2.479 3.902 65 HA LEU 10 HA LEU 10 -32.422 -0.152 4.187 66 HB2 LEU 10 HB2 LEU 10 -33.329 1.025 1.582 67 HB3 LEU 10 HB1 LEU 10 -33.356 -0.649 2.072 68 HG LEU 10 HG LEU 10 -35.193 1.552 2.961 69 HD11 LEU 10 HD11 LEU 10 -35.713 -1.027 1.513 70 HD12 LEU 10 HD12 LEU 10 -35.567 0.558 0.751 71 HD13 LEU 10 HD13 LEU 10 -36.886 0.241 1.886 72 HD21 LEU 10 HD21 LEU 10 -36.378 -0.355 4.156 73 HD22 LEU 10 HD22 LEU 10 -34.926 0.283 4.906 74 HD23 LEU 10 HD23 LEU 10 -34.855 -1.237 4.021 75 H ALA 11 HN ALA 11 -31.651 2.656 2.269 76 HA ALA 11 HA ALA 11 -29.819 1.513 0.494 77 HB1 ALA 11 HB1 ALA 11 -29.595 4.375 1.330 78 HB2 ALA 11 HB2 ALA 11 -31.033 3.819 0.474 79 HB3 ALA 11 HB3 ALA 11 -29.440 3.662 -0.278 80 H GLU 12 HN GLU 12 -29.295 3.138 3.597 81 HA GLU 12 HA GLU 12 -26.466 3.129 3.422 82 HB2 GLU 12 HB2 GLU 12 -28.344 3.506 5.727 83 HB3 GLU 12 HB1 GLU 12 -26.598 3.550 5.925 84 HG2 GLU 12 HG2 GLU 12 -26.525 5.375 4.236 85 HG3 GLU 12 HG1 GLU 12 -28.287 5.387 4.241 86 H MET 13 HN MET 13 -28.615 0.581 3.999 87 HA MET 13 HA MET 13 -26.960 -0.962 5.745 88 HB2 MET 13 HB2 MET 13 -29.078 -1.924 3.806 89 HB3 MET 13 HB1 MET 13 -28.373 -2.863 5.114 90 HG2 MET 13 HG2 MET 13 -29.295 -1.216 6.719 91 HG3 MET 13 HG1 MET 13 -30.099 -0.416 5.372 92 HE1 MET 13 HE1 MET 13 -32.453 -0.629 6.529 93 HE2 MET 13 HE2 MET 13 -31.694 -1.398 7.925 94 HE3 MET 13 HE3 MET 13 -33.103 -2.140 7.168 95 H GLY 14 HN GLY 14 -26.980 -0.312 2.359 96 HA2 GLY 14 HA2 GLY 14 -24.706 -0.630 1.394 97 HA3 GLY 14 HA1 GLY 14 -24.797 -2.275 2.005 98 H PHE 15 HN PHE 15 -27.134 -0.253 0.294 99 HA PHE 15 HA PHE 15 -26.794 -1.298 -2.260 100 HB2 PHE 15 HB2 PHE 15 -27.560 -3.415 -1.197 101 HB3 PHE 15 HB1 PHE 15 -29.087 -2.640 -0.801 102 HD1 PHE 15 HD2 PHE 15 -26.968 -3.910 -3.528 103 HD2 PHE 15 HD1 PHE 15 -30.769 -2.323 -2.458 104 HE1 PHE 15 HE2 PHE 15 -27.859 -4.575 -5.722 105 HE2 PHE 15 HE1 PHE 15 -31.664 -2.984 -4.652 106 HZ PHE 15 HZ PHE 15 -30.183 -4.127 -6.293 107 HA PRO 16 HA PRO 16 -29.414 2.229 -2.704 108 HB2 PRO 16 HB2 PRO 16 -29.561 2.290 -5.381 109 HB3 PRO 16 HB1 PRO 16 -28.060 2.663 -4.525 110 HG2 PRO 16 HG2 PRO 16 -28.889 0.132 -5.895 111 HG3 PRO 16 HG1 PRO 16 -27.312 0.953 -5.910 112 HD2 PRO 16 HD2 PRO 16 -27.909 -1.199 -4.316 113 HD3 PRO 16 HD1 PRO 16 -26.666 -0.004 -3.921 114 H LEU 17 HN LEU 17 -31.338 1.228 -1.719 115 HA LEU 17 HA LEU 17 -33.105 -0.228 -3.457 116 HB2 LEU 17 HB2 LEU 17 -33.523 0.843 -0.657 117 HB3 LEU 17 HB1 LEU 17 -34.802 0.098 -1.588 118 HG LEU 17 HG LEU 17 -33.979 -1.571 -0.145 119 HD11 LEU 17 HD11 LEU 17 -34.405 -2.345 -2.412 120 HD12 LEU 17 HD12 LEU 17 -33.109 -3.269 -1.657 121 HD13 LEU 17 HD13 LEU 17 -32.725 -2.026 -2.845 122 HD21 LEU 17 HD21 LEU 17 -31.866 -0.534 0.482 123 HD22 LEU 17 HD22 LEU 17 -31.196 -0.920 -1.105 124 HD23 LEU 17 HD23 LEU 17 -31.632 -2.217 0.010 125 H GLU 18 HN GLU 18 -32.638 1.857 -4.941 126 HA GLU 18 HA GLU 18 -34.252 4.088 -4.695 127 HB2 GLU 18 HB2 GLU 18 -32.765 2.736 -6.770 128 HB3 GLU 18 HB1 GLU 18 -34.232 3.458 -7.397 129 HG2 GLU 18 HG2 GLU 18 -32.408 5.001 -7.584 130 HG3 GLU 18 HG1 GLU 18 -33.580 5.612 -6.416 131 H ALA 19 HN ALA 19 -35.086 0.811 -5.449 132 HA ALA 19 HA ALA 19 -37.659 1.159 -6.491 133 HB1 ALA 19 HB1 ALA 19 -36.958 -1.005 -4.539 134 HB2 ALA 19 HB2 ALA 19 -36.318 -0.989 -6.175 135 HB3 ALA 19 HB3 ALA 19 -38.060 -1.074 -5.915 136 H CYS 20 HN CYS 20 -36.387 1.398 -3.272 137 HA CYS 20 HA CYS 20 -38.908 1.563 -1.918 138 HB2 CYS 20 HB2 CYS 20 -36.755 0.925 -0.780 139 HB3 CYS 20 HB1 CYS 20 -36.235 2.591 -0.957 140 HG CYS 20 HG CYS 20 -38.546 1.293 1.144 141 H ARG 21 HN ARG 21 -36.525 3.864 -3.138 142 HA ARG 21 HA ARG 21 -37.653 6.280 -2.387 143 HB2 ARG 21 HB2 ARG 21 -35.812 5.360 -4.362 144 HB3 ARG 21 HB1 ARG 21 -36.935 6.450 -5.156 145 HG2 ARG 21 HG2 ARG 21 -35.413 7.160 -2.660 146 HG3 ARG 21 HG1 ARG 21 -34.849 7.512 -4.298 147 HD2 ARG 21 HD2 ARG 21 -37.368 8.526 -2.978 148 HD3 ARG 21 HD1 ARG 21 -35.928 9.463 -3.371 149 HE ARG 21 HE ARG 21 -36.971 8.248 -5.703 150 HH11 ARG 21 HH11 ARG 21 -37.402 10.962 -3.535 151 HH12 ARG 21 HH12 ARG 21 -38.402 11.849 -4.643 152 HH21 ARG 21 HH21 ARG 21 -38.274 9.411 -7.170 153 HH22 ARG 21 HH22 ARG 21 -38.927 10.957 -6.701 154 H LYS 22 HN LYS 22 -38.374 4.375 -5.274 155 HA LYS 22 HA LYS 22 -40.650 5.792 -6.130 156 HB2 LYS 22 HB2 LYS 22 -40.173 2.835 -6.537 157 HB3 LYS 22 HB1 LYS 22 -41.039 3.943 -7.592 158 HG2 LYS 22 HG2 LYS 22 -39.031 4.981 -8.291 159 HG3 LYS 22 HG1 LYS 22 -38.100 4.177 -7.024 160 HD2 LYS 22 HD2 LYS 22 -39.064 2.013 -8.239 161 HD3 LYS 22 HD1 LYS 22 -39.103 3.124 -9.613 162 HE2 LYS 22 HE2 LYS 22 -36.729 3.670 -9.159 163 HE3 LYS 22 HE1 LYS 22 -36.720 2.436 -7.901 164 HZ1 LYS 22 HZ1 LYS 22 -37.378 0.821 -9.672 165 HZ2 LYS 22 HZ2 LYS 22 -35.824 1.471 -9.855 166 HZ3 LYS 22 HZ3 LYS 22 -37.098 2.037 -10.821 167 H ALA 23 HN ALA 23 -40.256 2.943 -4.075 168 HA ALA 23 HA ALA 23 -42.906 2.214 -3.718 169 HB1 ALA 23 HB1 ALA 23 -42.162 1.044 -1.727 170 HB2 ALA 23 HB2 ALA 23 -40.664 1.978 -1.722 171 HB3 ALA 23 HB3 ALA 23 -40.992 0.847 -3.035 172 H VAL 24 HN VAL 24 -40.938 4.430 -1.746 173 HA VAL 24 HA VAL 24 -42.907 5.029 0.155 174 HB VAL 24 HB VAL 24 -40.675 6.799 -0.883 175 HG11 VAL 24 HG11 VAL 24 -40.918 8.085 1.150 176 HG12 VAL 24 HG12 VAL 24 -42.253 7.053 1.669 177 HG13 VAL 24 HG13 VAL 24 -42.439 8.084 0.251 178 HG21 VAL 24 HG21 VAL 24 -39.474 6.080 1.127 179 HG22 VAL 24 HG22 VAL 24 -39.857 4.719 0.071 180 HG23 VAL 24 HG23 VAL 24 -40.807 4.998 1.531 181 H TYR 25 HN TYR 25 -42.108 6.593 -2.931 182 HA TYR 25 HA TYR 25 -44.150 8.529 -2.861 183 HB2 TYR 25 HB2 TYR 25 -42.365 8.746 -4.435 184 HB3 TYR 25 HB1 TYR 25 -42.722 7.180 -5.156 185 HD1 TYR 25 HD2 TYR 25 -44.106 10.596 -4.686 186 HD2 TYR 25 HD1 TYR 25 -44.128 7.046 -7.026 187 HE1 TYR 25 HE2 TYR 25 -45.527 11.713 -6.351 188 HE2 TYR 25 HE1 TYR 25 -45.554 8.151 -8.697 189 HH TYR 25 HH TYR 25 -46.051 11.506 -8.745 190 H PHE 26 HN PHE 26 -44.153 5.193 -4.102 191 HA PHE 26 HA PHE 26 -46.778 5.307 -5.180 192 HB2 PHE 26 HB2 PHE 26 -45.018 2.974 -4.434 193 HB3 PHE 26 HB1 PHE 26 -46.601 2.783 -5.172 194 HD1 PHE 26 HD2 PHE 26 -46.485 5.095 -7.087 195 HD2 PHE 26 HD1 PHE 26 -43.638 2.097 -6.087 196 HE1 PHE 26 HE2 PHE 26 -45.475 5.317 -9.319 197 HE2 PHE 26 HE1 PHE 26 -42.621 2.313 -8.316 198 HZ PHE 26 HZ PHE 26 -43.535 3.925 -9.933 199 H THR 27 HN THR 27 -45.527 4.266 -2.033 200 HA THR 27 HA THR 27 -47.933 3.083 -1.127 201 HB THR 27 HB THR 27 -46.975 3.363 1.174 202 HG1 THR 27 HG1 THR 27 -44.634 4.278 -0.143 203 HG21 THR 27 HG21 THR 27 -45.065 2.184 -0.832 204 HG22 THR 27 HG22 THR 27 -46.537 1.388 -0.274 205 HG23 THR 27 HG23 THR 27 -45.233 1.733 0.863 206 H GLY 28 HN GLY 28 -47.118 6.310 -1.655 207 HA2 GLY 28 HA2 GLY 28 -48.391 8.224 -1.249 208 HA3 GLY 28 HA1 GLY 28 -49.432 7.273 -0.193 209 H ASN 29 HN ASN 29 -46.035 7.082 0.127 210 HA ASN 29 HA ASN 29 -44.617 7.457 1.828 211 HB2 ASN 29 HB2 ASN 29 -45.039 9.837 1.104 212 HB3 ASN 29 HB1 ASN 29 -46.214 9.950 2.414 213 HD21 ASN 29 HD21 ASN 29 -45.032 11.525 3.496 214 HD22 ASN 29 HD22 ASN 29 -43.548 11.147 4.330 215 H MET 30 HN MET 30 -45.676 5.571 2.753 216 HA MET 30 HA MET 30 -47.477 6.106 4.983 217 HB2 MET 30 HB2 MET 30 -46.568 3.561 3.652 218 HB3 MET 30 HB1 MET 30 -47.553 3.578 5.105 219 HG2 MET 30 HG2 MET 30 -48.315 4.806 2.469 220 HG3 MET 30 HG1 MET 30 -48.882 3.255 3.080 221 HE1 MET 30 HE1 MET 30 -49.218 3.932 6.195 222 HE2 MET 30 HE2 MET 30 -50.379 2.988 5.262 223 HE3 MET 30 HE3 MET 30 -50.931 4.345 6.241 224 H GLY 31 HN GLY 31 -44.327 6.378 4.716 225 HA2 GLY 31 HA2 GLY 31 -42.931 6.715 6.592 226 HA3 GLY 31 HA1 GLY 31 -43.930 5.595 7.504 227 H ALA 32 HN ALA 32 -41.351 5.283 7.813 228 HA ALA 32 HA ALA 32 -39.859 3.879 5.965 229 HB1 ALA 32 HB1 ALA 32 -38.997 4.993 7.985 230 HB2 ALA 32 HB2 ALA 32 -38.414 3.346 7.806 231 HB3 ALA 32 HB3 ALA 32 -39.687 3.702 8.966 232 H GLU 33 HN GLU 33 -41.836 2.604 8.635 233 HA GLU 33 HA GLU 33 -41.154 -0.070 8.438 234 HB2 GLU 33 HB2 GLU 33 -43.822 1.118 9.215 235 HB3 GLU 33 HB1 GLU 33 -43.321 -0.536 9.536 236 HG2 GLU 33 HG2 GLU 33 -42.031 1.954 10.628 237 HG3 GLU 33 HG1 GLU 33 -43.077 0.841 11.509 238 H VAL 34 HN VAL 34 -43.692 1.673 6.692 239 HA VAL 34 HA VAL 34 -44.753 -0.677 5.470 240 HB VAL 34 HB VAL 34 -45.164 2.242 4.799 241 HG11 VAL 34 HG11 VAL 34 -46.482 -0.242 3.715 242 HG12 VAL 34 HG12 VAL 34 -45.680 1.051 2.815 243 HG13 VAL 34 HG13 VAL 34 -47.219 1.356 3.618 244 HG21 VAL 34 HG21 VAL 34 -46.856 0.259 6.324 245 HG22 VAL 34 HG22 VAL 34 -47.332 1.907 5.916 246 HG23 VAL 34 HG23 VAL 34 -45.973 1.625 7.005 247 H ALA 35 HN ALA 35 -42.493 1.851 4.427 248 HA ALA 35 HA ALA 35 -42.322 0.786 1.772 249 HB1 ALA 35 HB1 ALA 35 -41.900 3.161 2.296 250 HB2 ALA 35 HB2 ALA 35 -40.621 2.378 1.366 251 HB3 ALA 35 HB3 ALA 35 -40.399 2.678 3.091 252 H PHE 36 HN PHE 36 -40.472 0.376 4.745 253 HA PHE 36 HA PHE 36 -38.372 -1.178 3.718 254 HB2 PHE 36 HB2 PHE 36 -38.294 -0.473 6.019 255 HB3 PHE 36 HB1 PHE 36 -39.806 -1.301 6.389 256 HD1 PHE 36 HD2 PHE 36 -36.241 -1.790 5.555 257 HD2 PHE 36 HD1 PHE 36 -39.828 -3.603 6.961 258 HE1 PHE 36 HE2 PHE 36 -34.967 -3.783 6.233 259 HE2 PHE 36 HE1 PHE 36 -38.559 -5.594 7.641 260 HZ PHE 36 HZ PHE 36 -36.127 -5.690 7.280 261 H ASN 37 HN ASN 37 -41.653 -2.007 4.744 262 HA ASN 37 HA ASN 37 -41.475 -4.769 4.147 263 HB2 ASN 37 HB2 ASN 37 -43.233 -3.826 5.609 264 HB3 ASN 37 HB1 ASN 37 -43.934 -3.003 4.220 265 HD21 ASN 37 HD21 ASN 37 -43.416 -6.069 5.774 266 HD22 ASN 37 HD22 ASN 37 -44.567 -6.967 4.843 267 H TRP 38 HN TRP 38 -42.447 -1.932 2.269 268 HA TRP 38 HA TRP 38 -43.452 -3.341 0.047 269 HB2 TRP 38 HB2 TRP 38 -43.485 -0.746 0.727 270 HB3 TRP 38 HB1 TRP 38 -42.124 -0.700 -0.393 271 HD1 TRP 38 HD1 TRP 38 -42.749 -0.491 -2.903 272 HE1 TRP 38 HE1 TRP 38 -44.938 -0.677 -4.259 273 HE3 TRP 38 HE3 TRP 38 -45.859 -2.181 0.795 274 HZ2 TRP 38 HZ2 TRP 38 -47.612 -1.459 -3.815 275 HZ3 TRP 38 HZ3 TRP 38 -48.214 -2.632 0.242 276 HH2 TRP 38 HH2 TRP 38 -49.071 -2.278 -2.013 277 H ILE 39 HN ILE 39 -40.207 -2.430 1.010 278 HA ILE 39 HA ILE 39 -39.044 -3.107 -1.520 279 HB ILE 39 HB ILE 39 -38.121 -1.546 0.438 280 HG12 ILE 39 HG12 ILE 39 -35.958 -1.613 -0.680 281 HG13 ILE 39 HG11 ILE 39 -36.338 -3.194 -1.364 282 HG21 ILE 39 HG21 ILE 39 -36.616 -4.121 0.894 283 HG22 ILE 39 HG22 ILE 39 -37.766 -3.411 2.029 284 HG23 ILE 39 HG23 ILE 39 -36.271 -2.552 1.630 285 HD11 ILE 39 HD11 ILE 39 -36.602 -1.401 -2.989 286 HD12 ILE 39 HD12 ILE 39 -37.809 -0.642 -1.949 287 HD13 ILE 39 HD13 ILE 39 -38.130 -2.221 -2.665 288 H ILE 40 HN ILE 40 -39.443 -4.771 1.592 289 HA ILE 40 HA ILE 40 -37.923 -7.036 0.774 290 HB ILE 40 HB ILE 40 -38.810 -8.172 2.731 291 HG12 ILE 40 HG12 ILE 40 -40.139 -6.567 4.340 292 HG13 ILE 40 HG11 ILE 40 -40.672 -5.838 2.831 293 HG21 ILE 40 HG21 ILE 40 -38.055 -6.290 4.398 294 HG22 ILE 40 HG22 ILE 40 -37.646 -5.441 2.912 295 HG23 ILE 40 HG23 ILE 40 -36.913 -7.006 3.267 296 HD11 ILE 40 HD11 ILE 40 -41.078 -8.676 3.734 297 HD12 ILE 40 HD12 ILE 40 -41.443 -8.094 2.110 298 HD13 ILE 40 HD13 ILE 40 -42.305 -7.429 3.499 299 H VAL 41 HN VAL 41 -41.115 -6.013 0.203 300 HA VAL 41 HA VAL 41 -42.029 -8.525 -0.846 301 HB VAL 41 HB VAL 41 -43.049 -5.708 -1.288 302 HG11 VAL 41 HG11 VAL 41 -43.628 -7.112 -3.195 303 HG12 VAL 41 HG12 VAL 41 -45.057 -6.748 -2.227 304 HG13 VAL 41 HG13 VAL 41 -44.290 -8.331 -2.106 305 HG21 VAL 41 HG21 VAL 41 -44.859 -6.386 0.207 306 HG22 VAL 41 HG22 VAL 41 -43.292 -6.535 1.002 307 HG23 VAL 41 HG23 VAL 41 -44.112 -7.973 0.399 308 H HIS 42 HN HIS 42 -40.445 -5.640 -2.136 309 HA HIS 42 HA HIS 42 -40.531 -6.683 -4.849 310 HB2 HIS 42 HB2 HIS 42 -39.585 -4.117 -3.626 311 HB3 HIS 42 HB1 HIS 42 -39.086 -4.553 -5.255 312 HD1 HIS 42 HD1 HIS 42 -42.144 -3.655 -3.249 313 HD2 HIS 42 HD2 HIS 42 -41.011 -4.231 -7.207 314 HE1 HIS 42 HE1 HIS 42 -44.087 -2.856 -4.634 315 HE2 HIS 42 HE2 HIS 42 -43.297 -3.034 -7.019 316 H MET 43 HN MET 43 -38.663 -7.455 -2.306 317 HA MET 43 HA MET 43 -36.047 -7.335 -3.282 318 HB2 MET 43 HB2 MET 43 -35.501 -9.087 -1.686 319 HB3 MET 43 HB1 MET 43 -36.562 -7.895 -0.958 320 HG2 MET 43 HG2 MET 43 -37.400 -9.902 -0.185 321 HG3 MET 43 HG1 MET 43 -38.459 -9.522 -1.538 322 HE1 MET 43 HE1 MET 43 -39.360 -11.959 -1.633 323 HE2 MET 43 HE2 MET 43 -38.345 -12.416 -0.266 324 HE3 MET 43 HE3 MET 43 -38.343 -13.397 -1.731 325 H GLU 44 HN GLU 44 -38.668 -9.358 -4.225 326 HA GLU 44 HA GLU 44 -36.895 -11.241 -5.579 327 HB2 GLU 44 HB2 GLU 44 -38.952 -12.507 -6.067 328 HB3 GLU 44 HB1 GLU 44 -38.731 -12.220 -4.350 329 HG2 GLU 44 HG2 GLU 44 -40.380 -10.444 -4.402 330 HG3 GLU 44 HG1 GLU 44 -40.569 -10.653 -6.143 331 H GLU 45 HN GLU 45 -37.684 -8.318 -6.308 332 HA GLU 45 HA GLU 45 -38.533 -8.725 -9.066 333 HB2 GLU 45 HB2 GLU 45 -38.087 -6.327 -7.313 334 HB3 GLU 45 HB1 GLU 45 -38.196 -6.147 -9.059 335 HG2 GLU 45 HG2 GLU 45 -40.309 -7.544 -7.471 336 HG3 GLU 45 HG1 GLU 45 -40.314 -5.796 -7.713 337 HA PRO 46 HA PRO 46 -34.317 -8.910 -10.491 338 HB2 PRO 46 HB2 PRO 46 -34.911 -8.475 -13.128 339 HB3 PRO 46 HB1 PRO 46 -35.061 -10.046 -12.328 340 HG2 PRO 46 HG2 PRO 46 -37.163 -8.019 -12.965 341 HG3 PRO 46 HG1 PRO 46 -37.239 -9.787 -13.069 342 HD2 PRO 46 HD2 PRO 46 -38.343 -8.411 -11.029 343 HD3 PRO 46 HD1 PRO 46 -37.644 -10.029 -10.821 344 H ASP 47 HN ASP 47 -36.516 -6.331 -11.513 345 HA ASP 47 HA ASP 47 -34.179 -4.634 -12.087 346 HB2 ASP 47 HB2 ASP 47 -35.327 -5.310 -14.110 347 HB3 ASP 47 HB1 ASP 47 -36.867 -4.773 -13.463 348 H PHE 48 HN PHE 48 -35.712 -4.905 -9.557 349 HA PHE 48 HA PHE 48 -37.450 -2.660 -9.334 350 HB2 PHE 48 HB2 PHE 48 -37.620 -3.164 -7.009 351 HB3 PHE 48 HB1 PHE 48 -37.567 -4.693 -7.870 352 HD1 PHE 48 HD2 PHE 48 -34.880 -5.367 -8.254 353 HD2 PHE 48 HD1 PHE 48 -36.586 -3.283 -4.960 354 HE1 PHE 48 HE2 PHE 48 -33.015 -6.098 -6.832 355 HE2 PHE 48 HE1 PHE 48 -34.719 -4.010 -3.530 356 HZ PHE 48 HZ PHE 48 -32.998 -5.454 -4.401 357 H ALA 49 HN ALA 49 -34.024 -3.130 -8.713 358 HA ALA 49 HA ALA 49 -33.695 -0.275 -8.359 359 HB1 ALA 49 HB1 ALA 49 -34.007 -0.888 -6.079 360 HB2 ALA 49 HB2 ALA 49 -32.268 -0.657 -6.316 361 HB3 ALA 49 HB3 ALA 49 -32.944 -2.287 -6.246 362 H GLU 50 HN GLU 50 -32.247 0.146 -9.839 363 HA GLU 50 HA GLU 50 -30.289 -1.578 -10.853 364 HB2 GLU 50 HB2 GLU 50 -30.284 1.444 -10.719 365 HB3 GLU 50 HB1 GLU 50 -29.200 0.480 -11.710 366 HG2 GLU 50 HG2 GLU 50 -31.095 -0.365 -12.981 367 HG3 GLU 50 HG1 GLU 50 -32.196 0.571 -11.969 368 HA PRO 51 HA PRO 51 -27.466 -1.514 -7.360 369 HB2 PRO 51 HB2 PRO 51 -25.648 -2.998 -9.099 370 HB3 PRO 51 HB1 PRO 51 -26.458 -3.525 -7.623 371 HG2 PRO 51 HG2 PRO 51 -27.115 -4.490 -10.060 372 HG3 PRO 51 HG1 PRO 51 -28.302 -4.304 -8.757 373 HD2 PRO 51 HD2 PRO 51 -27.790 -2.528 -11.119 374 HD3 PRO 51 HD1 PRO 51 -29.339 -3.052 -10.419 375 H LEU 52 HN LEU 52 -27.544 0.718 -9.115 376 HA LEU 52 HA LEU 52 -24.927 1.240 -10.174 377 HB2 LEU 52 HB2 LEU 52 -27.036 2.138 -11.156 378 HB3 LEU 52 HB1 LEU 52 -27.232 3.135 -9.728 379 HG LEU 52 HG LEU 52 -25.139 4.308 -10.267 380 HD11 LEU 52 HD11 LEU 52 -24.014 2.508 -11.470 381 HD12 LEU 52 HD12 LEU 52 -24.091 3.976 -12.445 382 HD13 LEU 52 HD13 LEU 52 -25.190 2.639 -12.777 383 HD21 LEU 52 HD21 LEU 52 -26.001 5.566 -12.164 384 HD22 LEU 52 HD22 LEU 52 -27.304 5.175 -11.040 385 HD23 LEU 52 HD23 LEU 52 -27.127 4.261 -12.537 386 H THR 53 HN THR 53 -23.315 1.518 -8.795 387 HA THR 53 HA THR 53 -22.034 2.259 -7.080 388 HB THR 53 HB THR 53 -24.058 4.475 -6.703 389 HG1 THR 53 HG1 THR 53 -22.488 5.592 -8.165 390 HG21 THR 53 HG21 THR 53 -21.090 4.299 -6.151 391 HG22 THR 53 HG22 THR 53 -22.376 4.333 -4.945 392 HG23 THR 53 HG23 THR 53 -22.076 5.746 -5.956 393 H MET 54 HN MET 54 -23.159 0.184 -6.258 394 HA MET 54 HA MET 54 -24.922 0.629 -4.008 395 HB2 MET 54 HB2 MET 54 -24.928 -1.810 -3.761 396 HB3 MET 54 HB1 MET 54 -25.290 -1.340 -5.412 397 HG2 MET 54 HG2 MET 54 -23.810 -2.912 -5.957 398 HG3 MET 54 HG1 MET 54 -22.603 -1.699 -5.543 399 HE1 MET 54 HE1 MET 54 -24.638 -4.805 -4.265 400 HE2 MET 54 HE2 MET 54 -24.996 -3.573 -3.054 401 HE3 MET 54 HE3 MET 54 -24.019 -4.976 -2.622 402 HA PRO 55 HA PRO 55 -21.432 1.089 -1.316 403 HB2 PRO 55 HB2 PRO 55 -22.777 1.768 0.895 404 HB3 PRO 55 HB1 PRO 55 -22.677 2.859 -0.490 405 HG2 PRO 55 HG2 PRO 55 -24.922 1.070 0.348 406 HG3 PRO 55 HG1 PRO 55 -24.987 2.726 -0.283 407 HD2 PRO 55 HD2 PRO 55 -25.429 0.448 -1.787 408 HD3 PRO 55 HD1 PRO 55 -24.928 2.014 -2.451 409 H GLY 56 HN GLY 56 -21.115 0.423 1.165 410 HA2 GLY 56 HA2 GLY 56 -22.224 -2.238 1.668 411 HA3 GLY 56 HA1 GLY 56 -20.478 -2.091 1.515 412 H TYR 57 HN TYR 57 -22.838 -2.344 3.710 413 HA TYR 57 HA TYR 57 -21.398 -0.707 5.681 414 HB2 TYR 57 HB2 TYR 57 -23.646 0.105 5.496 415 HB3 TYR 57 HB1 TYR 57 -24.306 -1.527 5.595 416 HD1 TYR 57 HD1 TYR 57 -22.441 1.034 7.542 417 HD2 TYR 57 HD2 TYR 57 -24.884 -2.446 7.675 418 HE1 TYR 57 HE1 TYR 57 -22.630 1.265 9.983 419 HE2 TYR 57 HE2 TYR 57 -25.076 -2.224 10.114 420 HH TYR 57 HH TYR 57 -23.810 -1.221 11.963 421 H GLY 58 HN GLY 58 -20.275 -1.781 7.132 422 HA2 GLY 58 HA2 GLY 58 -21.326 -4.239 8.269 423 HA3 GLY 58 HA1 GLY 58 -19.810 -4.406 7.393 424 H GLY 59 HN GLY 59 -19.924 -5.040 10.059 425 HA2 GLY 59 HA2 GLY 59 -18.877 -2.742 11.532 426 HA3 GLY 59 HA1 GLY 59 -19.209 -4.342 12.185 427 H ALA 60 HN ALA 60 -17.623 -4.724 9.331 428 HA ALA 60 HA ALA 60 -14.975 -4.767 10.613 429 HB1 ALA 60 HB1 ALA 60 -15.902 -7.041 10.447 430 HB2 ALA 60 HB2 ALA 60 -14.469 -6.835 9.442 431 HB3 ALA 60 HB3 ALA 60 -16.071 -6.833 8.704 432 H ALA 61 HN ALA 61 -13.184 -4.707 9.071 433 HA ALA 61 HA ALA 61 -13.848 -2.936 6.822 434 HB1 ALA 61 HB1 ALA 61 -11.198 -3.423 8.177 435 HB2 ALA 61 HB2 ALA 61 -12.275 -2.058 8.475 436 HB3 ALA 61 HB3 ALA 61 -11.511 -2.248 6.899 437 H SER 62 HN SER 62 -12.644 -3.191 4.816 438 HA SER 62 HA SER 62 -12.189 -6.024 4.208 439 HB2 SER 62 HB2 SER 62 -12.453 -5.205 1.796 440 HB3 SER 62 HB1 SER 62 -13.898 -5.145 2.805 441 HG SER 62 HG SER 62 -12.916 -3.178 1.450 442 H ALA 63 HN ALA 63 -10.070 -6.319 4.762 443 HA ALA 63 HA ALA 63 -8.059 -4.456 3.737 444 HB1 ALA 63 HB1 ALA 63 -7.918 -5.128 6.091 445 HB2 ALA 63 HB2 ALA 63 -6.495 -5.639 5.187 446 HB3 ALA 63 HB3 ALA 63 -7.746 -6.813 5.598 447 H GLY 64 HN GLY 64 -6.666 -4.950 2.130 448 HA2 GLY 64 HA2 GLY 64 -6.730 -7.699 1.070 449 HA3 GLY 64 HA1 GLY 64 -6.878 -6.308 0.006 450 H ALA 65 HN ALA 65 -5.109 -5.263 -0.673 451 HA ALA 65 HA ALA 65 -2.934 -4.882 -1.186 452 HB1 ALA 65 HB1 ALA 65 -2.447 -5.556 1.713 453 HB2 ALA 65 HB2 ALA 65 -2.865 -3.962 1.082 454 HB3 ALA 65 HB3 ALA 65 -1.329 -4.711 0.641 455 H SER 66 HN SER 66 -3.032 -6.755 -2.558 456 HA SER 66 HA SER 66 -2.152 -9.312 -1.616 457 HB2 SER 66 HB2 SER 66 -2.385 -8.333 -4.469 458 HB3 SER 66 HB1 SER 66 -2.369 -10.010 -3.921 459 HG SER 66 HG SER 66 -4.365 -9.721 -2.985 460 H VAL 67 HN VAL 67 -0.716 -6.655 -3.451 461 HA VAL 67 HA VAL 67 1.829 -8.134 -3.494 462 HB VAL 67 HB VAL 67 2.468 -6.801 -5.431 463 HG11 VAL 67 HG11 VAL 67 1.271 -8.903 -5.799 464 HG12 VAL 67 HG12 VAL 67 0.903 -7.725 -7.059 465 HG13 VAL 67 HG13 VAL 67 -0.265 -8.034 -5.774 466 HG21 VAL 67 HG21 VAL 67 -0.275 -5.557 -5.224 467 HG22 VAL 67 HG22 VAL 67 0.887 -5.296 -6.526 468 HG23 VAL 67 HG23 VAL 67 1.257 -4.746 -4.892 469 H PHE 68 HN PHE 68 3.759 -7.050 -3.061 470 HA PHE 68 HA PHE 68 3.480 -4.427 -1.743 471 HB2 PHE 68 HB2 PHE 68 4.024 -6.311 -0.178 472 HB3 PHE 68 HB1 PHE 68 5.508 -6.583 -1.086 473 HD1 PHE 68 HD1 PHE 68 3.696 -3.969 0.846 474 HD2 PHE 68 HD2 PHE 68 7.445 -5.468 -0.497 475 HE1 PHE 68 HE1 PHE 68 4.859 -2.319 2.257 476 HE2 PHE 68 HE2 PHE 68 8.615 -3.822 0.905 477 HZ PHE 68 HZ PHE 68 7.301 -2.233 2.289 478 H GLY 69 HN GLY 69 5.191 -2.920 -2.131 479 HA2 GLY 69 HA2 GLY 69 6.804 -3.631 -4.500 480 HA3 GLY 69 HA1 GLY 69 6.023 -2.069 -4.316 481 H ALA 70 HN ALA 70 8.461 -4.190 -2.835 482 HA ALA 70 HA ALA 70 9.769 -1.949 -1.551 483 HB1 ALA 70 HB1 ALA 70 9.836 -4.179 -0.524 484 HB2 ALA 70 HB2 ALA 70 11.459 -3.579 -0.873 485 HB3 ALA 70 HB3 ALA 70 10.723 -4.793 -1.921 486 H SER 71 HN SER 71 11.236 -4.372 -3.669 487 HA SER 71 HA SER 71 12.612 -4.268 -5.448 488 HB2 SER 71 HB2 SER 71 11.212 -1.647 -5.990 489 HB3 SER 71 HB1 SER 71 12.139 -2.587 -7.159 490 HG SER 71 HG SER 71 10.352 -4.218 -6.052 491 H GLY 72 HN GLY 72 12.559 -0.746 -5.007 492 HA2 GLY 72 HA2 GLY 72 15.431 -0.688 -5.201 493 HA3 GLY 72 HA1 GLY 72 14.365 0.698 -5.018 494 H LEU 73 HN LEU 73 16.173 -1.769 -3.381 495 HA LEU 73 HA LEU 73 15.602 -0.502 -0.794 496 HB2 LEU 73 HB2 LEU 73 15.544 -3.151 -1.515 497 HB3 LEU 73 HB1 LEU 73 17.137 -3.003 -0.805 498 HG LEU 73 HG LEU 73 15.558 -3.754 0.862 499 HD11 LEU 73 HD11 LEU 73 16.366 -0.886 1.313 500 HD12 LEU 73 HD12 LEU 73 17.349 -2.313 1.638 501 HD13 LEU 73 HD13 LEU 73 15.878 -2.023 2.568 502 HD21 LEU 73 HD21 LEU 73 13.664 -2.385 1.551 503 HD22 LEU 73 HD22 LEU 73 13.528 -2.852 -0.143 504 HD23 LEU 73 HD23 LEU 73 14.037 -1.217 0.284 505 H ASP 74 HN ASP 74 17.028 1.164 -0.673 506 HA ASP 74 HA ASP 74 19.825 0.810 -1.317 507 HB2 ASP 74 HB2 ASP 74 18.911 3.010 -1.673 508 HB3 ASP 74 HB1 ASP 74 18.318 3.088 -0.017 509 H ASN 75 HN ASN 75 21.524 0.643 0.131 510 HA ASN 75 HA ASN 75 20.926 0.377 2.951 511 HB2 ASN 75 HB2 ASN 75 21.951 -1.854 3.114 512 HB3 ASN 75 HB1 ASN 75 20.518 -1.895 2.095 513 HD21 ASN 75 HD21 ASN 75 22.903 -3.643 2.277 514 HD22 ASN 75 HD22 ASN 75 23.517 -3.725 0.660 515 H GLN 76 HN GLN 76 22.608 1.049 4.155 516 HA GLN 76 HA GLN 76 25.069 1.643 2.689 517 HB2 GLN 76 HB2 GLN 76 23.952 3.504 3.969 518 HB3 GLN 76 HB1 GLN 76 24.262 2.607 5.448 519 HG2 GLN 76 HG2 GLN 76 26.720 2.648 4.716 520 HG3 GLN 76 HG1 GLN 76 26.217 3.920 3.608 521 HE21 GLN 76 HE21 GLN 76 24.764 3.470 6.748 522 HE22 GLN 76 HE22 GLN 76 25.411 4.902 7.475 523 HA PRO 77 HA PRO 77 27.202 -1.800 4.626 524 HB2 PRO 77 HB2 PRO 77 29.401 0.211 4.504 525 HB3 PRO 77 HB1 PRO 77 29.410 -1.486 4.019 526 HG2 PRO 77 HG2 PRO 77 29.276 0.413 2.201 527 HG3 PRO 77 HG1 PRO 77 28.299 -1.052 2.045 528 HD2 PRO 77 HD2 PRO 77 27.481 1.696 2.866 529 HD3 PRO 77 HD1 PRO 77 26.594 0.493 1.915 530 HA PRO 78 HA PRO 78 27.276 -0.897 8.906 531 HB2 PRO 78 HB2 PRO 78 29.532 -2.193 9.765 532 HB3 PRO 78 HB1 PRO 78 28.019 -3.016 9.373 533 HG2 PRO 78 HG2 PRO 78 30.457 -2.645 7.692 534 HG3 PRO 78 HG1 PRO 78 29.476 -4.103 7.907 535 HD2 PRO 78 HD2 PRO 78 29.240 -2.564 5.745 536 HD3 PRO 78 HD1 PRO 78 27.823 -3.322 6.480 537 H GLU 79 HN GLU 79 27.614 1.171 9.361 538 HA GLU 79 HA GLU 79 29.788 2.730 8.650 539 HB2 GLU 79 HB2 GLU 79 28.966 4.128 10.718 540 HB3 GLU 79 HB1 GLU 79 27.997 3.990 9.261 541 HG2 GLU 79 HG2 GLU 79 26.452 2.607 10.243 542 HG3 GLU 79 HG1 GLU 79 27.581 2.050 11.473 543 H GLU 80 HN GLU 80 29.356 0.606 11.380 544 HA GLU 80 HA GLU 80 31.585 1.340 12.902 545 HB2 GLU 80 HB2 GLU 80 30.334 -0.236 13.987 546 HB3 GLU 80 HB1 GLU 80 29.952 -1.100 12.509 547 HG2 GLU 80 HG2 GLU 80 32.195 -2.076 12.503 548 HG3 GLU 80 HG1 GLU 80 32.557 -1.222 14.010 549 H ILE 81 HN ILE 81 31.313 -0.964 10.214 550 HA ILE 81 HA ILE 81 34.099 -1.571 10.264 551 HB ILE 81 HB ILE 81 31.952 -2.262 8.278 552 HG12 ILE 81 HG12 ILE 81 33.482 -3.926 10.284 553 HG13 ILE 81 HG11 ILE 81 31.837 -3.344 10.505 554 HG21 ILE 81 HG21 ILE 81 33.833 -3.951 7.581 555 HG22 ILE 81 HG22 ILE 81 34.894 -2.684 8.219 556 HG23 ILE 81 HG23 ILE 81 33.775 -2.325 6.901 557 HD11 ILE 81 HD11 ILE 81 32.877 -5.486 8.723 558 HD12 ILE 81 HD12 ILE 81 31.421 -4.614 8.255 559 HD13 ILE 81 HD13 ILE 81 31.470 -5.492 9.789 560 H VAL 82 HN VAL 82 32.041 0.454 8.156 561 HA VAL 82 HA VAL 82 34.020 1.084 6.283 562 HB VAL 82 HB VAL 82 32.771 3.010 5.676 563 HG11 VAL 82 HG11 VAL 82 30.453 2.161 5.519 564 HG12 VAL 82 HG12 VAL 82 30.897 0.866 6.631 565 HG13 VAL 82 HG13 VAL 82 31.672 0.977 5.049 566 HG21 VAL 82 HG21 VAL 82 32.051 4.400 7.245 567 HG22 VAL 82 HG22 VAL 82 32.124 3.137 8.478 568 HG23 VAL 82 HG23 VAL 82 30.678 3.316 7.475 569 H ALA 83 HN ALA 83 33.267 2.382 9.434 570 HA ALA 83 HA ALA 83 35.107 4.472 9.611 571 HB1 ALA 83 HB1 ALA 83 34.925 3.806 12.134 572 HB2 ALA 83 HB2 ALA 83 33.676 2.698 11.533 573 HB3 ALA 83 HB3 ALA 83 33.517 4.442 11.278 574 H ILE 84 HN ILE 84 35.374 1.056 10.589 575 HA ILE 84 HA ILE 84 38.001 1.145 11.555 576 HB ILE 84 HB ILE 84 36.471 -1.135 10.282 577 HG12 ILE 84 HG12 ILE 84 37.081 -0.936 13.194 578 HG13 ILE 84 HG11 ILE 84 35.821 0.099 12.538 579 HG21 ILE 84 HG21 ILE 84 39.018 -1.257 11.895 580 HG22 ILE 84 HG22 ILE 84 38.888 -1.528 10.155 581 HG23 ILE 84 HG23 ILE 84 38.102 -2.636 11.282 582 HD11 ILE 84 HD11 ILE 84 35.848 -2.866 12.131 583 HD12 ILE 84 HD12 ILE 84 34.515 -1.725 11.887 584 HD13 ILE 84 HD13 ILE 84 35.085 -2.090 13.521 585 H ILE 85 HN ILE 85 36.739 0.575 8.313 586 HA ILE 85 HA ILE 85 39.177 -0.148 7.121 587 HB ILE 85 HB ILE 85 36.716 1.055 5.873 588 HG12 ILE 85 HG12 ILE 85 37.619 -1.823 6.071 589 HG13 ILE 85 HG11 ILE 85 36.429 -1.077 7.130 590 HG21 ILE 85 HG21 ILE 85 39.305 0.254 4.767 591 HG22 ILE 85 HG22 ILE 85 38.041 1.276 4.083 592 HG23 ILE 85 HG23 ILE 85 37.918 -0.477 3.961 593 HD11 ILE 85 HD11 ILE 85 35.461 -2.434 5.296 594 HD12 ILE 85 HD12 ILE 85 36.125 -1.268 4.153 595 HD13 ILE 85 HD13 ILE 85 34.915 -0.758 5.327 596 H THR 86 HN THR 86 37.472 3.002 7.209 597 HA THR 86 HA THR 86 39.599 4.322 5.858 598 HB THR 86 HB THR 86 37.590 5.458 5.637 599 HG1 THR 86 HG1 THR 86 39.316 6.894 6.093 600 HG21 THR 86 HG21 THR 86 36.058 4.829 7.160 601 HG22 THR 86 HG22 THR 86 36.503 6.388 7.880 602 HG23 THR 86 HG23 THR 86 37.202 4.895 8.511 603 H SER 87 HN SER 87 39.100 3.426 9.159 604 HA SER 87 HA SER 87 41.139 5.076 10.266 605 HB2 SER 87 HB2 SER 87 40.075 2.411 11.220 606 HB3 SER 87 HB1 SER 87 41.092 3.497 12.163 607 HG SER 87 HG SER 87 38.414 3.796 11.354 608 H MET 88 HN MET 88 41.078 1.977 8.645 609 HA MET 88 HA MET 88 43.725 1.139 9.163 610 HB2 MET 88 HB2 MET 88 41.895 0.602 6.825 611 HB3 MET 88 HB1 MET 88 43.436 -0.211 7.062 612 HG2 MET 88 HG2 MET 88 41.067 -0.328 8.911 613 HG3 MET 88 HG1 MET 88 41.580 -1.592 7.796 614 HE1 MET 88 HE1 MET 88 44.698 -1.580 8.022 615 HE2 MET 88 HE2 MET 88 43.744 -3.062 8.092 616 HE3 MET 88 HE3 MET 88 44.974 -2.747 9.314 617 H GLY 89 HN GLY 89 42.395 3.522 7.105 618 HA2 GLY 89 HA2 GLY 89 44.116 5.238 6.483 619 HA3 GLY 89 HA1 GLY 89 44.999 3.886 5.791 620 H PHE 90 HN PHE 90 41.776 3.326 5.348 621 HA PHE 90 HA PHE 90 41.942 4.192 2.567 622 HB2 PHE 90 HB2 PHE 90 40.013 2.321 3.955 623 HB3 PHE 90 HB1 PHE 90 40.027 2.656 2.224 624 HD1 PHE 90 HD2 PHE 90 42.731 2.523 1.395 625 HD2 PHE 90 HD1 PHE 90 40.800 0.213 4.405 626 HE1 PHE 90 HE2 PHE 90 44.375 0.720 1.069 627 HE2 PHE 90 HE1 PHE 90 42.438 -1.591 4.077 628 HZ PHE 90 HZ PHE 90 44.281 -1.297 2.450 629 H GLN 91 HN GLN 91 39.444 4.569 1.784 630 HA GLN 91 HA GLN 91 38.585 6.914 3.304 631 HB2 GLN 91 HB2 GLN 91 38.871 6.506 0.611 632 HB3 GLN 91 HB1 GLN 91 37.151 6.226 0.831 633 HG2 GLN 91 HG2 GLN 91 37.092 8.436 2.062 634 HG3 GLN 91 HG1 GLN 91 38.716 8.704 1.433 635 HE21 GLN 91 HE21 GLN 91 36.330 10.222 0.935 636 HE22 GLN 91 HE22 GLN 91 36.053 10.176 -0.776 637 H ARG 92 HN ARG 92 36.454 7.136 4.064 638 HA ARG 92 HA ARG 92 35.133 4.849 5.030 639 HB2 ARG 92 HB2 ARG 92 34.779 7.095 5.947 640 HB3 ARG 92 HB1 ARG 92 34.023 7.590 4.456 641 HG2 ARG 92 HG2 ARG 92 32.524 5.445 5.089 642 HG3 ARG 92 HG1 ARG 92 32.931 6.071 6.694 643 HD2 ARG 92 HD2 ARG 92 31.685 7.576 4.416 644 HD3 ARG 92 HD1 ARG 92 30.875 7.070 5.893 645 HE ARG 92 HE ARG 92 32.903 8.625 6.804 646 HH11 ARG 92 HH11 ARG 92 30.318 9.079 4.499 647 HH12 ARG 92 HH12 ARG 92 30.381 10.813 4.558 648 HH21 ARG 92 HH21 ARG 92 33.005 10.944 6.885 649 HH22 ARG 92 HH22 ARG 92 31.890 11.867 5.916 650 H ASN 93 HN ASN 93 34.293 6.980 2.326 651 HA ASN 93 HA ASN 93 32.113 5.504 1.347 652 HB2 ASN 93 HB2 ASN 93 32.516 7.799 0.702 653 HB3 ASN 93 HB1 ASN 93 34.023 7.352 -0.093 654 HD21 ASN 93 HD21 ASN 93 30.553 7.286 -0.286 655 HD22 ASN 93 HD22 ASN 93 30.451 6.839 -1.956 656 H GLN 94 HN GLN 94 35.539 5.285 0.682 657 HA GLN 94 HA GLN 94 35.397 3.384 -1.404 658 HB2 GLN 94 HB2 GLN 94 37.447 4.450 -1.270 659 HB3 GLN 94 HB1 GLN 94 37.515 4.321 0.476 660 HG2 GLN 94 HG2 GLN 94 38.270 2.114 0.406 661 HG3 GLN 94 HG1 GLN 94 37.744 1.889 -1.261 662 HE21 GLN 94 HE21 GLN 94 38.996 2.740 -2.934 663 HE22 GLN 94 HE22 GLN 94 40.645 3.217 -2.684 664 H ALA 95 HN ALA 95 35.626 3.175 2.092 665 HA ALA 95 HA ALA 95 35.721 0.377 2.342 666 HB1 ALA 95 HB1 ALA 95 34.560 2.479 4.179 667 HB2 ALA 95 HB2 ALA 95 36.228 1.896 4.169 668 HB3 ALA 95 HB3 ALA 95 34.912 0.807 4.630 669 H ILE 96 HN ILE 96 33.011 2.664 2.084 670 HA ILE 96 HA ILE 96 30.919 0.875 2.490 671 HB ILE 96 HB ILE 96 31.118 3.481 1.044 672 HG12 ILE 96 HG12 ILE 96 28.924 3.258 2.840 673 HG13 ILE 96 HG11 ILE 96 30.332 2.539 3.612 674 HG21 ILE 96 HG21 ILE 96 28.612 3.302 0.647 675 HG22 ILE 96 HG22 ILE 96 28.825 1.558 0.855 676 HG23 ILE 96 HG23 ILE 96 29.660 2.401 -0.451 677 HD11 ILE 96 HD11 ILE 96 30.109 5.321 2.500 678 HD12 ILE 96 HD12 ILE 96 31.579 4.603 3.156 679 HD13 ILE 96 HD13 ILE 96 30.180 4.856 4.202 680 H GLN 97 HN GLN 97 32.380 1.920 -0.578 681 HA GLN 97 HA GLN 97 30.901 0.278 -2.275 682 HB2 GLN 97 HB2 GLN 97 32.360 2.093 -3.055 683 HB3 GLN 97 HB1 GLN 97 33.761 1.123 -2.638 684 HG2 GLN 97 HG2 GLN 97 33.230 -0.506 -4.277 685 HG3 GLN 97 HG1 GLN 97 31.667 0.234 -4.588 686 HE21 GLN 97 HE21 GLN 97 32.841 2.940 -4.471 687 HE22 GLN 97 HE22 GLN 97 33.666 3.147 -5.974 688 H ALA 98 HN ALA 98 33.957 -0.344 -0.635 689 HA ALA 98 HA ALA 98 34.456 -2.877 -1.692 690 HB1 ALA 98 HB1 ALA 98 35.929 -1.333 -0.229 691 HB2 ALA 98 HB2 ALA 98 36.123 -3.081 -0.094 692 HB3 ALA 98 HB3 ALA 98 35.190 -2.195 1.121 693 H LEU 99 HN LEU 99 32.817 -1.984 1.363 694 HA LEU 99 HA LEU 99 32.122 -4.605 2.081 695 HB2 LEU 99 HB2 LEU 99 30.762 -2.018 2.754 696 HB3 LEU 99 HB1 LEU 99 30.403 -3.547 3.520 697 HG LEU 99 HG LEU 99 33.119 -2.251 3.592 698 HD11 LEU 99 HD11 LEU 99 31.046 -2.254 5.763 699 HD12 LEU 99 HD12 LEU 99 31.314 -0.903 4.666 700 HD13 LEU 99 HD13 LEU 99 32.603 -1.422 5.750 701 HD21 LEU 99 HD21 LEU 99 33.726 -4.224 4.393 702 HD22 LEU 99 HD22 LEU 99 32.064 -4.787 4.401 703 HD23 LEU 99 HD23 LEU 99 32.697 -3.907 5.789 704 H ARG 100 HN ARG 100 30.466 -2.236 0.044 705 HA ARG 100 HA ARG 100 28.010 -3.491 -0.304 706 HB2 ARG 100 HB2 ARG 100 29.732 -1.855 -2.140 707 HB3 ARG 100 HB1 ARG 100 28.238 -2.566 -2.727 708 HG2 ARG 100 HG2 ARG 100 26.937 -1.322 -1.173 709 HG3 ARG 100 HG1 ARG 100 28.386 -0.756 -0.336 710 HD2 ARG 100 HD2 ARG 100 29.036 0.593 -2.144 711 HD3 ARG 100 HD1 ARG 100 27.894 -0.187 -3.241 712 HE ARG 100 HE ARG 100 26.316 0.906 -1.295 713 HH11 ARG 100 HH11 ARG 100 28.712 2.177 -3.518 714 HH12 ARG 100 HH12 ARG 100 27.955 3.731 -3.639 715 HH21 ARG 100 HH21 ARG 100 25.316 2.960 -1.463 716 HH22 ARG 100 HH22 ARG 100 26.034 4.176 -2.483 717 H ALA 101 HN ALA 101 31.017 -3.962 -2.053 718 HA ALA 101 HA ALA 101 30.089 -6.050 -3.730 719 HB1 ALA 101 HB1 ALA 101 32.633 -6.378 -4.010 720 HB2 ALA 101 HB2 ALA 101 32.756 -4.930 -2.996 721 HB3 ALA 101 HB3 ALA 101 31.906 -4.859 -4.539 722 H THR 102 HN THR 102 31.837 -5.992 -0.655 723 HA THR 102 HA THR 102 32.252 -8.842 -0.672 724 HB THR 102 HB THR 102 33.478 -8.471 1.381 725 HG1 THR 102 HG1 THR 102 33.091 -5.694 1.170 726 HG21 THR 102 HG21 THR 102 35.188 -7.322 0.341 727 HG22 THR 102 HG22 THR 102 34.120 -6.232 -0.511 728 HG23 THR 102 HG23 THR 102 34.261 -7.916 -1.018 729 H ASN 103 HN ASN 103 29.583 -7.119 -0.022 730 HA ASN 103 HA ASN 103 27.664 -7.433 1.104 731 HB2 ASN 103 HB2 ASN 103 28.867 -10.165 1.467 732 HB3 ASN 103 HB1 ASN 103 27.300 -9.732 2.127 733 HD21 ASN 103 HD21 ASN 103 26.210 -11.197 0.860 734 HD22 ASN 103 HD22 ASN 103 25.991 -10.980 -0.842 735 H ASN 104 HN ASN 104 29.529 -5.988 2.386 736 HA ASN 104 HA ASN 104 29.920 -4.988 4.376 737 HB2 ASN 104 HB2 ASN 104 27.860 -6.928 5.456 738 HB3 ASN 104 HB1 ASN 104 28.498 -5.530 6.320 739 HD21 ASN 104 HD21 ASN 104 25.760 -6.196 5.482 740 HD22 ASN 104 HD22 ASN 104 25.218 -4.858 4.522 741 H ASN 105 HN ASN 105 31.243 -7.577 3.499 742 HA ASN 105 HA ASN 105 32.230 -8.655 5.997 743 HB2 ASN 105 HB2 ASN 105 32.854 -9.163 3.094 744 HB3 ASN 105 HB1 ASN 105 33.922 -9.769 4.354 745 HD21 ASN 105 HD21 ASN 105 33.528 -11.909 4.026 746 HD22 ASN 105 HD22 ASN 105 31.997 -12.655 4.340 747 H LEU 106 HN LEU 106 33.378 -7.321 7.154 748 HA LEU 106 HA LEU 106 34.760 -5.062 6.491 749 HB2 LEU 106 HB2 LEU 106 34.264 -5.727 8.772 750 HB3 LEU 106 HB1 LEU 106 35.352 -7.086 8.659 751 HG LEU 106 HG LEU 106 36.509 -4.366 8.285 752 HD11 LEU 106 HD11 LEU 106 36.043 -5.480 11.029 753 HD12 LEU 106 HD12 LEU 106 34.890 -4.389 10.268 754 HD13 LEU 106 HD13 LEU 106 36.545 -3.847 10.571 755 HD21 LEU 106 HD21 LEU 106 38.381 -5.378 9.492 756 HD22 LEU 106 HD22 LEU 106 37.929 -6.321 8.069 757 HD23 LEU 106 HD23 LEU 106 37.450 -6.866 9.679 758 H GLU 107 HN GLU 107 36.310 -8.173 7.153 759 HA GLU 107 HA GLU 107 38.875 -7.528 6.330 760 HB2 GLU 107 HB2 GLU 107 37.463 -10.193 6.311 761 HB3 GLU 107 HB1 GLU 107 39.192 -9.990 6.063 762 HG2 GLU 107 HG2 GLU 107 37.832 -8.917 8.490 763 HG3 GLU 107 HG1 GLU 107 38.373 -10.594 8.406 764 H ARG 108 HN ARG 108 36.272 -8.999 4.410 765 HA ARG 108 HA ARG 108 37.869 -9.276 2.080 766 HB2 ARG 108 HB2 ARG 108 35.647 -10.441 2.639 767 HB3 ARG 108 HB1 ARG 108 34.885 -8.991 2.031 768 HG2 ARG 108 HG2 ARG 108 36.070 -9.322 -0.108 769 HG3 ARG 108 HG1 ARG 108 36.671 -10.861 0.517 770 HD2 ARG 108 HD2 ARG 108 33.768 -10.189 0.510 771 HD3 ARG 108 HD1 ARG 108 34.544 -10.898 -0.911 772 HE ARG 108 HE ARG 108 35.265 -12.654 0.937 773 HH11 ARG 108 HH11 ARG 108 32.146 -11.107 0.516 774 HH12 ARG 108 HH12 ARG 108 31.247 -12.467 1.118 775 HH21 ARG 108 HH21 ARG 108 34.079 -14.447 1.718 776 HH22 ARG 108 HH22 ARG 108 32.345 -14.366 1.769 777 H ALA 109 HN ALA 109 35.893 -6.694 3.380 778 HA ALA 109 HA ALA 109 35.744 -5.074 1.110 779 HB1 ALA 109 HB1 ALA 109 34.972 -4.841 3.754 780 HB2 ALA 109 HB2 ALA 109 34.775 -3.608 2.511 781 HB3 ALA 109 HB3 ALA 109 36.187 -3.575 3.563 782 H LEU 110 HN LEU 110 38.074 -5.114 3.773 783 HA LEU 110 HA LEU 110 39.923 -3.307 2.713 784 HB2 LEU 110 HB2 LEU 110 40.451 -5.729 4.429 785 HB3 LEU 110 HB1 LEU 110 41.511 -4.349 4.242 786 HG LEU 110 HG LEU 110 38.731 -4.064 5.348 787 HD11 LEU 110 HD11 LEU 110 41.273 -4.603 6.878 788 HD12 LEU 110 HD12 LEU 110 39.912 -5.709 6.693 789 HD13 LEU 110 HD13 LEU 110 39.704 -4.197 7.578 790 HD21 LEU 110 HD21 LEU 110 39.662 -2.043 6.330 791 HD22 LEU 110 HD22 LEU 110 39.862 -2.045 4.578 792 HD23 LEU 110 HD23 LEU 110 41.236 -2.408 5.622 793 H ASP 111 HN ASP 111 39.611 -6.800 2.397 794 HA ASP 111 HA ASP 111 41.793 -7.406 0.773 795 HB2 ASP 111 HB2 ASP 111 39.823 -8.930 1.714 796 HB3 ASP 111 HB1 ASP 111 39.099 -8.569 0.161 797 H TRP 112 HN TRP 112 38.546 -6.418 -0.150 798 HA TRP 112 HA TRP 112 38.880 -6.321 -2.922 799 HB2 TRP 112 HB2 TRP 112 36.729 -6.309 -1.634 800 HB3 TRP 112 HB1 TRP 112 37.047 -4.628 -1.233 801 HD1 TRP 112 HD1 TRP 112 35.997 -6.846 -4.161 802 HE1 TRP 112 HE1 TRP 112 35.098 -5.344 -6.052 803 HE3 TRP 112 HE3 TRP 112 37.230 -2.283 -2.228 804 HZ2 TRP 112 HZ2 TRP 112 34.926 -2.592 -6.635 805 HZ3 TRP 112 HZ3 TRP 112 36.660 -0.265 -3.512 806 HH2 TRP 112 HH2 TRP 112 35.534 -0.418 -5.670 807 H ILE 113 HN ILE 113 39.086 -3.807 -0.461 808 HA ILE 113 HA ILE 113 39.751 -1.692 -2.178 809 HB ILE 113 HB ILE 113 40.351 -2.058 0.765 810 HG12 ILE 113 HG12 ILE 113 38.081 -0.676 -0.698 811 HG13 ILE 113 HG11 ILE 113 37.954 -2.117 0.300 812 HG21 ILE 113 HG21 ILE 113 40.404 0.441 -0.933 813 HG22 ILE 113 HG22 ILE 113 41.796 -0.362 -0.217 814 HG23 ILE 113 HG23 ILE 113 40.589 0.388 0.819 815 HD11 ILE 113 HD11 ILE 113 39.014 0.347 1.546 816 HD12 ILE 113 HD12 ILE 113 38.032 -0.955 2.230 817 HD13 ILE 113 HD13 ILE 113 37.295 0.254 1.182 818 H PHE 114 HN PHE 114 41.744 -3.973 -0.351 819 HA PHE 114 HA PHE 114 44.291 -2.986 -0.993 820 HB2 PHE 114 HB2 PHE 114 43.166 -5.601 -0.116 821 HB3 PHE 114 HB1 PHE 114 44.804 -5.602 -0.737 822 HD1 PHE 114 HD1 PHE 114 45.847 -3.053 0.296 823 HD2 PHE 114 HD2 PHE 114 43.359 -5.959 2.157 824 HE1 PHE 114 HE1 PHE 114 46.664 -2.334 2.503 825 HE2 PHE 114 HE2 PHE 114 44.171 -5.247 4.366 826 HZ PHE 114 HZ PHE 114 45.840 -3.429 4.537 827 H SER 115 HN SER 115 42.088 -5.053 -2.711 828 HA SER 115 HA SER 115 43.982 -5.736 -4.776 829 HB2 SER 115 HB2 SER 115 41.011 -6.196 -4.520 830 HB3 SER 115 HB1 SER 115 42.026 -6.863 -5.796 831 HG SER 115 HG SER 115 42.031 -7.431 -3.026 832 H HIS 116 HN HIS 116 42.796 -2.954 -4.090 833 HA HIS 116 HA HIS 116 42.511 -2.137 -6.903 834 HB2 HIS 116 HB2 HIS 116 40.280 -2.174 -5.779 835 HB3 HIS 116 HB1 HIS 116 40.888 -1.039 -4.581 836 HD1 HIS 116 HD1 HIS 116 40.381 -1.204 -8.346 837 HD2 HIS 116 HD2 HIS 116 40.481 1.557 -5.234 838 HE1 HIS 116 HE1 HIS 116 39.687 0.994 -9.363 839 HE2 HIS 116 HE2 HIS 116 39.617 2.620 -7.433 840 HA PRO 117 HA PRO 117 46.148 -0.169 -4.686 841 HB2 PRO 117 HB2 PRO 117 47.346 0.185 -7.183 842 HB3 PRO 117 HB1 PRO 117 47.671 -1.141 -6.066 843 HG2 PRO 117 HG2 PRO 117 45.786 -1.031 -8.400 844 HG3 PRO 117 HG1 PRO 117 46.891 -2.341 -7.906 845 HD2 PRO 117 HD2 PRO 117 44.329 -2.562 -7.339 846 HD3 PRO 117 HD1 PRO 117 45.522 -2.941 -6.079 847 H GLU 118 HN GLU 118 45.235 0.774 -7.940 848 HA GLU 118 HA GLU 118 43.999 3.187 -7.402 849 HB2 GLU 118 HB2 GLU 118 45.870 4.687 -8.256 850 HB3 GLU 118 HB1 GLU 118 45.977 4.146 -6.591 851 HG2 GLU 118 HG2 GLU 118 47.526 2.361 -7.358 852 HG3 GLU 118 HG1 GLU 118 47.509 3.103 -8.957 853 H PHE 119 HN PHE 119 46.372 1.791 -9.645 854 HA PHE 119 HA PHE 119 44.554 2.505 -11.825 855 HB2 PHE 119 HB2 PHE 119 46.943 3.529 -11.671 856 HB3 PHE 119 HB1 PHE 119 47.473 1.951 -12.238 857 HD1 PHE 119 HD1 PHE 119 45.440 4.911 -13.114 858 HD2 PHE 119 HD2 PHE 119 47.277 1.331 -14.500 859 HE1 PHE 119 HE1 PHE 119 45.004 5.589 -15.435 860 HE2 PHE 119 HE2 PHE 119 46.844 2.007 -16.825 861 HZ PHE 119 HZ PHE 119 45.719 4.183 -17.285 862 H GLU 120 HN GLU 120 45.249 0.051 -10.010 863 HA GLU 120 HA GLU 120 44.964 -2.183 -10.098 864 HB2 GLU 120 HB2 GLU 120 43.628 -1.621 -12.732 865 HB3 GLU 120 HB1 GLU 120 43.362 -3.017 -11.690 866 HG2 GLU 120 HG2 GLU 120 42.850 -0.198 -10.867 867 HG3 GLU 120 HG1 GLU 120 41.604 -1.240 -11.555 868 H GLU 121 HN GLU 121 45.049 -4.123 -12.013 869 HA GLU 121 HA GLU 121 47.095 -3.528 -13.970 870 HB2 GLU 121 HB2 GLU 121 48.432 -5.489 -13.455 871 HB3 GLU 121 HB1 GLU 121 48.431 -4.373 -12.103 872 HG2 GLU 121 HG2 GLU 121 46.644 -6.776 -12.245 873 HG3 GLU 121 HG1 GLU 121 48.266 -6.830 -11.560 874 H ASP 122 HN ASP 122 47.253 -5.156 -15.629 875 HA ASP 122 HA ASP 122 44.784 -6.734 -15.827 876 HB2 ASP 122 HB2 ASP 122 44.758 -6.298 -18.241 877 HB3 ASP 122 HB1 ASP 122 44.695 -4.797 -17.327 878 H SER 123 HN SER 123 47.164 -7.698 -14.740 879 HA SER 123 HA SER 123 48.631 -9.223 -16.653 880 HB2 SER 123 HB2 SER 123 49.443 -10.415 -14.567 881 HB3 SER 123 HB1 SER 123 49.731 -8.677 -14.617 882 HG SER 123 HG SER 123 47.685 -10.057 -13.195 883 H ASP 124 HN ASP 124 45.629 -9.598 -15.072 884 HA ASP 124 HA ASP 124 45.097 -12.086 -16.389 885 HB2 ASP 124 HB2 ASP 124 44.532 -13.318 -14.315 886 HB3 ASP 124 HB1 ASP 124 46.250 -12.996 -14.482 887 H PHE 125 HN PHE 125 42.958 -12.339 -16.747 888 HA PHE 125 HA PHE 125 41.133 -10.485 -15.358 889 HB2 PHE 125 HB2 PHE 125 40.986 -11.576 -18.176 890 HB3 PHE 125 HB1 PHE 125 39.689 -10.673 -17.403 891 HD1 PHE 125 HD2 PHE 125 40.179 -8.298 -16.651 892 HD2 PHE 125 HD1 PHE 125 42.720 -10.481 -19.273 893 HE1 PHE 125 HE2 PHE 125 41.211 -6.191 -17.402 894 HE2 PHE 125 HE1 PHE 125 43.754 -8.383 -20.026 895 HZ PHE 125 HZ PHE 125 42.952 -6.228 -19.139 896 H VAL 126 HN VAL 126 42.033 -13.625 -15.529 897 HA VAL 126 HA VAL 126 39.307 -14.641 -15.135 898 HB VAL 126 HB VAL 126 40.312 -16.914 -15.652 899 HG11 VAL 126 HG11 VAL 126 40.341 -14.835 -17.837 900 HG12 VAL 126 HG12 VAL 126 38.917 -15.682 -17.235 901 HG13 VAL 126 HG13 VAL 126 40.188 -16.576 -18.068 902 HG21 VAL 126 HG21 VAL 126 42.373 -16.943 -16.982 903 HG22 VAL 126 HG22 VAL 126 42.668 -16.349 -15.348 904 HG23 VAL 126 HG23 VAL 126 42.580 -15.215 -16.696 Start of MODEL 11 1 H1 ASP 1 HT1 ASP 1 -38.007 14.236 2.058 2 H2 ASP 1 HT2 ASP 1 -39.340 15.213 1.684 3 H3 ASP 1 HT3 ASP 1 -38.980 13.859 0.723 4 HA ASP 1 HA ASP 1 -39.830 13.817 3.561 5 HB2 ASP 1 HB2 ASP 1 -41.638 14.382 1.946 6 HB3 ASP 1 HB1 ASP 1 -41.298 12.886 1.080 7 H ILE 2 HN ILE 2 -39.634 11.746 0.671 8 HA ILE 2 HA ILE 2 -39.203 9.367 2.106 9 HB ILE 2 HB ILE 2 -38.907 10.169 -0.772 10 HG12 ILE 2 HG12 ILE 2 -40.570 8.252 -1.004 11 HG13 ILE 2 HG11 ILE 2 -40.660 8.245 0.752 12 HG21 ILE 2 HG21 ILE 2 -38.340 7.816 -1.326 13 HG22 ILE 2 HG22 ILE 2 -38.055 7.540 0.391 14 HG23 ILE 2 HG23 ILE 2 -37.054 8.689 -0.490 15 HD11 ILE 2 HD11 ILE 2 -42.501 9.486 -0.080 16 HD12 ILE 2 HD12 ILE 2 -41.456 10.458 -1.114 17 HD13 ILE 2 HD13 ILE 2 -41.373 10.635 0.640 18 H ASP 3 HN ASP 3 -37.450 8.756 3.157 19 HA ASP 3 HA ASP 3 -34.964 10.113 2.981 20 HB2 ASP 3 HB2 ASP 3 -35.753 7.509 4.292 21 HB3 ASP 3 HB1 ASP 3 -34.131 8.182 4.392 22 H GLU 4 HN GLU 4 -34.570 9.979 0.710 23 HA GLU 4 HA GLU 4 -34.070 7.486 -0.569 24 HB2 GLU 4 HB2 GLU 4 -33.223 10.289 -1.300 25 HB3 GLU 4 HB1 GLU 4 -33.021 8.878 -2.334 26 HG2 GLU 4 HG2 GLU 4 -35.479 8.530 -2.217 27 HG3 GLU 4 HG1 GLU 4 -35.601 10.076 -1.374 28 H SER 5 HN SER 5 -32.307 9.336 1.660 29 HA SER 5 HA SER 5 -29.689 8.564 1.039 30 HB2 SER 5 HB2 SER 5 -30.511 10.168 2.876 31 HB3 SER 5 HB1 SER 5 -30.781 8.724 3.850 32 HG SER 5 HG SER 5 -28.292 9.268 2.607 33 H SER 6 HN SER 6 -32.400 6.832 2.364 34 HA SER 6 HA SER 6 -31.002 4.577 3.357 35 HB2 SER 6 HB2 SER 6 -33.819 4.492 2.298 36 HB3 SER 6 HB1 SER 6 -33.125 3.601 3.654 37 HG SER 6 HG SER 6 -34.146 6.169 3.548 38 H VAL 7 HN VAL 7 -32.732 5.152 0.272 39 HA VAL 7 HA VAL 7 -32.184 2.587 -0.755 40 HB VAL 7 HB VAL 7 -33.941 3.702 -1.851 41 HG11 VAL 7 HG11 VAL 7 -32.040 5.973 -2.348 42 HG12 VAL 7 HG12 VAL 7 -33.522 5.998 -1.387 43 HG13 VAL 7 HG13 VAL 7 -33.605 5.816 -3.138 44 HG21 VAL 7 HG21 VAL 7 -33.334 3.578 -4.156 45 HG22 VAL 7 HG22 VAL 7 -32.382 2.368 -3.278 46 HG23 VAL 7 HG23 VAL 7 -31.641 3.893 -3.775 47 H MET 8 HN MET 8 -30.537 5.678 -1.163 48 HA MET 8 HA MET 8 -28.586 4.633 -2.926 49 HB2 MET 8 HB2 MET 8 -28.805 7.182 -1.375 50 HB3 MET 8 HB1 MET 8 -27.329 6.787 -2.250 51 HG2 MET 8 HG2 MET 8 -28.545 6.631 -4.316 52 HG3 MET 8 HG1 MET 8 -30.073 6.886 -3.480 53 HE1 MET 8 HE1 MET 8 -30.767 9.188 -2.358 54 HE2 MET 8 HE2 MET 8 -29.739 10.619 -2.329 55 HE3 MET 8 HE3 MET 8 -29.290 9.191 -1.396 56 H GLN 9 HN GLN 9 -28.791 4.722 0.576 57 HA GLN 9 HA GLN 9 -26.043 4.134 1.002 58 HB2 GLN 9 HB2 GLN 9 -26.534 3.934 3.239 59 HB3 GLN 9 HB1 GLN 9 -27.916 4.879 2.713 60 HG2 GLN 9 HG2 GLN 9 -29.252 2.821 2.587 61 HG3 GLN 9 HG1 GLN 9 -27.862 1.906 3.174 62 HE21 GLN 9 HE21 GLN 9 -28.882 1.201 5.020 63 HE22 GLN 9 HE22 GLN 9 -29.280 2.254 6.344 64 H LEU 10 HN LEU 10 -28.901 2.148 0.401 65 HA LEU 10 HA LEU 10 -27.595 -0.375 0.620 66 HB2 LEU 10 HB2 LEU 10 -29.831 0.231 -1.300 67 HB3 LEU 10 HB1 LEU 10 -29.441 -1.306 -0.564 68 HG LEU 10 HG LEU 10 -30.717 1.079 0.747 69 HD11 LEU 10 HD11 LEU 10 -31.714 -1.715 0.270 70 HD12 LEU 10 HD12 LEU 10 -32.129 -0.302 -0.701 71 HD13 LEU 10 HD13 LEU 10 -32.613 -0.381 0.995 72 HD21 LEU 10 HD21 LEU 10 -30.851 -0.296 2.772 73 HD22 LEU 10 HD22 LEU 10 -29.182 0.025 2.319 74 HD23 LEU 10 HD23 LEU 10 -29.895 -1.548 1.982 75 H ALA 11 HN ALA 11 -28.181 1.890 -1.975 76 HA ALA 11 HA ALA 11 -27.245 0.349 -4.117 77 HB1 ALA 11 HB1 ALA 11 -27.009 3.323 -4.146 78 HB2 ALA 11 HB2 ALA 11 -28.608 2.588 -4.023 79 HB3 ALA 11 HB3 ALA 11 -27.569 2.228 -5.411 80 H GLU 12 HN GLU 12 -25.584 2.568 -1.946 81 HA GLU 12 HA GLU 12 -23.117 2.640 -3.308 82 HB2 GLU 12 HB2 GLU 12 -23.795 3.089 -0.421 83 HB3 GLU 12 HB1 GLU 12 -22.181 3.322 -1.068 84 HG2 GLU 12 HG2 GLU 12 -23.050 5.031 -2.588 85 HG3 GLU 12 HG1 GLU 12 -24.666 4.793 -1.921 86 H MET 13 HN MET 13 -24.515 0.167 -1.343 87 HA MET 13 HA MET 13 -21.858 -1.068 -1.044 88 HB2 MET 13 HB2 MET 13 -22.613 -2.118 0.996 89 HB3 MET 13 HB1 MET 13 -22.848 -0.378 1.101 90 HG2 MET 13 HG2 MET 13 -25.213 -0.648 0.625 91 HG3 MET 13 HG1 MET 13 -24.983 -2.383 0.438 92 HE1 MET 13 HE1 MET 13 -25.013 0.646 2.930 93 HE2 MET 13 HE2 MET 13 -23.367 0.034 3.100 94 HE3 MET 13 HE3 MET 13 -24.508 -0.122 4.437 95 H GLY 14 HN GLY 14 -24.666 -1.375 -2.762 96 HA2 GLY 14 HA2 GLY 14 -24.142 -4.196 -3.250 97 HA3 GLY 14 HA1 GLY 14 -25.710 -3.825 -2.560 98 H PHE 15 HN PHE 15 -27.293 -2.995 -3.821 99 HA PHE 15 HA PHE 15 -26.705 -2.871 -6.706 100 HB2 PHE 15 HB2 PHE 15 -29.035 -4.238 -5.325 101 HB3 PHE 15 HB1 PHE 15 -28.896 -4.024 -7.065 102 HD1 PHE 15 HD2 PHE 15 -26.973 -5.135 -8.264 103 HD2 PHE 15 HD1 PHE 15 -28.033 -6.053 -4.244 104 HE1 PHE 15 HE2 PHE 15 -25.729 -7.252 -8.424 105 HE2 PHE 15 HE1 PHE 15 -26.787 -8.172 -4.396 106 HZ PHE 15 HZ PHE 15 -25.668 -8.793 -6.488 107 HA PRO 16 HA PRO 16 -29.299 0.772 -6.762 108 HB2 PRO 16 HB2 PRO 16 -30.651 0.534 -9.088 109 HB3 PRO 16 HB1 PRO 16 -28.915 0.877 -9.043 110 HG2 PRO 16 HG2 PRO 16 -30.317 -1.749 -9.451 111 HG3 PRO 16 HG1 PRO 16 -28.964 -1.053 -10.372 112 HD2 PRO 16 HD2 PRO 16 -28.580 -2.903 -8.448 113 HD3 PRO 16 HD1 PRO 16 -27.411 -1.603 -8.742 114 H LEU 17 HN LEU 17 -30.543 -0.050 -4.900 115 HA LEU 17 HA LEU 17 -32.917 -1.567 -5.390 116 HB2 LEU 17 HB2 LEU 17 -31.768 -0.275 -2.937 117 HB3 LEU 17 HB1 LEU 17 -33.443 -0.789 -2.947 118 HG LEU 17 HG LEU 17 -32.202 -2.537 -1.951 119 HD11 LEU 17 HD11 LEU 17 -33.926 -3.293 -3.467 120 HD12 LEU 17 HD12 LEU 17 -32.562 -4.413 -3.481 121 HD13 LEU 17 HD13 LEU 17 -32.784 -3.274 -4.811 122 HD21 LEU 17 HD21 LEU 17 -30.298 -3.631 -3.015 123 HD22 LEU 17 HD22 LEU 17 -29.978 -1.922 -2.718 124 HD23 LEU 17 HD23 LEU 17 -30.375 -2.476 -4.344 125 H GLU 18 HN GLU 18 -33.474 0.214 -7.133 126 HA GLU 18 HA GLU 18 -34.873 2.487 -6.370 127 HB2 GLU 18 HB2 GLU 18 -34.427 1.214 -8.719 128 HB3 GLU 18 HB1 GLU 18 -36.127 0.828 -8.467 129 HG2 GLU 18 HG2 GLU 18 -35.588 3.619 -7.947 130 HG3 GLU 18 HG1 GLU 18 -35.083 3.134 -9.569 131 H ALA 19 HN ALA 19 -35.646 -0.875 -6.064 132 HA ALA 19 HA ALA 19 -38.329 -0.778 -5.319 133 HB1 ALA 19 HB1 ALA 19 -36.344 -2.561 -3.946 134 HB2 ALA 19 HB2 ALA 19 -36.766 -2.797 -5.636 135 HB3 ALA 19 HB3 ALA 19 -38.016 -2.904 -4.399 136 H CYS 20 HN CYS 20 -35.431 0.095 -3.631 137 HA CYS 20 HA CYS 20 -36.584 0.337 -1.014 138 HB2 CYS 20 HB2 CYS 20 -34.083 0.075 -1.503 139 HB3 CYS 20 HB1 CYS 20 -34.108 1.759 -1.998 140 HG CYS 20 HG CYS 20 -35.476 2.085 0.771 141 H ARG 21 HN ARG 21 -35.877 2.501 -3.691 142 HA ARG 21 HA ARG 21 -36.632 4.954 -2.668 143 HB2 ARG 21 HB2 ARG 21 -36.066 3.954 -5.158 144 HB3 ARG 21 HB1 ARG 21 -37.775 4.312 -5.317 145 HG2 ARG 21 HG2 ARG 21 -35.726 6.309 -4.399 146 HG3 ARG 21 HG1 ARG 21 -36.238 6.102 -6.080 147 HD2 ARG 21 HD2 ARG 21 -38.491 6.716 -5.526 148 HD3 ARG 21 HD1 ARG 21 -38.118 6.728 -3.801 149 HE ARG 21 HE ARG 21 -36.411 8.572 -4.701 150 HH11 ARG 21 HH11 ARG 21 -39.817 8.099 -5.425 151 HH12 ARG 21 HH12 ARG 21 -40.119 9.791 -5.669 152 HH21 ARG 21 HH21 ARG 21 -36.831 10.791 -5.011 153 HH22 ARG 21 HH22 ARG 21 -38.433 11.310 -5.445 154 H LYS 22 HN LYS 22 -38.708 2.521 -4.175 155 HA LYS 22 HA LYS 22 -41.166 3.731 -3.443 156 HB2 LYS 22 HB2 LYS 22 -40.399 0.989 -4.418 157 HB3 LYS 22 HB1 LYS 22 -42.064 1.415 -4.051 158 HG2 LYS 22 HG2 LYS 22 -42.186 2.948 -5.797 159 HG3 LYS 22 HG1 LYS 22 -40.432 3.069 -5.936 160 HD2 LYS 22 HD2 LYS 22 -41.779 0.451 -6.444 161 HD3 LYS 22 HD1 LYS 22 -41.806 1.702 -7.689 162 HE2 LYS 22 HE2 LYS 22 -39.357 1.812 -7.621 163 HE3 LYS 22 HE1 LYS 22 -39.330 0.544 -6.389 164 HZ1 LYS 22 HZ1 LYS 22 -40.133 -1.028 -7.922 165 HZ2 LYS 22 HZ2 LYS 22 -38.945 -0.166 -8.771 166 HZ3 LYS 22 HZ3 LYS 22 -40.586 0.159 -9.047 167 H ALA 23 HN ALA 23 -39.100 1.320 -1.945 168 HA ALA 23 HA ALA 23 -40.857 0.351 0.002 169 HB1 ALA 23 HB1 ALA 23 -38.906 -0.425 1.176 170 HB2 ALA 23 HB2 ALA 23 -37.879 0.684 0.264 171 HB3 ALA 23 HB3 ALA 23 -38.676 -0.659 -0.558 172 H VAL 24 HN VAL 24 -38.580 3.062 0.113 173 HA VAL 24 HA VAL 24 -39.102 3.780 2.792 174 HB VAL 24 HB VAL 24 -38.137 5.507 0.497 175 HG11 VAL 24 HG11 VAL 24 -37.309 7.039 2.187 176 HG12 VAL 24 HG12 VAL 24 -37.997 6.021 3.459 177 HG13 VAL 24 HG13 VAL 24 -39.060 6.849 2.325 178 HG21 VAL 24 HG21 VAL 24 -35.910 5.147 1.482 179 HG22 VAL 24 HG22 VAL 24 -36.648 3.640 0.937 180 HG23 VAL 24 HG23 VAL 24 -36.622 4.039 2.656 181 H TYR 25 HN TYR 25 -40.506 4.850 -0.283 182 HA TYR 25 HA TYR 25 -42.375 6.659 0.788 183 HB2 TYR 25 HB2 TYR 25 -41.874 6.540 -1.603 184 HB3 TYR 25 HB1 TYR 25 -42.571 4.927 -1.686 185 HD1 TYR 25 HD2 TYR 25 -43.402 8.490 -1.028 186 HD2 TYR 25 HD1 TYR 25 -44.872 4.638 -2.076 187 HE1 TYR 25 HE2 TYR 25 -45.599 9.471 -1.532 188 HE2 TYR 25 HE1 TYR 25 -47.071 5.609 -2.580 189 HH TYR 25 HH TYR 25 -48.388 7.570 -1.980 190 H PHE 26 HN PHE 26 -42.543 3.169 0.249 191 HA PHE 26 HA PHE 26 -45.238 2.846 1.055 192 HB2 PHE 26 HB2 PHE 26 -44.067 1.184 -0.313 193 HB3 PHE 26 HB1 PHE 26 -42.959 0.853 1.013 194 HD1 PHE 26 HD2 PHE 26 -46.517 0.661 0.003 195 HD2 PHE 26 HD1 PHE 26 -43.489 -0.732 2.648 196 HE1 PHE 26 HE2 PHE 26 -48.048 -1.070 0.834 197 HE2 PHE 26 HE1 PHE 26 -45.017 -2.472 3.484 198 HZ PHE 26 HZ PHE 26 -47.298 -2.642 2.575 199 H THR 27 HN THR 27 -42.154 2.521 2.796 200 HA THR 27 HA THR 27 -43.286 1.590 5.213 201 HB THR 27 HB THR 27 -41.120 2.339 6.276 202 HG1 THR 27 HG1 THR 27 -40.252 2.800 3.619 203 HG21 THR 27 HG21 THR 27 -40.783 0.647 3.804 204 HG22 THR 27 HG22 THR 27 -41.510 0.070 5.303 205 HG23 THR 27 HG23 THR 27 -39.824 0.587 5.282 206 H GLY 28 HN GLY 28 -43.194 4.672 3.783 207 HA2 GLY 28 HA2 GLY 28 -44.314 6.587 4.458 208 HA3 GLY 28 HA1 GLY 28 -44.642 5.817 6.005 209 H ASN 29 HN ASN 29 -41.639 6.590 4.269 210 HA ASN 29 HA ASN 29 -39.634 7.331 5.041 211 HB2 ASN 29 HB2 ASN 29 -39.665 9.662 5.919 212 HB3 ASN 29 HB1 ASN 29 -40.584 9.443 4.441 213 HD21 ASN 29 HD21 ASN 29 -42.684 10.006 4.403 214 HD22 ASN 29 HD22 ASN 29 -43.549 10.632 5.766 215 H MET 30 HN MET 30 -40.416 5.373 6.672 216 HA MET 30 HA MET 30 -40.508 6.017 9.414 217 HB2 MET 30 HB2 MET 30 -40.181 3.577 7.807 218 HB3 MET 30 HB1 MET 30 -39.424 3.515 9.392 219 HG2 MET 30 HG2 MET 30 -42.312 4.147 8.835 220 HG3 MET 30 HG1 MET 30 -41.678 2.621 9.455 221 HE1 MET 30 HE1 MET 30 -44.020 4.082 10.943 222 HE2 MET 30 HE2 MET 30 -43.474 3.989 12.617 223 HE3 MET 30 HE3 MET 30 -43.254 2.611 11.540 224 H GLY 31 HN GLY 31 -37.799 4.578 7.587 225 HA2 GLY 31 HA2 GLY 31 -35.861 6.322 8.670 226 HA3 GLY 31 HA1 GLY 31 -35.898 4.829 9.601 227 H ALA 32 HN ALA 32 -33.622 5.506 8.310 228 HA ALA 32 HA ALA 32 -33.389 4.594 5.664 229 HB1 ALA 32 HB1 ALA 32 -31.795 6.107 6.688 230 HB2 ALA 32 HB2 ALA 32 -30.986 4.647 6.141 231 HB3 ALA 32 HB3 ALA 32 -31.330 4.865 7.849 232 H GLU 33 HN GLU 33 -32.778 3.064 8.788 233 HA GLU 33 HA GLU 33 -31.838 0.626 7.622 234 HB2 GLU 33 HB2 GLU 33 -32.735 1.076 10.470 235 HB3 GLU 33 HB1 GLU 33 -31.637 -0.163 9.879 236 HG2 GLU 33 HG2 GLU 33 -31.097 2.798 9.902 237 HG3 GLU 33 HG1 GLU 33 -30.462 1.627 11.051 238 H VAL 34 HN VAL 34 -34.895 1.886 8.730 239 HA VAL 34 HA VAL 34 -36.371 -0.475 8.967 240 HB VAL 34 HB VAL 34 -37.312 2.218 7.948 241 HG11 VAL 34 HG11 VAL 34 -38.894 -0.164 8.916 242 HG12 VAL 34 HG12 VAL 34 -38.897 0.518 7.288 243 HG13 VAL 34 HG13 VAL 34 -39.563 1.443 8.635 244 HG21 VAL 34 HG21 VAL 34 -38.102 2.560 10.234 245 HG22 VAL 34 HG22 VAL 34 -36.361 2.299 10.198 246 HG23 VAL 34 HG23 VAL 34 -37.434 0.998 10.705 247 H ALA 35 HN ALA 35 -35.679 1.509 6.100 248 HA ALA 35 HA ALA 35 -37.122 -0.270 4.362 249 HB1 ALA 35 HB1 ALA 35 -36.858 2.164 3.905 250 HB2 ALA 35 HB2 ALA 35 -36.435 1.101 2.565 251 HB3 ALA 35 HB3 ALA 35 -35.161 1.855 3.528 252 H PHE 36 HN PHE 36 -33.758 0.207 5.303 253 HA PHE 36 HA PHE 36 -32.466 -1.597 3.651 254 HB2 PHE 36 HB2 PHE 36 -31.159 -0.396 5.240 255 HB3 PHE 36 HB1 PHE 36 -32.109 -0.999 6.594 256 HD1 PHE 36 HD2 PHE 36 -29.820 -2.129 3.901 257 HD2 PHE 36 HD1 PHE 36 -31.360 -2.840 7.800 258 HE1 PHE 36 HE2 PHE 36 -28.186 -3.938 4.208 259 HE2 PHE 36 HE1 PHE 36 -29.727 -4.657 8.118 260 HZ PHE 36 HZ PHE 36 -28.156 -5.214 6.367 261 H ASN 37 HN ASN 37 -34.296 -2.236 6.624 262 HA ASN 37 HA ASN 37 -34.138 -5.032 6.620 263 HB2 ASN 37 HB2 ASN 37 -36.096 -3.059 7.747 264 HB3 ASN 37 HB1 ASN 37 -36.451 -4.778 7.810 265 HD21 ASN 37 HD21 ASN 37 -34.346 -2.248 8.975 266 HD22 ASN 37 HD22 ASN 37 -33.668 -3.161 10.276 267 H TRP 38 HN TRP 38 -36.538 -2.849 5.167 268 HA TRP 38 HA TRP 38 -38.318 -4.807 4.280 269 HB2 TRP 38 HB2 TRP 38 -38.669 -2.271 4.314 270 HB3 TRP 38 HB1 TRP 38 -37.776 -2.219 2.804 271 HD1 TRP 38 HD1 TRP 38 -41.146 -3.231 4.241 272 HE1 TRP 38 HE1 TRP 38 -42.771 -3.748 2.308 273 HE3 TRP 38 HE3 TRP 38 -37.843 -3.089 0.332 274 HZ2 TRP 38 HZ2 TRP 38 -42.665 -4.047 -0.485 275 HZ3 TRP 38 HZ3 TRP 38 -38.693 -3.506 -1.940 276 HH2 TRP 38 HH2 TRP 38 -41.056 -3.976 -2.337 277 H ILE 39 HN ILE 39 -35.374 -3.553 2.862 278 HA ILE 39 HA ILE 39 -35.728 -4.853 0.350 279 HB ILE 39 HB ILE 39 -33.792 -3.037 1.539 280 HG12 ILE 39 HG12 ILE 39 -33.644 -2.303 -0.845 281 HG13 ILE 39 HG11 ILE 39 -34.691 -3.658 -1.273 282 HG21 ILE 39 HG21 ILE 39 -32.724 -5.157 -0.325 283 HG22 ILE 39 HG22 ILE 39 -32.215 -4.860 1.343 284 HG23 ILE 39 HG23 ILE 39 -31.891 -3.659 0.087 285 HD11 ILE 39 HD11 ILE 39 -35.905 -1.541 -1.098 286 HD12 ILE 39 HD12 ILE 39 -35.441 -1.427 0.600 287 HD13 ILE 39 HD13 ILE 39 -36.480 -2.745 0.054 288 H ILE 40 HN ILE 40 -33.726 -5.580 3.217 289 HA ILE 40 HA ILE 40 -32.548 -7.840 1.952 290 HB ILE 40 HB ILE 40 -31.732 -8.439 4.216 291 HG12 ILE 40 HG12 ILE 40 -32.002 -6.457 5.901 292 HG13 ILE 40 HG11 ILE 40 -33.469 -6.120 4.990 293 HG21 ILE 40 HG21 ILE 40 -30.491 -6.122 4.435 294 HG22 ILE 40 HG22 ILE 40 -31.296 -5.812 2.903 295 HG23 ILE 40 HG23 ILE 40 -30.207 -7.188 3.064 296 HD11 ILE 40 HD11 ILE 40 -32.799 -8.601 6.541 297 HD12 ILE 40 HD12 ILE 40 -34.172 -8.475 5.441 298 HD13 ILE 40 HD13 ILE 40 -34.080 -7.429 6.864 299 H VAL 41 HN VAL 41 -35.497 -7.324 3.598 300 HA VAL 41 HA VAL 41 -36.120 -10.113 3.898 301 HB VAL 41 HB VAL 41 -37.881 -7.659 3.989 302 HG11 VAL 41 HG11 VAL 41 -38.599 -10.526 4.595 303 HG12 VAL 41 HG12 VAL 41 -39.202 -9.568 3.245 304 HG13 VAL 41 HG13 VAL 41 -39.627 -9.124 4.897 305 HG21 VAL 41 HG21 VAL 41 -36.282 -7.882 5.828 306 HG22 VAL 41 HG22 VAL 41 -36.901 -9.501 6.162 307 HG23 VAL 41 HG23 VAL 41 -37.943 -8.096 6.382 308 H HIS 42 HN HIS 42 -36.769 -7.584 1.472 309 HA HIS 42 HA HIS 42 -38.241 -9.598 -0.081 310 HB2 HIS 42 HB2 HIS 42 -38.321 -6.593 -0.140 311 HB3 HIS 42 HB1 HIS 42 -39.009 -7.572 -1.434 312 HD1 HIS 42 HD1 HIS 42 -40.952 -9.285 -0.668 313 HD2 HIS 42 HD2 HIS 42 -39.922 -6.301 2.055 314 HE1 HIS 42 HE1 HIS 42 -42.836 -9.194 1.000 315 HE2 HIS 42 HE2 HIS 42 -42.082 -7.544 2.751 316 H MET 43 HN MET 43 -35.228 -9.074 0.110 317 HA MET 43 HA MET 43 -34.400 -8.522 -2.536 318 HB2 MET 43 HB2 MET 43 -32.308 -9.692 -1.924 319 HB3 MET 43 HB1 MET 43 -32.787 -8.501 -0.722 320 HG2 MET 43 HG2 MET 43 -33.575 -10.216 0.752 321 HG3 MET 43 HG1 MET 43 -33.321 -11.453 -0.482 322 HE1 MET 43 HE1 MET 43 -31.952 -12.934 1.227 323 HE2 MET 43 HE2 MET 43 -32.225 -11.723 2.479 324 HE3 MET 43 HE3 MET 43 -30.595 -12.331 2.182 325 H GLU 44 HN GLU 44 -35.944 -11.162 -1.064 326 HA GLU 44 HA GLU 44 -35.177 -13.180 -2.951 327 HB2 GLU 44 HB2 GLU 44 -36.934 -14.510 -1.790 328 HB3 GLU 44 HB1 GLU 44 -35.717 -13.843 -0.711 329 HG2 GLU 44 HG2 GLU 44 -37.267 -12.002 -0.159 330 HG3 GLU 44 HG1 GLU 44 -38.492 -12.774 -1.163 331 H GLU 45 HN GLU 45 -36.993 -10.542 -3.436 332 HA GLU 45 HA GLU 45 -39.153 -11.756 -4.933 333 HB2 GLU 45 HB2 GLU 45 -38.218 -8.881 -4.988 334 HB3 GLU 45 HB1 GLU 45 -39.754 -9.495 -5.573 335 HG2 GLU 45 HG2 GLU 45 -38.846 -9.389 -2.707 336 HG3 GLU 45 HG1 GLU 45 -40.030 -8.337 -3.473 337 HA PRO 46 HA PRO 46 -36.769 -12.552 -8.553 338 HB2 PRO 46 HB2 PRO 46 -38.815 -12.506 -10.380 339 HB3 PRO 46 HB1 PRO 46 -38.464 -13.879 -9.320 340 HG2 PRO 46 HG2 PRO 46 -40.514 -11.722 -9.040 341 HG3 PRO 46 HG1 PRO 46 -40.655 -13.461 -8.699 342 HD2 PRO 46 HD2 PRO 46 -40.323 -11.641 -6.740 343 HD3 PRO 46 HD1 PRO 46 -39.615 -13.267 -6.647 344 H ASP 47 HN ASP 47 -39.148 -9.943 -8.719 345 HA ASP 47 HA ASP 47 -37.576 -8.690 -10.874 346 HB2 ASP 47 HB2 ASP 47 -39.719 -9.631 -11.604 347 HB3 ASP 47 HB1 ASP 47 -40.563 -8.687 -10.395 348 H PHE 48 HN PHE 48 -37.359 -8.353 -7.951 349 HA PHE 48 HA PHE 48 -38.690 -6.091 -6.994 350 HB2 PHE 48 HB2 PHE 48 -37.132 -6.093 -5.174 351 HB3 PHE 48 HB1 PHE 48 -37.466 -7.767 -5.595 352 HD1 PHE 48 HD2 PHE 48 -35.728 -8.721 -7.430 353 HD2 PHE 48 HD1 PHE 48 -34.971 -5.552 -4.702 354 HE1 PHE 48 HE2 PHE 48 -33.311 -9.132 -7.630 355 HE2 PHE 48 HE1 PHE 48 -32.552 -5.954 -4.896 356 HZ PHE 48 HZ PHE 48 -31.722 -7.752 -6.360 357 H ALA 49 HN ALA 49 -35.715 -6.352 -8.829 358 HA ALA 49 HA ALA 49 -35.765 -3.541 -9.437 359 HB1 ALA 49 HB1 ALA 49 -34.500 -3.422 -7.395 360 HB2 ALA 49 HB2 ALA 49 -33.380 -3.223 -8.743 361 HB3 ALA 49 HB3 ALA 49 -33.476 -4.766 -7.894 362 H GLU 50 HN GLU 50 -35.502 -3.557 -11.541 363 HA GLU 50 HA GLU 50 -34.522 -5.727 -13.033 364 HB2 GLU 50 HB2 GLU 50 -34.772 -2.835 -13.885 365 HB3 GLU 50 HB1 GLU 50 -34.641 -4.223 -14.958 366 HG2 GLU 50 HG2 GLU 50 -36.764 -5.090 -13.975 367 HG3 GLU 50 HG1 GLU 50 -36.914 -3.570 -13.101 368 HA PRO 51 HA PRO 51 -30.282 -4.782 -12.173 369 HB2 PRO 51 HB2 PRO 51 -29.410 -7.304 -12.839 370 HB3 PRO 51 HB1 PRO 51 -30.095 -6.848 -11.283 371 HG2 PRO 51 HG2 PRO 51 -31.212 -8.591 -13.272 372 HG3 PRO 51 HG1 PRO 51 -31.887 -8.154 -11.695 373 HD2 PRO 51 HD2 PRO 51 -32.532 -7.100 -14.368 374 HD3 PRO 51 HD1 PRO 51 -33.494 -7.063 -12.876 375 H LEU 52 HN LEU 52 -30.765 -3.548 -14.426 376 HA LEU 52 HA LEU 52 -28.637 -4.522 -16.217 377 HB2 LEU 52 HB2 LEU 52 -30.934 -4.624 -17.229 378 HB3 LEU 52 HB1 LEU 52 -31.021 -2.881 -17.076 379 HG LEU 52 HG LEU 52 -29.044 -2.687 -18.569 380 HD11 LEU 52 HD11 LEU 52 -29.410 -5.664 -18.883 381 HD12 LEU 52 HD12 LEU 52 -28.027 -4.852 -18.150 382 HD13 LEU 52 HD13 LEU 52 -28.356 -4.650 -19.869 383 HD21 LEU 52 HD21 LEU 52 -31.288 -2.459 -19.464 384 HD22 LEU 52 HD22 LEU 52 -31.400 -4.204 -19.679 385 HD23 LEU 52 HD23 LEU 52 -30.243 -3.272 -20.631 386 H THR 53 HN THR 53 -28.305 -2.950 -13.935 387 HA THR 53 HA THR 53 -26.784 -0.806 -14.968 388 HB THR 53 HB THR 53 -28.908 0.324 -15.206 389 HG1 THR 53 HG1 THR 53 -27.496 1.267 -12.913 390 HG21 THR 53 HG21 THR 53 -30.233 -0.973 -13.616 391 HG22 THR 53 HG22 THR 53 -30.395 0.757 -13.306 392 HG23 THR 53 HG23 THR 53 -29.362 -0.232 -12.272 393 H MET 54 HN MET 54 -25.956 -2.841 -13.525 394 HA MET 54 HA MET 54 -26.070 -2.366 -10.689 395 HB2 MET 54 HB2 MET 54 -25.847 -4.641 -11.563 396 HB3 MET 54 HB1 MET 54 -24.311 -4.220 -12.306 397 HG2 MET 54 HG2 MET 54 -23.357 -3.805 -10.090 398 HG3 MET 54 HG1 MET 54 -24.897 -4.244 -9.353 399 HE1 MET 54 HE1 MET 54 -23.195 -5.927 -12.488 400 HE2 MET 54 HE2 MET 54 -22.240 -7.192 -11.715 401 HE3 MET 54 HE3 MET 54 -21.832 -5.497 -11.454 402 HA PRO 55 HA PRO 55 -22.654 0.511 -10.901 403 HB2 PRO 55 HB2 PRO 55 -23.006 1.603 -8.492 404 HB3 PRO 55 HB1 PRO 55 -24.155 1.903 -9.802 405 HG2 PRO 55 HG2 PRO 55 -24.388 0.086 -7.449 406 HG3 PRO 55 HG1 PRO 55 -25.631 1.077 -8.230 407 HD2 PRO 55 HD2 PRO 55 -25.218 -1.657 -8.642 408 HD3 PRO 55 HD1 PRO 55 -26.163 -0.585 -9.691 409 H GLY 56 HN GLY 56 -20.697 0.934 -9.628 410 HA2 GLY 56 HA2 GLY 56 -19.655 -1.497 -8.413 411 HA3 GLY 56 HA1 GLY 56 -18.741 -0.041 -8.788 412 H TYR 57 HN TYR 57 -19.890 -1.881 -6.336 413 HA TYR 57 HA TYR 57 -20.875 0.071 -4.532 414 HB2 TYR 57 HB2 TYR 57 -20.650 -1.691 -2.816 415 HB3 TYR 57 HB1 TYR 57 -21.473 -2.265 -4.262 416 HD1 TYR 57 HD2 TYR 57 -20.132 -3.652 -5.927 417 HD2 TYR 57 HD1 TYR 57 -18.746 -2.786 -2.000 418 HE1 TYR 57 HE2 TYR 57 -18.557 -5.532 -6.075 419 HE2 TYR 57 HE1 TYR 57 -17.168 -4.667 -2.136 420 HH TYR 57 HH TYR 57 -17.032 -6.864 -3.448 421 H GLY 58 HN GLY 58 -19.910 1.122 -2.842 422 HA2 GLY 58 HA2 GLY 58 -17.091 1.671 -3.243 423 HA3 GLY 58 HA1 GLY 58 -18.188 2.547 -2.187 424 H GLY 59 HN GLY 59 -16.586 -0.603 -2.492 425 HA2 GLY 59 HA2 GLY 59 -15.599 -0.382 0.217 426 HA3 GLY 59 HA1 GLY 59 -16.801 -1.649 -0.008 427 H ALA 60 HN ALA 60 -13.786 -0.424 -1.427 428 HA ALA 60 HA ALA 60 -13.215 -3.116 -2.430 429 HB1 ALA 60 HB1 ALA 60 -11.459 -2.047 -3.765 430 HB2 ALA 60 HB2 ALA 60 -11.863 -0.491 -3.036 431 HB3 ALA 60 HB3 ALA 60 -13.042 -1.320 -4.053 432 H ALA 61 HN ALA 61 -11.405 -0.472 -0.867 433 HA ALA 61 HA ALA 61 -10.018 -2.453 0.785 434 HB1 ALA 61 HB1 ALA 61 -8.585 -2.074 -1.177 435 HB2 ALA 61 HB2 ALA 61 -7.841 -1.469 0.301 436 HB3 ALA 61 HB3 ALA 61 -8.582 -0.343 -0.832 437 H SER 62 HN SER 62 -9.282 -1.652 2.761 438 HA SER 62 HA SER 62 -10.555 0.824 3.592 439 HB2 SER 62 HB2 SER 62 -9.787 0.080 5.882 440 HB3 SER 62 HB1 SER 62 -10.877 -1.041 5.066 441 HG SER 62 HG SER 62 -8.049 -1.231 5.268 442 H ALA 63 HN ALA 63 -9.526 2.680 3.486 443 HA ALA 63 HA ALA 63 -6.609 2.721 3.925 444 HB1 ALA 63 HB1 ALA 63 -6.523 4.727 2.533 445 HB2 ALA 63 HB2 ALA 63 -8.264 4.628 2.274 446 HB3 ALA 63 HB3 ALA 63 -7.207 3.366 1.642 447 H GLY 64 HN GLY 64 -7.421 2.732 6.220 448 HA2 GLY 64 HA2 GLY 64 -7.886 5.534 7.050 449 HA3 GLY 64 HA1 GLY 64 -8.730 4.197 7.817 450 H ALA 65 HN ALA 65 -6.553 2.379 7.874 451 HA ALA 65 HA ALA 65 -4.898 3.659 9.938 452 HB1 ALA 65 HB1 ALA 65 -6.195 1.716 10.675 453 HB2 ALA 65 HB2 ALA 65 -4.462 1.407 10.768 454 HB3 ALA 65 HB3 ALA 65 -5.411 0.725 9.444 455 H SER 66 HN SER 66 -2.878 4.140 9.424 456 HA SER 66 HA SER 66 -1.766 3.244 6.927 457 HB2 SER 66 HB2 SER 66 -0.531 4.950 9.104 458 HB3 SER 66 HB1 SER 66 0.087 4.750 7.465 459 HG SER 66 HG SER 66 -2.111 5.557 6.832 460 H VAL 67 HN VAL 67 -1.566 1.009 7.269 461 HA VAL 67 HA VAL 67 0.048 -0.057 9.374 462 HB VAL 67 HB VAL 67 -0.760 -1.348 6.755 463 HG11 VAL 67 HG11 VAL 67 1.132 -2.463 7.817 464 HG12 VAL 67 HG12 VAL 67 -0.320 -3.464 7.878 465 HG13 VAL 67 HG13 VAL 67 0.216 -2.597 9.318 466 HG21 VAL 67 HG21 VAL 67 -2.076 -1.463 9.465 467 HG22 VAL 67 HG22 VAL 67 -2.550 -2.408 8.052 468 HG23 VAL 67 HG23 VAL 67 -2.704 -0.650 8.031 469 H PHE 68 HN PHE 68 0.514 0.134 5.856 470 HA PHE 68 HA PHE 68 2.366 0.213 4.541 471 HB2 PHE 68 HB2 PHE 68 2.401 2.460 5.731 472 HB3 PHE 68 HB1 PHE 68 3.627 1.780 6.794 473 HD1 PHE 68 HD1 PHE 68 2.871 2.724 3.317 474 HD2 PHE 68 HD2 PHE 68 5.882 1.571 6.091 475 HE1 PHE 68 HE1 PHE 68 4.601 3.345 1.686 476 HE2 PHE 68 HE2 PHE 68 7.621 2.190 4.461 477 HZ PHE 68 HZ PHE 68 6.982 3.075 2.256 478 H GLY 69 HN GLY 69 2.802 -2.017 4.670 479 HA2 GLY 69 HA2 GLY 69 4.349 -3.103 6.832 480 HA3 GLY 69 HA1 GLY 69 3.847 -3.952 5.381 481 H ALA 70 HN ALA 70 6.226 -1.701 6.684 482 HA ALA 70 HA ALA 70 7.990 -2.095 4.411 483 HB1 ALA 70 HB1 ALA 70 7.785 0.125 5.461 484 HB2 ALA 70 HB2 ALA 70 9.440 -0.486 5.498 485 HB3 ALA 70 HB3 ALA 70 8.447 -0.537 6.955 486 H SER 71 HN SER 71 7.690 -4.506 5.255 487 HA SER 71 HA SER 71 9.326 -5.333 7.424 488 HB2 SER 71 HB2 SER 71 8.430 -6.988 5.054 489 HB3 SER 71 HB1 SER 71 8.884 -7.574 6.657 490 HG SER 71 HG SER 71 6.490 -7.001 5.876 491 H GLY 72 HN GLY 72 9.846 -4.872 3.991 492 HA2 GLY 72 HA2 GLY 72 12.674 -5.638 4.351 493 HA3 GLY 72 HA1 GLY 72 11.819 -5.663 2.814 494 H LEU 73 HN LEU 73 10.826 -3.460 2.249 495 HA LEU 73 HA LEU 73 11.206 -1.364 1.475 496 HB2 LEU 73 HB2 LEU 73 11.122 -1.163 4.147 497 HB3 LEU 73 HB1 LEU 73 12.754 -0.583 3.885 498 HG LEU 73 HG LEU 73 11.190 1.273 4.029 499 HD11 LEU 73 HD11 LEU 73 12.095 0.975 1.176 500 HD12 LEU 73 HD12 LEU 73 13.154 1.417 2.512 501 HD13 LEU 73 HD13 LEU 73 11.817 2.474 2.064 502 HD21 LEU 73 HD21 LEU 73 9.462 1.590 2.312 503 HD22 LEU 73 HD22 LEU 73 9.174 0.157 3.300 504 HD23 LEU 73 HD23 LEU 73 9.826 -0.012 1.670 505 H ASP 74 HN ASP 74 14.116 -1.045 3.374 506 HA ASP 74 HA ASP 74 15.830 -1.648 1.091 507 HB2 ASP 74 HB2 ASP 74 15.342 1.065 2.181 508 HB3 ASP 74 HB1 ASP 74 17.027 0.641 1.896 509 H ASN 75 HN ASN 75 18.070 -1.775 1.664 510 HA ASN 75 HA ASN 75 18.658 -1.878 4.533 511 HB2 ASN 75 HB2 ASN 75 18.011 -4.192 3.629 512 HB3 ASN 75 HB1 ASN 75 19.497 -4.117 2.688 513 HD21 ASN 75 HD21 ASN 75 20.436 -5.837 3.736 514 HD22 ASN 75 HD22 ASN 75 20.991 -5.753 5.371 515 H GLN 76 HN GLN 76 19.294 -0.006 2.485 516 HA GLN 76 HA GLN 76 21.975 -0.387 1.563 517 HB2 GLN 76 HB2 GLN 76 20.289 1.092 0.438 518 HB3 GLN 76 HB1 GLN 76 20.382 2.179 1.815 519 HG2 GLN 76 HG2 GLN 76 22.869 2.348 1.319 520 HG3 GLN 76 HG1 GLN 76 22.499 1.563 -0.214 521 HE21 GLN 76 HE21 GLN 76 22.069 4.425 1.713 522 HE22 GLN 76 HE22 GLN 76 21.501 5.446 0.440 523 HA PRO 77 HA PRO 77 24.314 0.814 5.193 524 HB2 PRO 77 HB2 PRO 77 25.937 2.229 3.131 525 HB3 PRO 77 HB1 PRO 77 26.463 1.146 4.427 526 HG2 PRO 77 HG2 PRO 77 26.379 0.293 1.940 527 HG3 PRO 77 HG1 PRO 77 25.823 -0.748 3.261 528 HD2 PRO 77 HD2 PRO 77 24.227 0.814 1.275 529 HD3 PRO 77 HD1 PRO 77 23.924 -0.793 1.947 530 HA PRO 78 HA PRO 78 23.161 4.938 6.196 531 HB2 PRO 78 HB2 PRO 78 25.351 5.863 7.546 532 HB3 PRO 78 HB1 PRO 78 24.195 4.717 8.239 533 HG2 PRO 78 HG2 PRO 78 26.832 4.185 6.946 534 HG3 PRO 78 HG1 PRO 78 26.178 3.499 8.439 535 HD2 PRO 78 HD2 PRO 78 26.140 2.148 6.140 536 HD3 PRO 78 HD1 PRO 78 24.798 2.040 7.291 537 H GLU 79 HN GLU 79 22.972 6.271 4.521 538 HA GLU 79 HA GLU 79 24.882 6.805 2.577 539 HB2 GLU 79 HB2 GLU 79 23.402 8.560 1.838 540 HB3 GLU 79 HB1 GLU 79 22.461 7.150 2.294 541 HG2 GLU 79 HG2 GLU 79 22.145 8.290 4.534 542 HG3 GLU 79 HG1 GLU 79 22.784 9.738 3.769 543 H GLU 80 HN GLU 80 24.301 8.275 5.677 544 HA GLU 80 HA GLU 80 25.865 10.571 5.383 545 HB2 GLU 80 HB2 GLU 80 24.782 10.614 7.392 546 HB3 GLU 80 HB1 GLU 80 24.970 8.887 7.650 547 HG2 GLU 80 HG2 GLU 80 27.255 9.177 8.316 548 HG3 GLU 80 HG1 GLU 80 27.186 10.901 7.931 549 H ILE 81 HN ILE 81 26.731 7.291 6.377 550 HA ILE 81 HA ILE 81 29.479 7.951 6.761 551 HB ILE 81 HB ILE 81 28.063 5.301 6.700 552 HG12 ILE 81 HG12 ILE 81 29.300 6.901 8.947 553 HG13 ILE 81 HG11 ILE 81 27.576 6.790 8.619 554 HG21 ILE 81 HG21 ILE 81 30.331 4.625 7.827 555 HG22 ILE 81 HG22 ILE 81 30.947 5.993 6.886 556 HG23 ILE 81 HG23 ILE 81 30.161 4.641 6.070 557 HD11 ILE 81 HD11 ILE 81 29.429 4.775 9.774 558 HD12 ILE 81 HD12 ILE 81 28.029 4.217 8.864 559 HD13 ILE 81 HD13 ILE 81 27.805 5.240 10.288 560 H VAL 82 HN VAL 82 27.665 6.225 4.223 561 HA VAL 82 HA VAL 82 29.860 5.441 2.694 562 HB VAL 82 HB VAL 82 28.420 5.299 0.788 563 HG11 VAL 82 HG11 VAL 82 26.494 4.040 1.693 564 HG12 VAL 82 HG12 VAL 82 26.914 4.630 3.302 565 HG13 VAL 82 HG13 VAL 82 28.033 3.583 2.425 566 HG21 VAL 82 HG21 VAL 82 26.920 6.861 0.324 567 HG22 VAL 82 HG22 VAL 82 27.121 7.554 1.937 568 HG23 VAL 82 HG23 VAL 82 25.928 6.279 1.662 569 H ALA 83 HN ALA 83 28.112 8.449 2.919 570 HA ALA 83 HA ALA 83 29.403 9.961 0.946 571 HB1 ALA 83 HB1 ALA 83 28.723 11.862 2.585 572 HB2 ALA 83 HB2 ALA 83 27.925 10.542 3.469 573 HB3 ALA 83 HB3 ALA 83 27.474 10.896 1.794 574 H ILE 84 HN ILE 84 30.068 9.600 4.421 575 HA ILE 84 HA ILE 84 32.285 11.314 4.565 576 HB ILE 84 HB ILE 84 31.593 8.859 6.195 577 HG12 ILE 84 HG12 ILE 84 31.407 11.671 7.175 578 HG13 ILE 84 HG11 ILE 84 30.169 11.076 6.077 579 HG21 ILE 84 HG21 ILE 84 33.639 10.990 6.804 580 HG22 ILE 84 HG22 ILE 84 33.988 9.322 6.343 581 HG23 ILE 84 HG23 ILE 84 33.166 9.664 7.868 582 HD11 ILE 84 HD11 ILE 84 30.910 9.622 8.590 583 HD12 ILE 84 HD12 ILE 84 29.463 9.440 7.584 584 HD13 ILE 84 HD13 ILE 84 29.694 10.901 8.548 585 H ILE 85 HN ILE 85 32.038 7.867 3.856 586 HA ILE 85 HA ILE 85 34.787 7.318 3.803 587 HB ILE 85 HB ILE 85 32.516 5.943 2.385 588 HG12 ILE 85 HG12 ILE 85 33.917 5.266 4.973 589 HG13 ILE 85 HG11 ILE 85 32.385 6.123 4.868 590 HG21 ILE 85 HG21 ILE 85 35.402 5.449 2.432 591 HG22 ILE 85 HG22 ILE 85 34.167 4.892 1.300 592 HG23 ILE 85 HG23 ILE 85 34.408 4.048 2.828 593 HD11 ILE 85 HD11 ILE 85 32.181 3.705 5.380 594 HD12 ILE 85 HD12 ILE 85 32.830 3.362 3.777 595 HD13 ILE 85 HD13 ILE 85 31.300 4.218 3.942 596 H THR 86 HN THR 86 32.521 8.089 1.138 597 HA THR 86 HA THR 86 34.627 8.094 -0.783 598 HB THR 86 HB THR 86 32.543 7.661 -1.735 599 HG1 THR 86 HG1 THR 86 33.944 9.342 -2.806 600 HG21 THR 86 HG21 THR 86 30.865 8.349 -0.365 601 HG22 THR 86 HG22 THR 86 30.737 9.560 -1.652 602 HG23 THR 86 HG23 THR 86 31.556 9.964 -0.139 603 H SER 87 HN SER 87 33.458 10.449 1.466 604 HA SER 87 HA SER 87 34.773 12.673 0.223 605 HB2 SER 87 HB2 SER 87 33.878 12.307 3.092 606 HB3 SER 87 HB1 SER 87 34.400 13.830 2.370 607 HG SER 87 HG SER 87 32.119 12.270 1.717 608 H MET 88 HN MET 88 35.738 10.044 2.239 609 HA MET 88 HA MET 88 38.211 11.146 3.147 610 HB2 MET 88 HB2 MET 88 37.315 8.282 2.839 611 HB3 MET 88 HB1 MET 88 38.832 8.760 3.581 612 HG2 MET 88 HG2 MET 88 36.093 9.506 4.586 613 HG3 MET 88 HG1 MET 88 37.101 8.213 5.224 614 HE1 MET 88 HE1 MET 88 36.094 11.860 5.515 615 HE2 MET 88 HE2 MET 88 37.371 12.075 4.318 616 HE3 MET 88 HE3 MET 88 37.576 12.715 5.948 617 H GLY 89 HN GLY 89 37.105 9.682 0.246 618 HA2 GLY 89 HA2 GLY 89 38.605 10.373 -1.682 619 HA3 GLY 89 HA1 GLY 89 39.855 9.527 -0.784 620 H PHE 90 HN PHE 90 36.989 7.958 -0.285 621 HA PHE 90 HA PHE 90 37.704 5.898 -2.228 622 HB2 PHE 90 HB2 PHE 90 35.862 5.793 0.172 623 HB3 PHE 90 HB1 PHE 90 36.300 4.417 -0.834 624 HD1 PHE 90 HD1 PHE 90 39.118 4.634 -1.239 625 HD2 PHE 90 HD2 PHE 90 36.858 5.585 2.238 626 HE1 PHE 90 HE1 PHE 90 41.111 4.257 0.155 627 HE2 PHE 90 HE2 PHE 90 38.843 5.202 3.638 628 HZ PHE 90 HZ PHE 90 40.973 4.538 2.596 629 H GLN 91 HN GLN 91 35.547 4.576 -2.807 630 HA GLN 91 HA GLN 91 33.807 6.485 -4.159 631 HB2 GLN 91 HB2 GLN 91 34.721 4.711 -5.525 632 HB3 GLN 91 HB1 GLN 91 34.173 3.495 -4.391 633 HG2 GLN 91 HG2 GLN 91 31.869 4.006 -4.942 634 HG3 GLN 91 HG1 GLN 91 32.405 5.255 -6.061 635 HE21 GLN 91 HE21 GLN 91 34.166 2.286 -5.705 636 HE22 GLN 91 HE22 GLN 91 33.741 1.610 -7.242 637 H ARG 92 HN ARG 92 31.603 6.621 -3.768 638 HA ARG 92 HA ARG 92 30.604 6.063 -1.209 639 HB2 ARG 92 HB2 ARG 92 29.621 7.711 -2.709 640 HB3 ARG 92 HB1 ARG 92 29.087 6.431 -3.779 641 HG2 ARG 92 HG2 ARG 92 27.922 5.554 -1.586 642 HG3 ARG 92 HG1 ARG 92 28.020 7.261 -1.144 643 HD2 ARG 92 HD2 ARG 92 26.795 6.137 -3.643 644 HD3 ARG 92 HD1 ARG 92 25.912 6.742 -2.245 645 HE ARG 92 HE ARG 92 27.648 8.760 -3.132 646 HH11 ARG 92 HH11 ARG 92 24.749 7.103 -4.232 647 HH12 ARG 92 HH12 ARG 92 24.240 8.433 -5.235 648 HH21 ARG 92 HH21 ARG 92 26.958 10.480 -4.410 649 HH22 ARG 92 HH22 ARG 92 25.477 10.363 -5.314 650 H ASN 93 HN ASN 93 29.901 4.394 -4.273 651 HA ASN 93 HA ASN 93 28.356 2.319 -3.201 652 HB2 ASN 93 HB2 ASN 93 28.568 2.858 -5.621 653 HB3 ASN 93 HB1 ASN 93 30.186 2.155 -5.607 654 HD21 ASN 93 HD21 ASN 93 29.730 0.521 -7.037 655 HD22 ASN 93 HD22 ASN 93 28.678 -0.804 -6.655 656 H GLN 94 HN GLN 94 31.815 2.676 -3.529 657 HA GLN 94 HA GLN 94 32.562 0.080 -2.693 658 HB2 GLN 94 HB2 GLN 94 34.253 1.241 -3.773 659 HB3 GLN 94 HB1 GLN 94 33.897 2.736 -2.931 660 HG2 GLN 94 HG2 GLN 94 35.033 2.047 -0.999 661 HG3 GLN 94 HG1 GLN 94 35.119 0.373 -1.542 662 HE21 GLN 94 HE21 GLN 94 36.615 -0.190 -3.125 663 HE22 GLN 94 HE22 GLN 94 37.930 0.843 -3.567 664 H ALA 95 HN ALA 95 31.996 3.132 -1.048 665 HA ALA 95 HA ALA 95 32.562 2.309 1.574 666 HB1 ALA 95 HB1 ALA 95 30.594 4.368 0.569 667 HB2 ALA 95 HB2 ALA 95 32.307 4.639 0.916 668 HB3 ALA 95 HB3 ALA 95 31.187 4.233 2.227 669 H ILE 96 HN ILE 96 29.588 2.184 -0.372 670 HA ILE 96 HA ILE 96 27.850 1.190 1.557 671 HB ILE 96 HB ILE 96 27.897 1.001 -1.426 672 HG12 ILE 96 HG12 ILE 96 25.410 1.807 -0.287 673 HG13 ILE 96 HG11 ILE 96 26.700 2.650 0.556 674 HG21 ILE 96 HG21 ILE 96 25.646 -0.180 -1.238 675 HG22 ILE 96 HG22 ILE 96 26.149 -0.610 0.404 676 HG23 ILE 96 HG23 ILE 96 27.092 -1.159 -0.982 677 HD11 ILE 96 HD11 ILE 96 26.176 2.642 -2.406 678 HD12 ILE 96 HD12 ILE 96 27.554 3.419 -1.628 679 HD13 ILE 96 HD13 ILE 96 25.916 3.980 -1.285 680 H GLN 97 HN GLN 97 29.789 -0.581 -0.819 681 HA GLN 97 HA GLN 97 29.181 -3.174 -0.026 682 HB2 GLN 97 HB2 GLN 97 30.401 -2.651 -2.068 683 HB3 GLN 97 HB1 GLN 97 31.769 -2.116 -1.115 684 HG2 GLN 97 HG2 GLN 97 32.201 -4.307 -0.329 685 HG3 GLN 97 HG1 GLN 97 30.690 -4.905 -1.003 686 HE21 GLN 97 HE21 GLN 97 33.420 -5.825 -1.470 687 HE22 GLN 97 HE22 GLN 97 33.673 -5.706 -3.179 688 H ALA 98 HN ALA 98 31.779 -1.049 1.066 689 HA ALA 98 HA ALA 98 33.031 -2.831 2.808 690 HB1 ALA 98 HB1 ALA 98 33.725 -0.476 1.968 691 HB2 ALA 98 HB2 ALA 98 34.273 -1.022 3.555 692 HB3 ALA 98 HB3 ALA 98 32.899 0.087 3.422 693 H LEU 99 HN LEU 99 30.552 -0.346 3.499 694 HA LEU 99 HA LEU 99 30.246 -0.954 6.220 695 HB2 LEU 99 HB2 LEU 99 28.262 0.183 4.277 696 HB3 LEU 99 HB1 LEU 99 28.034 0.153 6.008 697 HG LEU 99 HG LEU 99 30.319 1.579 4.660 698 HD11 LEU 99 HD11 LEU 99 27.787 2.780 5.746 699 HD12 LEU 99 HD12 LEU 99 28.070 2.464 4.039 700 HD13 LEU 99 HD13 LEU 99 29.096 3.610 4.903 701 HD21 LEU 99 HD21 LEU 99 31.080 1.726 6.735 702 HD22 LEU 99 HD22 LEU 99 29.631 0.958 7.368 703 HD23 LEU 99 HD23 LEU 99 29.664 2.700 7.125 704 H ARG 100 HN ARG 100 28.692 -2.339 3.362 705 HA ARG 100 HA ARG 100 26.718 -3.886 4.565 706 HB2 ARG 100 HB2 ARG 100 28.450 -4.339 2.153 707 HB3 ARG 100 HB1 ARG 100 27.281 -5.552 2.661 708 HG2 ARG 100 HG2 ARG 100 25.467 -4.062 2.316 709 HG3 ARG 100 HG1 ARG 100 26.555 -2.692 2.088 710 HD2 ARG 100 HD2 ARG 100 27.343 -3.534 0.033 711 HD3 ARG 100 HD1 ARG 100 26.589 -5.108 0.300 712 HE ARG 100 HE ARG 100 24.563 -3.183 0.320 713 HH11 ARG 100 HH11 ARG 100 26.838 -4.598 -1.946 714 HH12 ARG 100 HH12 ARG 100 25.829 -4.315 -3.329 715 HH21 ARG 100 HH21 ARG 100 23.232 -2.840 -1.491 716 HH22 ARG 100 HH22 ARG 100 23.771 -3.315 -3.075 717 H ALA 101 HN ALA 101 30.099 -4.611 4.001 718 HA ALA 101 HA ALA 101 30.066 -7.160 5.258 719 HB1 ALA 101 HB1 ALA 101 32.620 -6.704 5.234 720 HB2 ALA 101 HB2 ALA 101 32.167 -5.278 4.289 721 HB3 ALA 101 HB3 ALA 101 31.756 -6.893 3.710 722 H THR 102 HN THR 102 30.964 -3.898 6.337 723 HA THR 102 HA THR 102 31.928 -4.856 8.874 724 HB THR 102 HB THR 102 32.558 -2.579 9.287 725 HG1 THR 102 HG1 THR 102 31.812 -0.923 8.032 726 HG21 THR 102 HG21 THR 102 34.149 -2.502 7.612 727 HG22 THR 102 HG22 THR 102 33.055 -3.067 6.370 728 HG23 THR 102 HG23 THR 102 33.682 -4.186 7.581 729 H ASN 103 HN ASN 103 28.902 -4.467 7.788 730 HA ASN 103 HA ASN 103 26.851 -4.289 8.743 731 HB2 ASN 103 HB2 ASN 103 28.007 -5.711 10.527 732 HB3 ASN 103 HB1 ASN 103 28.191 -4.221 11.441 733 HD21 ASN 103 HD21 ASN 103 25.429 -4.906 9.429 734 HD22 ASN 103 HD22 ASN 103 24.286 -5.072 10.714 735 H ASN 104 HN ASN 104 27.917 -2.026 7.778 736 HA ASN 104 HA ASN 104 27.573 0.209 7.675 737 HB2 ASN 104 HB2 ASN 104 25.792 -0.219 10.090 738 HB3 ASN 104 HB1 ASN 104 25.906 1.278 9.166 739 HD21 ASN 104 HD21 ASN 104 23.601 -0.443 9.633 740 HD22 ASN 104 HD22 ASN 104 23.037 -0.922 8.075 741 H ASN 105 HN ASN 105 29.547 -1.165 9.632 742 HA ASN 105 HA ASN 105 30.125 0.934 11.518 743 HB2 ASN 105 HB2 ASN 105 30.749 -1.526 11.790 744 HB3 ASN 105 HB1 ASN 105 32.013 -1.238 10.597 745 HD21 ASN 105 HD21 ASN 105 31.005 -0.785 13.852 746 HD22 ASN 105 HD22 ASN 105 32.474 -0.060 14.429 747 H LEU 106 HN LEU 106 30.801 2.814 10.846 748 HA LEU 106 HA LEU 106 31.724 3.495 8.316 749 HB2 LEU 106 HB2 LEU 106 30.805 5.097 9.877 750 HB3 LEU 106 HB1 LEU 106 32.111 4.827 11.002 751 HG LEU 106 HG LEU 106 32.832 5.869 8.308 752 HD11 LEU 106 HD11 LEU 106 31.861 7.730 10.448 753 HD12 LEU 106 HD12 LEU 106 30.760 7.074 9.241 754 HD13 LEU 106 HD13 LEU 106 32.132 8.059 8.729 755 HD21 LEU 106 HD21 LEU 106 34.465 7.122 9.621 756 HD22 LEU 106 HD22 LEU 106 34.553 5.393 9.959 757 HD23 LEU 106 HD23 LEU 106 33.767 6.476 11.109 758 H GLU 107 HN GLU 107 33.594 3.359 11.293 759 HA GLU 107 HA GLU 107 36.127 3.768 10.298 760 HB2 GLU 107 HB2 GLU 107 35.306 2.026 12.626 761 HB3 GLU 107 HB1 GLU 107 36.931 2.636 12.335 762 HG2 GLU 107 HG2 GLU 107 34.690 4.569 12.483 763 HG3 GLU 107 HG1 GLU 107 35.296 3.852 13.980 764 H ARG 108 HN ARG 108 34.518 0.630 10.835 765 HA ARG 108 HA ARG 108 36.708 -0.900 9.886 766 HB2 ARG 108 HB2 ARG 108 34.730 -1.615 11.356 767 HB3 ARG 108 HB1 ARG 108 33.850 -1.800 9.859 768 HG2 ARG 108 HG2 ARG 108 35.512 -3.416 9.095 769 HG3 ARG 108 HG1 ARG 108 36.347 -3.257 10.644 770 HD2 ARG 108 HD2 ARG 108 33.474 -4.019 10.348 771 HD3 ARG 108 HD1 ARG 108 34.780 -5.200 10.516 772 HE ARG 108 HE ARG 108 35.065 -3.482 12.644 773 HH11 ARG 108 HH11 ARG 108 32.524 -5.597 11.469 774 HH12 ARG 108 HH12 ARG 108 31.837 -5.835 13.046 775 HH21 ARG 108 HH21 ARG 108 34.180 -3.808 14.695 776 HH22 ARG 108 HH22 ARG 108 32.792 -4.842 14.891 777 H ALA 109 HN ALA 109 33.935 0.582 8.318 778 HA ALA 109 HA ALA 109 34.063 -0.811 5.889 779 HB1 ALA 109 HB1 ALA 109 32.570 1.302 6.892 780 HB2 ALA 109 HB2 ALA 109 32.432 0.602 5.280 781 HB3 ALA 109 HB3 ALA 109 33.465 2.005 5.541 782 H LEU 110 HN LEU 110 35.480 2.260 6.905 783 HA LEU 110 HA LEU 110 37.122 2.727 4.698 784 HB2 LEU 110 HB2 LEU 110 37.629 3.400 7.589 785 HB3 LEU 110 HB1 LEU 110 38.397 4.159 6.210 786 HG LEU 110 HG LEU 110 35.423 4.237 6.605 787 HD11 LEU 110 HD11 LEU 110 37.473 6.218 7.605 788 HD12 LEU 110 HD12 LEU 110 36.457 5.170 8.601 789 HD13 LEU 110 HD13 LEU 110 35.721 6.443 7.623 790 HD21 LEU 110 HD21 LEU 110 35.614 6.187 5.148 791 HD22 LEU 110 HD22 LEU 110 36.276 4.736 4.388 792 HD23 LEU 110 HD23 LEU 110 37.361 5.955 5.064 793 H ASP 111 HN ASP 111 37.671 0.966 7.684 794 HA ASP 111 HA ASP 111 40.313 0.141 7.337 795 HB2 ASP 111 HB2 ASP 111 38.456 -0.304 9.245 796 HB3 ASP 111 HB1 ASP 111 38.347 -1.835 8.400 797 H TRP 112 HN TRP 112 37.325 -1.452 6.349 798 HA TRP 112 HA TRP 112 38.406 -3.658 5.022 799 HB2 TRP 112 HB2 TRP 112 36.027 -3.333 5.738 800 HB3 TRP 112 HB1 TRP 112 35.827 -2.228 4.386 801 HD1 TRP 112 HD1 TRP 112 35.376 -3.264 2.022 802 HE1 TRP 112 HE1 TRP 112 35.054 -5.671 1.154 803 HE3 TRP 112 HE3 TRP 112 36.890 -5.830 6.180 804 HZ2 TRP 112 HZ2 TRP 112 35.395 -8.304 2.120 805 HZ3 TRP 112 HZ3 TRP 112 36.863 -8.288 6.125 806 HH2 TRP 112 HH2 TRP 112 36.130 -9.497 4.137 807 H ILE 113 HN ILE 113 37.460 -0.484 3.878 808 HA ILE 113 HA ILE 113 38.016 -0.974 1.149 809 HB ILE 113 HB ILE 113 37.742 1.617 2.671 810 HG12 ILE 113 HG12 ILE 113 35.790 0.030 0.979 811 HG13 ILE 113 HG11 ILE 113 35.703 0.268 2.721 812 HG21 ILE 113 HG21 ILE 113 37.756 1.106 -0.304 813 HG22 ILE 113 HG22 ILE 113 39.003 1.946 0.618 814 HG23 ILE 113 HG23 ILE 113 37.392 2.648 0.473 815 HD11 ILE 113 HD11 ILE 113 35.647 2.604 0.873 816 HD12 ILE 113 HD12 ILE 113 35.031 2.439 2.522 817 HD13 ILE 113 HD13 ILE 113 34.197 1.651 1.188 818 H PHE 114 HN PHE 114 39.844 0.478 3.798 819 HA PHE 114 HA PHE 114 42.046 1.405 2.297 820 HB2 PHE 114 HB2 PHE 114 41.338 1.122 5.106 821 HB3 PHE 114 HB1 PHE 114 43.040 0.784 4.834 822 HD1 PHE 114 HD1 PHE 114 44.208 2.570 3.218 823 HD2 PHE 114 HD2 PHE 114 40.742 3.263 5.578 824 HE1 PHE 114 HE1 PHE 114 44.669 4.987 3.170 825 HE2 PHE 114 HE2 PHE 114 41.192 5.680 5.540 826 HZ PHE 114 HZ PHE 114 43.155 6.546 4.304 827 H SER 115 HN SER 115 41.220 -1.706 3.579 828 HA SER 115 HA SER 115 43.846 -2.830 3.140 829 HB2 SER 115 HB2 SER 115 42.058 -3.517 4.898 830 HB3 SER 115 HB1 SER 115 41.321 -4.410 3.575 831 HG SER 115 HG SER 115 43.978 -4.900 3.703 832 H HIS 116 HN HIS 116 41.616 -1.775 1.117 833 HA HIS 116 HA HIS 116 42.495 -3.645 -0.963 834 HB2 HIS 116 HB2 HIS 116 39.666 -2.703 -0.501 835 HB3 HIS 116 HB1 HIS 116 40.207 -3.374 -2.036 836 HD1 HIS 116 HD1 HIS 116 41.856 -5.735 -1.137 837 HD2 HIS 116 HD2 HIS 116 38.240 -4.699 0.638 838 HE1 HIS 116 HE1 HIS 116 40.965 -7.852 -0.110 839 HE2 HIS 116 HE2 HIS 116 38.971 -7.104 1.227 840 HA PRO 117 HA PRO 117 43.725 0.721 -2.018 841 HB2 PRO 117 HB2 PRO 117 45.588 -0.429 -3.769 842 HB3 PRO 117 HB1 PRO 117 45.928 0.192 -2.155 843 HG2 PRO 117 HG2 PRO 117 45.345 -2.618 -3.025 844 HG3 PRO 117 HG1 PRO 117 46.531 -2.033 -1.832 845 HD2 PRO 117 HD2 PRO 117 44.275 -3.104 -0.968 846 HD3 PRO 117 HD1 PRO 117 44.854 -1.595 -0.229 847 H GLU 118 HN GLU 118 44.204 -1.710 -4.484 848 HA GLU 118 HA GLU 118 41.736 -1.312 -5.786 849 HB2 GLU 118 HB2 GLU 118 42.727 -0.537 -7.948 850 HB3 GLU 118 HB1 GLU 118 42.672 0.676 -6.683 851 HG2 GLU 118 HG2 GLU 118 45.031 0.262 -6.218 852 HG3 GLU 118 HG1 GLU 118 45.081 -0.915 -7.527 853 H PHE 119 HN PHE 119 45.094 -2.321 -6.298 854 HA PHE 119 HA PHE 119 44.064 -4.843 -7.384 855 HB2 PHE 119 HB2 PHE 119 45.234 -3.476 -9.074 856 HB3 PHE 119 HB1 PHE 119 46.658 -3.422 -8.047 857 HD1 PHE 119 HD1 PHE 119 44.396 -5.957 -9.596 858 HD2 PHE 119 HD2 PHE 119 48.373 -4.855 -8.560 859 HE1 PHE 119 HE1 PHE 119 45.247 -7.993 -10.694 860 HE2 PHE 119 HE2 PHE 119 49.227 -6.882 -9.650 861 HZ PHE 119 HZ PHE 119 47.657 -8.482 -10.679 862 H GLU 120 HN GLU 120 45.018 -3.771 -4.642 863 HA GLU 120 HA GLU 120 46.074 -4.529 -2.782 864 HB2 GLU 120 HB2 GLU 120 46.197 -7.126 -4.314 865 HB3 GLU 120 HB1 GLU 120 46.454 -6.943 -2.584 866 HG2 GLU 120 HG2 GLU 120 43.921 -6.072 -3.879 867 HG3 GLU 120 HG1 GLU 120 44.169 -7.754 -3.408 868 H GLU 121 HN GLU 121 48.205 -6.039 -2.227 869 HA GLU 121 HA GLU 121 50.356 -5.059 -3.939 870 HB2 GLU 121 HB2 GLU 121 51.834 -6.186 -2.230 871 HB3 GLU 121 HB1 GLU 121 50.874 -4.840 -1.628 872 HG2 GLU 121 HG2 GLU 121 49.866 -7.637 -1.363 873 HG3 GLU 121 HG1 GLU 121 51.082 -7.022 -0.242 874 H ASP 122 HN ASP 122 51.687 -6.392 -5.131 875 HA ASP 122 HA ASP 122 50.704 -9.138 -5.437 876 HB2 ASP 122 HB2 ASP 122 50.473 -7.726 -7.448 877 HB3 ASP 122 HB1 ASP 122 52.207 -7.426 -7.433 878 H SER 123 HN SER 123 52.223 -10.811 -5.810 879 HA SER 123 HA SER 123 54.143 -11.022 -3.862 880 HB2 SER 123 HB2 SER 123 54.971 -12.986 -5.222 881 HB3 SER 123 HB1 SER 123 53.243 -12.985 -4.868 882 HG SER 123 HG SER 123 53.965 -11.701 -7.204 883 H ASP 124 HN ASP 124 56.005 -10.023 -3.579 884 HA ASP 124 HA ASP 124 57.454 -8.932 -5.848 885 HB2 ASP 124 HB2 ASP 124 58.854 -7.818 -4.137 886 HB3 ASP 124 HB1 ASP 124 57.144 -7.447 -3.960 887 H PHE 125 HN PHE 125 59.620 -9.377 -6.238 888 HA PHE 125 HA PHE 125 60.413 -12.083 -5.401 889 HB2 PHE 125 HB2 PHE 125 60.056 -11.605 -7.851 890 HB3 PHE 125 HB1 PHE 125 61.415 -10.491 -7.775 891 HD1 PHE 125 HD1 PHE 125 60.389 -14.000 -7.688 892 HD2 PHE 125 HD2 PHE 125 63.677 -11.302 -7.613 893 HE1 PHE 125 HE1 PHE 125 61.926 -15.866 -8.147 894 HE2 PHE 125 HE2 PHE 125 65.219 -13.161 -8.070 895 HZ PHE 125 HZ PHE 125 64.344 -15.448 -8.339 896 H VAL 126 HN VAL 126 62.105 -12.300 -4.089 897 HA VAL 126 HA VAL 126 63.713 -9.942 -3.513 898 HB VAL 126 HB VAL 126 62.765 -10.965 -1.565 899 HG11 VAL 126 HG11 VAL 126 62.383 -13.211 -2.424 900 HG12 VAL 126 HG12 VAL 126 63.240 -13.258 -0.883 901 HG13 VAL 126 HG13 VAL 126 64.118 -13.527 -2.388 902 HG21 VAL 126 HG21 VAL 126 64.773 -11.458 -0.250 903 HG22 VAL 126 HG22 VAL 126 64.990 -10.052 -1.293 904 HG23 VAL 126 HG23 VAL 126 65.702 -11.602 -1.743 Start of MODEL 12 1 H1 ASP 1 HT1 ASP 1 -41.161 16.404 2.913 2 H2 ASP 1 HT2 ASP 1 -41.571 16.235 4.550 3 H3 ASP 1 HT3 ASP 1 -42.210 17.515 3.645 4 HA ASP 1 HA ASP 1 -43.787 15.678 4.059 5 HB2 ASP 1 HB2 ASP 1 -43.035 16.383 1.218 6 HB3 ASP 1 HB1 ASP 1 -44.484 15.466 1.627 7 H ILE 2 HN ILE 2 -41.657 14.758 1.356 8 HA ILE 2 HA ILE 2 -42.296 11.991 1.757 9 HB ILE 2 HB ILE 2 -40.373 13.324 -0.158 10 HG12 ILE 2 HG12 ILE 2 -43.149 12.197 -0.612 11 HG13 ILE 2 HG11 ILE 2 -42.780 13.911 -0.446 12 HG21 ILE 2 HG21 ILE 2 -40.500 11.160 -1.380 13 HG22 ILE 2 HG22 ILE 2 -41.360 10.489 0.007 14 HG23 ILE 2 HG23 ILE 2 -39.699 11.048 0.190 15 HD11 ILE 2 HD11 ILE 2 -41.688 12.119 -2.601 16 HD12 ILE 2 HD12 ILE 2 -41.474 13.864 -2.459 17 HD13 ILE 2 HD13 ILE 2 -43.071 13.197 -2.778 18 H ASP 3 HN ASP 3 -41.398 10.938 3.364 19 HA ASP 3 HA ASP 3 -38.906 11.657 4.555 20 HB2 ASP 3 HB2 ASP 3 -40.825 10.640 5.798 21 HB3 ASP 3 HB1 ASP 3 -40.526 9.130 4.948 22 H GLU 4 HN GLU 4 -37.433 11.509 2.807 23 HA GLU 4 HA GLU 4 -36.999 9.056 1.428 24 HB2 GLU 4 HB2 GLU 4 -35.363 11.572 1.627 25 HB3 GLU 4 HB1 GLU 4 -34.875 10.182 0.661 26 HG2 GLU 4 HG2 GLU 4 -37.119 10.367 -0.488 27 HG3 GLU 4 HG1 GLU 4 -37.293 11.924 0.321 28 H SER 5 HN SER 5 -36.288 9.924 4.561 29 HA SER 5 HA SER 5 -33.834 8.556 4.898 30 HB2 SER 5 HB2 SER 5 -34.944 10.149 6.556 31 HB3 SER 5 HB1 SER 5 -36.008 8.809 6.985 32 HG SER 5 HG SER 5 -33.645 9.315 7.969 33 H SER 6 HN SER 6 -37.181 7.598 4.734 34 HA SER 6 HA SER 6 -36.934 4.936 5.630 35 HB2 SER 6 HB2 SER 6 -38.884 6.046 3.593 36 HB3 SER 6 HB1 SER 6 -39.096 4.595 4.576 37 HG SER 6 HG SER 6 -38.875 7.267 5.547 38 H VAL 7 HN VAL 7 -36.758 6.331 2.337 39 HA VAL 7 HA VAL 7 -36.278 3.808 1.122 40 HB VAL 7 HB VAL 7 -37.125 5.506 -0.308 41 HG11 VAL 7 HG11 VAL 7 -34.670 7.117 0.330 42 HG12 VAL 7 HG12 VAL 7 -36.329 7.495 0.794 43 HG13 VAL 7 HG13 VAL 7 -35.861 7.520 -0.906 44 HG21 VAL 7 HG21 VAL 7 -35.622 5.369 -2.159 45 HG22 VAL 7 HG22 VAL 7 -35.511 3.862 -1.236 46 HG23 VAL 7 HG23 VAL 7 -34.251 5.092 -1.083 47 H MET 8 HN MET 8 -34.186 6.397 2.267 48 HA MET 8 HA MET 8 -31.766 5.258 1.394 49 HB2 MET 8 HB2 MET 8 -32.467 7.284 3.470 50 HB3 MET 8 HB1 MET 8 -30.826 6.658 3.393 51 HG2 MET 8 HG2 MET 8 -30.571 7.426 1.153 52 HG3 MET 8 HG1 MET 8 -32.268 7.887 1.062 53 HE1 MET 8 HE1 MET 8 -29.177 9.993 3.780 54 HE2 MET 8 HE2 MET 8 -28.792 8.621 2.741 55 HE3 MET 8 HE3 MET 8 -29.853 8.402 4.132 56 H GLN 9 HN GLN 9 -33.716 4.650 4.266 57 HA GLN 9 HA GLN 9 -31.714 3.161 5.609 58 HB2 GLN 9 HB2 GLN 9 -33.304 2.641 7.201 59 HB3 GLN 9 HB1 GLN 9 -33.958 4.117 6.526 60 HG2 GLN 9 HG2 GLN 9 -35.553 2.874 5.227 61 HG3 GLN 9 HG1 GLN 9 -34.837 1.350 5.751 62 HE21 GLN 9 HE21 GLN 9 -35.214 0.612 7.829 63 HE22 GLN 9 HE22 GLN 9 -36.458 1.268 8.836 64 H LEU 10 HN LEU 10 -34.278 2.278 3.319 65 HA LEU 10 HA LEU 10 -33.687 -0.504 3.257 66 HB2 LEU 10 HB2 LEU 10 -34.564 1.070 0.859 67 HB3 LEU 10 HB1 LEU 10 -34.853 -0.620 1.192 68 HG LEU 10 HG LEU 10 -36.201 1.762 2.403 69 HD11 LEU 10 HD11 LEU 10 -37.295 -0.596 0.910 70 HD12 LEU 10 HD12 LEU 10 -36.863 0.943 0.164 71 HD13 LEU 10 HD13 LEU 10 -38.148 0.876 1.377 72 HD21 LEU 10 HD21 LEU 10 -37.595 0.007 3.603 73 HD22 LEU 10 HD22 LEU 10 -35.995 0.328 4.254 74 HD23 LEU 10 HD23 LEU 10 -36.270 -1.114 3.281 75 H ALA 11 HN ALA 11 -32.558 2.267 1.478 76 HA ALA 11 HA ALA 11 -31.123 0.970 -0.531 77 HB1 ALA 11 HB1 ALA 11 -30.210 3.623 0.446 78 HB2 ALA 11 HB2 ALA 11 -31.857 3.476 -0.169 79 HB3 ALA 11 HB3 ALA 11 -30.484 3.058 -1.203 80 H GLU 12 HN GLU 12 -30.172 1.913 2.694 81 HA GLU 12 HA GLU 12 -27.377 1.361 2.246 82 HB2 GLU 12 HB2 GLU 12 -27.039 2.037 4.501 83 HB3 GLU 12 HB1 GLU 12 -28.276 3.079 3.833 84 HG2 GLU 12 HG2 GLU 12 -30.001 1.964 5.000 85 HG3 GLU 12 HG1 GLU 12 -28.898 0.689 5.517 86 H MET 13 HN MET 13 -30.114 -0.243 3.691 87 HA MET 13 HA MET 13 -28.460 -2.425 4.678 88 HB2 MET 13 HB2 MET 13 -30.395 -3.253 5.796 89 HB3 MET 13 HB1 MET 13 -30.369 -1.508 6.017 90 HG2 MET 13 HG2 MET 13 -32.069 -1.214 4.356 91 HG3 MET 13 HG1 MET 13 -32.008 -2.923 3.935 92 HE1 MET 13 HE1 MET 13 -31.812 -1.422 7.560 93 HE2 MET 13 HE2 MET 13 -33.514 -1.382 8.023 94 HE3 MET 13 HE3 MET 13 -32.921 -0.317 6.747 95 H GLY 14 HN GLY 14 -29.635 -1.764 1.702 96 HA2 GLY 14 HA2 GLY 14 -29.538 -4.542 0.930 97 HA3 GLY 14 HA1 GLY 14 -31.141 -3.841 0.812 98 H PHE 15 HN PHE 15 -31.537 -2.224 -0.737 99 HA PHE 15 HA PHE 15 -29.518 -1.982 -2.853 100 HB2 PHE 15 HB2 PHE 15 -32.361 -2.968 -3.218 101 HB3 PHE 15 HB1 PHE 15 -31.279 -2.546 -4.539 102 HD1 PHE 15 HD2 PHE 15 -29.170 -3.881 -4.840 103 HD2 PHE 15 HD1 PHE 15 -32.307 -5.093 -2.232 104 HE1 PHE 15 HE2 PHE 15 -28.294 -6.179 -4.857 105 HE2 PHE 15 HE1 PHE 15 -31.440 -7.396 -2.250 106 HZ PHE 15 HZ PHE 15 -29.428 -7.940 -3.565 107 HA PRO 16 HA PRO 16 -31.005 2.188 -3.313 108 HB2 PRO 16 HB2 PRO 16 -30.994 2.565 -5.992 109 HB3 PRO 16 HB1 PRO 16 -29.496 2.418 -5.063 110 HG2 PRO 16 HG2 PRO 16 -30.979 0.299 -6.596 111 HG3 PRO 16 HG1 PRO 16 -29.247 0.716 -6.677 112 HD2 PRO 16 HD2 PRO 16 -30.076 -1.347 -5.204 113 HD3 PRO 16 HD1 PRO 16 -28.796 -0.271 -4.601 114 H LEU 17 HN LEU 17 -33.148 1.458 -2.518 115 HA LEU 17 HA LEU 17 -35.091 0.674 -4.499 116 HB2 LEU 17 HB2 LEU 17 -35.326 0.984 -1.499 117 HB3 LEU 17 HB1 LEU 17 -36.591 0.370 -2.554 118 HG LEU 17 HG LEU 17 -33.872 -0.902 -2.226 119 HD11 LEU 17 HD11 LEU 17 -35.286 -1.038 -0.198 120 HD12 LEU 17 HD12 LEU 17 -34.951 -2.597 -0.938 121 HD13 LEU 17 HD13 LEU 17 -36.524 -1.841 -1.163 122 HD21 LEU 17 HD21 LEU 17 -34.868 -2.779 -3.437 123 HD22 LEU 17 HD22 LEU 17 -34.852 -1.307 -4.414 124 HD23 LEU 17 HD23 LEU 17 -36.349 -1.847 -3.655 125 H GLU 18 HN GLU 18 -34.585 3.045 -5.408 126 HA GLU 18 HA GLU 18 -36.061 5.191 -4.469 127 HB2 GLU 18 HB2 GLU 18 -34.567 4.973 -6.597 128 HB3 GLU 18 HB1 GLU 18 -36.081 4.535 -7.388 129 HG2 GLU 18 HG2 GLU 18 -37.001 6.676 -6.253 130 HG3 GLU 18 HG1 GLU 18 -35.295 7.087 -6.092 131 H ALA 19 HN ALA 19 -37.097 2.178 -5.720 132 HA ALA 19 HA ALA 19 -39.750 2.676 -6.396 133 HB1 ALA 19 HB1 ALA 19 -38.852 0.269 -4.837 134 HB2 ALA 19 HB2 ALA 19 -38.427 0.499 -6.528 135 HB3 ALA 19 HB3 ALA 19 -40.122 0.376 -6.060 136 H CYS 20 HN CYS 20 -38.133 2.381 -3.327 137 HA CYS 20 HA CYS 20 -40.439 2.561 -1.660 138 HB2 CYS 20 HB2 CYS 20 -38.144 1.787 -0.893 139 HB3 CYS 20 HB1 CYS 20 -37.637 3.464 -0.987 140 HG CYS 20 HG CYS 20 -39.822 2.061 1.209 141 H ARG 21 HN ARG 21 -38.031 4.891 -2.853 142 HA ARG 21 HA ARG 21 -39.029 7.171 -1.610 143 HB2 ARG 21 HB2 ARG 21 -36.962 7.364 -2.761 144 HB3 ARG 21 HB1 ARG 21 -37.675 6.855 -4.287 145 HG2 ARG 21 HG2 ARG 21 -38.585 8.894 -4.710 146 HG3 ARG 21 HG1 ARG 21 -38.727 9.322 -3.004 147 HD2 ARG 21 HD2 ARG 21 -37.045 10.714 -3.913 148 HD3 ARG 21 HD1 ARG 21 -36.217 9.487 -2.958 149 HE ARG 21 HE ARG 21 -36.456 8.828 -5.747 150 HH11 ARG 21 HH11 ARG 21 -34.526 10.472 -3.327 151 HH12 ARG 21 HH12 ARG 21 -33.072 10.436 -4.291 152 HH21 ARG 21 HH21 ARG 21 -34.549 8.781 -7.019 153 HH22 ARG 21 HH22 ARG 21 -33.083 9.475 -6.381 154 H LYS 22 HN LYS 22 -39.954 5.913 -4.814 155 HA LYS 22 HA LYS 22 -42.018 7.843 -5.173 156 HB2 LYS 22 HB2 LYS 22 -42.673 6.508 -7.115 157 HB3 LYS 22 HB1 LYS 22 -40.934 6.757 -7.079 158 HG2 LYS 22 HG2 LYS 22 -40.749 4.469 -6.041 159 HG3 LYS 22 HG1 LYS 22 -42.458 4.258 -6.423 160 HD2 LYS 22 HD2 LYS 22 -41.398 3.289 -8.250 161 HD3 LYS 22 HD1 LYS 22 -41.768 4.911 -8.828 162 HE2 LYS 22 HE2 LYS 22 -39.111 4.173 -7.613 163 HE3 LYS 22 HE1 LYS 22 -39.445 4.018 -9.338 164 HZ1 LYS 22 HZ1 LYS 22 -38.330 6.101 -8.831 165 HZ2 LYS 22 HZ2 LYS 22 -39.573 6.546 -7.771 166 HZ3 LYS 22 HZ3 LYS 22 -39.889 6.398 -9.429 167 H ALA 23 HN ALA 23 -41.833 4.781 -3.568 168 HA ALA 23 HA ALA 23 -44.638 4.295 -3.361 169 HB1 ALA 23 HB1 ALA 23 -44.034 2.674 -1.651 170 HB2 ALA 23 HB2 ALA 23 -42.399 3.337 -1.591 171 HB3 ALA 23 HB3 ALA 23 -42.967 2.524 -3.052 172 H VAL 24 HN VAL 24 -42.223 5.848 -1.303 173 HA VAL 24 HA VAL 24 -43.817 6.450 0.899 174 HB VAL 24 HB VAL 24 -41.549 8.079 -0.294 175 HG11 VAL 24 HG11 VAL 24 -41.352 9.176 1.867 176 HG12 VAL 24 HG12 VAL 24 -42.774 8.298 2.454 177 HG13 VAL 24 HG13 VAL 24 -42.938 9.478 1.153 178 HG21 VAL 24 HG21 VAL 24 -40.200 7.054 1.482 179 HG22 VAL 24 HG22 VAL 24 -40.874 5.847 0.387 180 HG23 VAL 24 HG23 VAL 24 -41.596 6.095 1.976 181 H TYR 25 HN TYR 25 -43.336 8.267 -2.117 182 HA TYR 25 HA TYR 25 -45.143 10.353 -1.508 183 HB2 TYR 25 HB2 TYR 25 -43.559 10.580 -3.334 184 HB3 TYR 25 HB1 TYR 25 -44.284 9.213 -4.179 185 HD1 TYR 25 HD2 TYR 25 -44.929 12.689 -3.042 186 HD2 TYR 25 HD1 TYR 25 -46.117 9.526 -5.630 187 HE1 TYR 25 HE2 TYR 25 -46.443 14.230 -4.222 188 HE2 TYR 25 HE1 TYR 25 -47.633 11.057 -6.815 189 HH TYR 25 HH TYR 25 -47.511 14.422 -6.450 190 H PHE 26 HN PHE 26 -45.582 7.214 -3.093 191 HA PHE 26 HA PHE 26 -48.291 7.597 -3.810 192 HB2 PHE 26 HB2 PHE 26 -46.829 5.916 -4.860 193 HB3 PHE 26 HB1 PHE 26 -46.782 5.018 -3.348 194 HD1 PHE 26 HD2 PHE 26 -49.131 6.263 -5.947 195 HD2 PHE 26 HD1 PHE 26 -48.363 3.378 -2.911 196 HE1 PHE 26 HE2 PHE 26 -51.143 5.018 -6.626 197 HE2 PHE 26 HE1 PHE 26 -50.372 2.133 -3.584 198 HZ PHE 26 HZ PHE 26 -51.756 2.946 -5.460 199 H THR 27 HN THR 27 -46.771 6.127 -0.968 200 HA THR 27 HA THR 27 -49.120 5.091 0.186 201 HB THR 27 HB THR 27 -47.816 5.137 2.351 202 HG1 THR 27 HG1 THR 27 -45.575 5.818 0.775 203 HG21 THR 27 HG21 THR 27 -46.359 3.898 0.026 204 HG22 THR 27 HG22 THR 27 -47.817 3.223 0.749 205 HG23 THR 27 HG23 THR 27 -46.339 3.357 1.702 206 H GLY 28 HN GLY 28 -47.886 8.287 -0.001 207 HA2 GLY 28 HA2 GLY 28 -49.122 10.220 0.578 208 HA3 GLY 28 HA1 GLY 28 -50.054 9.251 1.715 209 H ASN 29 HN ASN 29 -46.617 8.940 1.617 210 HA ASN 29 HA ASN 29 -44.952 9.411 3.087 211 HB2 ASN 29 HB2 ASN 29 -46.617 11.855 3.737 212 HB3 ASN 29 HB1 ASN 29 -44.925 11.627 4.156 213 HD21 ASN 29 HD21 ASN 29 -44.356 10.330 1.555 214 HD22 ASN 29 HD22 ASN 29 -44.312 11.617 0.405 215 H MET 30 HN MET 30 -46.582 7.531 3.973 216 HA MET 30 HA MET 30 -47.897 8.184 6.429 217 HB2 MET 30 HB2 MET 30 -47.403 5.591 4.991 218 HB3 MET 30 HB1 MET 30 -48.212 5.658 6.549 219 HG2 MET 30 HG2 MET 30 -49.116 6.970 3.997 220 HG3 MET 30 HG1 MET 30 -49.828 5.552 4.765 221 HE1 MET 30 HE1 MET 30 -52.220 6.730 4.605 222 HE2 MET 30 HE2 MET 30 -51.487 8.154 3.868 223 HE3 MET 30 HE3 MET 30 -52.563 8.332 5.254 224 H GLY 31 HN GLY 31 -44.725 7.028 5.616 225 HA2 GLY 31 HA2 GLY 31 -43.272 7.636 7.663 226 HA3 GLY 31 HA1 GLY 31 -44.239 6.395 8.446 227 H ALA 32 HN ALA 32 -41.729 5.906 8.638 228 HA ALA 32 HA ALA 32 -40.353 4.791 6.446 229 HB1 ALA 32 HB1 ALA 32 -39.969 4.251 9.385 230 HB2 ALA 32 HB2 ALA 32 -39.241 5.576 8.476 231 HB3 ALA 32 HB3 ALA 32 -38.810 3.909 8.101 232 H GLU 33 HN GLU 33 -41.854 3.129 9.222 233 HA GLU 33 HA GLU 33 -41.475 0.528 8.354 234 HB2 GLU 33 HB2 GLU 33 -43.725 1.659 10.024 235 HB3 GLU 33 HB1 GLU 33 -43.363 -0.055 9.865 236 HG2 GLU 33 HG2 GLU 33 -41.510 2.028 11.002 237 HG3 GLU 33 HG1 GLU 33 -42.480 0.889 11.937 238 H VAL 34 HN VAL 34 -44.002 2.800 7.528 239 HA VAL 34 HA VAL 34 -45.766 0.952 6.323 240 HB VAL 34 HB VAL 34 -45.488 3.915 5.797 241 HG11 VAL 34 HG11 VAL 34 -47.639 1.929 5.112 242 HG12 VAL 34 HG12 VAL 34 -46.772 3.023 4.031 243 HG13 VAL 34 HG13 VAL 34 -47.939 3.662 5.187 244 HG21 VAL 34 HG21 VAL 34 -47.258 2.420 7.731 245 HG22 VAL 34 HG22 VAL 34 -47.313 4.154 7.420 246 HG23 VAL 34 HG23 VAL 34 -45.879 3.437 8.154 247 H ALA 35 HN ALA 35 -43.251 3.076 4.953 248 HA ALA 35 HA ALA 35 -43.710 2.086 2.295 249 HB1 ALA 35 HB1 ALA 35 -42.869 4.381 2.773 250 HB2 ALA 35 HB2 ALA 35 -41.923 3.470 1.596 251 HB3 ALA 35 HB3 ALA 35 -41.329 3.656 3.247 252 H PHE 36 HN PHE 36 -41.466 1.382 4.910 253 HA PHE 36 HA PHE 36 -39.775 -0.413 3.581 254 HB2 PHE 36 HB2 PHE 36 -39.250 0.206 5.832 255 HB3 PHE 36 HB1 PHE 36 -40.810 -0.354 6.427 256 HD1 PHE 36 HD2 PHE 36 -37.589 -1.485 5.003 257 HD2 PHE 36 HD1 PHE 36 -41.095 -2.558 7.159 258 HE1 PHE 36 HE2 PHE 36 -36.586 -3.668 5.532 259 HE2 PHE 36 HE1 PHE 36 -40.103 -4.744 7.695 260 HZ PHE 36 HZ PHE 36 -37.838 -5.293 6.905 261 H ASN 37 HN ASN 37 -42.924 -0.892 5.140 262 HA ASN 37 HA ASN 37 -43.242 -3.613 4.503 263 HB2 ASN 37 HB2 ASN 37 -44.672 -2.561 6.159 264 HB3 ASN 37 HB1 ASN 37 -45.313 -1.448 4.953 265 HD21 ASN 37 HD21 ASN 37 -46.860 -2.156 3.514 266 HD22 ASN 37 HD22 ASN 37 -47.677 -3.675 3.673 267 H TRP 38 HN TRP 38 -43.932 -0.665 2.693 268 HA TRP 38 HA TRP 38 -45.456 -1.917 0.661 269 HB2 TRP 38 HB2 TRP 38 -45.213 0.635 1.232 270 HB3 TRP 38 HB1 TRP 38 -43.844 0.563 0.126 271 HD1 TRP 38 HD1 TRP 38 -44.380 0.763 -2.396 272 HE1 TRP 38 HE1 TRP 38 -46.538 0.768 -3.814 273 HE3 TRP 38 HE3 TRP 38 -47.737 -0.501 1.247 274 HZ2 TRP 38 HZ2 TRP 38 -49.292 0.287 -3.422 275 HZ3 TRP 38 HZ3 TRP 38 -50.112 -0.714 0.643 276 HH2 TRP 38 HH2 TRP 38 -50.875 -0.327 -1.645 277 H ILE 39 HN ILE 39 -42.020 -1.402 1.126 278 HA ILE 39 HA ILE 39 -41.355 -2.183 -1.550 279 HB ILE 39 HB ILE 39 -39.973 -0.737 0.200 280 HG12 ILE 39 HG12 ILE 39 -37.988 -1.126 -1.195 281 HG13 ILE 39 HG11 ILE 39 -38.716 -2.606 -1.813 282 HG21 ILE 39 HG21 ILE 39 -38.712 -3.458 0.513 283 HG22 ILE 39 HG22 ILE 39 -39.631 -2.634 1.773 284 HG23 ILE 39 HG23 ILE 39 -38.119 -1.938 1.177 285 HD11 ILE 39 HD11 ILE 39 -38.901 -0.739 -3.379 286 HD12 ILE 39 HD12 ILE 39 -39.837 0.161 -2.182 287 HD13 ILE 39 HD13 ILE 39 -40.479 -1.336 -2.865 288 H ILE 40 HN ILE 40 -41.476 -3.807 1.586 289 HA ILE 40 HA ILE 40 -40.207 -6.153 0.613 290 HB ILE 40 HB ILE 40 -40.905 -7.228 2.695 291 HG12 ILE 40 HG12 ILE 40 -41.902 -5.499 4.421 292 HG13 ILE 40 HG11 ILE 40 -42.575 -4.762 2.969 293 HG21 ILE 40 HG21 ILE 40 -39.782 -5.453 4.210 294 HG22 ILE 40 HG22 ILE 40 -39.597 -4.544 2.712 295 HG23 ILE 40 HG23 ILE 40 -38.874 -6.144 2.869 296 HD11 ILE 40 HD11 ILE 40 -43.040 -7.560 3.965 297 HD12 ILE 40 HD12 ILE 40 -43.600 -6.943 2.409 298 HD13 ILE 40 HD13 ILE 40 -44.203 -6.233 3.908 299 H VAL 41 HN VAL 41 -43.515 -5.058 0.697 300 HA VAL 41 HA VAL 41 -44.531 -7.586 -0.214 301 HB VAL 41 HB VAL 41 -45.905 -5.888 1.050 302 HG11 VAL 41 HG11 VAL 41 -47.014 -4.132 -0.212 303 HG12 VAL 41 HG12 VAL 41 -46.031 -4.521 -1.622 304 HG13 VAL 41 HG13 VAL 41 -45.268 -3.886 -0.162 305 HG21 VAL 41 HG21 VAL 41 -47.961 -6.416 -0.125 306 HG22 VAL 41 HG22 VAL 41 -46.885 -7.811 -0.101 307 HG23 VAL 41 HG23 VAL 41 -47.046 -6.850 -1.569 308 H HIS 42 HN HIS 42 -43.176 -4.719 -1.697 309 HA HIS 42 HA HIS 42 -43.968 -5.697 -4.354 310 HB2 HIS 42 HB2 HIS 42 -43.118 -3.064 -3.287 311 HB3 HIS 42 HB1 HIS 42 -42.654 -3.440 -4.944 312 HD1 HIS 42 HD1 HIS 42 -45.421 -2.163 -2.969 313 HD2 HIS 42 HD2 HIS 42 -44.974 -4.123 -6.607 314 HE1 HIS 42 HE1 HIS 42 -47.575 -1.779 -4.217 315 HE2 HIS 42 HE2 HIS 42 -47.304 -3.013 -6.397 316 H MET 43 HN MET 43 -41.594 -6.492 -2.359 317 HA MET 43 HA MET 43 -39.256 -6.270 -3.892 318 HB2 MET 43 HB2 MET 43 -38.297 -7.989 -2.550 319 HB3 MET 43 HB1 MET 43 -39.335 -7.034 -1.504 320 HG2 MET 43 HG2 MET 43 -40.990 -8.725 -1.454 321 HG3 MET 43 HG1 MET 43 -40.207 -9.618 -2.759 322 HE1 MET 43 HE1 MET 43 -39.808 -8.389 0.979 323 HE2 MET 43 HE2 MET 43 -38.319 -7.858 0.194 324 HE3 MET 43 HE3 MET 43 -38.270 -9.139 1.406 325 H GLU 44 HN GLU 44 -42.041 -8.231 -4.265 326 HA GLU 44 HA GLU 44 -41.155 -10.268 -5.935 327 HB2 GLU 44 HB2 GLU 44 -43.485 -10.092 -6.942 328 HB3 GLU 44 HB1 GLU 44 -43.401 -10.341 -5.203 329 HG2 GLU 44 HG2 GLU 44 -43.775 -7.954 -4.845 330 HG3 GLU 44 HG1 GLU 44 -43.883 -7.710 -6.589 331 H GLU 45 HN GLU 45 -41.220 -6.888 -6.469 332 HA GLU 45 HA GLU 45 -40.590 -7.290 -9.315 333 HB2 GLU 45 HB2 GLU 45 -41.204 -4.700 -7.874 334 HB3 GLU 45 HB1 GLU 45 -40.989 -4.909 -9.606 335 HG2 GLU 45 HG2 GLU 45 -43.227 -6.000 -7.925 336 HG3 GLU 45 HG1 GLU 45 -43.321 -4.673 -9.081 337 HA PRO 46 HA PRO 46 -36.389 -6.944 -7.341 338 HB2 PRO 46 HB2 PRO 46 -35.261 -7.684 -9.792 339 HB3 PRO 46 HB1 PRO 46 -35.617 -8.788 -8.452 340 HG2 PRO 46 HG2 PRO 46 -37.208 -8.181 -10.910 341 HG3 PRO 46 HG1 PRO 46 -36.955 -9.740 -10.089 342 HD2 PRO 46 HD2 PRO 46 -39.247 -8.436 -9.801 343 HD3 PRO 46 HD1 PRO 46 -38.489 -9.230 -8.401 344 H ASP 47 HN ASP 47 -37.424 -6.031 -10.555 345 HA ASP 47 HA ASP 47 -35.317 -4.027 -10.746 346 HB2 ASP 47 HB2 ASP 47 -35.406 -5.669 -12.503 347 HB3 ASP 47 HB1 ASP 47 -37.109 -5.363 -12.783 348 H PHE 48 HN PHE 48 -37.893 -3.792 -9.198 349 HA PHE 48 HA PHE 48 -39.385 -1.725 -10.534 350 HB2 PHE 48 HB2 PHE 48 -40.336 -3.302 -8.783 351 HB3 PHE 48 HB1 PHE 48 -39.410 -2.409 -7.580 352 HD1 PHE 48 HD2 PHE 48 -41.189 -0.971 -10.488 353 HD2 PHE 48 HD1 PHE 48 -41.150 -1.525 -6.268 354 HE1 PHE 48 HE2 PHE 48 -43.038 0.639 -10.261 355 HE2 PHE 48 HE1 PHE 48 -42.991 0.088 -6.036 356 HZ PHE 48 HZ PHE 48 -43.978 1.126 -8.020 357 H ALA 49 HN ALA 49 -36.487 -1.916 -8.793 358 HA ALA 49 HA ALA 49 -36.382 1.014 -8.504 359 HB1 ALA 49 HB1 ALA 49 -36.077 -0.022 -6.358 360 HB2 ALA 49 HB2 ALA 49 -34.495 0.557 -6.892 361 HB3 ALA 49 HB3 ALA 49 -34.901 -1.156 -7.016 362 H GLU 50 HN GLU 50 -33.334 0.120 -8.124 363 HA GLU 50 HA GLU 50 -32.685 0.245 -10.984 364 HB2 GLU 50 HB2 GLU 50 -30.979 0.760 -8.539 365 HB3 GLU 50 HB1 GLU 50 -30.384 0.798 -10.193 366 HG2 GLU 50 HG2 GLU 50 -31.953 2.619 -10.695 367 HG3 GLU 50 HG1 GLU 50 -32.478 2.602 -9.013 368 HA PRO 51 HA PRO 51 -31.028 -3.865 -11.554 369 HB2 PRO 51 HB2 PRO 51 -28.408 -2.419 -11.478 370 HB3 PRO 51 HB1 PRO 51 -28.960 -3.680 -12.587 371 HG2 PRO 51 HG2 PRO 51 -29.005 -1.041 -13.221 372 HG3 PRO 51 HG1 PRO 51 -30.155 -2.211 -13.875 373 HD2 PRO 51 HD2 PRO 51 -30.607 -0.018 -12.023 374 HD3 PRO 51 HD1 PRO 51 -31.795 -1.033 -12.864 375 H LEU 52 HN LEU 52 -30.193 -5.491 -10.293 376 HA LEU 52 HA LEU 52 -30.198 -4.828 -7.496 377 HB2 LEU 52 HB2 LEU 52 -30.103 -7.451 -8.975 378 HB3 LEU 52 HB1 LEU 52 -30.034 -7.353 -7.229 379 HG LEU 52 HG LEU 52 -32.274 -7.871 -7.809 380 HD11 LEU 52 HD11 LEU 52 -32.028 -6.255 -6.011 381 HD12 LEU 52 HD12 LEU 52 -33.514 -5.973 -6.919 382 HD13 LEU 52 HD13 LEU 52 -32.113 -4.931 -7.175 383 HD21 LEU 52 HD21 LEU 52 -33.629 -6.491 -9.317 384 HD22 LEU 52 HD22 LEU 52 -32.253 -7.219 -10.142 385 HD23 LEU 52 HD23 LEU 52 -32.207 -5.517 -9.690 386 H THR 53 HN THR 53 -28.075 -3.604 -7.904 387 HA THR 53 HA THR 53 -25.790 -5.385 -7.467 388 HB THR 53 HB THR 53 -24.474 -3.209 -7.554 389 HG1 THR 53 HG1 THR 53 -26.313 -1.876 -9.014 390 HG21 THR 53 HG21 THR 53 -26.061 -3.983 -10.005 391 HG22 THR 53 HG22 THR 53 -24.580 -4.760 -9.449 392 HG23 THR 53 HG23 THR 53 -24.543 -3.084 -9.996 393 H MET 54 HN MET 54 -24.856 -5.590 -5.508 394 HA MET 54 HA MET 54 -26.235 -4.354 -3.276 395 HB2 MET 54 HB2 MET 54 -24.818 -5.867 -1.875 396 HB3 MET 54 HB1 MET 54 -25.824 -6.706 -3.045 397 HG2 MET 54 HG2 MET 54 -23.896 -6.964 -4.520 398 HG3 MET 54 HG1 MET 54 -22.885 -6.129 -3.343 399 HE1 MET 54 HE1 MET 54 -25.003 -9.347 -4.106 400 HE2 MET 54 HE2 MET 54 -25.779 -8.715 -2.656 401 HE3 MET 54 HE3 MET 54 -24.878 -10.230 -2.585 402 HA PRO 55 HA PRO 55 -23.027 -1.267 -3.147 403 HB2 PRO 55 HB2 PRO 55 -24.300 0.458 -1.534 404 HB3 PRO 55 HB1 PRO 55 -24.796 0.222 -3.214 405 HG2 PRO 55 HG2 PRO 55 -26.023 -0.836 -0.710 406 HG3 PRO 55 HG1 PRO 55 -26.810 -0.261 -2.190 407 HD2 PRO 55 HD2 PRO 55 -26.370 -2.927 -1.539 408 HD3 PRO 55 HD1 PRO 55 -26.688 -2.312 -3.172 409 H GLY 56 HN GLY 56 -23.398 -3.617 -1.102 410 HA2 GLY 56 HA2 GLY 56 -22.113 -4.315 0.679 411 HA3 GLY 56 HA1 GLY 56 -21.269 -2.776 0.610 412 H TYR 57 HN TYR 57 -24.137 -4.403 1.825 413 HA TYR 57 HA TYR 57 -25.031 -2.146 3.356 414 HB2 TYR 57 HB2 TYR 57 -26.717 -3.770 4.255 415 HB3 TYR 57 HB1 TYR 57 -26.706 -3.622 2.502 416 HD1 TYR 57 HD2 TYR 57 -25.907 -5.464 1.101 417 HD2 TYR 57 HD1 TYR 57 -26.042 -5.835 5.339 418 HE1 TYR 57 HE2 TYR 57 -25.657 -7.901 0.887 419 HE2 TYR 57 HE1 TYR 57 -25.795 -8.271 5.137 420 HH TYR 57 HH TYR 57 -26.261 -10.028 3.429 421 H GLY 58 HN GLY 58 -22.327 -3.299 3.921 422 HA2 GLY 58 HA2 GLY 58 -22.187 -2.897 6.648 423 HA3 GLY 58 HA1 GLY 58 -22.432 -4.627 6.442 424 H GLY 59 HN GLY 59 -20.387 -1.967 5.243 425 HA2 GLY 59 HA2 GLY 59 -18.071 -1.883 5.186 426 HA3 GLY 59 HA1 GLY 59 -18.025 -3.522 5.821 427 H ALA 60 HN ALA 60 -16.391 -4.048 4.354 428 HA ALA 60 HA ALA 60 -17.299 -4.368 1.566 429 HB1 ALA 60 HB1 ALA 60 -14.985 -4.117 0.876 430 HB2 ALA 60 HB2 ALA 60 -14.486 -3.942 2.557 431 HB3 ALA 60 HB3 ALA 60 -15.504 -2.714 1.810 432 H ALA 61 HN ALA 61 -15.160 -5.995 0.734 433 HA ALA 61 HA ALA 61 -16.041 -8.481 2.029 434 HB1 ALA 61 HB1 ALA 61 -16.654 -8.229 -0.326 435 HB2 ALA 61 HB2 ALA 61 -15.561 -9.592 -0.077 436 HB3 ALA 61 HB3 ALA 61 -14.949 -8.081 -0.751 437 H SER 62 HN SER 62 -13.786 -6.779 2.916 438 HA SER 62 HA SER 62 -11.805 -7.120 3.951 439 HB2 SER 62 HB2 SER 62 -13.083 -9.208 4.659 440 HB3 SER 62 HB1 SER 62 -12.183 -10.069 3.414 441 HG SER 62 HG SER 62 -10.882 -10.333 5.078 442 H ALA 63 HN ALA 63 -11.297 -6.181 1.586 443 HA ALA 63 HA ALA 63 -9.547 -7.892 0.063 444 HB1 ALA 63 HB1 ALA 63 -9.956 -4.909 -0.105 445 HB2 ALA 63 HB2 ALA 63 -10.816 -6.126 -1.050 446 HB3 ALA 63 HB3 ALA 63 -9.080 -5.900 -1.268 447 H GLY 64 HN GLY 64 -7.473 -8.265 0.467 448 HA2 GLY 64 HA2 GLY 64 -5.898 -6.224 1.884 449 HA3 GLY 64 HA1 GLY 64 -5.939 -7.859 2.533 450 H ALA 65 HN ALA 65 -3.790 -6.096 1.261 451 HA ALA 65 HA ALA 65 -2.857 -8.112 -0.671 452 HB1 ALA 65 HB1 ALA 65 -2.394 -5.136 -0.787 453 HB2 ALA 65 HB2 ALA 65 -3.448 -6.071 -1.851 454 HB3 ALA 65 HB3 ALA 65 -1.702 -6.326 -1.888 455 H SER 66 HN SER 66 -1.262 -9.209 0.223 456 HA SER 66 HA SER 66 0.351 -8.071 2.335 457 HB2 SER 66 HB2 SER 66 -0.510 -10.465 2.272 458 HB3 SER 66 HB1 SER 66 0.698 -10.769 1.023 459 HG SER 66 HG SER 66 1.214 -9.825 3.659 460 H VAL 67 HN VAL 67 1.589 -6.484 1.398 461 HA VAL 67 HA VAL 67 3.403 -7.235 -0.778 462 HB VAL 67 HB VAL 67 2.937 -4.501 0.434 463 HG11 VAL 67 HG11 VAL 67 5.124 -4.719 -0.615 464 HG12 VAL 67 HG12 VAL 67 4.078 -3.670 -1.572 465 HG13 VAL 67 HG13 VAL 67 4.372 -5.331 -2.090 466 HG21 VAL 67 HG21 VAL 67 1.817 -5.705 -2.094 467 HG22 VAL 67 HG22 VAL 67 1.647 -4.020 -1.604 468 HG23 VAL 67 HG23 VAL 67 0.911 -5.299 -0.638 469 H PHE 68 HN PHE 68 5.472 -7.716 -0.356 470 HA PHE 68 HA PHE 68 6.434 -7.566 2.355 471 HB2 PHE 68 HB2 PHE 68 7.652 -8.666 -0.179 472 HB3 PHE 68 HB1 PHE 68 8.362 -8.812 1.417 473 HD1 PHE 68 HD2 PHE 68 7.169 -10.128 3.177 474 HD2 PHE 68 HD1 PHE 68 5.952 -10.118 -0.900 475 HE1 PHE 68 HE2 PHE 68 5.884 -12.191 3.560 476 HE2 PHE 68 HE1 PHE 68 4.664 -12.177 -0.525 477 HZ PHE 68 HZ PHE 68 4.592 -13.189 1.719 478 H GLY 69 HN GLY 69 7.010 -6.000 -0.726 479 HA2 GLY 69 HA2 GLY 69 7.704 -3.759 -0.903 480 HA3 GLY 69 HA1 GLY 69 8.345 -3.851 0.728 481 H ALA 70 HN ALA 70 10.179 -5.623 0.862 482 HA ALA 70 HA ALA 70 12.405 -5.935 0.491 483 HB1 ALA 70 HB1 ALA 70 11.584 -7.305 -1.361 484 HB2 ALA 70 HB2 ALA 70 13.095 -6.503 -1.790 485 HB3 ALA 70 HB3 ALA 70 11.564 -5.886 -2.409 486 H SER 71 HN SER 71 11.536 -3.337 0.920 487 HA SER 71 HA SER 71 12.230 -1.393 -0.911 488 HB2 SER 71 HB2 SER 71 12.442 -1.116 2.088 489 HB3 SER 71 HB1 SER 71 12.065 0.145 0.912 490 HG SER 71 HG SER 71 10.227 -0.786 2.076 491 H GLY 72 HN GLY 72 14.088 -0.724 -1.713 492 HA2 GLY 72 HA2 GLY 72 16.225 0.204 -1.597 493 HA3 GLY 72 HA1 GLY 72 16.389 -0.434 0.033 494 H LEU 73 HN LEU 73 16.132 -3.046 -0.140 495 HA LEU 73 HA LEU 73 17.417 -4.902 -0.462 496 HB2 LEU 73 HB2 LEU 73 16.326 -4.225 -2.879 497 HB3 LEU 73 HB1 LEU 73 18.026 -4.316 -3.278 498 HG LEU 73 HG LEU 73 16.975 -6.436 -3.753 499 HD11 LEU 73 HD11 LEU 73 18.691 -6.580 -1.283 500 HD12 LEU 73 HD12 LEU 73 19.253 -6.540 -2.954 501 HD13 LEU 73 HD13 LEU 73 18.339 -7.928 -2.363 502 HD21 LEU 73 HD21 LEU 73 15.908 -7.772 -2.023 503 HD22 LEU 73 HD22 LEU 73 15.081 -6.229 -2.223 504 HD23 LEU 73 HD23 LEU 73 16.160 -6.478 -0.851 505 H ASP 74 HN ASP 74 18.879 -3.470 0.845 506 HA ASP 74 HA ASP 74 20.950 -1.962 -0.250 507 HB2 ASP 74 HB2 ASP 74 20.717 -3.353 2.417 508 HB3 ASP 74 HB1 ASP 74 22.068 -2.304 1.997 509 H ASN 75 HN ASN 75 22.639 -2.496 -1.349 510 HA ASN 75 HA ASN 75 23.760 -5.203 -1.114 511 HB2 ASN 75 HB2 ASN 75 24.835 -4.686 -3.337 512 HB3 ASN 75 HB1 ASN 75 23.075 -4.770 -3.386 513 HD21 ASN 75 HD21 ASN 75 21.895 -2.929 -3.754 514 HD22 ASN 75 HD22 ASN 75 22.608 -1.450 -4.312 515 H GLN 76 HN GLN 76 24.153 -3.063 0.707 516 HA GLN 76 HA GLN 76 26.625 -1.742 0.227 517 HB2 GLN 76 HB2 GLN 76 24.663 -1.038 1.749 518 HB3 GLN 76 HB1 GLN 76 25.331 -2.168 2.914 519 HG2 GLN 76 HG2 GLN 76 27.422 -0.937 2.932 520 HG3 GLN 76 HG1 GLN 76 26.780 0.191 1.743 521 HE21 GLN 76 HE21 GLN 76 26.892 1.988 2.982 522 HE22 GLN 76 HE22 GLN 76 25.924 2.247 4.394 523 HA PRO 77 HA PRO 77 29.593 -4.901 1.368 524 HB2 PRO 77 HB2 PRO 77 30.786 -2.583 2.823 525 HB3 PRO 77 HB1 PRO 77 31.568 -3.763 1.766 526 HG2 PRO 77 HG2 PRO 77 31.040 -1.360 0.870 527 HG3 PRO 77 HG1 PRO 77 30.721 -2.771 -0.150 528 HD2 PRO 77 HD2 PRO 77 28.805 -1.067 1.380 529 HD3 PRO 77 HD1 PRO 77 28.615 -1.820 -0.212 530 HA PRO 78 HA PRO 78 28.628 -6.335 5.377 531 HB2 PRO 78 HB2 PRO 78 31.007 -7.311 6.285 532 HB3 PRO 78 HB1 PRO 78 30.023 -8.122 5.060 533 HG2 PRO 78 HG2 PRO 78 32.386 -6.341 4.706 534 HG3 PRO 78 HG1 PRO 78 32.026 -7.876 3.904 535 HD2 PRO 78 HD2 PRO 78 31.606 -5.529 2.706 536 HD3 PRO 78 HD1 PRO 78 30.501 -6.891 2.468 537 H GLU 79 HN GLU 79 28.095 -4.926 6.859 538 HA GLU 79 HA GLU 79 29.460 -2.584 7.474 539 HB2 GLU 79 HB2 GLU 79 27.824 -2.322 9.244 540 HB3 GLU 79 HB1 GLU 79 27.038 -2.939 7.799 541 HG2 GLU 79 HG2 GLU 79 27.389 -5.248 8.879 542 HG3 GLU 79 HG1 GLU 79 27.661 -4.345 10.362 543 H GLU 80 HN GLU 80 29.753 -5.787 8.891 544 HA GLU 80 HA GLU 80 31.053 -4.887 11.261 545 HB2 GLU 80 HB2 GLU 80 31.389 -7.128 11.787 546 HB3 GLU 80 HB1 GLU 80 29.986 -7.188 10.741 547 HG2 GLU 80 HG2 GLU 80 32.637 -7.535 9.480 548 HG3 GLU 80 HG1 GLU 80 31.988 -8.856 10.458 549 H ILE 81 HN ILE 81 32.057 -6.011 8.122 550 HA ILE 81 HA ILE 81 34.848 -5.803 8.624 551 HB ILE 81 HB ILE 81 33.351 -5.933 6.012 552 HG12 ILE 81 HG12 ILE 81 35.076 -7.942 7.478 553 HG13 ILE 81 HG11 ILE 81 33.317 -7.980 7.396 554 HG21 ILE 81 HG21 ILE 81 35.773 -6.540 5.217 555 HG22 ILE 81 HG22 ILE 81 36.249 -5.563 6.618 556 HG23 ILE 81 HG23 ILE 81 35.261 -4.857 5.335 557 HD11 ILE 81 HD11 ILE 81 35.338 -8.759 5.394 558 HD12 ILE 81 HD12 ILE 81 33.907 -7.942 4.759 559 HD13 ILE 81 HD13 ILE 81 33.734 -9.429 5.709 560 H VAL 82 HN VAL 82 32.555 -3.622 6.955 561 HA VAL 82 HA VAL 82 34.427 -1.705 6.188 562 HB VAL 82 HB VAL 82 32.649 -0.108 6.049 563 HG11 VAL 82 HG11 VAL 82 30.931 -1.367 4.783 564 HG12 VAL 82 HG12 VAL 82 31.670 -2.863 5.354 565 HG13 VAL 82 HG13 VAL 82 32.585 -1.765 4.319 566 HG21 VAL 82 HG21 VAL 82 31.139 0.050 7.663 567 HG22 VAL 82 HG22 VAL 82 31.559 -1.553 8.268 568 HG23 VAL 82 HG23 VAL 82 30.347 -1.378 6.993 569 H ALA 83 HN ALA 83 32.735 -2.257 9.184 570 HA ALA 83 HA ALA 83 33.644 -0.108 10.722 571 HB1 ALA 83 HB1 ALA 83 33.247 -1.849 12.601 572 HB2 ALA 83 HB2 ALA 83 32.666 -2.868 11.269 573 HB3 ALA 83 HB3 ALA 83 31.884 -1.318 11.610 574 H ILE 84 HN ILE 84 34.952 -3.392 10.296 575 HA ILE 84 HA ILE 84 37.141 -3.158 12.036 576 HB ILE 84 HB ILE 84 36.766 -4.856 9.559 577 HG12 ILE 84 HG12 ILE 84 36.819 -5.923 12.346 578 HG13 ILE 84 HG11 ILE 84 35.386 -5.048 11.825 579 HG21 ILE 84 HG21 ILE 84 38.912 -5.080 11.671 580 HG22 ILE 84 HG22 ILE 84 39.151 -4.543 10.009 581 HG23 ILE 84 HG23 ILE 84 38.647 -6.202 10.333 582 HD11 ILE 84 HD11 ILE 84 36.530 -7.366 10.307 583 HD12 ILE 84 HD12 ILE 84 34.946 -6.600 10.113 584 HD13 ILE 84 HD13 ILE 84 35.306 -7.532 11.567 585 H ILE 85 HN ILE 85 36.773 -2.413 8.609 586 HA ILE 85 HA ILE 85 39.475 -1.831 8.092 587 HB ILE 85 HB ILE 85 37.004 -0.839 6.684 588 HG12 ILE 85 HG12 ILE 85 38.861 -3.133 6.029 589 HG13 ILE 85 HG11 ILE 85 37.307 -3.308 6.832 590 HG21 ILE 85 HG21 ILE 85 39.856 -0.327 6.264 591 HG22 ILE 85 HG22 ILE 85 38.448 0.537 5.639 592 HG23 ILE 85 HG23 ILE 85 39.019 -0.924 4.833 593 HD11 ILE 85 HD11 ILE 85 37.317 -3.807 4.383 594 HD12 ILE 85 HD12 ILE 85 37.620 -2.089 4.109 595 HD13 ILE 85 HD13 ILE 85 36.137 -2.606 4.905 596 H THR 86 HN THR 86 36.732 0.306 8.921 597 HA THR 86 HA THR 86 38.415 2.615 8.973 598 HB THR 86 HB THR 86 36.191 3.145 8.527 599 HG1 THR 86 HG1 THR 86 37.079 4.646 9.963 600 HG21 THR 86 HG21 THR 86 34.788 1.480 9.130 601 HG22 THR 86 HG22 THR 86 34.425 2.642 10.419 602 HG23 THR 86 HG23 THR 86 35.514 1.288 10.733 603 H SER 87 HN SER 87 37.680 0.129 11.228 604 HA SER 87 HA SER 87 38.654 1.495 13.546 605 HB2 SER 87 HB2 SER 87 37.179 -0.569 13.566 606 HB3 SER 87 HB1 SER 87 38.597 -1.500 13.085 607 HG SER 87 HG SER 87 38.700 0.184 15.347 608 H MET 88 HN MET 88 40.062 -0.336 10.928 609 HA MET 88 HA MET 88 42.660 -0.663 11.981 610 HB2 MET 88 HB2 MET 88 41.730 -0.412 9.120 611 HB3 MET 88 HB1 MET 88 43.370 -0.836 9.584 612 HG2 MET 88 HG2 MET 88 40.891 -2.418 10.213 613 HG3 MET 88 HG1 MET 88 42.081 -2.801 8.970 614 HE1 MET 88 HE1 MET 88 45.257 -3.603 11.138 615 HE2 MET 88 HE2 MET 88 44.799 -2.052 10.434 616 HE3 MET 88 HE3 MET 88 44.593 -3.535 9.503 617 H GLY 89 HN GLY 89 40.987 1.999 10.583 618 HA2 GLY 89 HA2 GLY 89 42.060 4.165 11.394 619 HA3 GLY 89 HA1 GLY 89 43.456 3.582 10.500 620 H PHE 90 HN PHE 90 41.007 2.472 8.747 621 HA PHE 90 HA PHE 90 41.195 4.656 6.852 622 HB2 PHE 90 HB2 PHE 90 39.935 1.911 6.652 623 HB3 PHE 90 HB1 PHE 90 40.040 3.055 5.318 624 HD1 PHE 90 HD2 PHE 90 42.667 4.116 5.399 625 HD2 PHE 90 HD1 PHE 90 41.390 0.165 6.327 626 HE1 PHE 90 HE2 PHE 90 44.912 3.270 4.856 627 HE2 PHE 90 HE1 PHE 90 43.635 -0.688 5.793 628 HZ PHE 90 HZ PHE 90 45.398 0.861 5.054 629 H GLN 91 HN GLN 91 38.903 4.774 5.547 630 HA GLN 91 HA GLN 91 36.995 5.695 7.552 631 HB2 GLN 91 HB2 GLN 91 37.600 7.339 5.905 632 HB3 GLN 91 HB1 GLN 91 37.284 6.218 4.591 633 HG2 GLN 91 HG2 GLN 91 34.932 6.264 5.055 634 HG3 GLN 91 HG1 GLN 91 35.194 7.280 6.469 635 HE21 GLN 91 HE21 GLN 91 36.981 7.731 3.503 636 HE22 GLN 91 HE22 GLN 91 36.216 9.216 3.042 637 H ARG 92 HN ARG 92 34.834 4.958 7.594 638 HA ARG 92 HA ARG 92 34.342 2.275 6.951 639 HB2 ARG 92 HB2 ARG 92 32.987 3.541 8.554 640 HB3 ARG 92 HB1 ARG 92 32.324 4.501 7.247 641 HG2 ARG 92 HG2 ARG 92 31.695 2.126 6.293 642 HG3 ARG 92 HG1 ARG 92 31.776 1.688 8.000 643 HD2 ARG 92 HD2 ARG 92 30.124 3.909 6.834 644 HD3 ARG 92 HD1 ARG 92 29.516 2.320 7.286 645 HE ARG 92 HE ARG 92 30.794 4.040 9.312 646 HH11 ARG 92 HH11 ARG 92 27.950 2.341 8.146 647 HH12 ARG 92 HH12 ARG 92 27.073 2.553 9.636 648 HH21 ARG 92 HH21 ARG 92 29.641 4.336 11.231 649 HH22 ARG 92 HH22 ARG 92 28.025 3.715 11.375 650 H ASN 93 HN ASN 93 33.250 5.190 5.271 651 HA ASN 93 HA ASN 93 31.983 3.963 3.102 652 HB2 ASN 93 HB2 ASN 93 31.779 6.344 3.689 653 HB3 ASN 93 HB1 ASN 93 33.441 6.606 3.158 654 HD21 ASN 93 HD21 ASN 93 30.170 6.005 2.166 655 HD22 ASN 93 HD22 ASN 93 30.401 6.355 0.486 656 H GLN 94 HN GLN 94 35.335 4.909 3.562 657 HA GLN 94 HA GLN 94 36.374 4.271 1.043 658 HB2 GLN 94 HB2 GLN 94 37.721 5.471 2.557 659 HB3 GLN 94 HB1 GLN 94 37.506 4.260 3.803 660 HG2 GLN 94 HG2 GLN 94 39.700 4.055 2.947 661 HG3 GLN 94 HG1 GLN 94 38.790 2.667 2.392 662 HE21 GLN 94 HE21 GLN 94 40.297 5.665 1.495 663 HE22 GLN 94 HE22 GLN 94 40.290 5.394 -0.212 664 H ALA 95 HN ALA 95 36.011 2.412 3.995 665 HA ALA 95 HA ALA 95 36.960 -0.053 3.127 666 HB1 ALA 95 HB1 ALA 95 34.778 0.561 5.121 667 HB2 ALA 95 HB2 ALA 95 36.514 0.545 5.450 668 HB3 ALA 95 HB3 ALA 95 35.683 -0.952 5.003 669 H ILE 96 HN ILE 96 33.714 1.367 2.949 670 HA ILE 96 HA ILE 96 32.360 -0.807 1.857 671 HB ILE 96 HB ILE 96 31.900 2.140 1.786 672 HG12 ILE 96 HG12 ILE 96 29.625 0.548 2.441 673 HG13 ILE 96 HG11 ILE 96 31.020 -0.083 3.302 674 HG21 ILE 96 HG21 ILE 96 29.726 1.601 0.526 675 HG22 ILE 96 HG22 ILE 96 30.585 0.151 -0.023 676 HG23 ILE 96 HG23 ILE 96 31.221 1.754 -0.399 677 HD11 ILE 96 HD11 ILE 96 29.926 2.710 3.394 678 HD12 ILE 96 HD12 ILE 96 31.452 2.220 4.123 679 HD13 ILE 96 HD13 ILE 96 29.938 1.514 4.693 680 H GLN 97 HN GLN 97 33.928 1.910 0.208 681 HA GLN 97 HA GLN 97 33.483 1.126 -2.424 682 HB2 GLN 97 HB2 GLN 97 34.334 3.325 -1.843 683 HB3 GLN 97 HB1 GLN 97 35.831 2.606 -1.271 684 HG2 GLN 97 HG2 GLN 97 36.457 1.945 -3.453 685 HG3 GLN 97 HG1 GLN 97 34.873 2.361 -4.097 686 HE21 GLN 97 HE21 GLN 97 35.779 3.752 -5.626 687 HE22 GLN 97 HE22 GLN 97 36.429 5.294 -5.185 688 H ALA 98 HN ALA 98 36.204 0.440 -0.300 689 HA ALA 98 HA ALA 98 37.750 -1.018 -2.097 690 HB1 ALA 98 HB1 ALA 98 38.272 -0.125 0.274 691 HB2 ALA 98 HB2 ALA 98 39.068 -1.597 -0.282 692 HB3 ALA 98 HB3 ALA 98 37.680 -1.697 0.806 693 H LEU 99 HN LEU 99 35.397 -2.189 0.324 694 HA LEU 99 HA LEU 99 35.621 -4.907 -0.321 695 HB2 LEU 99 HB2 LEU 99 33.296 -3.395 0.824 696 HB3 LEU 99 HB1 LEU 99 33.388 -5.137 0.754 697 HG LEU 99 HG LEU 99 35.389 -3.440 2.219 698 HD11 LEU 99 HD11 LEU 99 33.051 -4.915 3.391 699 HD12 LEU 99 HD12 LEU 99 33.059 -3.185 3.062 700 HD13 LEU 99 HD13 LEU 99 34.196 -3.864 4.228 701 HD21 LEU 99 HD21 LEU 99 36.463 -5.357 2.519 702 HD22 LEU 99 HD22 LEU 99 35.267 -6.177 1.518 703 HD23 LEU 99 HD23 LEU 99 35.024 -6.056 3.260 704 H ARG 100 HN ARG 100 33.637 -2.352 -1.725 705 HA ARG 100 HA ARG 100 31.932 -3.885 -3.316 706 HB2 ARG 100 HB2 ARG 100 33.222 -1.198 -3.744 707 HB3 ARG 100 HB1 ARG 100 32.123 -1.893 -4.930 708 HG2 ARG 100 HG2 ARG 100 30.305 -1.851 -3.414 709 HG3 ARG 100 HG1 ARG 100 31.366 -1.470 -2.053 710 HD2 ARG 100 HD2 ARG 100 31.824 0.696 -2.915 711 HD3 ARG 100 HD1 ARG 100 31.032 0.321 -4.446 712 HE ARG 100 HE ARG 100 29.090 0.005 -2.521 713 HH11 ARG 100 HH11 ARG 100 31.172 2.598 -3.633 714 HH12 ARG 100 HH12 ARG 100 30.064 3.855 -3.163 715 HH21 ARG 100 HH21 ARG 100 27.633 1.681 -1.906 716 HH22 ARG 100 HH22 ARG 100 28.077 3.339 -2.192 717 H ALA 101 HN ALA 101 35.172 -2.677 -3.979 718 HA ALA 101 HA ALA 101 35.422 -3.875 -6.537 719 HB1 ALA 101 HB1 ALA 101 37.920 -3.402 -6.030 720 HB2 ALA 101 HB2 ALA 101 37.288 -2.591 -4.588 721 HB3 ALA 101 HB3 ALA 101 36.800 -2.048 -6.196 722 H THR 102 HN THR 102 36.423 -4.842 -3.283 723 HA THR 102 HA THR 102 37.855 -7.143 -4.248 724 HB THR 102 HB THR 102 38.488 -7.472 -1.958 725 HG1 THR 102 HG1 THR 102 37.478 -6.417 -0.310 726 HG21 THR 102 HG21 THR 102 39.763 -5.576 -1.839 727 HG22 THR 102 HG22 THR 102 38.457 -4.508 -2.298 728 HG23 THR 102 HG23 THR 102 39.261 -5.504 -3.513 729 H ASN 103 HN ASN 103 34.647 -6.592 -3.790 730 HA ASN 103 HA ASN 103 32.801 -7.880 -3.675 731 HB2 ASN 103 HB2 ASN 103 34.819 -10.086 -4.042 732 HB3 ASN 103 HB1 ASN 103 33.102 -10.395 -3.863 733 HD21 ASN 103 HD21 ASN 103 34.422 -7.621 -5.548 734 HD22 ASN 103 HD22 ASN 103 33.915 -8.109 -7.126 735 H ASN 104 HN ASN 104 33.645 -6.858 -1.382 736 HA ASN 104 HA ASN 104 33.216 -6.909 0.846 737 HB2 ASN 104 HB2 ASN 104 32.030 -9.621 0.226 738 HB3 ASN 104 HB1 ASN 104 31.987 -8.874 1.818 739 HD21 ASN 104 HD21 ASN 104 29.721 -8.958 1.739 740 HD22 ASN 104 HD22 ASN 104 28.809 -7.803 0.831 741 H ASN 105 HN ASN 105 35.572 -8.420 -0.576 742 HA ASN 105 HA ASN 105 36.517 -10.180 1.492 743 HB2 ASN 105 HB2 ASN 105 37.162 -10.254 -1.000 744 HB3 ASN 105 HB1 ASN 105 38.219 -8.890 -0.643 745 HD21 ASN 105 HD21 ASN 105 37.722 -12.271 -0.357 746 HD22 ASN 105 HD22 ASN 105 39.249 -12.655 0.380 747 H LEU 106 HN LEU 106 37.044 -9.410 3.374 748 HA LEU 106 HA LEU 106 37.440 -6.750 4.076 749 HB2 LEU 106 HB2 LEU 106 36.780 -8.467 5.647 750 HB3 LEU 106 HB1 LEU 106 38.292 -9.308 5.440 751 HG LEU 106 HG LEU 106 38.400 -6.520 6.483 752 HD11 LEU 106 HD11 LEU 106 37.844 -8.824 8.320 753 HD12 LEU 106 HD12 LEU 106 36.535 -7.859 7.642 754 HD13 LEU 106 HD13 LEU 106 37.757 -7.092 8.661 755 HD21 LEU 106 HD21 LEU 106 40.231 -7.452 7.803 756 HD22 LEU 106 HD22 LEU 106 40.454 -7.762 6.079 757 HD23 LEU 106 HD23 LEU 106 39.893 -9.053 7.145 758 H GLU 107 HN GLU 107 39.864 -9.316 4.035 759 HA GLU 107 HA GLU 107 42.135 -7.792 4.472 760 HB2 GLU 107 HB2 GLU 107 41.847 -10.297 2.807 761 HB3 GLU 107 HB1 GLU 107 43.368 -9.648 3.399 762 HG2 GLU 107 HG2 GLU 107 41.220 -10.179 5.361 763 HG3 GLU 107 HG1 GLU 107 42.086 -11.555 4.674 764 H ARG 108 HN ARG 108 40.663 -8.664 1.359 765 HA ARG 108 HA ARG 108 42.636 -7.344 -0.199 766 HB2 ARG 108 HB2 ARG 108 40.921 -9.160 -0.874 767 HB3 ARG 108 HB1 ARG 108 39.833 -7.818 -1.140 768 HG2 ARG 108 HG2 ARG 108 41.445 -6.866 -2.724 769 HG3 ARG 108 HG1 ARG 108 42.462 -8.296 -2.499 770 HD2 ARG 108 HD2 ARG 108 39.599 -8.355 -3.338 771 HD3 ARG 108 HD1 ARG 108 40.952 -8.440 -4.475 772 HE ARG 108 HE ARG 108 41.352 -10.455 -2.611 773 HH11 ARG 108 HH11 ARG 108 38.964 -9.626 -5.044 774 HH12 ARG 108 HH12 ARG 108 38.386 -11.259 -5.211 775 HH21 ARG 108 HH21 ARG 108 40.627 -12.593 -2.852 776 HH22 ARG 108 HH22 ARG 108 39.369 -12.963 -3.999 777 H ALA 109 HN ALA 109 39.644 -6.300 1.321 778 HA ALA 109 HA ALA 109 39.284 -3.909 -0.112 779 HB1 ALA 109 HB1 ALA 109 38.014 -5.160 1.995 780 HB2 ALA 109 HB2 ALA 109 37.586 -3.596 1.305 781 HB3 ALA 109 HB3 ALA 109 38.647 -3.677 2.710 782 H LEU 110 HN LEU 110 40.909 -4.562 2.973 783 HA LEU 110 HA LEU 110 42.110 -2.073 3.373 784 HB2 LEU 110 HB2 LEU 110 43.243 -4.790 4.033 785 HB3 LEU 110 HB1 LEU 110 43.663 -3.276 4.805 786 HG LEU 110 HG LEU 110 40.860 -4.355 4.888 787 HD11 LEU 110 HD11 LEU 110 43.121 -4.914 6.809 788 HD12 LEU 110 HD12 LEU 110 42.294 -6.087 5.778 789 HD13 LEU 110 HD13 LEU 110 41.422 -5.297 7.092 790 HD21 LEU 110 HD21 LEU 110 40.699 -2.934 6.850 791 HD22 LEU 110 HD22 LEU 110 41.237 -1.998 5.456 792 HD23 LEU 110 HD23 LEU 110 42.398 -2.485 6.690 793 H ASP 111 HN ASP 111 43.123 -4.889 1.560 794 HA ASP 111 HA ASP 111 45.634 -4.087 0.647 795 HB2 ASP 111 HB2 ASP 111 44.232 -6.310 0.264 796 HB3 ASP 111 HB1 ASP 111 43.747 -5.482 -1.203 797 H TRP 112 HN TRP 112 42.464 -3.646 -0.821 798 HA TRP 112 HA TRP 112 43.278 -2.191 -3.080 799 HB2 TRP 112 HB2 TRP 112 41.073 -3.370 -2.715 800 HB3 TRP 112 HB1 TRP 112 40.599 -2.006 -1.706 801 HD1 TRP 112 HD1 TRP 112 41.239 -2.948 -5.355 802 HE1 TRP 112 HE1 TRP 112 40.276 -1.110 -6.878 803 HE3 TRP 112 HE3 TRP 112 39.995 0.492 -1.778 804 HZ2 TRP 112 HZ2 TRP 112 39.143 1.462 -6.594 805 HZ3 TRP 112 HZ3 TRP 112 38.980 2.616 -2.490 806 HH2 TRP 112 HH2 TRP 112 38.563 3.088 -4.851 807 H ILE 113 HN ILE 113 42.026 -1.190 0.049 808 HA ILE 113 HA ILE 113 42.082 1.577 -0.389 809 HB ILE 113 HB ILE 113 42.348 0.045 2.207 810 HG12 ILE 113 HG12 ILE 113 39.940 1.250 0.815 811 HG13 ILE 113 HG11 ILE 113 40.263 -0.465 1.023 812 HG21 ILE 113 HG21 ILE 113 41.684 2.948 1.706 813 HG22 ILE 113 HG22 ILE 113 43.133 2.317 2.481 814 HG23 ILE 113 HG23 ILE 113 41.569 2.137 3.268 815 HD11 ILE 113 HD11 ILE 113 40.076 1.243 3.436 816 HD12 ILE 113 HD12 ILE 113 39.647 -0.453 3.200 817 HD13 ILE 113 HD13 ILE 113 38.603 0.813 2.570 818 H PHE 114 HN PHE 114 44.546 -0.697 0.671 819 HA PHE 114 HA PHE 114 46.520 1.212 1.390 820 HB2 PHE 114 HB2 PHE 114 46.607 -1.132 2.131 821 HB3 PHE 114 HB1 PHE 114 46.818 -1.651 0.458 822 HD1 PHE 114 HD2 PHE 114 48.407 0.481 3.066 823 HD2 PHE 114 HD1 PHE 114 48.947 -1.954 -0.381 824 HE1 PHE 114 HE2 PHE 114 50.844 0.666 3.323 825 HE2 PHE 114 HE1 PHE 114 51.391 -1.778 -0.127 826 HZ PHE 114 HZ PHE 114 52.338 -0.460 1.717 827 H SER 115 HN SER 115 45.572 -0.264 -1.615 828 HA SER 115 HA SER 115 47.870 0.594 -3.089 829 HB2 SER 115 HB2 SER 115 46.541 -1.376 -3.730 830 HB3 SER 115 HB1 SER 115 45.152 -0.345 -4.032 831 HG SER 115 HG SER 115 46.855 0.755 -5.522 832 H HIS 116 HN HIS 116 45.398 2.223 -1.733 833 HA HIS 116 HA HIS 116 46.142 4.580 -3.287 834 HB2 HIS 116 HB2 HIS 116 43.302 3.761 -2.661 835 HB3 HIS 116 HB1 HIS 116 43.744 5.427 -3.011 836 HD1 HIS 116 HD1 HIS 116 45.432 5.343 -5.411 837 HD2 HIS 116 HD2 HIS 116 42.270 2.676 -4.899 838 HE1 HIS 116 HE1 HIS 116 44.801 4.583 -7.723 839 HE2 HIS 116 HE2 HIS 116 43.043 2.813 -7.375 840 HA PRO 117 HA PRO 117 47.470 4.405 1.168 841 HB2 PRO 117 HB2 PRO 117 48.397 7.070 0.558 842 HB3 PRO 117 HB1 PRO 117 49.343 5.627 0.897 843 HG2 PRO 117 HG2 PRO 117 48.496 6.768 -1.700 844 HG3 PRO 117 HG1 PRO 117 49.887 5.718 -1.332 845 HD2 PRO 117 HD2 PRO 117 47.817 4.720 -2.659 846 HD3 PRO 117 HD1 PRO 117 48.544 3.776 -1.341 847 H GLU 118 HN GLU 118 46.636 7.600 0.040 848 HA GLU 118 HA GLU 118 44.158 7.681 1.442 849 HB2 GLU 118 HB2 GLU 118 44.851 9.828 2.651 850 HB3 GLU 118 HB1 GLU 118 45.350 8.299 3.363 851 HG2 GLU 118 HG2 GLU 118 47.560 8.584 2.337 852 HG3 GLU 118 HG1 GLU 118 47.045 10.145 1.697 853 H PHE 119 HN PHE 119 46.720 9.485 -0.151 854 HA PHE 119 HA PHE 119 44.835 10.205 -2.207 855 HB2 PHE 119 HB2 PHE 119 44.859 12.070 -0.484 856 HB3 PHE 119 HB1 PHE 119 46.530 12.361 -0.941 857 HD1 PHE 119 HD1 PHE 119 43.189 11.962 -2.576 858 HD2 PHE 119 HD2 PHE 119 46.927 13.997 -2.488 859 HE1 PHE 119 HE1 PHE 119 42.436 13.427 -4.405 860 HE2 PHE 119 HE2 PHE 119 46.179 15.465 -4.312 861 HZ PHE 119 HZ PHE 119 43.930 15.134 -5.311 862 H GLU 120 HN GLU 120 46.754 8.342 -2.312 863 HA GLU 120 HA GLU 120 48.363 7.557 -3.692 864 HB2 GLU 120 HB2 GLU 120 47.976 10.230 -5.031 865 HB3 GLU 120 HB1 GLU 120 48.934 8.911 -5.695 866 HG2 GLU 120 HG2 GLU 120 46.069 8.566 -4.946 867 HG3 GLU 120 HG1 GLU 120 46.549 9.160 -6.535 868 H GLU 121 HN GLU 121 50.536 8.968 -4.929 869 HA GLU 121 HA GLU 121 51.933 10.092 -2.604 870 HB2 GLU 121 HB2 GLU 121 53.966 8.858 -3.247 871 HB3 GLU 121 HB1 GLU 121 52.650 7.776 -2.816 872 HG2 GLU 121 HG2 GLU 121 52.241 7.228 -5.088 873 HG3 GLU 121 HG1 GLU 121 53.319 8.504 -5.651 874 H ASP 122 HN ASP 122 54.300 10.699 -3.614 875 HA ASP 122 HA ASP 122 55.481 12.204 -4.811 876 HB2 ASP 122 HB2 ASP 122 55.025 10.665 -6.700 877 HB3 ASP 122 HB1 ASP 122 53.568 11.583 -7.069 878 H SER 123 HN SER 123 54.432 13.638 -3.221 879 HA SER 123 HA SER 123 52.979 15.762 -4.651 880 HB2 SER 123 HB2 SER 123 51.912 16.333 -2.455 881 HB3 SER 123 HB1 SER 123 51.425 14.761 -3.089 882 HG SER 123 HG SER 123 53.284 13.989 -1.688 883 H ASP 124 HN ASP 124 53.606 17.875 -4.195 884 HA ASP 124 HA ASP 124 56.329 18.077 -3.184 885 HB2 ASP 124 HB2 ASP 124 56.292 20.333 -4.194 886 HB3 ASP 124 HB1 ASP 124 55.904 19.065 -5.348 887 H PHE 125 HN PHE 125 53.966 17.754 -1.429 888 HA PHE 125 HA PHE 125 54.194 20.236 0.134 889 HB2 PHE 125 HB2 PHE 125 52.070 18.079 0.284 890 HB3 PHE 125 HB1 PHE 125 52.112 19.546 1.255 891 HD1 PHE 125 HD2 PHE 125 51.782 21.755 0.158 892 HD2 PHE 125 HD1 PHE 125 51.221 18.083 -1.920 893 HE1 PHE 125 HE2 PHE 125 50.507 22.939 -1.584 894 HE2 PHE 125 HE1 PHE 125 49.944 19.257 -3.663 895 HZ PHE 125 HZ PHE 125 49.587 21.689 -3.494 896 H VAL 126 HN VAL 126 56.254 19.522 0.918 897 HA VAL 126 HA VAL 126 56.110 17.303 2.835 898 HB VAL 126 HB VAL 126 57.754 16.815 1.161 899 HG11 VAL 126 HG11 VAL 126 59.005 19.487 1.769 900 HG12 VAL 126 HG12 VAL 126 58.139 19.056 0.295 901 HG13 VAL 126 HG13 VAL 126 59.663 18.260 0.687 902 HG21 VAL 126 HG21 VAL 126 59.125 17.757 3.675 903 HG22 VAL 126 HG22 VAL 126 59.782 16.603 2.514 904 HG23 VAL 126 HG23 VAL 126 58.338 16.195 3.441 Start of MODEL 13 1 H1 ASP 1 HT1 ASP 1 -45.034 15.246 0.889 2 H2 ASP 1 HT2 ASP 1 -44.733 14.425 -0.563 3 H3 ASP 1 HT3 ASP 1 -43.505 14.574 0.594 4 HA ASP 1 HA ASP 1 -44.712 13.218 2.136 5 HB2 ASP 1 HB2 ASP 1 -46.713 12.936 -0.119 6 HB3 ASP 1 HB1 ASP 1 -46.742 12.038 1.391 7 H ILE 2 HN ILE 2 -44.790 10.815 1.951 8 HA ILE 2 HA ILE 2 -43.639 8.928 1.480 9 HB ILE 2 HB ILE 2 -43.855 9.840 -1.397 10 HG12 ILE 2 HG12 ILE 2 -45.746 8.165 0.277 11 HG13 ILE 2 HG11 ILE 2 -46.052 9.805 -0.282 12 HG21 ILE 2 HG21 ILE 2 -43.770 7.382 -1.837 13 HG22 ILE 2 HG22 ILE 2 -43.386 7.149 -0.130 14 HG23 ILE 2 HG23 ILE 2 -42.280 8.049 -1.165 15 HD11 ILE 2 HD11 ILE 2 -45.712 7.382 -2.032 16 HD12 ILE 2 HD12 ILE 2 -46.012 9.026 -2.587 17 HD13 ILE 2 HD13 ILE 2 -47.233 8.182 -1.639 18 H ASP 3 HN ASP 3 -41.750 9.506 2.507 19 HA ASP 3 HA ASP 3 -39.749 11.161 1.411 20 HB2 ASP 3 HB2 ASP 3 -39.893 10.767 3.811 21 HB3 ASP 3 HB1 ASP 3 -39.552 9.054 3.574 22 H GLU 4 HN GLU 4 -39.290 10.477 -0.666 23 HA GLU 4 HA GLU 4 -38.383 7.851 -1.263 24 HB2 GLU 4 HB2 GLU 4 -38.183 10.447 -2.777 25 HB3 GLU 4 HB1 GLU 4 -37.600 8.912 -3.412 26 HG2 GLU 4 HG2 GLU 4 -39.886 7.989 -3.089 27 HG3 GLU 4 HG1 GLU 4 -40.426 9.612 -2.668 28 H SER 5 HN SER 5 -36.930 10.297 0.452 29 HA SER 5 HA SER 5 -34.251 10.140 -0.327 30 HB2 SER 5 HB2 SER 5 -35.109 10.343 2.557 31 HB3 SER 5 HB1 SER 5 -33.742 11.123 1.758 32 HG SER 5 HG SER 5 -36.263 12.016 2.079 33 H SER 6 HN SER 6 -36.227 8.098 1.743 34 HA SER 6 HA SER 6 -34.193 6.432 2.733 35 HB2 SER 6 HB2 SER 6 -37.121 5.806 2.287 36 HB3 SER 6 HB1 SER 6 -36.027 4.947 3.374 37 HG SER 6 HG SER 6 -36.854 7.671 3.564 38 H VAL 7 HN VAL 7 -36.414 5.979 -0.037 39 HA VAL 7 HA VAL 7 -35.364 3.454 -0.739 40 HB VAL 7 HB VAL 7 -37.536 3.967 -1.552 41 HG11 VAL 7 HG11 VAL 7 -36.309 6.273 -3.041 42 HG12 VAL 7 HG12 VAL 7 -37.431 6.376 -1.683 43 HG13 VAL 7 HG13 VAL 7 -37.970 5.713 -3.228 44 HG21 VAL 7 HG21 VAL 7 -37.336 3.396 -3.877 45 HG22 VAL 7 HG22 VAL 7 -36.057 2.566 -2.979 46 HG23 VAL 7 HG23 VAL 7 -35.685 4.012 -3.923 47 H MET 8 HN MET 8 -34.658 6.716 -1.883 48 HA MET 8 HA MET 8 -32.856 5.999 -3.899 49 HB2 MET 8 HB2 MET 8 -32.982 8.481 -2.195 50 HB3 MET 8 HB1 MET 8 -31.939 8.306 -3.602 51 HG2 MET 8 HG2 MET 8 -33.898 7.945 -5.008 52 HG3 MET 8 HG1 MET 8 -34.941 8.124 -3.601 53 HE1 MET 8 HE1 MET 8 -31.681 10.162 -4.397 54 HE2 MET 8 HE2 MET 8 -32.334 11.563 -5.248 55 HE3 MET 8 HE3 MET 8 -32.399 9.965 -5.997 56 H GLN 9 HN GLN 9 -32.435 6.265 -0.429 57 HA GLN 9 HA GLN 9 -29.605 6.064 -0.459 58 HB2 GLN 9 HB2 GLN 9 -31.658 5.510 1.670 59 HB3 GLN 9 HB1 GLN 9 -29.936 5.272 1.945 60 HG2 GLN 9 HG2 GLN 9 -29.501 7.602 1.483 61 HG3 GLN 9 HG1 GLN 9 -31.198 7.867 1.090 62 HE21 GLN 9 HE21 GLN 9 -32.702 7.947 2.730 63 HE22 GLN 9 HE22 GLN 9 -32.257 8.142 4.390 64 H LEU 10 HN LEU 10 -32.201 3.626 -0.377 65 HA LEU 10 HA LEU 10 -30.455 1.376 -0.241 66 HB2 LEU 10 HB2 LEU 10 -32.949 1.387 -1.902 67 HB3 LEU 10 HB1 LEU 10 -32.211 0.040 -1.081 68 HG LEU 10 HG LEU 10 -33.874 2.242 0.097 69 HD11 LEU 10 HD11 LEU 10 -34.217 -0.740 0.123 70 HD12 LEU 10 HD12 LEU 10 -34.947 0.328 -1.079 71 HD13 LEU 10 HD13 LEU 10 -35.382 0.486 0.629 72 HD21 LEU 10 HD21 LEU 10 -33.584 0.992 2.249 73 HD22 LEU 10 HD22 LEU 10 -32.155 1.854 1.706 74 HD23 LEU 10 HD23 LEU 10 -32.257 0.113 1.490 75 H ALA 11 HN ALA 11 -31.817 3.261 -2.846 76 HA ALA 11 HA ALA 11 -31.144 1.589 -4.980 77 HB1 ALA 11 HB1 ALA 11 -31.487 4.555 -5.249 78 HB2 ALA 11 HB2 ALA 11 -32.843 3.508 -4.834 79 HB3 ALA 11 HB3 ALA 11 -31.983 3.274 -6.361 80 H GLU 12 HN GLU 12 -29.505 4.464 -3.716 81 HA GLU 12 HA GLU 12 -27.558 4.712 -5.701 82 HB2 GLU 12 HB2 GLU 12 -26.389 6.150 -4.213 83 HB3 GLU 12 HB1 GLU 12 -28.098 6.340 -3.877 84 HG2 GLU 12 HG2 GLU 12 -27.977 5.180 -1.863 85 HG3 GLU 12 HG1 GLU 12 -26.398 4.503 -2.256 86 H MET 13 HN MET 13 -27.652 2.723 -2.859 87 HA MET 13 HA MET 13 -24.947 1.743 -3.386 88 HB2 MET 13 HB2 MET 13 -25.019 0.744 -1.174 89 HB3 MET 13 HB1 MET 13 -25.433 2.451 -1.097 90 HG2 MET 13 HG2 MET 13 -27.772 1.921 -0.892 91 HG3 MET 13 HG1 MET 13 -27.428 0.208 -1.113 92 HE1 MET 13 HE1 MET 13 -28.845 -0.312 1.072 93 HE2 MET 13 HE2 MET 13 -29.151 1.408 1.314 94 HE3 MET 13 HE3 MET 13 -28.530 0.427 2.642 95 H GLY 14 HN GLY 14 -27.856 0.916 -4.549 96 HA2 GLY 14 HA2 GLY 14 -27.135 -1.390 -5.738 97 HA3 GLY 14 HA1 GLY 14 -27.621 -1.948 -4.150 98 H PHE 15 HN PHE 15 -28.636 -0.878 -7.230 99 HA PHE 15 HA PHE 15 -30.478 -1.437 -8.413 100 HB2 PHE 15 HB2 PHE 15 -31.362 -2.800 -5.867 101 HB3 PHE 15 HB1 PHE 15 -32.191 -2.933 -7.413 102 HD1 PHE 15 HD2 PHE 15 -30.736 -3.775 -9.404 103 HD2 PHE 15 HD1 PHE 15 -29.751 -4.345 -5.304 104 HE1 PHE 15 HE2 PHE 15 -29.272 -5.651 -10.023 105 HE2 PHE 15 HE1 PHE 15 -28.284 -6.225 -5.915 106 HZ PHE 15 HZ PHE 15 -28.042 -6.879 -8.279 107 HA PRO 16 HA PRO 16 -33.289 1.913 -7.577 108 HB2 PRO 16 HB2 PRO 16 -34.980 1.503 -9.634 109 HB3 PRO 16 HB1 PRO 16 -33.340 2.113 -9.895 110 HG2 PRO 16 HG2 PRO 16 -34.366 -0.707 -10.120 111 HG3 PRO 16 HG1 PRO 16 -33.366 0.210 -11.274 112 HD2 PRO 16 HD2 PRO 16 -32.277 -1.545 -9.554 113 HD3 PRO 16 HD1 PRO 16 -31.440 -0.045 -10.006 114 H LEU 17 HN LEU 17 -34.028 0.881 -5.583 115 HA LEU 17 HA LEU 17 -36.036 -1.160 -5.754 116 HB2 LEU 17 HB2 LEU 17 -34.921 0.295 -3.350 117 HB3 LEU 17 HB1 LEU 17 -36.013 -1.080 -3.293 118 HG LEU 17 HG LEU 17 -33.219 -1.091 -4.434 119 HD11 LEU 17 HD11 LEU 17 -33.405 -0.973 -1.954 120 HD12 LEU 17 HD12 LEU 17 -32.622 -2.428 -2.560 121 HD13 LEU 17 HD13 LEU 17 -34.289 -2.497 -1.999 122 HD21 LEU 17 HD21 LEU 17 -35.216 -3.335 -4.152 123 HD22 LEU 17 HD22 LEU 17 -33.540 -3.507 -4.673 124 HD23 LEU 17 HD23 LEU 17 -34.683 -2.601 -5.665 125 H GLU 18 HN GLU 18 -37.286 0.636 -7.128 126 HA GLU 18 HA GLU 18 -38.856 2.537 -5.861 127 HB2 GLU 18 HB2 GLU 18 -38.606 1.639 -8.380 128 HB3 GLU 18 HB1 GLU 18 -40.127 0.866 -7.950 129 HG2 GLU 18 HG2 GLU 18 -39.795 3.763 -7.390 130 HG3 GLU 18 HG1 GLU 18 -40.036 3.230 -9.048 131 H ALA 19 HN ALA 19 -39.010 -0.920 -5.706 132 HA ALA 19 HA ALA 19 -41.550 -1.321 -4.631 133 HB1 ALA 19 HB1 ALA 19 -39.073 -2.730 -3.679 134 HB2 ALA 19 HB2 ALA 19 -39.810 -3.052 -5.244 135 HB3 ALA 19 HB3 ALA 19 -40.721 -3.357 -3.767 136 H CYS 20 HN CYS 20 -38.586 -0.157 -3.208 137 HA CYS 20 HA CYS 20 -39.596 0.044 -0.537 138 HB2 CYS 20 HB2 CYS 20 -37.133 -0.028 -1.135 139 HB3 CYS 20 HB1 CYS 20 -37.314 1.610 -1.738 140 HG CYS 20 HG CYS 20 -37.465 0.533 1.487 141 H ARG 21 HN ARG 21 -39.354 2.161 -3.335 142 HA ARG 21 HA ARG 21 -40.099 4.573 -2.132 143 HB2 ARG 21 HB2 ARG 21 -39.371 3.989 -4.587 144 HB3 ARG 21 HB1 ARG 21 -41.099 3.835 -4.869 145 HG2 ARG 21 HG2 ARG 21 -39.923 6.300 -3.642 146 HG3 ARG 21 HG1 ARG 21 -39.978 6.065 -5.389 147 HD2 ARG 21 HD2 ARG 21 -42.405 5.869 -3.625 148 HD3 ARG 21 HD1 ARG 21 -41.886 7.376 -4.379 149 HE ARG 21 HE ARG 21 -42.539 4.967 -5.966 150 HH11 ARG 21 HH11 ARG 21 -42.770 8.415 -5.358 151 HH12 ARG 21 HH12 ARG 21 -43.769 8.718 -6.747 152 HH21 ARG 21 HH21 ARG 21 -43.855 5.378 -7.794 153 HH22 ARG 21 HH22 ARG 21 -44.374 7.003 -8.124 154 H LYS 22 HN LYS 22 -42.148 2.056 -3.592 155 HA LYS 22 HA LYS 22 -44.571 3.275 -2.675 156 HB2 LYS 22 HB2 LYS 22 -45.681 1.262 -3.481 157 HB3 LYS 22 HB1 LYS 22 -44.525 1.839 -4.670 158 HG2 LYS 22 HG2 LYS 22 -42.913 0.137 -3.696 159 HG3 LYS 22 HG1 LYS 22 -44.313 -0.543 -2.868 160 HD2 LYS 22 HD2 LYS 22 -44.194 -1.812 -4.811 161 HD3 LYS 22 HD1 LYS 22 -45.390 -0.584 -5.219 162 HE2 LYS 22 HE2 LYS 22 -42.465 -0.362 -5.912 163 HE3 LYS 22 HE1 LYS 22 -43.675 -1.041 -6.999 164 HZ1 LYS 22 HZ1 LYS 22 -43.258 1.270 -7.516 165 HZ2 LYS 22 HZ2 LYS 22 -43.641 1.730 -5.936 166 HZ3 LYS 22 HZ3 LYS 22 -44.845 1.091 -6.941 167 H ALA 23 HN ALA 23 -42.281 1.013 -1.349 168 HA ALA 23 HA ALA 23 -43.832 0.029 0.801 169 HB1 ALA 23 HB1 ALA 23 -41.701 -0.556 1.831 170 HB2 ALA 23 HB2 ALA 23 -40.855 0.459 0.657 171 HB3 ALA 23 HB3 ALA 23 -41.711 -0.987 0.119 172 H VAL 24 HN VAL 24 -41.739 2.843 0.440 173 HA VAL 24 HA VAL 24 -42.009 3.909 3.012 174 HB VAL 24 HB VAL 24 -41.722 5.346 0.360 175 HG11 VAL 24 HG11 VAL 24 -40.946 7.270 1.662 176 HG12 VAL 24 HG12 VAL 24 -41.365 6.419 3.151 177 HG13 VAL 24 HG13 VAL 24 -42.629 6.873 2.010 178 HG21 VAL 24 HG21 VAL 24 -39.367 5.536 0.982 179 HG22 VAL 24 HG22 VAL 24 -39.870 3.848 0.891 180 HG23 VAL 24 HG23 VAL 24 -39.682 4.629 2.463 181 H TYR 25 HN TYR 25 -44.083 4.196 0.148 182 HA TYR 25 HA TYR 25 -46.068 5.813 1.294 183 HB2 TYR 25 HB2 TYR 25 -46.072 5.327 -1.084 184 HB3 TYR 25 HB1 TYR 25 -46.327 3.611 -0.766 185 HD1 TYR 25 HD2 TYR 25 -47.916 6.949 -0.331 186 HD2 TYR 25 HD1 TYR 25 -48.483 2.750 -0.645 187 HE1 TYR 25 HE2 TYR 25 -50.348 7.293 -0.440 188 HE2 TYR 25 HE1 TYR 25 -50.914 3.079 -0.757 189 HH TYR 25 HH TYR 25 -52.570 4.796 -0.032 190 H PHE 26 HN PHE 26 -45.637 2.282 1.399 191 HA PHE 26 HA PHE 26 -47.943 1.693 2.918 192 HB2 PHE 26 HB2 PHE 26 -45.311 0.243 2.634 193 HB3 PHE 26 HB1 PHE 26 -46.628 -0.375 3.622 194 HD1 PHE 26 HD2 PHE 26 -48.953 -0.470 2.350 195 HD2 PHE 26 HD1 PHE 26 -45.131 -0.526 0.489 196 HE1 PHE 26 HE2 PHE 26 -49.942 -1.520 0.358 197 HE2 PHE 26 HE1 PHE 26 -46.111 -1.568 -1.510 198 HZ PHE 26 HZ PHE 26 -48.484 -2.174 -1.536 199 H THR 27 HN THR 27 -44.604 2.379 3.897 200 HA THR 27 HA THR 27 -45.065 1.948 6.666 201 HB THR 27 HB THR 27 -42.869 3.123 6.980 202 HG1 THR 27 HG1 THR 27 -42.476 3.006 4.212 203 HG21 THR 27 HG21 THR 27 -42.897 0.923 4.911 204 HG22 THR 27 HG22 THR 27 -43.031 0.684 6.653 205 HG23 THR 27 HG23 THR 27 -41.551 1.350 5.967 206 H GLY 28 HN GLY 28 -45.948 4.480 4.635 207 HA2 GLY 28 HA2 GLY 28 -47.029 6.469 5.100 208 HA3 GLY 28 HA1 GLY 28 -46.899 6.084 6.813 209 H ASN 29 HN ASN 29 -44.317 6.324 4.450 210 HA ASN 29 HA ASN 29 -42.279 7.290 4.594 211 HB2 ASN 29 HB2 ASN 29 -42.342 9.822 4.639 212 HB3 ASN 29 HB1 ASN 29 -43.286 9.040 3.384 213 HD21 ASN 29 HD21 ASN 29 -43.384 10.916 6.307 214 HD22 ASN 29 HD22 ASN 29 -45.053 11.365 6.188 215 H MET 30 HN MET 30 -42.698 6.064 6.900 216 HA MET 30 HA MET 30 -42.268 7.603 9.215 217 HB2 MET 30 HB2 MET 30 -41.784 4.756 8.450 218 HB3 MET 30 HB1 MET 30 -41.087 5.355 9.946 219 HG2 MET 30 HG2 MET 30 -43.317 5.998 10.718 220 HG3 MET 30 HG1 MET 30 -44.007 5.390 9.213 221 HE1 MET 30 HE1 MET 30 -45.167 2.759 11.893 222 HE2 MET 30 HE2 MET 30 -45.697 3.824 10.592 223 HE3 MET 30 HE3 MET 30 -45.019 4.508 12.069 224 H GLY 31 HN GLY 31 -39.886 5.643 7.433 225 HA2 GLY 31 HA2 GLY 31 -37.929 7.592 7.148 226 HA3 GLY 31 HA1 GLY 31 -37.646 6.817 8.701 227 H ALA 32 HN ALA 32 -35.622 6.489 7.217 228 HA ALA 32 HA ALA 32 -35.709 4.541 5.182 229 HB1 ALA 32 HB1 ALA 32 -33.366 5.330 6.906 230 HB2 ALA 32 HB2 ALA 32 -33.887 6.169 5.447 231 HB3 ALA 32 HB3 ALA 32 -33.293 4.510 5.345 232 H GLU 33 HN GLU 33 -35.352 4.307 8.656 233 HA GLU 33 HA GLU 33 -34.176 1.811 8.919 234 HB2 GLU 33 HB2 GLU 33 -36.304 3.045 10.676 235 HB3 GLU 33 HB1 GLU 33 -35.272 1.698 11.132 236 HG2 GLU 33 HG2 GLU 33 -34.333 4.475 10.460 237 HG3 GLU 33 HG1 GLU 33 -34.505 3.808 12.083 238 H VAL 34 HN VAL 34 -37.695 2.424 9.127 239 HA VAL 34 HA VAL 34 -38.317 -0.308 9.143 240 HB VAL 34 HB VAL 34 -40.654 0.436 8.863 241 HG11 VAL 34 HG11 VAL 34 -40.807 1.552 11.031 242 HG12 VAL 34 HG12 VAL 34 -39.075 1.882 10.984 243 HG13 VAL 34 HG13 VAL 34 -39.654 0.218 11.082 244 HG21 VAL 34 HG21 VAL 34 -41.180 2.777 8.846 245 HG22 VAL 34 HG22 VAL 34 -40.131 2.383 7.488 246 HG23 VAL 34 HG23 VAL 34 -39.463 3.190 8.899 247 H ALA 35 HN ALA 35 -37.990 2.002 6.543 248 HA ALA 35 HA ALA 35 -39.384 0.328 4.667 249 HB1 ALA 35 HB1 ALA 35 -39.269 2.822 4.492 250 HB2 ALA 35 HB2 ALA 35 -38.902 1.917 3.027 251 HB3 ALA 35 HB3 ALA 35 -37.590 2.629 3.968 252 H PHE 36 HN PHE 36 -35.984 0.959 5.463 253 HA PHE 36 HA PHE 36 -34.795 -0.571 3.433 254 HB2 PHE 36 HB2 PHE 36 -33.423 0.784 4.889 255 HB3 PHE 36 HB1 PHE 36 -33.941 -0.119 6.307 256 HD1 PHE 36 HD2 PHE 36 -32.219 -0.603 3.041 257 HD2 PHE 36 HD1 PHE 36 -32.612 -1.834 7.097 258 HE1 PHE 36 HE2 PHE 36 -30.301 -2.119 2.763 259 HE2 PHE 36 HE1 PHE 36 -30.697 -3.353 6.827 260 HZ PHE 36 HZ PHE 36 -29.529 -3.487 4.664 261 H ASN 37 HN ASN 37 -36.030 -1.482 6.632 262 HA ASN 37 HA ASN 37 -35.525 -4.250 6.415 263 HB2 ASN 37 HB2 ASN 37 -37.399 -2.598 8.081 264 HB3 ASN 37 HB1 ASN 37 -37.464 -4.353 8.134 265 HD21 ASN 37 HD21 ASN 37 -35.615 -1.533 8.954 266 HD22 ASN 37 HD22 ASN 37 -34.467 -2.347 9.962 267 H TRP 38 HN TRP 38 -38.169 -2.210 5.341 268 HA TRP 38 HA TRP 38 -40.051 -4.263 4.879 269 HB2 TRP 38 HB2 TRP 38 -40.403 -1.692 5.030 270 HB3 TRP 38 HB1 TRP 38 -39.972 -1.680 3.328 271 HD1 TRP 38 HD1 TRP 38 -41.630 -3.098 1.649 272 HE1 TRP 38 HE1 TRP 38 -44.167 -3.521 1.813 273 HE3 TRP 38 HE3 TRP 38 -42.284 -2.043 6.601 274 HZ2 TRP 38 HZ2 TRP 38 -46.178 -3.405 3.800 275 HZ3 TRP 38 HZ3 TRP 38 -44.540 -2.219 7.559 276 HH2 TRP 38 HH2 TRP 38 -46.449 -2.887 6.186 277 H ILE 39 HN ILE 39 -37.492 -2.852 2.927 278 HA ILE 39 HA ILE 39 -38.365 -4.137 0.519 279 HB ILE 39 HB ILE 39 -36.989 -1.959 0.703 280 HG12 ILE 39 HG12 ILE 39 -35.945 -2.364 -1.480 281 HG13 ILE 39 HG11 ILE 39 -36.134 -4.102 -1.249 282 HG21 ILE 39 HG21 ILE 39 -34.668 -3.869 0.679 283 HG22 ILE 39 HG22 ILE 39 -35.179 -2.977 2.109 284 HG23 ILE 39 HG23 ILE 39 -34.613 -2.106 0.683 285 HD11 ILE 39 HD11 ILE 39 -37.834 -3.156 -2.729 286 HD12 ILE 39 HD12 ILE 39 -38.391 -2.126 -1.408 287 HD13 ILE 39 HD13 ILE 39 -38.532 -3.881 -1.281 288 H ILE 40 HN ILE 40 -35.881 -4.772 2.935 289 HA ILE 40 HA ILE 40 -34.697 -6.871 1.438 290 HB ILE 40 HB ILE 40 -33.452 -7.428 3.442 291 HG12 ILE 40 HG12 ILE 40 -33.879 -5.669 5.399 292 HG13 ILE 40 HG11 ILE 40 -35.522 -5.749 4.770 293 HG21 ILE 40 HG21 ILE 40 -32.591 -5.002 3.875 294 HG22 ILE 40 HG22 ILE 40 -33.705 -4.587 2.577 295 HG23 ILE 40 HG23 ILE 40 -32.405 -5.742 2.288 296 HD11 ILE 40 HD11 ILE 40 -33.870 -7.970 5.924 297 HD12 ILE 40 HD12 ILE 40 -35.343 -8.257 4.996 298 HD13 ILE 40 HD13 ILE 40 -35.412 -7.333 6.504 299 H VAL 41 HN VAL 41 -37.365 -6.740 3.667 300 HA VAL 41 HA VAL 41 -37.598 -9.601 3.799 301 HB VAL 41 HB VAL 41 -38.448 -8.140 5.625 302 HG11 VAL 41 HG11 VAL 41 -40.586 -7.032 5.416 303 HG12 VAL 41 HG12 VAL 41 -40.682 -7.495 3.717 304 HG13 VAL 41 HG13 VAL 41 -39.436 -6.368 4.253 305 HG21 VAL 41 HG21 VAL 41 -40.448 -9.980 4.333 306 HG22 VAL 41 HG22 VAL 41 -40.521 -9.411 6.000 307 HG23 VAL 41 HG23 VAL 41 -39.180 -10.428 5.475 308 H HIS 42 HN HIS 42 -38.863 -7.032 1.735 309 HA HIS 42 HA HIS 42 -40.584 -9.009 0.399 310 HB2 HIS 42 HB2 HIS 42 -40.536 -6.010 0.398 311 HB3 HIS 42 HB1 HIS 42 -41.354 -6.893 -0.885 312 HD1 HIS 42 HD1 HIS 42 -41.811 -5.685 2.531 313 HD2 HIS 42 HD2 HIS 42 -43.504 -8.579 0.081 314 HE1 HIS 42 HE1 HIS 42 -43.993 -6.304 3.625 315 HE2 HIS 42 HE2 HIS 42 -45.062 -7.956 2.042 316 H MET 43 HN MET 43 -37.524 -8.443 0.165 317 HA MET 43 HA MET 43 -37.026 -7.755 -2.510 318 HB2 MET 43 HB2 MET 43 -34.821 -8.734 -2.181 319 HB3 MET 43 HB1 MET 43 -35.285 -7.779 -0.781 320 HG2 MET 43 HG2 MET 43 -34.368 -9.627 0.214 321 HG3 MET 43 HG1 MET 43 -36.072 -10.064 0.174 322 HE1 MET 43 HE1 MET 43 -33.647 -10.004 -2.906 323 HE2 MET 43 HE2 MET 43 -33.024 -11.654 -2.905 324 HE3 MET 43 HE3 MET 43 -32.586 -10.547 -1.607 325 H GLU 44 HN GLU 44 -38.281 -10.643 -1.133 326 HA GLU 44 HA GLU 44 -37.460 -12.377 -3.256 327 HB2 GLU 44 HB2 GLU 44 -39.056 -13.996 -2.188 328 HB3 GLU 44 HB1 GLU 44 -37.766 -13.409 -1.150 329 HG2 GLU 44 HG2 GLU 44 -39.340 -11.809 -0.138 330 HG3 GLU 44 HG1 GLU 44 -40.625 -12.467 -1.151 331 H GLU 45 HN GLU 45 -39.757 -9.983 -3.144 332 HA GLU 45 HA GLU 45 -41.842 -11.099 -4.704 333 HB2 GLU 45 HB2 GLU 45 -40.823 -8.293 -4.293 334 HB3 GLU 45 HB1 GLU 45 -42.134 -8.631 -5.412 335 HG2 GLU 45 HG2 GLU 45 -42.225 -9.438 -2.526 336 HG3 GLU 45 HG1 GLU 45 -42.776 -7.863 -3.096 337 HA PRO 46 HA PRO 46 -39.553 -11.715 -8.540 338 HB2 PRO 46 HB2 PRO 46 -41.869 -11.925 -10.058 339 HB3 PRO 46 HB1 PRO 46 -41.076 -13.273 -9.228 340 HG2 PRO 46 HG2 PRO 46 -43.422 -11.625 -8.386 341 HG3 PRO 46 HG1 PRO 46 -43.148 -13.370 -8.193 342 HD2 PRO 46 HD2 PRO 46 -42.850 -11.685 -6.141 343 HD3 PRO 46 HD1 PRO 46 -41.760 -13.069 -6.358 344 H ASP 47 HN ASP 47 -42.242 -9.529 -8.095 345 HA ASP 47 HA ASP 47 -41.361 -7.909 -10.387 346 HB2 ASP 47 HB2 ASP 47 -43.447 -9.013 -10.854 347 HB3 ASP 47 HB1 ASP 47 -44.127 -8.508 -9.319 348 H PHE 48 HN PHE 48 -40.520 -7.766 -7.567 349 HA PHE 48 HA PHE 48 -41.802 -5.689 -6.190 350 HB2 PHE 48 HB2 PHE 48 -39.888 -5.601 -4.758 351 HB3 PHE 48 HB1 PHE 48 -40.148 -7.286 -5.189 352 HD1 PHE 48 HD2 PHE 48 -38.811 -7.909 -7.481 353 HD2 PHE 48 HD1 PHE 48 -37.682 -4.938 -4.650 354 HE1 PHE 48 HE2 PHE 48 -36.473 -8.081 -8.230 355 HE2 PHE 48 HE1 PHE 48 -35.348 -5.104 -5.398 356 HZ PHE 48 HZ PHE 48 -34.715 -6.653 -7.123 357 H ALA 49 HN ALA 49 -39.155 -5.569 -8.554 358 HA ALA 49 HA ALA 49 -39.586 -2.813 -9.071 359 HB1 ALA 49 HB1 ALA 49 -38.211 -2.423 -7.163 360 HB2 ALA 49 HB2 ALA 49 -37.146 -2.247 -8.565 361 HB3 ALA 49 HB3 ALA 49 -37.111 -3.729 -7.606 362 H GLU 50 HN GLU 50 -38.244 -2.145 -10.797 363 HA GLU 50 HA GLU 50 -37.323 -4.329 -12.523 364 HB2 GLU 50 HB2 GLU 50 -37.808 -1.417 -13.215 365 HB3 GLU 50 HB1 GLU 50 -37.455 -2.714 -14.352 366 HG2 GLU 50 HG2 GLU 50 -39.558 -3.766 -13.898 367 HG3 GLU 50 HG1 GLU 50 -39.892 -2.631 -12.589 368 HA PRO 51 HA PRO 51 -33.467 -2.601 -10.866 369 HB2 PRO 51 HB2 PRO 51 -32.148 -4.898 -10.573 370 HB3 PRO 51 HB1 PRO 51 -33.440 -4.423 -9.470 371 HG2 PRO 51 HG2 PRO 51 -33.463 -6.427 -11.663 372 HG3 PRO 51 HG1 PRO 51 -34.330 -6.441 -10.120 373 HD2 PRO 51 HD2 PRO 51 -35.381 -5.696 -12.614 374 HD3 PRO 51 HD1 PRO 51 -36.125 -5.412 -11.029 375 H LEU 52 HN LEU 52 -33.912 -2.300 -13.543 376 HA LEU 52 HA LEU 52 -31.783 -3.611 -15.019 377 HB2 LEU 52 HB2 LEU 52 -33.755 -1.500 -15.895 378 HB3 LEU 52 HB1 LEU 52 -32.657 -2.367 -16.950 379 HG LEU 52 HG LEU 52 -34.942 -3.585 -15.392 380 HD11 LEU 52 HD11 LEU 52 -34.588 -3.011 -18.329 381 HD12 LEU 52 HD12 LEU 52 -35.744 -2.254 -17.234 382 HD13 LEU 52 HD13 LEU 52 -35.904 -3.962 -17.637 383 HD21 LEU 52 HD21 LEU 52 -33.042 -4.851 -17.365 384 HD22 LEU 52 HD22 LEU 52 -34.436 -5.634 -16.619 385 HD23 LEU 52 HD23 LEU 52 -33.065 -5.137 -15.626 386 H THR 53 HN THR 53 -31.052 -1.894 -12.834 387 HA THR 53 HA THR 53 -29.067 -0.319 -14.188 388 HB THR 53 HB THR 53 -31.016 1.097 -12.347 389 HG1 THR 53 HG1 THR 53 -31.044 0.700 -15.018 390 HG21 THR 53 HG21 THR 53 -28.725 1.905 -12.092 391 HG22 THR 53 HG22 THR 53 -29.726 3.109 -12.907 392 HG23 THR 53 HG23 THR 53 -28.597 2.122 -13.836 393 H MET 54 HN MET 54 -27.593 -1.635 -13.154 394 HA MET 54 HA MET 54 -27.542 -1.722 -10.241 395 HB2 MET 54 HB2 MET 54 -25.547 -2.805 -12.244 396 HB3 MET 54 HB1 MET 54 -25.608 -3.180 -10.526 397 HG2 MET 54 HG2 MET 54 -27.802 -4.223 -10.840 398 HG3 MET 54 HG1 MET 54 -27.717 -3.866 -12.561 399 HE1 MET 54 HE1 MET 54 -24.937 -5.123 -10.066 400 HE2 MET 54 HE2 MET 54 -24.991 -6.861 -10.358 401 HE3 MET 54 HE3 MET 54 -26.369 -6.048 -9.616 402 HA PRO 55 HA PRO 55 -25.260 2.157 -10.575 403 HB2 PRO 55 HB2 PRO 55 -25.622 2.337 -7.685 404 HB3 PRO 55 HB1 PRO 55 -26.275 3.373 -8.955 405 HG2 PRO 55 HG2 PRO 55 -27.829 1.710 -7.497 406 HG3 PRO 55 HG1 PRO 55 -28.184 2.110 -9.187 407 HD2 PRO 55 HD2 PRO 55 -26.879 -0.341 -8.060 408 HD3 PRO 55 HD1 PRO 55 -28.111 -0.207 -9.335 409 H GLY 56 HN GLY 56 -24.740 0.360 -7.529 410 HA2 GLY 56 HA2 GLY 56 -22.482 -0.863 -7.596 411 HA3 GLY 56 HA1 GLY 56 -21.847 0.744 -7.911 412 H TYR 57 HN TYR 57 -20.659 -0.113 -5.895 413 HA TYR 57 HA TYR 57 -21.610 1.341 -3.639 414 HB2 TYR 57 HB2 TYR 57 -21.538 -0.735 -2.107 415 HB3 TYR 57 HB1 TYR 57 -22.982 -0.496 -3.086 416 HD1 TYR 57 HD2 TYR 57 -19.762 -2.340 -2.987 417 HD2 TYR 57 HD1 TYR 57 -23.718 -2.194 -4.532 418 HE1 TYR 57 HE2 TYR 57 -19.479 -4.603 -3.897 419 HE2 TYR 57 HE1 TYR 57 -23.450 -4.459 -5.447 420 HH TYR 57 HH TYR 57 -20.864 -6.501 -4.563 421 H GLY 58 HN GLY 58 -20.049 0.884 -1.695 422 HA2 GLY 58 HA2 GLY 58 -17.753 -0.321 -1.482 423 HA3 GLY 58 HA1 GLY 58 -17.349 0.707 -2.847 424 H GLY 59 HN GLY 59 -15.934 2.105 -2.048 425 HA2 GLY 59 HA2 GLY 59 -16.485 4.361 -0.699 426 HA3 GLY 59 HA1 GLY 59 -16.259 3.214 0.615 427 H ALA 60 HN ALA 60 -14.362 3.762 1.479 428 HA ALA 60 HA ALA 60 -12.015 3.566 -0.281 429 HB1 ALA 60 HB1 ALA 60 -10.907 5.371 0.919 430 HB2 ALA 60 HB2 ALA 60 -12.349 5.625 1.902 431 HB3 ALA 60 HB3 ALA 60 -12.396 5.945 0.168 432 H ALA 61 HN ALA 61 -13.225 3.574 3.055 433 HA ALA 61 HA ALA 61 -12.612 2.404 4.910 434 HB1 ALA 61 HB1 ALA 61 -12.311 0.019 4.593 435 HB2 ALA 61 HB2 ALA 61 -11.981 0.269 2.878 436 HB3 ALA 61 HB3 ALA 61 -13.582 0.623 3.528 437 H SER 62 HN SER 62 -10.689 4.123 4.452 438 HA SER 62 HA SER 62 -8.542 4.641 4.932 439 HB2 SER 62 HB2 SER 62 -8.438 1.802 5.989 440 HB3 SER 62 HB1 SER 62 -7.225 3.046 6.295 441 HG SER 62 HG SER 62 -9.635 4.040 6.889 442 H ALA 63 HN ALA 63 -8.610 4.503 2.441 443 HA ALA 63 HA ALA 63 -7.066 2.376 1.260 444 HB1 ALA 63 HB1 ALA 63 -7.932 5.019 0.086 445 HB2 ALA 63 HB2 ALA 63 -8.837 3.508 -0.005 446 HB3 ALA 63 HB3 ALA 63 -7.275 3.649 -0.811 447 H GLY 64 HN GLY 64 -6.553 5.760 2.145 448 HA2 GLY 64 HA2 GLY 64 -3.715 5.523 1.446 449 HA3 GLY 64 HA1 GLY 64 -4.563 7.012 1.851 450 H ALA 65 HN ALA 65 -4.318 3.892 3.535 451 HA ALA 65 HA ALA 65 -3.761 5.365 6.004 452 HB1 ALA 65 HB1 ALA 65 -5.664 3.806 5.968 453 HB2 ALA 65 HB2 ALA 65 -4.450 3.363 7.170 454 HB3 ALA 65 HB3 ALA 65 -4.549 2.477 5.647 455 H SER 66 HN SER 66 -1.744 4.719 3.869 456 HA SER 66 HA SER 66 0.300 3.762 5.684 457 HB2 SER 66 HB2 SER 66 -0.297 2.327 3.081 458 HB3 SER 66 HB1 SER 66 1.147 2.067 4.061 459 HG SER 66 HG SER 66 -1.176 1.891 5.497 460 H VAL 67 HN VAL 67 2.261 4.591 5.278 461 HA VAL 67 HA VAL 67 2.522 6.338 2.916 462 HB VAL 67 HB VAL 67 4.040 6.489 5.534 463 HG11 VAL 67 HG11 VAL 67 3.985 8.356 3.167 464 HG12 VAL 67 HG12 VAL 67 5.332 7.338 3.673 465 HG13 VAL 67 HG13 VAL 67 4.801 8.669 4.700 466 HG21 VAL 67 HG21 VAL 67 2.716 8.477 6.020 467 HG22 VAL 67 HG22 VAL 67 1.679 7.064 5.835 468 HG23 VAL 67 HG23 VAL 67 1.798 8.246 4.531 469 H PHE 68 HN PHE 68 3.542 5.142 1.398 470 HA PHE 68 HA PHE 68 5.956 3.676 2.227 471 HB2 PHE 68 HB2 PHE 68 4.106 2.149 1.598 472 HB3 PHE 68 HB1 PHE 68 4.043 2.906 0.012 473 HD1 PHE 68 HD2 PHE 68 6.268 0.996 2.282 474 HD2 PHE 68 HD1 PHE 68 5.412 2.162 -1.717 475 HE1 PHE 68 HE2 PHE 68 7.962 -0.585 1.467 476 HE2 PHE 68 HE1 PHE 68 7.108 0.578 -2.543 477 HZ PHE 68 HZ PHE 68 8.384 -0.796 -0.948 478 H GLY 69 HN GLY 69 7.519 5.068 1.666 479 HA2 GLY 69 HA2 GLY 69 7.689 5.720 -1.213 480 HA3 GLY 69 HA1 GLY 69 8.120 6.901 0.020 481 H ALA 70 HN ALA 70 8.783 3.622 0.673 482 HA ALA 70 HA ALA 70 11.608 4.225 0.821 483 HB1 ALA 70 HB1 ALA 70 10.385 3.066 2.654 484 HB2 ALA 70 HB2 ALA 70 11.813 2.206 2.082 485 HB3 ALA 70 HB3 ALA 70 10.206 1.671 1.589 486 H SER 71 HN SER 71 11.761 4.394 -1.561 487 HA SER 71 HA SER 71 11.623 2.102 -3.213 488 HB2 SER 71 HB2 SER 71 13.171 3.476 -4.695 489 HB3 SER 71 HB1 SER 71 11.652 4.256 -4.253 490 HG SER 71 HG SER 71 14.270 4.861 -3.493 491 H GLY 72 HN GLY 72 14.228 3.614 -1.392 492 HA2 GLY 72 HA2 GLY 72 15.590 1.024 -1.269 493 HA3 GLY 72 HA1 GLY 72 16.504 2.423 -1.832 494 H LEU 73 HN LEU 73 14.660 1.135 0.876 495 HA LEU 73 HA LEU 73 15.326 3.292 2.634 496 HB2 LEU 73 HB2 LEU 73 13.281 1.808 2.753 497 HB3 LEU 73 HB1 LEU 73 14.332 0.574 3.420 498 HG LEU 73 HG LEU 73 14.407 3.211 4.763 499 HD11 LEU 73 HD11 LEU 73 12.056 1.345 5.015 500 HD12 LEU 73 HD12 LEU 73 12.040 2.940 4.263 501 HD13 LEU 73 HD13 LEU 73 12.360 2.783 5.993 502 HD21 LEU 73 HD21 LEU 73 14.537 1.801 6.748 503 HD22 LEU 73 HD22 LEU 73 15.731 1.305 5.545 504 HD23 LEU 73 HD23 LEU 73 14.253 0.367 5.763 505 H ASP 74 HN ASP 74 16.277 -0.131 2.485 506 HA ASP 74 HA ASP 74 18.548 0.465 4.233 507 HB2 ASP 74 HB2 ASP 74 17.166 -1.449 4.881 508 HB3 ASP 74 HB1 ASP 74 17.435 -2.191 3.305 509 H ASN 75 HN ASN 75 20.429 0.882 3.344 510 HA ASN 75 HA ASN 75 21.148 -0.477 0.841 511 HB2 ASN 75 HB2 ASN 75 22.247 1.554 0.035 512 HB3 ASN 75 HB1 ASN 75 20.541 1.864 0.331 513 HD21 ASN 75 HD21 ASN 75 22.817 3.686 0.192 514 HD22 ASN 75 HD22 ASN 75 22.846 4.535 1.703 515 H GLN 76 HN GLN 76 21.715 -1.226 3.507 516 HA GLN 76 HA GLN 76 24.431 -0.411 4.107 517 HB2 GLN 76 HB2 GLN 76 22.729 -0.819 5.887 518 HB3 GLN 76 HB1 GLN 76 22.703 -2.513 5.420 519 HG2 GLN 76 HG2 GLN 76 25.275 -2.356 5.846 520 HG3 GLN 76 HG1 GLN 76 24.809 -0.975 6.837 521 HE21 GLN 76 HE21 GLN 76 25.916 -3.609 7.565 522 HE22 GLN 76 HE22 GLN 76 24.808 -4.275 8.710 523 HA PRO 77 HA PRO 77 26.462 -3.838 1.999 524 HB2 PRO 77 HB2 PRO 77 28.388 -3.470 4.226 525 HB3 PRO 77 HB1 PRO 77 28.680 -3.506 2.484 526 HG2 PRO 77 HG2 PRO 77 28.774 -1.228 3.798 527 HG3 PRO 77 HG1 PRO 77 27.995 -1.308 2.208 528 HD2 PRO 77 HD2 PRO 77 26.750 -1.276 4.935 529 HD3 PRO 77 HD1 PRO 77 26.274 -0.385 3.477 530 HA PRO 78 HA PRO 78 25.577 -7.433 4.437 531 HB2 PRO 78 HB2 PRO 78 27.608 -9.104 3.743 532 HB3 PRO 78 HB1 PRO 78 26.264 -8.726 2.659 533 HG2 PRO 78 HG2 PRO 78 29.000 -7.523 2.752 534 HG3 PRO 78 HG1 PRO 78 28.085 -8.073 1.341 535 HD2 PRO 78 HD2 PRO 78 28.228 -5.490 2.006 536 HD3 PRO 78 HD1 PRO 78 26.745 -6.189 1.336 537 H GLU 79 HN GLU 79 25.792 -7.218 6.556 538 HA GLU 79 HA GLU 79 27.997 -6.309 7.975 539 HB2 GLU 79 HB2 GLU 79 26.881 -7.171 9.945 540 HB3 GLU 79 HB1 GLU 79 25.702 -6.436 8.874 541 HG2 GLU 79 HG2 GLU 79 25.306 -8.792 8.001 542 HG3 GLU 79 HG1 GLU 79 26.188 -9.337 9.421 543 H GLU 80 HN GLU 80 27.195 -9.525 6.866 544 HA GLU 80 HA GLU 80 29.053 -11.027 8.279 545 HB2 GLU 80 HB2 GLU 80 27.671 -12.350 7.007 546 HB3 GLU 80 HB1 GLU 80 27.700 -11.249 5.641 547 HG2 GLU 80 HG2 GLU 80 29.953 -11.993 5.084 548 HG3 GLU 80 HG1 GLU 80 29.920 -13.114 6.451 549 H ILE 81 HN ILE 81 29.423 -9.287 5.221 550 HA ILE 81 HA ILE 81 32.156 -10.047 4.955 551 HB ILE 81 HB ILE 81 30.454 -8.109 3.413 552 HG12 ILE 81 HG12 ILE 81 31.637 -10.802 2.709 553 HG13 ILE 81 HG11 ILE 81 29.958 -10.522 3.159 554 HG21 ILE 81 HG21 ILE 81 32.487 -8.372 1.778 555 HG22 ILE 81 HG22 ILE 81 33.368 -8.692 3.278 556 HG23 ILE 81 HG23 ILE 81 32.514 -7.164 3.063 557 HD11 ILE 81 HD11 ILE 81 31.409 -9.764 0.666 558 HD12 ILE 81 HD12 ILE 81 29.982 -8.868 1.169 559 HD13 ILE 81 HD13 ILE 81 29.866 -10.601 0.853 560 H VAL 82 HN VAL 82 30.477 -7.058 5.917 561 HA VAL 82 HA VAL 82 32.734 -5.431 6.103 562 HB VAL 82 HB VAL 82 31.536 -3.991 7.556 563 HG11 VAL 82 HG11 VAL 82 29.353 -3.754 6.475 564 HG12 VAL 82 HG12 VAL 82 29.560 -5.348 5.749 565 HG13 VAL 82 HG13 VAL 82 30.652 -4.033 5.313 566 HG21 VAL 82 HG21 VAL 82 30.559 -4.895 9.338 567 HG22 VAL 82 HG22 VAL 82 30.328 -6.442 8.522 568 HG23 VAL 82 HG23 VAL 82 29.154 -5.139 8.295 569 H ALA 83 HN ALA 83 31.350 -7.780 8.286 570 HA ALA 83 HA ALA 83 33.032 -7.506 10.500 571 HB1 ALA 83 HB1 ALA 83 32.397 -10.038 10.711 572 HB2 ALA 83 HB2 ALA 83 31.329 -9.656 9.343 573 HB3 ALA 83 HB3 ALA 83 31.159 -8.787 10.873 574 H ILE 84 HN ILE 84 33.261 -9.562 7.621 575 HA ILE 84 HA ILE 84 35.649 -10.887 8.283 576 HB ILE 84 HB ILE 84 34.416 -10.254 5.598 577 HG12 ILE 84 HG12 ILE 84 34.530 -12.967 6.834 578 HG13 ILE 84 HG11 ILE 84 33.372 -11.807 7.466 579 HG21 ILE 84 HG21 ILE 84 36.665 -12.170 6.213 580 HG22 ILE 84 HG22 ILE 84 36.822 -10.640 5.350 581 HG23 ILE 84 HG23 ILE 84 35.880 -11.955 4.646 582 HD11 ILE 84 HD11 ILE 84 33.538 -12.507 4.560 583 HD12 ILE 84 HD12 ILE 84 32.244 -11.660 5.421 584 HD13 ILE 84 HD13 ILE 84 32.525 -13.379 5.713 585 H ILE 85 HN ILE 85 35.018 -7.886 6.535 586 HA ILE 85 HA ILE 85 37.662 -7.439 5.688 587 HB ILE 85 HB ILE 85 35.449 -5.452 6.140 588 HG12 ILE 85 HG12 ILE 85 36.361 -6.806 3.598 589 HG13 ILE 85 HG11 ILE 85 34.999 -7.352 4.570 590 HG21 ILE 85 HG21 ILE 85 38.216 -5.169 5.242 591 HG22 ILE 85 HG22 ILE 85 37.077 -3.940 5.812 592 HG23 ILE 85 HG23 ILE 85 37.031 -4.483 4.132 593 HD11 ILE 85 HD11 ILE 85 34.375 -6.003 2.586 594 HD12 ILE 85 HD12 ILE 85 35.185 -4.624 3.327 595 HD13 ILE 85 HD13 ILE 85 33.789 -5.353 4.114 596 H THR 86 HN THR 86 35.875 -6.141 8.503 597 HA THR 86 HA THR 86 38.178 -4.784 9.481 598 HB THR 86 HB THR 86 36.215 -3.865 10.318 599 HG1 THR 86 HG1 THR 86 37.954 -4.857 12.002 600 HG21 THR 86 HG21 THR 86 34.471 -5.288 10.060 601 HG22 THR 86 HG22 THR 86 34.686 -5.397 11.817 602 HG23 THR 86 HG23 THR 86 35.335 -6.661 10.769 603 H SER 87 HN SER 87 37.109 -8.053 9.647 604 HA SER 87 HA SER 87 38.823 -8.871 11.780 605 HB2 SER 87 HB2 SER 87 36.834 -10.173 10.930 606 HB3 SER 87 HB1 SER 87 37.773 -10.560 9.490 607 HG SER 87 HG SER 87 37.845 -11.675 11.968 608 H MET 88 HN MET 88 39.155 -8.457 8.313 609 HA MET 88 HA MET 88 41.666 -9.680 7.955 610 HB2 MET 88 HB2 MET 88 40.319 -7.421 6.482 611 HB3 MET 88 HB1 MET 88 41.851 -8.116 5.970 612 HG2 MET 88 HG2 MET 88 39.224 -9.575 6.175 613 HG3 MET 88 HG1 MET 88 39.999 -9.022 4.690 614 HE1 MET 88 HE1 MET 88 40.371 -12.930 4.512 615 HE2 MET 88 HE2 MET 88 39.736 -11.491 3.714 616 HE3 MET 88 HE3 MET 88 39.020 -12.050 5.226 617 H GLY 89 HN GLY 89 40.708 -6.669 9.310 618 HA2 GLY 89 HA2 GLY 89 42.472 -5.778 10.876 619 HA3 GLY 89 HA1 GLY 89 43.512 -5.798 9.462 620 H PHE 90 HN PHE 90 40.420 -5.043 8.516 621 HA PHE 90 HA PHE 90 41.103 -2.207 8.366 622 HB2 PHE 90 HB2 PHE 90 39.023 -3.824 6.872 623 HB3 PHE 90 HB1 PHE 90 39.353 -2.119 6.595 624 HD1 PHE 90 HD2 PHE 90 42.150 -1.838 6.498 625 HD2 PHE 90 HD1 PHE 90 39.801 -5.111 5.129 626 HE1 PHE 90 HE2 PHE 90 43.921 -2.432 4.901 627 HE2 PHE 90 HE1 PHE 90 41.571 -5.717 3.532 628 HZ PHE 90 HZ PHE 90 43.634 -4.377 3.415 629 H GLN 91 HN GLN 91 38.789 -0.932 8.195 630 HA GLN 91 HA GLN 91 37.557 -1.291 10.799 631 HB2 GLN 91 HB2 GLN 91 37.555 0.850 8.708 632 HB3 GLN 91 HB1 GLN 91 36.291 0.826 9.924 633 HG2 GLN 91 HG2 GLN 91 37.844 1.086 11.668 634 HG3 GLN 91 HG1 GLN 91 39.212 0.813 10.594 635 HE21 GLN 91 HE21 GLN 91 39.856 2.449 9.207 636 HE22 GLN 91 HE22 GLN 91 39.342 4.088 9.404 637 H ARG 92 HN ARG 92 35.357 -1.641 11.117 638 HA ARG 92 HA ARG 92 33.907 -3.180 9.238 639 HB2 ARG 92 HB2 ARG 92 33.395 -3.203 11.627 640 HB3 ARG 92 HB1 ARG 92 32.922 -1.520 11.559 641 HG2 ARG 92 HG2 ARG 92 31.302 -2.518 9.675 642 HG3 ARG 92 HG1 ARG 92 31.458 -3.929 10.726 643 HD2 ARG 92 HD2 ARG 92 30.689 -1.171 11.652 644 HD3 ARG 92 HD1 ARG 92 29.543 -2.460 11.293 645 HE ARG 92 HE ARG 92 30.695 -3.740 13.107 646 HH11 ARG 92 HH11 ARG 92 30.789 -0.238 13.092 647 HH12 ARG 92 HH12 ARG 92 30.977 -0.115 14.811 648 HH21 ARG 92 HH21 ARG 92 30.932 -3.561 15.375 649 HH22 ARG 92 HH22 ARG 92 31.057 -1.988 16.099 650 H ASN 93 HN ASN 93 33.592 0.207 10.246 651 HA ASN 93 HA ASN 93 31.619 0.933 8.373 652 HB2 ASN 93 HB2 ASN 93 32.138 2.293 10.334 653 HB3 ASN 93 HB1 ASN 93 33.733 2.657 9.675 654 HD21 ASN 93 HD21 ASN 93 30.288 3.211 9.333 655 HD22 ASN 93 HD22 ASN 93 30.428 4.603 8.304 656 H GLN 94 HN GLN 94 35.163 1.028 8.209 657 HA GLN 94 HA GLN 94 35.300 2.230 5.656 658 HB2 GLN 94 HB2 GLN 94 37.323 2.215 6.800 659 HB3 GLN 94 HB1 GLN 94 37.151 0.532 7.268 660 HG2 GLN 94 HG2 GLN 94 38.163 -0.218 5.426 661 HG3 GLN 94 HG1 GLN 94 37.320 0.934 4.386 662 HE21 GLN 94 HE21 GLN 94 40.115 0.435 6.413 663 HE22 GLN 94 HE22 GLN 94 41.028 1.770 5.812 664 H ALA 95 HN ALA 95 34.978 -1.094 6.735 665 HA ALA 95 HA ALA 95 35.069 -2.355 4.226 666 HB1 ALA 95 HB1 ALA 95 33.581 -3.139 6.738 667 HB2 ALA 95 HB2 ALA 95 35.261 -3.535 6.354 668 HB3 ALA 95 HB3 ALA 95 33.946 -4.204 5.376 669 H ILE 96 HN ILE 96 32.393 -0.960 6.097 670 HA ILE 96 HA ILE 96 30.308 -1.607 4.374 671 HB ILE 96 HB ILE 96 30.704 0.575 6.375 672 HG12 ILE 96 HG12 ILE 96 28.232 -0.843 6.565 673 HG13 ILE 96 HG11 ILE 96 29.530 -2.001 6.309 674 HG21 ILE 96 HG21 ILE 96 28.301 1.269 5.887 675 HG22 ILE 96 HG22 ILE 96 28.525 0.478 4.318 676 HG23 ILE 96 HG23 ILE 96 29.551 1.839 4.779 677 HD11 ILE 96 HD11 ILE 96 29.309 0.044 8.499 678 HD12 ILE 96 HD12 ILE 96 30.737 -0.943 8.197 679 HD13 ILE 96 HD13 ILE 96 29.218 -1.713 8.654 680 H GLN 97 HN GLN 97 32.265 1.350 4.511 681 HA GLN 97 HA GLN 97 31.233 2.693 2.331 682 HB2 GLN 97 HB2 GLN 97 32.845 3.694 3.843 683 HB3 GLN 97 HB1 GLN 97 34.084 2.587 3.276 684 HG2 GLN 97 HG2 GLN 97 34.098 3.574 1.115 685 HG3 GLN 97 HG1 GLN 97 32.693 4.560 1.504 686 HE21 GLN 97 HE21 GLN 97 35.321 5.386 0.589 687 HE22 GLN 97 HE22 GLN 97 35.928 6.471 1.795 688 H ALA 98 HN ALA 98 33.860 0.361 2.426 689 HA ALA 98 HA ALA 98 34.570 0.438 -0.270 690 HB1 ALA 98 HB1 ALA 98 35.685 -0.684 1.802 691 HB2 ALA 98 HB2 ALA 98 35.931 -1.371 0.197 692 HB3 ALA 98 HB3 ALA 98 34.752 -2.092 1.297 693 H LEU 99 HN LEU 99 32.413 -1.847 1.442 694 HA LEU 99 HA LEU 99 31.642 -3.281 -0.841 695 HB2 LEU 99 HB2 LEU 99 30.155 -2.832 1.723 696 HB3 LEU 99 HB1 LEU 99 29.700 -4.007 0.514 697 HG LEU 99 HG LEU 99 32.347 -4.046 1.940 698 HD11 LEU 99 HD11 LEU 99 29.937 -5.731 2.537 699 HD12 LEU 99 HD12 LEU 99 30.376 -4.290 3.452 700 HD13 LEU 99 HD13 LEU 99 31.467 -5.677 3.416 701 HD21 LEU 99 HD21 LEU 99 32.843 -5.621 0.469 702 HD22 LEU 99 HD22 LEU 99 31.253 -5.463 -0.266 703 HD23 LEU 99 HD23 LEU 99 31.491 -6.579 1.074 704 H ARG 100 HN ARG 100 30.346 -0.322 0.596 705 HA ARG 100 HA ARG 100 27.970 -0.049 -0.833 706 HB2 ARG 100 HB2 ARG 100 29.988 1.974 0.118 707 HB3 ARG 100 HB1 ARG 100 28.545 2.471 -0.753 708 HG2 ARG 100 HG2 ARG 100 27.121 1.707 0.972 709 HG3 ARG 100 HG1 ARG 100 28.438 0.842 1.772 710 HD2 ARG 100 HD2 ARG 100 29.506 2.863 2.383 711 HD3 ARG 100 HD1 ARG 100 28.445 3.820 1.354 712 HE ARG 100 HE ARG 100 26.750 2.667 3.138 713 HH11 ARG 100 HH11 ARG 100 29.648 4.629 3.399 714 HH12 ARG 100 HH12 ARG 100 29.222 5.273 4.959 715 HH21 ARG 100 HH21 ARG 100 26.191 3.525 5.186 716 HH22 ARG 100 HH22 ARG 100 27.237 4.692 5.942 717 H ALA 101 HN ALA 101 31.251 0.829 -1.694 718 HA ALA 101 HA ALA 101 30.619 1.853 -4.275 719 HB1 ALA 101 HB1 ALA 101 33.167 1.623 -4.523 720 HB2 ALA 101 HB2 ALA 101 33.133 1.154 -2.816 721 HB3 ALA 101 HB3 ALA 101 32.538 2.740 -3.312 722 H THR 102 HN THR 102 31.957 -1.207 -3.073 723 HA THR 102 HA THR 102 32.387 -2.258 -5.708 724 HB THR 102 HB THR 102 33.225 -4.213 -4.578 725 HG1 THR 102 HG1 THR 102 33.001 -4.437 -2.364 726 HG21 THR 102 HG21 THR 102 35.056 -3.122 -3.704 727 HG22 THR 102 HG22 THR 102 34.109 -1.862 -2.946 728 HG23 THR 102 HG23 THR 102 34.354 -1.860 -4.694 729 H ASN 103 HN ASN 103 29.631 -1.855 -4.047 730 HA ASN 103 HA ASN 103 27.559 -2.726 -4.022 731 HB2 ASN 103 HB2 ASN 103 28.485 -4.319 -6.423 732 HB3 ASN 103 HB1 ASN 103 26.819 -4.061 -5.926 733 HD21 ASN 103 HD21 ASN 103 29.507 -2.787 -7.605 734 HD22 ASN 103 HD22 ASN 103 28.781 -1.300 -8.111 735 H ASN 104 HN ASN 104 28.711 -3.655 -2.064 736 HA ASN 104 HA ASN 104 29.034 -5.262 -0.533 737 HB2 ASN 104 HB2 ASN 104 27.355 -6.949 -0.279 738 HB3 ASN 104 HB1 ASN 104 26.578 -5.491 -0.870 739 HD21 ASN 104 HD21 ASN 104 25.410 -5.584 -2.690 740 HD22 ASN 104 HD22 ASN 104 25.208 -7.006 -3.655 741 H ASN 105 HN ASN 105 30.584 -5.477 -3.080 742 HA ASN 105 HA ASN 105 31.143 -8.328 -3.206 743 HB2 ASN 105 HB2 ASN 105 31.240 -6.739 -5.212 744 HB3 ASN 105 HB1 ASN 105 32.733 -6.118 -4.518 745 HD21 ASN 105 HD21 ASN 105 31.794 -9.472 -4.245 746 HD22 ASN 105 HD22 ASN 105 33.010 -10.097 -5.311 747 H LEU 106 HN LEU 106 32.223 -9.176 -1.632 748 HA LEU 106 HA LEU 106 33.578 -7.889 0.412 749 HB2 LEU 106 HB2 LEU 106 32.724 -10.155 0.558 750 HB3 LEU 106 HB1 LEU 106 33.857 -10.708 -0.648 751 HG LEU 106 HG LEU 106 34.975 -9.526 1.850 752 HD11 LEU 106 HD11 LEU 106 34.121 -12.398 1.792 753 HD12 LEU 106 HD12 LEU 106 33.034 -11.141 2.369 754 HD13 LEU 106 HD13 LEU 106 34.579 -11.401 3.181 755 HD21 LEU 106 HD21 LEU 106 36.635 -11.311 1.510 756 HD22 LEU 106 HD22 LEU 106 36.484 -10.245 0.113 757 HD23 LEU 106 HD23 LEU 106 35.741 -11.844 0.085 758 H GLU 107 HN GLU 107 35.063 -9.848 -2.110 759 HA GLU 107 HA GLU 107 37.722 -9.305 -1.596 760 HB2 GLU 107 HB2 GLU 107 36.436 -9.849 -4.270 761 HB3 GLU 107 HB1 GLU 107 38.137 -10.054 -3.885 762 HG2 GLU 107 HG2 GLU 107 36.079 -11.472 -2.276 763 HG3 GLU 107 HG1 GLU 107 36.536 -12.104 -3.859 764 H ARG 108 HN ARG 108 35.546 -7.612 -3.811 765 HA ARG 108 HA ARG 108 37.473 -5.760 -4.734 766 HB2 ARG 108 HB2 ARG 108 35.139 -6.452 -5.652 767 HB3 ARG 108 HB1 ARG 108 34.555 -5.160 -4.628 768 HG2 ARG 108 HG2 ARG 108 35.984 -3.587 -5.816 769 HG3 ARG 108 HG1 ARG 108 36.533 -4.904 -6.863 770 HD2 ARG 108 HD2 ARG 108 33.688 -4.081 -6.467 771 HD3 ARG 108 HD1 ARG 108 34.674 -3.605 -7.859 772 HE ARG 108 HE ARG 108 34.012 -6.421 -7.213 773 HH11 ARG 108 HH11 ARG 108 34.320 -3.812 -9.532 774 HH12 ARG 108 HH12 ARG 108 33.990 -4.827 -10.906 775 HH21 ARG 108 HH21 ARG 108 33.555 -7.749 -9.004 776 HH22 ARG 108 HH22 ARG 108 33.560 -7.068 -10.610 777 H ALA 109 HN ALA 109 35.303 -5.836 -1.983 778 HA ALA 109 HA ALA 109 35.470 -3.124 -1.287 779 HB1 ALA 109 HB1 ALA 109 34.253 -5.378 -0.224 780 HB2 ALA 109 HB2 ALA 109 34.192 -3.749 0.449 781 HB3 ALA 109 HB3 ALA 109 35.410 -4.890 1.015 782 H LEU 110 HN LEU 110 37.304 -5.957 -0.197 783 HA LEU 110 HA LEU 110 39.270 -4.651 1.299 784 HB2 LEU 110 HB2 LEU 110 39.561 -7.118 -0.406 785 HB3 LEU 110 HB1 LEU 110 40.582 -6.670 0.945 786 HG LEU 110 HG LEU 110 37.638 -7.185 1.281 787 HD11 LEU 110 HD11 LEU 110 39.909 -9.166 1.500 788 HD12 LEU 110 HD12 LEU 110 38.621 -9.175 0.294 789 HD13 LEU 110 HD13 LEU 110 38.239 -9.456 1.994 790 HD21 LEU 110 HD21 LEU 110 38.294 -7.565 3.597 791 HD22 LEU 110 HD22 LEU 110 38.789 -5.962 3.048 792 HD23 LEU 110 HD23 LEU 110 39.980 -7.257 3.180 793 H ASP 111 HN ASP 111 39.056 -5.443 -2.116 794 HA ASP 111 HA ASP 111 41.450 -4.464 -3.118 795 HB2 ASP 111 HB2 ASP 111 39.435 -5.551 -4.376 796 HB3 ASP 111 HB1 ASP 111 38.799 -3.918 -4.428 797 H TRP 112 HN TRP 112 38.405 -2.780 -2.698 798 HA TRP 112 HA TRP 112 39.219 -0.223 -3.488 799 HB2 TRP 112 HB2 TRP 112 36.873 -1.161 -3.284 800 HB3 TRP 112 HB1 TRP 112 37.000 -0.863 -1.555 801 HD1 TRP 112 HD1 TRP 112 36.898 1.678 -0.729 802 HE1 TRP 112 HE1 TRP 112 36.098 3.837 -1.887 803 HE3 TRP 112 HE3 TRP 112 36.801 0.012 -5.564 804 HZ2 TRP 112 HZ2 TRP 112 35.505 4.706 -4.508 805 HZ3 TRP 112 HZ3 TRP 112 36.111 1.568 -7.334 806 HH2 TRP 112 HH2 TRP 112 35.476 3.866 -6.819 807 H ILE 113 HN ILE 113 39.081 -1.794 -0.363 808 HA ILE 113 HA ILE 113 39.743 0.503 1.169 809 HB ILE 113 HB ILE 113 39.876 -2.441 1.817 810 HG12 ILE 113 HG12 ILE 113 37.867 -0.268 2.472 811 HG13 ILE 113 HG11 ILE 113 37.621 -1.614 1.372 812 HG21 ILE 113 HG21 ILE 113 40.120 -0.080 3.688 813 HG22 ILE 113 HG22 ILE 113 41.434 -1.157 3.220 814 HG23 ILE 113 HG23 ILE 113 40.074 -1.780 4.157 815 HD11 ILE 113 HD11 ILE 113 38.258 -2.106 4.239 816 HD12 ILE 113 HD12 ILE 113 37.424 -3.136 3.071 817 HD13 ILE 113 HD13 ILE 113 36.621 -1.713 3.723 818 H PHE 114 HN PHE 114 41.624 -2.121 -0.260 819 HA PHE 114 HA PHE 114 44.116 -1.468 0.896 820 HB2 PHE 114 HB2 PHE 114 43.630 -3.609 -0.277 821 HB3 PHE 114 HB1 PHE 114 43.566 -2.732 -1.800 822 HD1 PHE 114 HD2 PHE 114 45.861 -3.330 1.082 823 HD2 PHE 114 HD1 PHE 114 45.462 -2.600 -3.092 824 HE1 PHE 114 HE2 PHE 114 48.288 -3.632 0.806 825 HE2 PHE 114 HE1 PHE 114 47.887 -2.898 -3.375 826 HZ PHE 114 HZ PHE 114 49.303 -3.410 -1.426 827 H SER 115 HN SER 115 42.371 -0.287 -1.873 828 HA SER 115 HA SER 115 44.523 1.410 -2.786 829 HB2 SER 115 HB2 SER 115 42.869 0.337 -4.313 830 HB3 SER 115 HB1 SER 115 41.621 1.366 -3.627 831 HG SER 115 HG SER 115 43.132 3.149 -4.265 832 H HIS 116 HN HIS 116 42.872 1.548 -0.132 833 HA HIS 116 HA HIS 116 42.814 4.486 -0.091 834 HB2 HIS 116 HB2 HIS 116 40.484 3.657 -0.288 835 HB3 HIS 116 HB1 HIS 116 40.714 2.688 1.162 836 HD1 HIS 116 HD1 HIS 116 39.997 3.756 3.284 837 HD2 HIS 116 HD2 HIS 116 40.745 6.564 0.306 838 HE1 HIS 116 HE1 HIS 116 39.311 5.970 4.249 839 HE2 HIS 116 HE2 HIS 116 39.656 7.633 2.397 840 HA PRO 117 HA PRO 117 45.722 2.515 3.030 841 HB2 PRO 117 HB2 PRO 117 47.205 4.885 2.950 842 HB3 PRO 117 HB1 PRO 117 47.586 3.390 2.097 843 HG2 PRO 117 HG2 PRO 117 46.143 5.823 1.132 844 HG3 PRO 117 HG1 PRO 117 47.315 4.795 0.278 845 HD2 PRO 117 HD2 PRO 117 44.743 4.565 -0.261 846 HD3 PRO 117 HD1 PRO 117 45.731 3.104 -0.067 847 H GLU 118 HN GLU 118 45.254 6.012 3.010 848 HA GLU 118 HA GLU 118 43.759 6.160 5.375 849 HB2 GLU 118 HB2 GLU 118 45.541 7.224 6.780 850 HB3 GLU 118 HB1 GLU 118 45.697 5.489 6.571 851 HG2 GLU 118 HG2 GLU 118 47.405 5.812 4.923 852 HG3 GLU 118 HG1 GLU 118 47.204 7.560 5.001 853 H PHE 119 HN PHE 119 46.170 7.749 3.352 854 HA PHE 119 HA PHE 119 44.412 10.043 3.046 855 HB2 PHE 119 HB2 PHE 119 45.919 10.507 4.990 856 HB3 PHE 119 HB1 PHE 119 47.299 10.339 3.920 857 HD1 PHE 119 HD1 PHE 119 44.107 12.267 4.147 858 HD2 PHE 119 HD2 PHE 119 48.224 12.251 3.064 859 HE1 PHE 119 HE1 PHE 119 43.971 14.663 3.612 860 HE2 PHE 119 HE2 PHE 119 48.095 14.648 2.529 861 HZ PHE 119 HZ PHE 119 45.968 15.858 2.800 862 H GLU 120 HN GLU 120 45.650 7.731 1.529 863 HA GLU 120 HA GLU 120 46.495 7.218 -0.483 864 HB2 GLU 120 HB2 GLU 120 45.851 10.100 -1.045 865 HB3 GLU 120 HB1 GLU 120 46.407 8.966 -2.269 866 HG2 GLU 120 HG2 GLU 120 43.960 8.623 -0.585 867 HG3 GLU 120 HG1 GLU 120 43.965 9.212 -2.249 868 H GLU 121 HN GLU 121 48.546 6.698 -0.804 869 HA GLU 121 HA GLU 121 50.614 8.524 0.106 870 HB2 GLU 121 HB2 GLU 121 52.170 6.661 -0.235 871 HB3 GLU 121 HB1 GLU 121 50.823 6.206 0.786 872 HG2 GLU 121 HG2 GLU 121 50.947 5.559 -2.143 873 HG3 GLU 121 HG1 GLU 121 51.591 4.496 -0.900 874 H ASP 122 HN ASP 122 51.660 9.851 -1.156 875 HA ASP 122 HA ASP 122 52.085 9.091 -3.948 876 HB2 ASP 122 HB2 ASP 122 51.288 11.077 -4.871 877 HB3 ASP 122 HB1 ASP 122 50.103 10.734 -3.618 878 H SER 123 HN SER 123 52.885 11.495 -1.460 879 HA SER 123 HA SER 123 55.659 11.419 -2.441 880 HB2 SER 123 HB2 SER 123 54.481 13.610 -2.775 881 HB3 SER 123 HB1 SER 123 54.320 13.736 -1.026 882 HG SER 123 HG SER 123 56.852 13.310 -2.213 883 H ASP 124 HN ASP 124 55.140 9.466 -0.804 884 HA ASP 124 HA ASP 124 56.118 10.373 1.820 885 HB2 ASP 124 HB2 ASP 124 54.015 9.154 1.973 886 HB3 ASP 124 HB1 ASP 124 54.715 7.788 1.112 887 H PHE 125 HN PHE 125 56.496 7.861 -0.648 888 HA PHE 125 HA PHE 125 59.077 7.059 0.325 889 HB2 PHE 125 HB2 PHE 125 57.735 5.431 -0.880 890 HB3 PHE 125 HB1 PHE 125 57.630 6.495 -2.277 891 HD1 PHE 125 HD1 PHE 125 60.192 4.798 -0.162 892 HD2 PHE 125 HD2 PHE 125 59.061 6.133 -4.042 893 HE1 PHE 125 HE1 PHE 125 62.213 3.759 -1.109 894 HE2 PHE 125 HE2 PHE 125 61.076 5.093 -4.993 895 HZ PHE 125 HZ PHE 125 62.658 3.903 -3.524 896 H VAL 126 HN VAL 126 57.787 9.166 -2.161 897 HA VAL 126 HA VAL 126 60.506 10.100 -2.744 898 HB VAL 126 HB VAL 126 59.436 11.068 -4.856 899 HG11 VAL 126 HG11 VAL 126 59.603 8.915 -6.045 900 HG12 VAL 126 HG12 VAL 126 59.583 8.073 -4.495 901 HG13 VAL 126 HG13 VAL 126 60.922 9.146 -4.899 902 HG21 VAL 126 HG21 VAL 126 57.410 9.954 -5.659 903 HG22 VAL 126 HG22 VAL 126 57.094 10.846 -4.170 904 HG23 VAL 126 HG23 VAL 126 57.271 9.093 -4.127 Start of MODEL 14 1 H1 ASP 1 HT1 ASP 1 -42.723 11.466 -8.769 2 H2 ASP 1 HT2 ASP 1 -43.781 12.248 -7.700 3 H3 ASP 1 HT3 ASP 1 -43.936 12.491 -9.371 4 HA ASP 1 HA ASP 1 -45.654 11.016 -8.676 5 HB2 ASP 1 HB2 ASP 1 -43.415 9.465 -10.013 6 HB3 ASP 1 HB1 ASP 1 -45.118 9.020 -10.019 7 H ILE 2 HN ILE 2 -42.450 9.872 -7.753 8 HA ILE 2 HA ILE 2 -43.600 8.594 -5.401 9 HB ILE 2 HB ILE 2 -41.681 7.362 -7.383 10 HG12 ILE 2 HG12 ILE 2 -44.343 6.448 -6.276 11 HG13 ILE 2 HG11 ILE 2 -44.049 7.061 -7.898 12 HG21 ILE 2 HG21 ILE 2 -41.689 5.428 -5.699 13 HG22 ILE 2 HG22 ILE 2 -42.212 6.653 -4.542 14 HG23 ILE 2 HG23 ILE 2 -40.670 6.828 -5.366 15 HD11 ILE 2 HD11 ILE 2 -42.890 4.530 -6.758 16 HD12 ILE 2 HD12 ILE 2 -42.662 5.140 -8.397 17 HD13 ILE 2 HD13 ILE 2 -44.262 4.631 -7.861 18 H ASP 3 HN ASP 3 -42.437 9.077 -3.575 19 HA ASP 3 HA ASP 3 -40.187 10.813 -3.672 20 HB2 ASP 3 HB2 ASP 3 -41.306 9.160 -1.398 21 HB3 ASP 3 HB1 ASP 3 -40.003 10.325 -1.216 22 H GLU 4 HN GLU 4 -39.001 9.440 -5.211 23 HA GLU 4 HA GLU 4 -37.935 6.955 -4.363 24 HB2 GLU 4 HB2 GLU 4 -37.072 8.807 -6.581 25 HB3 GLU 4 HB1 GLU 4 -36.522 7.144 -6.374 26 HG2 GLU 4 HG2 GLU 4 -38.895 6.415 -6.509 27 HG3 GLU 4 HG1 GLU 4 -39.328 8.079 -6.903 28 H SER 5 HN SER 5 -37.236 10.061 -3.412 29 HA SER 5 HA SER 5 -34.499 9.873 -2.810 30 HB2 SER 5 HB2 SER 5 -36.642 11.219 -1.146 31 HB3 SER 5 HB1 SER 5 -34.927 11.622 -1.197 32 HG SER 5 HG SER 5 -35.229 12.157 -3.436 33 H SER 6 HN SER 6 -37.378 8.517 -1.369 34 HA SER 6 HA SER 6 -36.247 7.635 1.072 35 HB2 SER 6 HB2 SER 6 -38.668 7.796 0.741 36 HB3 SER 6 HB1 SER 6 -38.596 6.550 -0.504 37 HG SER 6 HG SER 6 -38.002 5.060 1.055 38 H VAL 7 HN VAL 7 -36.885 5.908 -1.989 39 HA VAL 7 HA VAL 7 -35.724 3.499 -1.128 40 HB VAL 7 HB VAL 7 -37.203 3.413 -3.002 41 HG11 VAL 7 HG11 VAL 7 -35.223 5.169 -4.425 42 HG12 VAL 7 HG12 VAL 7 -36.904 5.541 -4.035 43 HG13 VAL 7 HG13 VAL 7 -36.529 4.299 -5.229 44 HG21 VAL 7 HG21 VAL 7 -36.002 1.952 -4.414 45 HG22 VAL 7 HG22 VAL 7 -35.250 1.824 -2.815 46 HG23 VAL 7 HG23 VAL 7 -34.479 2.779 -4.085 47 H MET 8 HN MET 8 -34.418 6.293 -2.775 48 HA MET 8 HA MET 8 -31.870 5.207 -3.275 49 HB2 MET 8 HB2 MET 8 -32.857 8.030 -3.063 50 HB3 MET 8 HB1 MET 8 -31.155 7.670 -3.339 51 HG2 MET 8 HG2 MET 8 -33.435 6.750 -5.073 52 HG3 MET 8 HG1 MET 8 -32.367 8.109 -5.427 53 HE1 MET 8 HE1 MET 8 -31.436 5.148 -7.948 54 HE2 MET 8 HE2 MET 8 -32.117 6.772 -7.834 55 HE3 MET 8 HE3 MET 8 -33.023 5.389 -7.222 56 H GLN 9 HN GLN 9 -33.249 6.678 -0.399 57 HA GLN 9 HA GLN 9 -30.809 6.917 1.007 58 HB2 GLN 9 HB2 GLN 9 -33.648 6.597 1.950 59 HB3 GLN 9 HB1 GLN 9 -32.299 6.736 3.068 60 HG2 GLN 9 HG2 GLN 9 -31.709 8.896 1.977 61 HG3 GLN 9 HG1 GLN 9 -33.193 8.764 1.035 62 HE21 GLN 9 HE21 GLN 9 -34.070 10.635 1.912 63 HE22 GLN 9 HE22 GLN 9 -34.639 10.716 3.546 64 H LEU 10 HN LEU 10 -33.158 4.256 0.736 65 HA LEU 10 HA LEU 10 -31.674 2.423 2.347 66 HB2 LEU 10 HB2 LEU 10 -33.397 1.682 -0.005 67 HB3 LEU 10 HB1 LEU 10 -33.007 0.688 1.377 68 HG LEU 10 HG LEU 10 -34.906 2.999 1.225 69 HD11 LEU 10 HD11 LEU 10 -35.269 0.155 2.087 70 HD12 LEU 10 HD12 LEU 10 -35.618 0.786 0.478 71 HD13 LEU 10 HD13 LEU 10 -36.526 1.377 1.873 72 HD21 LEU 10 HD21 LEU 10 -35.314 2.433 3.678 73 HD22 LEU 10 HD22 LEU 10 -33.898 3.394 3.289 74 HD23 LEU 10 HD23 LEU 10 -33.720 1.677 3.642 75 H ALA 11 HN ALA 11 -31.775 3.214 -1.036 76 HA ALA 11 HA ALA 11 -30.064 1.250 -2.048 77 HB1 ALA 11 HB1 ALA 11 -30.122 3.984 -3.234 78 HB2 ALA 11 HB2 ALA 11 -31.598 3.016 -3.207 79 HB3 ALA 11 HB3 ALA 11 -30.153 2.411 -4.033 80 H GLU 12 HN GLU 12 -29.339 4.404 -0.634 81 HA GLU 12 HA GLU 12 -26.559 4.364 -1.158 82 HB2 GLU 12 HB2 GLU 12 -28.133 5.776 0.976 83 HB3 GLU 12 HB1 GLU 12 -26.404 5.998 0.751 84 HG2 GLU 12 HG2 GLU 12 -26.903 6.710 -1.597 85 HG3 GLU 12 HG1 GLU 12 -28.612 6.684 -1.169 86 H MET 13 HN MET 13 -28.489 2.663 1.113 87 HA MET 13 HA MET 13 -26.272 1.924 2.810 88 HB2 MET 13 HB2 MET 13 -29.022 0.669 2.629 89 HB3 MET 13 HB1 MET 13 -27.856 0.465 3.931 90 HG2 MET 13 HG2 MET 13 -28.053 2.857 4.445 91 HG3 MET 13 HG1 MET 13 -29.269 3.013 3.186 92 HE1 MET 13 HE1 MET 13 -28.418 1.388 6.680 93 HE2 MET 13 HE2 MET 13 -28.794 -0.007 5.669 94 HE3 MET 13 HE3 MET 13 -29.878 0.445 6.982 95 H GLY 14 HN GLY 14 -27.137 1.190 -0.250 96 HA2 GLY 14 HA2 GLY 14 -26.005 -0.231 -1.679 97 HA3 GLY 14 HA1 GLY 14 -25.362 -1.099 -0.291 98 H PHE 15 HN PHE 15 -28.690 -0.397 -1.268 99 HA PHE 15 HA PHE 15 -29.104 -3.222 -1.868 100 HB2 PHE 15 HB2 PHE 15 -30.787 -1.735 0.155 101 HB3 PHE 15 HB1 PHE 15 -31.163 -3.320 -0.492 102 HD1 PHE 15 HD2 PHE 15 -29.542 -5.212 -0.033 103 HD2 PHE 15 HD1 PHE 15 -29.401 -1.489 2.018 104 HE1 PHE 15 HE2 PHE 15 -28.221 -6.255 1.761 105 HE2 PHE 15 HE1 PHE 15 -28.080 -2.523 3.818 106 HZ PHE 15 HZ PHE 15 -27.522 -4.923 3.704 107 HA PRO 16 HA PRO 16 -31.533 -1.215 -5.065 108 HB2 PRO 16 HB2 PRO 16 -32.214 -3.473 -6.363 109 HB3 PRO 16 HB1 PRO 16 -30.570 -2.822 -6.442 110 HG2 PRO 16 HG2 PRO 16 -31.650 -5.026 -4.710 111 HG3 PRO 16 HG1 PRO 16 -30.153 -4.992 -5.668 112 HD2 PRO 16 HD2 PRO 16 -30.184 -4.491 -2.997 113 HD3 PRO 16 HD1 PRO 16 -29.027 -3.721 -4.106 114 H LEU 17 HN LEU 17 -32.993 -0.856 -2.985 115 HA LEU 17 HA LEU 17 -35.094 -2.849 -2.786 116 HB2 LEU 17 HB2 LEU 17 -34.705 -0.375 -1.061 117 HB3 LEU 17 HB1 LEU 17 -35.826 -1.695 -0.780 118 HG LEU 17 HG LEU 17 -32.819 -1.894 -0.742 119 HD11 LEU 17 HD11 LEU 17 -33.870 -0.768 1.199 120 HD12 LEU 17 HD12 LEU 17 -33.048 -2.272 1.600 121 HD13 LEU 17 HD13 LEU 17 -34.807 -2.236 1.490 122 HD21 LEU 17 HD21 LEU 17 -33.201 -4.201 0.015 123 HD22 LEU 17 HD22 LEU 17 -33.777 -3.931 -1.631 124 HD23 LEU 17 HD23 LEU 17 -34.926 -4.003 -0.294 125 H GLU 18 HN GLU 18 -35.548 -2.047 -5.143 126 HA GLU 18 HA GLU 18 -37.197 0.127 -5.599 127 HB2 GLU 18 HB2 GLU 18 -36.388 -1.758 -7.217 128 HB3 GLU 18 HB1 GLU 18 -37.887 -2.552 -6.747 129 HG2 GLU 18 HG2 GLU 18 -38.981 -0.277 -7.331 130 HG3 GLU 18 HG1 GLU 18 -37.480 -0.000 -8.208 131 H ALA 19 HN ALA 19 -37.720 -2.723 -3.755 132 HA ALA 19 HA ALA 19 -40.492 -2.764 -3.503 133 HB1 ALA 19 HB1 ALA 19 -38.656 -3.267 -1.190 134 HB2 ALA 19 HB2 ALA 19 -38.726 -4.366 -2.559 135 HB3 ALA 19 HB3 ALA 19 -40.174 -4.071 -1.596 136 H CYS 20 HN CYS 20 -38.064 -0.693 -2.124 137 HA CYS 20 HA CYS 20 -39.784 0.718 -0.314 138 HB2 CYS 20 HB2 CYS 20 -37.209 0.735 -0.277 139 HB3 CYS 20 HB1 CYS 20 -37.314 1.837 -1.641 140 HG CYS 20 HG CYS 20 -38.563 2.443 1.489 141 H ARG 21 HN ARG 21 -38.552 1.251 -3.580 142 HA ARG 21 HA ARG 21 -39.796 3.689 -4.120 143 HB2 ARG 21 HB2 ARG 21 -38.200 2.855 -5.674 144 HB3 ARG 21 HB1 ARG 21 -39.116 1.377 -5.932 145 HG2 ARG 21 HG2 ARG 21 -40.604 2.379 -7.340 146 HG3 ARG 21 HG1 ARG 21 -40.383 3.977 -6.622 147 HD2 ARG 21 HD2 ARG 21 -38.937 4.487 -8.227 148 HD3 ARG 21 HD1 ARG 21 -37.897 3.163 -7.707 149 HE ARG 21 HE ARG 21 -39.704 1.893 -9.234 150 HH11 ARG 21 HH11 ARG 21 -37.861 4.832 -9.803 151 HH12 ARG 21 HH12 ARG 21 -37.704 4.538 -11.515 152 HH21 ARG 21 HH21 ARG 21 -39.519 1.525 -11.464 153 HH22 ARG 21 HH22 ARG 21 -38.641 2.651 -12.461 154 H LYS 22 HN LYS 22 -41.095 0.409 -4.650 155 HA LYS 22 HA LYS 22 -43.654 1.436 -5.425 156 HB2 LYS 22 HB2 LYS 22 -44.395 -0.900 -5.418 157 HB3 LYS 22 HB1 LYS 22 -42.902 -0.689 -6.315 158 HG2 LYS 22 HG2 LYS 22 -41.771 -1.412 -4.088 159 HG3 LYS 22 HG1 LYS 22 -43.370 -2.060 -3.710 160 HD2 LYS 22 HD2 LYS 22 -42.049 -3.801 -4.721 161 HD3 LYS 22 HD1 LYS 22 -43.305 -3.315 -5.861 162 HE2 LYS 22 HE2 LYS 22 -41.672 -1.882 -7.016 163 HE3 LYS 22 HE1 LYS 22 -40.425 -2.407 -5.886 164 HZ1 LYS 22 HZ1 LYS 22 -40.312 -3.596 -7.986 165 HZ2 LYS 22 HZ2 LYS 22 -41.896 -4.172 -7.778 166 HZ3 LYS 22 HZ3 LYS 22 -40.669 -4.661 -6.713 167 H ALA 23 HN ALA 23 -42.156 0.584 -2.417 168 HA ALA 23 HA ALA 23 -44.482 0.389 -0.822 169 HB1 ALA 23 HB1 ALA 23 -43.023 0.921 1.062 170 HB2 ALA 23 HB2 ALA 23 -41.749 1.412 -0.056 171 HB3 ALA 23 HB3 ALA 23 -42.275 -0.272 0.002 172 H VAL 24 HN VAL 24 -42.422 3.106 -1.738 173 HA VAL 24 HA VAL 24 -43.822 5.165 -0.476 174 HB VAL 24 HB VAL 24 -42.335 5.189 -3.118 175 HG11 VAL 24 HG11 VAL 24 -42.239 7.574 -2.956 176 HG12 VAL 24 HG12 VAL 24 -43.109 7.544 -1.416 177 HG13 VAL 24 HG13 VAL 24 -43.930 7.068 -2.902 178 HG21 VAL 24 HG21 VAL 24 -40.514 6.178 -1.805 179 HG22 VAL 24 HG22 VAL 24 -40.937 4.565 -1.236 180 HG23 VAL 24 HG23 VAL 24 -41.477 5.984 -0.341 181 H TYR 25 HN TYR 25 -44.304 3.638 -3.628 182 HA TYR 25 HA TYR 25 -46.552 5.097 -4.442 183 HB2 TYR 25 HB2 TYR 25 -45.335 3.577 -5.930 184 HB3 TYR 25 HB1 TYR 25 -45.861 2.197 -4.973 185 HD1 TYR 25 HD2 TYR 25 -47.053 4.897 -7.213 186 HD2 TYR 25 HD1 TYR 25 -47.961 1.170 -5.369 187 HE1 TYR 25 HE2 TYR 25 -49.047 4.683 -8.635 188 HE2 TYR 25 HE1 TYR 25 -49.955 0.949 -6.790 189 HH TYR 25 HH TYR 25 -51.500 2.447 -8.030 190 H PHE 26 HN PHE 26 -46.374 2.038 -2.602 191 HA PHE 26 HA PHE 26 -49.136 1.718 -2.221 192 HB2 PHE 26 HB2 PHE 26 -46.803 0.755 -0.563 193 HB3 PHE 26 HB1 PHE 26 -48.468 0.281 -0.254 194 HD1 PHE 26 HD2 PHE 26 -49.550 -0.226 -2.879 195 HD2 PHE 26 HD1 PHE 26 -45.677 -1.085 -1.340 196 HE1 PHE 26 HE2 PHE 26 -49.312 -2.055 -4.509 197 HE2 PHE 26 HE1 PHE 26 -45.431 -2.912 -2.966 198 HZ PHE 26 HZ PHE 26 -47.285 -3.450 -4.501 199 H THR 27 HN THR 27 -46.712 3.358 -0.202 200 HA THR 27 HA THR 27 -48.473 3.928 1.930 201 HB THR 27 HB THR 27 -46.802 5.676 2.592 202 HG1 THR 27 HG1 THR 27 -45.174 4.667 0.514 203 HG21 THR 27 HG21 THR 27 -45.618 2.993 1.913 204 HG22 THR 27 HG22 THR 27 -46.640 3.315 3.314 205 HG23 THR 27 HG23 THR 27 -45.064 4.097 3.171 206 H GLY 28 HN GLY 28 -47.888 5.447 -1.119 207 HA2 GLY 28 HA2 GLY 28 -49.344 6.974 -2.154 208 HA3 GLY 28 HA1 GLY 28 -50.024 7.360 -0.579 209 H ASN 29 HN ASN 29 -46.616 7.275 -1.400 210 HA ASN 29 HA ASN 29 -44.967 8.841 -1.281 211 HB2 ASN 29 HB2 ASN 29 -47.232 10.558 -2.286 212 HB3 ASN 29 HB1 ASN 29 -45.641 11.236 -1.964 213 HD21 ASN 29 HD21 ASN 29 -46.279 8.033 -3.282 214 HD22 ASN 29 HD22 ASN 29 -45.611 8.349 -4.845 215 H MET 30 HN MET 30 -45.336 8.261 1.087 216 HA MET 30 HA MET 30 -46.431 10.487 2.630 217 HB2 MET 30 HB2 MET 30 -45.745 7.649 3.364 218 HB3 MET 30 HB1 MET 30 -46.149 8.859 4.575 219 HG2 MET 30 HG2 MET 30 -47.911 7.925 2.318 220 HG3 MET 30 HG1 MET 30 -48.090 7.534 4.027 221 HE1 MET 30 HE1 MET 30 -50.311 8.805 2.011 222 HE2 MET 30 HE2 MET 30 -51.101 9.962 3.083 223 HE3 MET 30 HE3 MET 30 -50.692 8.351 3.672 224 H GLY 31 HN GLY 31 -43.393 8.797 2.068 225 HA2 GLY 31 HA2 GLY 31 -41.665 10.770 2.449 226 HA3 GLY 31 HA1 GLY 31 -42.089 10.405 4.114 227 H ALA 32 HN ALA 32 -39.540 10.225 3.510 228 HA ALA 32 HA ALA 32 -38.657 7.783 2.396 229 HB1 ALA 32 HB1 ALA 32 -37.191 9.623 4.272 230 HB2 ALA 32 HB2 ALA 32 -37.272 9.803 2.519 231 HB3 ALA 32 HB3 ALA 32 -36.474 8.400 3.225 232 H GLU 33 HN GLU 33 -38.809 8.835 5.806 233 HA GLU 33 HA GLU 33 -37.896 6.329 6.769 234 HB2 GLU 33 HB2 GLU 33 -39.329 8.561 8.212 235 HB3 GLU 33 HB1 GLU 33 -38.581 7.176 8.998 236 HG2 GLU 33 HG2 GLU 33 -36.412 7.849 8.016 237 HG3 GLU 33 HG1 GLU 33 -37.193 9.291 7.372 238 H VAL 34 HN VAL 34 -41.006 7.581 5.928 239 HA VAL 34 HA VAL 34 -42.611 5.653 7.223 240 HB VAL 34 HB VAL 34 -43.151 7.105 4.623 241 HG11 VAL 34 HG11 VAL 34 -44.972 5.589 6.484 242 HG12 VAL 34 HG12 VAL 34 -44.655 5.262 4.779 243 HG13 VAL 34 HG13 VAL 34 -45.547 6.708 5.248 244 HG21 VAL 34 HG21 VAL 34 -42.728 8.646 6.459 245 HG22 VAL 34 HG22 VAL 34 -43.915 7.806 7.455 246 HG23 VAL 34 HG23 VAL 34 -44.434 8.669 6.007 247 H ALA 35 HN ALA 35 -41.161 5.733 3.970 248 HA ALA 35 HA ALA 35 -42.072 3.074 3.361 249 HB1 ALA 35 HB1 ALA 35 -41.737 4.868 1.655 250 HB2 ALA 35 HB2 ALA 35 -40.994 3.315 1.277 251 HB3 ALA 35 HB3 ALA 35 -39.996 4.650 1.864 252 H PHE 36 HN PHE 36 -39.141 4.527 4.633 253 HA PHE 36 HA PHE 36 -37.440 2.306 4.609 254 HB2 PHE 36 HB2 PHE 36 -36.628 4.447 5.365 255 HB3 PHE 36 HB1 PHE 36 -37.811 4.497 6.668 256 HD1 PHE 36 HD2 PHE 36 -34.820 2.676 5.448 257 HD2 PHE 36 HD1 PHE 36 -37.298 3.619 8.777 258 HE1 PHE 36 HE2 PHE 36 -33.182 1.637 6.959 259 HE2 PHE 36 HE1 PHE 36 -35.665 2.579 10.293 260 HZ PHE 36 HZ PHE 36 -33.592 1.618 9.395 261 H ASN 37 HN ASN 37 -39.963 3.272 6.904 262 HA ASN 37 HA ASN 37 -39.831 1.037 8.608 263 HB2 ASN 37 HB2 ASN 37 -41.047 3.066 9.209 264 HB3 ASN 37 HB1 ASN 37 -42.178 2.811 7.885 265 HD21 ASN 37 HD21 ASN 37 -43.986 2.672 9.127 266 HD22 ASN 37 HD22 ASN 37 -44.302 1.363 10.211 267 H TRP 38 HN TRP 38 -41.617 1.641 5.625 268 HA TRP 38 HA TRP 38 -43.165 -0.712 5.688 269 HB2 TRP 38 HB2 TRP 38 -43.540 1.356 4.236 270 HB3 TRP 38 HB1 TRP 38 -42.299 0.717 3.172 271 HD1 TRP 38 HD1 TRP 38 -42.879 -1.682 1.946 272 HE1 TRP 38 HE1 TRP 38 -45.148 -2.662 1.215 273 HE3 TRP 38 HE3 TRP 38 -45.961 1.228 4.798 274 HZ2 TRP 38 HZ2 TRP 38 -47.887 -2.239 1.777 275 HZ3 TRP 38 HZ3 TRP 38 -48.387 0.882 4.642 276 HH2 TRP 38 HH2 TRP 38 -49.331 -0.815 3.163 277 H ILE 39 HN ILE 39 -39.908 -0.049 4.555 278 HA ILE 39 HA ILE 39 -39.728 -2.499 3.085 279 HB ILE 39 HB ILE 39 -38.337 -0.284 2.783 280 HG12 ILE 39 HG12 ILE 39 -36.644 -1.551 1.557 281 HG13 ILE 39 HG11 ILE 39 -37.068 -3.005 2.460 282 HG21 ILE 39 HG21 ILE 39 -36.484 -1.858 4.560 283 HG22 ILE 39 HG22 ILE 39 -37.275 -0.350 5.011 284 HG23 ILE 39 HG23 ILE 39 -36.098 -0.372 3.688 285 HD11 ILE 39 HD11 ILE 39 -38.018 -2.990 0.212 286 HD12 ILE 39 HD12 ILE 39 -38.907 -1.518 0.609 287 HD13 ILE 39 HD13 ILE 39 -39.264 -3.022 1.460 288 H ILE 40 HN ILE 40 -38.761 -1.448 6.300 289 HA ILE 40 HA ILE 40 -37.348 -3.848 6.870 290 HB ILE 40 HB ILE 40 -37.312 -3.113 9.194 291 HG12 ILE 40 HG12 ILE 40 -38.235 -0.652 9.489 292 HG13 ILE 40 HG11 ILE 40 -39.366 -1.163 8.239 293 HG21 ILE 40 HG21 ILE 40 -36.344 -0.730 8.612 294 HG22 ILE 40 HG22 ILE 40 -36.575 -1.299 6.962 295 HG23 ILE 40 HG23 ILE 40 -35.546 -2.203 8.071 296 HD11 ILE 40 HD11 ILE 40 -38.972 -2.376 10.962 297 HD12 ILE 40 HD12 ILE 40 -39.969 -3.094 9.697 298 HD13 ILE 40 HD13 ILE 40 -40.390 -1.513 10.359 299 H VAL 41 HN VAL 41 -40.701 -2.880 7.211 300 HA VAL 41 HA VAL 41 -41.380 -5.308 8.601 301 HB VAL 41 HB VAL 41 -42.679 -3.184 8.858 302 HG11 VAL 41 HG11 VAL 41 -44.399 -2.648 7.219 303 HG12 VAL 41 HG12 VAL 41 -43.762 -3.890 6.143 304 HG13 VAL 41 HG13 VAL 41 -42.780 -2.481 6.544 305 HG21 VAL 41 HG21 VAL 41 -43.594 -5.271 9.632 306 HG22 VAL 41 HG22 VAL 41 -44.204 -5.641 8.021 307 HG23 VAL 41 HG23 VAL 41 -44.882 -4.290 8.932 308 H HIS 42 HN HIS 42 -40.936 -4.365 5.305 309 HA HIS 42 HA HIS 42 -42.443 -6.703 4.345 310 HB2 HIS 42 HB2 HIS 42 -42.819 -4.411 3.354 311 HB3 HIS 42 HB1 HIS 42 -41.189 -4.493 2.703 312 HD1 HIS 42 HD1 HIS 42 -40.952 -5.539 0.463 313 HD2 HIS 42 HD2 HIS 42 -44.581 -6.486 2.245 314 HE1 HIS 42 HE1 HIS 42 -42.275 -6.733 -1.304 315 HE2 HIS 42 HE2 HIS 42 -44.426 -7.396 -0.180 316 H MET 43 HN MET 43 -39.423 -6.107 5.383 317 HA MET 43 HA MET 43 -37.707 -7.032 3.371 318 HB2 MET 43 HB2 MET 43 -36.056 -7.334 5.117 319 HB3 MET 43 HB1 MET 43 -36.954 -5.851 5.402 320 HG2 MET 43 HG2 MET 43 -38.308 -6.991 7.087 321 HG3 MET 43 HG1 MET 43 -37.409 -8.477 6.799 322 HE1 MET 43 HE1 MET 43 -37.101 -8.480 9.504 323 HE2 MET 43 HE2 MET 43 -37.874 -6.901 9.634 324 HE3 MET 43 HE3 MET 43 -36.299 -7.174 10.376 325 H GLU 44 HN GLU 44 -39.857 -8.810 5.403 326 HA GLU 44 HA GLU 44 -38.378 -11.241 5.500 327 HB2 GLU 44 HB2 GLU 44 -40.404 -12.214 6.427 328 HB3 GLU 44 HB1 GLU 44 -40.088 -10.651 7.166 329 HG2 GLU 44 HG2 GLU 44 -41.754 -9.627 5.695 330 HG3 GLU 44 HG1 GLU 44 -42.090 -11.210 4.993 331 H GLU 45 HN GLU 45 -40.044 -9.768 3.000 332 HA GLU 45 HA GLU 45 -41.131 -12.113 1.748 333 HB2 GLU 45 HB2 GLU 45 -40.637 -9.324 0.693 334 HB3 GLU 45 HB1 GLU 45 -41.525 -10.578 -0.162 335 HG2 GLU 45 HG2 GLU 45 -42.330 -9.618 2.560 336 HG3 GLU 45 HG1 GLU 45 -42.878 -8.831 1.080 337 HA PRO 46 HA PRO 46 -37.307 -13.631 -0.009 338 HB2 PRO 46 HB2 PRO 46 -38.577 -15.116 -1.968 339 HB3 PRO 46 HB1 PRO 46 -38.270 -15.679 -0.317 340 HG2 PRO 46 HG2 PRO 46 -40.753 -14.520 -1.514 341 HG3 PRO 46 HG1 PRO 46 -40.582 -15.864 -0.364 342 HD2 PRO 46 HD2 PRO 46 -41.358 -13.444 0.450 343 HD3 PRO 46 HD1 PRO 46 -40.265 -14.434 1.442 344 H ASP 47 HN ASP 47 -39.929 -12.299 -1.905 345 HA ASP 47 HA ASP 47 -38.082 -11.787 -4.139 346 HB2 ASP 47 HB2 ASP 47 -39.715 -13.489 -4.675 347 HB3 ASP 47 HB1 ASP 47 -41.031 -12.469 -4.126 348 H PHE 48 HN PHE 48 -38.688 -10.102 -1.794 349 HA PHE 48 HA PHE 48 -40.522 -8.069 -2.448 350 HB2 PHE 48 HB2 PHE 48 -39.671 -6.854 -0.585 351 HB3 PHE 48 HB1 PHE 48 -39.620 -8.556 -0.151 352 HD1 PHE 48 HD2 PHE 48 -37.248 -9.663 -0.961 353 HD2 PHE 48 HD1 PHE 48 -37.898 -5.619 0.185 354 HE1 PHE 48 HE2 PHE 48 -34.868 -9.447 -0.379 355 HE2 PHE 48 HE1 PHE 48 -35.518 -5.394 0.763 356 HZ PHE 48 HZ PHE 48 -34.016 -7.267 0.537 357 H ALA 49 HN ALA 49 -37.138 -8.480 -3.257 358 HA ALA 49 HA ALA 49 -37.347 -6.184 -5.047 359 HB1 ALA 49 HB1 ALA 49 -36.154 -5.385 -3.064 360 HB2 ALA 49 HB2 ALA 49 -35.061 -5.472 -4.446 361 HB3 ALA 49 HB3 ALA 49 -35.008 -6.718 -3.199 362 H GLU 50 HN GLU 50 -34.368 -6.751 -5.473 363 HA GLU 50 HA GLU 50 -34.744 -9.055 -7.237 364 HB2 GLU 50 HB2 GLU 50 -32.675 -6.851 -7.265 365 HB3 GLU 50 HB1 GLU 50 -32.613 -8.259 -8.317 366 HG2 GLU 50 HG2 GLU 50 -34.764 -7.632 -9.289 367 HG3 GLU 50 HG1 GLU 50 -34.825 -6.214 -8.242 368 HA PRO 51 HA PRO 51 -32.363 -11.087 -4.001 369 HB2 PRO 51 HB2 PRO 51 -33.181 -13.562 -5.257 370 HB3 PRO 51 HB1 PRO 51 -33.662 -12.911 -3.691 371 HG2 PRO 51 HG2 PRO 51 -35.366 -13.137 -5.806 372 HG3 PRO 51 HG1 PRO 51 -35.538 -11.905 -4.541 373 HD2 PRO 51 HD2 PRO 51 -34.374 -11.654 -7.291 374 HD3 PRO 51 HD1 PRO 51 -35.430 -10.529 -6.406 375 H LEU 52 HN LEU 52 -30.748 -10.077 -5.769 376 HA LEU 52 HA LEU 52 -29.118 -12.327 -6.722 377 HB2 LEU 52 HB2 LEU 52 -29.569 -9.660 -8.065 378 HB3 LEU 52 HB1 LEU 52 -28.358 -10.822 -8.558 379 HG LEU 52 HG LEU 52 -31.335 -11.305 -8.599 380 HD11 LEU 52 HD11 LEU 52 -31.097 -11.191 -11.032 381 HD12 LEU 52 HD12 LEU 52 -29.398 -10.750 -10.842 382 HD13 LEU 52 HD13 LEU 52 -30.662 -9.664 -10.263 383 HD21 LEU 52 HD21 LEU 52 -30.751 -13.324 -9.859 384 HD22 LEU 52 HD22 LEU 52 -30.061 -13.349 -8.235 385 HD23 LEU 52 HD23 LEU 52 -29.039 -12.971 -9.623 386 H THR 53 HN THR 53 -27.734 -12.349 -5.028 387 HA THR 53 HA THR 53 -26.267 -11.626 -3.434 388 HB THR 53 HB THR 53 -24.840 -12.271 -5.245 389 HG1 THR 53 HG1 THR 53 -24.038 -11.012 -3.297 390 HG21 THR 53 HG21 THR 53 -25.058 -9.422 -6.207 391 HG22 THR 53 HG22 THR 53 -25.627 -10.865 -7.046 392 HG23 THR 53 HG23 THR 53 -23.898 -10.601 -6.814 393 H MET 54 HN MET 54 -27.149 -10.201 -2.060 394 HA MET 54 HA MET 54 -27.550 -7.445 -2.683 395 HB2 MET 54 HB2 MET 54 -27.499 -8.842 -0.004 396 HB3 MET 54 HB1 MET 54 -28.111 -7.221 -0.298 397 HG2 MET 54 HG2 MET 54 -29.821 -8.158 -1.791 398 HG3 MET 54 HG1 MET 54 -29.230 -9.777 -1.424 399 HE1 MET 54 HE1 MET 54 -32.272 -8.972 -1.088 400 HE2 MET 54 HE2 MET 54 -32.634 -9.723 0.464 401 HE3 MET 54 HE3 MET 54 -31.623 -10.568 -0.710 402 HA PRO 55 HA PRO 55 -23.345 -6.189 -2.110 403 HB2 PRO 55 HB2 PRO 55 -24.339 -3.443 -2.101 404 HB3 PRO 55 HB1 PRO 55 -23.352 -4.269 -3.309 405 HG2 PRO 55 HG2 PRO 55 -25.923 -3.571 -3.763 406 HG3 PRO 55 HG1 PRO 55 -25.180 -5.009 -4.488 407 HD2 PRO 55 HD2 PRO 55 -27.003 -4.807 -2.118 408 HD3 PRO 55 HD1 PRO 55 -26.995 -5.992 -3.440 409 H GLY 56 HN GLY 56 -25.544 -3.913 -0.427 410 HA2 GLY 56 HA2 GLY 56 -25.570 -3.326 1.824 411 HA3 GLY 56 HA1 GLY 56 -24.279 -4.481 2.122 412 H TYR 57 HN TYR 57 -24.190 -2.027 3.332 413 HA TYR 57 HA TYR 57 -22.570 -0.234 1.748 414 HB2 TYR 57 HB2 TYR 57 -22.505 1.112 3.906 415 HB3 TYR 57 HB1 TYR 57 -24.092 0.870 3.186 416 HD1 TYR 57 HD2 TYR 57 -21.871 -0.098 5.958 417 HD2 TYR 57 HD1 TYR 57 -25.795 -0.385 4.338 418 HE1 TYR 57 HE2 TYR 57 -22.681 -1.003 8.096 419 HE2 TYR 57 HE1 TYR 57 -26.614 -1.290 6.472 420 HH TYR 57 HH TYR 57 -25.808 -2.397 8.442 421 H GLY 58 HN GLY 58 -21.517 -2.892 2.335 422 HA2 GLY 58 HA2 GLY 58 -19.359 -2.437 4.236 423 HA3 GLY 58 HA1 GLY 58 -19.700 -3.937 3.383 424 H GLY 59 HN GLY 59 -18.527 -0.630 2.863 425 HA2 GLY 59 HA2 GLY 59 -16.522 -1.718 1.019 426 HA3 GLY 59 HA1 GLY 59 -17.580 -0.436 0.439 427 H ALA 60 HN ALA 60 -14.944 0.035 0.362 428 HA ALA 60 HA ALA 60 -14.605 2.009 2.511 429 HB1 ALA 60 HB1 ALA 60 -13.145 0.105 2.985 430 HB2 ALA 60 HB2 ALA 60 -12.212 1.546 2.580 431 HB3 ALA 60 HB3 ALA 60 -12.414 0.262 1.387 432 H ALA 61 HN ALA 61 -13.897 3.971 1.888 433 HA ALA 61 HA ALA 61 -12.976 4.309 -0.887 434 HB1 ALA 61 HB1 ALA 61 -15.302 5.051 -0.766 435 HB2 ALA 61 HB2 ALA 61 -14.218 6.419 -1.027 436 HB3 ALA 61 HB3 ALA 61 -14.897 6.126 0.574 437 H SER 62 HN SER 62 -11.040 5.209 -0.956 438 HA SER 62 HA SER 62 -9.035 5.968 -0.199 439 HB2 SER 62 HB2 SER 62 -9.121 8.315 0.743 440 HB3 SER 62 HB1 SER 62 -9.930 8.100 -0.806 441 HG SER 62 HG SER 62 -11.654 7.647 1.220 442 H ALA 63 HN ALA 63 -9.439 4.005 1.354 443 HA ALA 63 HA ALA 63 -9.796 4.689 4.129 444 HB1 ALA 63 HB1 ALA 63 -8.903 2.097 2.871 445 HB2 ALA 63 HB2 ALA 63 -10.568 2.539 3.250 446 HB3 ALA 63 HB3 ALA 63 -9.394 2.318 4.550 447 H GLY 64 HN GLY 64 -8.124 6.231 4.385 448 HA2 GLY 64 HA2 GLY 64 -6.055 5.995 5.820 449 HA3 GLY 64 HA1 GLY 64 -5.409 5.083 4.461 450 H ALA 65 HN ALA 65 -4.104 6.199 3.208 451 HA ALA 65 HA ALA 65 -4.822 8.768 2.170 452 HB1 ALA 65 HB1 ALA 65 -3.914 9.502 4.315 453 HB2 ALA 65 HB2 ALA 65 -2.834 9.970 3.003 454 HB3 ALA 65 HB3 ALA 65 -2.434 8.588 4.022 455 H SER 66 HN SER 66 -3.393 9.400 0.438 456 HA SER 66 HA SER 66 -2.111 7.127 -0.812 457 HB2 SER 66 HB2 SER 66 -3.525 8.778 -2.078 458 HB3 SER 66 HB1 SER 66 -2.278 9.989 -1.795 459 HG SER 66 HG SER 66 -1.771 7.509 -3.075 460 H VAL 67 HN VAL 67 -0.533 6.982 0.972 461 HA VAL 67 HA VAL 67 1.573 9.013 0.959 462 HB VAL 67 HB VAL 67 1.259 6.585 2.740 463 HG11 VAL 67 HG11 VAL 67 2.934 7.662 4.156 464 HG12 VAL 67 HG12 VAL 67 3.082 8.975 2.990 465 HG13 VAL 67 HG13 VAL 67 3.575 7.342 2.542 466 HG21 VAL 67 HG21 VAL 67 -0.561 8.195 3.047 467 HG22 VAL 67 HG22 VAL 67 0.620 9.480 3.304 468 HG23 VAL 67 HG23 VAL 67 0.505 8.146 4.450 469 H PHE 68 HN PHE 68 3.361 8.749 -0.179 470 HA PHE 68 HA PHE 68 3.934 6.178 -1.411 471 HB2 PHE 68 HB2 PHE 68 5.163 8.916 -1.798 472 HB3 PHE 68 HB1 PHE 68 5.523 7.491 -2.751 473 HD1 PHE 68 HD1 PHE 68 3.556 6.394 -4.007 474 HD2 PHE 68 HD2 PHE 68 3.471 10.349 -2.442 475 HE1 PHE 68 HE1 PHE 68 1.710 6.954 -5.536 476 HE2 PHE 68 HE2 PHE 68 1.625 10.916 -3.964 477 HZ PHE 68 HZ PHE 68 0.743 9.216 -5.513 478 H GLY 69 HN GLY 69 6.532 5.970 -1.661 479 HA2 GLY 69 HA2 GLY 69 7.912 6.617 0.800 480 HA3 GLY 69 HA1 GLY 69 7.538 4.913 0.601 481 H ALA 70 HN ALA 70 9.890 4.726 0.726 482 HA ALA 70 HA ALA 70 11.139 5.186 -1.905 483 HB1 ALA 70 HB1 ALA 70 12.168 6.664 -0.305 484 HB2 ALA 70 HB2 ALA 70 13.308 5.372 -0.694 485 HB3 ALA 70 HB3 ALA 70 12.414 5.334 0.825 486 H SER 71 HN SER 71 11.953 3.374 1.044 487 HA SER 71 HA SER 71 12.519 1.218 1.420 488 HB2 SER 71 HB2 SER 71 10.763 0.595 -0.964 489 HB3 SER 71 HB1 SER 71 11.183 -0.493 0.359 490 HG SER 71 HG SER 71 10.095 1.831 1.270 491 H GLY 72 HN GLY 72 14.584 2.235 0.500 492 HA2 GLY 72 HA2 GLY 72 15.999 0.302 -0.933 493 HA3 GLY 72 HA1 GLY 72 15.513 1.550 -2.076 494 H LEU 73 HN LEU 73 16.372 1.916 1.324 495 HA LEU 73 HA LEU 73 18.554 3.712 0.474 496 HB2 LEU 73 HB2 LEU 73 16.453 3.980 2.549 497 HB3 LEU 73 HB1 LEU 73 18.044 4.587 2.959 498 HG LEU 73 HG LEU 73 16.580 6.354 2.095 499 HD11 LEU 73 HD11 LEU 73 18.856 5.674 0.238 500 HD12 LEU 73 HD12 LEU 73 18.990 6.537 1.768 501 HD13 LEU 73 HD13 LEU 73 18.112 7.264 0.421 502 HD21 LEU 73 HD21 LEU 73 15.886 6.391 -0.231 503 HD22 LEU 73 HD22 LEU 73 15.215 4.978 0.584 504 HD23 LEU 73 HD23 LEU 73 16.602 4.800 -0.489 505 H ASP 74 HN ASP 74 18.456 0.773 1.209 506 HA ASP 74 HA ASP 74 20.797 0.883 2.946 507 HB2 ASP 74 HB2 ASP 74 20.046 -0.892 4.397 508 HB3 ASP 74 HB1 ASP 74 18.826 0.374 4.415 509 H ASN 75 HN ASN 75 22.240 -0.827 2.652 510 HA ASN 75 HA ASN 75 21.694 -3.101 1.055 511 HB2 ASN 75 HB2 ASN 75 23.132 -2.580 -0.867 512 HB3 ASN 75 HB1 ASN 75 21.800 -1.432 -0.783 513 HD21 ASN 75 HD21 ASN 75 22.218 0.705 -0.349 514 HD22 ASN 75 HD22 ASN 75 23.811 1.367 -0.325 515 H GLN 76 HN GLN 76 23.968 -4.142 0.510 516 HA GLN 76 HA GLN 76 25.997 -3.175 2.349 517 HB2 GLN 76 HB2 GLN 76 24.678 -5.016 3.478 518 HB3 GLN 76 HB1 GLN 76 25.251 -6.107 2.220 519 HG2 GLN 76 HG2 GLN 76 27.592 -5.413 2.904 520 HG3 GLN 76 HG1 GLN 76 26.849 -4.684 4.324 521 HE21 GLN 76 HE21 GLN 76 24.798 -6.793 4.458 522 HE22 GLN 76 HE22 GLN 76 25.602 -8.180 5.107 523 HA PRO 77 HA PRO 77 28.739 -4.026 -1.136 524 HB2 PRO 77 HB2 PRO 77 30.557 -4.616 1.157 525 HB3 PRO 77 HB1 PRO 77 30.855 -3.633 -0.282 526 HG2 PRO 77 HG2 PRO 77 30.384 -2.473 2.029 527 HG3 PRO 77 HG1 PRO 77 29.633 -1.844 0.556 528 HD2 PRO 77 HD2 PRO 77 28.435 -3.497 2.740 529 HD3 PRO 77 HD1 PRO 77 27.723 -2.155 1.828 530 HA PRO 78 HA PRO 78 28.863 -8.446 -1.440 531 HB2 PRO 78 HB2 PRO 78 31.307 -8.915 -2.559 532 HB3 PRO 78 HB1 PRO 78 29.943 -8.262 -3.471 533 HG2 PRO 78 HG2 PRO 78 32.230 -6.812 -2.210 534 HG3 PRO 78 HG1 PRO 78 31.543 -6.588 -3.829 535 HD2 PRO 78 HD2 PRO 78 30.957 -4.946 -1.808 536 HD3 PRO 78 HD1 PRO 78 29.734 -5.403 -3.004 537 H GLU 79 HN GLU 79 28.912 -9.409 0.497 538 HA GLU 79 HA GLU 79 30.821 -9.043 2.488 539 HB2 GLU 79 HB2 GLU 79 29.830 -10.925 3.596 540 HB3 GLU 79 HB1 GLU 79 28.552 -10.000 2.826 541 HG2 GLU 79 HG2 GLU 79 28.633 -11.609 0.946 542 HG3 GLU 79 HG1 GLU 79 29.764 -12.578 1.884 543 H GLU 80 HN GLU 80 30.795 -11.086 -0.293 544 HA GLU 80 HA GLU 80 32.889 -12.816 0.307 545 HB2 GLU 80 HB2 GLU 80 31.956 -13.375 -1.704 546 HB3 GLU 80 HB1 GLU 80 31.646 -11.704 -2.137 547 HG2 GLU 80 HG2 GLU 80 34.052 -11.440 -2.666 548 HG3 GLU 80 HG1 GLU 80 34.267 -13.164 -2.348 549 H ILE 81 HN ILE 81 32.959 -9.603 -1.194 550 HA ILE 81 HA ILE 81 35.797 -9.560 -1.358 551 HB ILE 81 HB ILE 81 33.743 -7.405 -1.797 552 HG12 ILE 81 HG12 ILE 81 35.554 -8.912 -3.700 553 HG13 ILE 81 HG11 ILE 81 33.845 -9.251 -3.457 554 HG21 ILE 81 HG21 ILE 81 35.847 -6.309 -2.925 555 HG22 ILE 81 HG22 ILE 81 36.718 -7.295 -1.738 556 HG23 ILE 81 HG23 ILE 81 35.534 -6.104 -1.202 557 HD11 ILE 81 HD11 ILE 81 35.162 -6.991 -4.862 558 HD12 ILE 81 HD12 ILE 81 33.601 -6.714 -4.096 559 HD13 ILE 81 HD13 ILE 81 33.765 -7.960 -5.340 560 H VAL 82 HN VAL 82 33.427 -8.026 0.820 561 HA VAL 82 HA VAL 82 35.223 -6.452 2.255 562 HB VAL 82 HB VAL 82 33.667 -6.382 4.049 563 HG11 VAL 82 HG11 VAL 82 31.507 -5.984 2.940 564 HG12 VAL 82 HG12 VAL 82 32.150 -6.732 1.479 565 HG13 VAL 82 HG13 VAL 82 32.864 -5.240 2.093 566 HG21 VAL 82 HG21 VAL 82 32.908 -8.330 4.810 567 HG22 VAL 82 HG22 VAL 82 33.054 -9.099 3.231 568 HG23 VAL 82 HG23 VAL 82 31.616 -8.145 3.620 569 H ALA 83 HN ALA 83 34.376 -9.840 2.489 570 HA ALA 83 HA ALA 83 35.889 -10.625 4.704 571 HB1 ALA 83 HB1 ALA 83 35.884 -12.848 3.314 572 HB2 ALA 83 HB2 ALA 83 34.768 -11.932 2.278 573 HB3 ALA 83 HB3 ALA 83 34.385 -12.198 3.985 574 H ILE 84 HN ILE 84 36.694 -10.586 1.249 575 HA ILE 84 HA ILE 84 39.306 -11.582 1.443 576 HB ILE 84 HB ILE 84 38.047 -9.707 -0.571 577 HG12 ILE 84 HG12 ILE 84 38.749 -12.556 -1.115 578 HG13 ILE 84 HG11 ILE 84 37.328 -12.221 -0.141 579 HG21 ILE 84 HG21 ILE 84 40.664 -11.200 -0.787 580 HG22 ILE 84 HG22 ILE 84 40.480 -9.455 -0.590 581 HG23 ILE 84 HG23 ILE 84 39.903 -10.244 -2.059 582 HD11 ILE 84 HD11 ILE 84 37.763 -10.988 -2.834 583 HD12 ILE 84 HD12 ILE 84 36.269 -11.079 -1.887 584 HD13 ILE 84 HD13 ILE 84 36.955 -12.539 -2.604 585 H ILE 85 HN ILE 85 38.015 -8.308 1.627 586 HA ILE 85 HA ILE 85 40.497 -6.982 1.666 587 HB ILE 85 HB ILE 85 37.825 -6.095 2.731 588 HG12 ILE 85 HG12 ILE 85 39.192 -5.504 0.104 589 HG13 ILE 85 HG11 ILE 85 37.930 -6.712 0.324 590 HG21 ILE 85 HG21 ILE 85 40.466 -4.821 2.685 591 HG22 ILE 85 HG22 ILE 85 39.033 -4.444 3.644 592 HG23 ILE 85 HG23 ILE 85 39.171 -3.842 1.995 593 HD11 ILE 85 HD11 ILE 85 37.157 -4.542 -0.625 594 HD12 ILE 85 HD12 ILE 85 37.557 -3.794 0.922 595 HD13 ILE 85 HD13 ILE 85 36.323 -5.047 0.842 596 H THR 86 HN THR 86 38.316 -7.989 4.311 597 HA THR 86 HA THR 86 40.136 -7.063 6.298 598 HB THR 86 HB THR 86 37.969 -7.159 7.115 599 HG1 THR 86 HG1 THR 86 39.463 -7.999 8.619 600 HG21 THR 86 HG21 THR 86 36.628 -8.439 5.833 601 HG22 THR 86 HG22 THR 86 36.819 -9.541 7.208 602 HG23 THR 86 HG23 THR 86 37.783 -9.774 5.749 603 H SER 87 HN SER 87 39.943 -9.936 4.417 604 HA SER 87 HA SER 87 41.774 -11.455 6.008 605 HB2 SER 87 HB2 SER 87 40.201 -12.444 4.306 606 HB3 SER 87 HB1 SER 87 41.209 -11.740 3.045 607 HG SER 87 HG SER 87 42.442 -13.337 5.003 608 H MET 88 HN MET 88 42.034 -8.974 3.580 609 HA MET 88 HA MET 88 44.782 -9.290 2.947 610 HB2 MET 88 HB2 MET 88 42.971 -6.888 2.826 611 HB3 MET 88 HB1 MET 88 44.633 -6.865 2.259 612 HG2 MET 88 HG2 MET 88 42.433 -8.613 1.174 613 HG3 MET 88 HG1 MET 88 43.040 -7.137 0.433 614 HE1 MET 88 HE1 MET 88 43.396 -10.942 0.721 615 HE2 MET 88 HE2 MET 88 44.554 -10.495 1.971 616 HE3 MET 88 HE3 MET 88 45.118 -11.241 0.476 617 H GLY 89 HN GLY 89 43.115 -7.971 5.619 618 HA2 GLY 89 HA2 GLY 89 44.659 -7.870 7.627 619 HA3 GLY 89 HA1 GLY 89 45.580 -6.746 6.639 620 H PHE 90 HN PHE 90 42.559 -6.173 5.730 621 HA PHE 90 HA PHE 90 42.358 -3.836 7.440 622 HB2 PHE 90 HB2 PHE 90 40.825 -4.628 4.957 623 HB3 PHE 90 HB1 PHE 90 40.687 -3.078 5.782 624 HD1 PHE 90 HD2 PHE 90 43.359 -2.273 6.365 625 HD2 PHE 90 HD1 PHE 90 41.907 -4.349 2.946 626 HE1 PHE 90 HE2 PHE 90 45.236 -1.400 5.038 627 HE2 PHE 90 HE1 PHE 90 43.781 -3.473 1.614 628 HZ PHE 90 HZ PHE 90 45.477 -2.012 2.690 629 H GLN 91 HN GLN 91 39.809 -3.237 7.661 630 HA GLN 91 HA GLN 91 38.704 -5.416 9.268 631 HB2 GLN 91 HB2 GLN 91 38.954 -3.292 10.402 632 HB3 GLN 91 HB1 GLN 91 38.089 -2.459 9.123 633 HG2 GLN 91 HG2 GLN 91 36.074 -3.760 9.718 634 HG3 GLN 91 HG1 GLN 91 36.962 -4.448 11.073 635 HE21 GLN 91 HE21 GLN 91 37.506 -3.126 12.823 636 HE22 GLN 91 HE22 GLN 91 36.728 -1.602 13.088 637 H ARG 92 HN ARG 92 36.565 -6.176 8.936 638 HA ARG 92 HA ARG 92 35.631 -6.350 6.301 639 HB2 ARG 92 HB2 ARG 92 34.939 -7.906 8.063 640 HB3 ARG 92 HB1 ARG 92 34.057 -6.623 8.859 641 HG2 ARG 92 HG2 ARG 92 32.942 -6.485 6.435 642 HG3 ARG 92 HG1 ARG 92 33.356 -8.198 6.479 643 HD2 ARG 92 HD2 ARG 92 31.779 -6.728 8.576 644 HD3 ARG 92 HD1 ARG 92 31.084 -7.734 7.309 645 HE ARG 92 HE ARG 92 33.019 -9.145 8.881 646 HH11 ARG 92 HH11 ARG 92 29.664 -8.168 8.682 647 HH12 ARG 92 HH12 ARG 92 29.120 -9.320 9.871 648 HH21 ARG 92 HH21 ARG 92 32.308 -10.675 10.438 649 HH22 ARG 92 HH22 ARG 92 30.618 -10.751 10.848 650 H ASN 93 HN ASN 93 34.295 -4.425 8.980 651 HA ASN 93 HA ASN 93 32.395 -3.000 7.511 652 HB2 ASN 93 HB2 ASN 93 32.467 -3.068 9.960 653 HB3 ASN 93 HB1 ASN 93 33.939 -2.101 9.955 654 HD21 ASN 93 HD21 ASN 93 33.815 0.097 9.559 655 HD22 ASN 93 HD22 ASN 93 32.308 0.951 9.522 656 H GLN 94 HN GLN 94 35.798 -2.361 8.052 657 HA GLN 94 HA GLN 94 35.929 0.185 6.841 658 HB2 GLN 94 HB2 GLN 94 37.773 -0.325 8.138 659 HB3 GLN 94 HB1 GLN 94 37.874 -1.963 7.534 660 HG2 GLN 94 HG2 GLN 94 38.924 -1.268 5.540 661 HG3 GLN 94 HG1 GLN 94 38.576 0.429 5.855 662 HE21 GLN 94 HE21 GLN 94 39.825 1.534 7.389 663 HE22 GLN 94 HE22 GLN 94 41.315 0.899 7.985 664 H ALA 95 HN ALA 95 36.233 -3.099 5.654 665 HA ALA 95 HA ALA 95 36.799 -2.496 2.957 666 HB1 ALA 95 HB1 ALA 95 35.416 -4.881 4.181 667 HB2 ALA 95 HB2 ALA 95 37.156 -4.686 3.942 668 HB3 ALA 95 HB3 ALA 95 36.077 -4.799 2.546 669 H ILE 96 HN ILE 96 33.777 -2.902 4.756 670 HA ILE 96 HA ILE 96 31.996 -2.833 2.612 671 HB ILE 96 HB ILE 96 31.738 -2.184 5.512 672 HG12 ILE 96 HG12 ILE 96 29.695 -3.861 4.473 673 HG13 ILE 96 HG11 ILE 96 31.226 -4.381 3.781 674 HG21 ILE 96 HG21 ILE 96 29.265 -1.776 5.074 675 HG22 ILE 96 HG22 ILE 96 29.739 -1.468 3.396 676 HG23 ILE 96 HG23 ILE 96 30.376 -0.458 4.693 677 HD11 ILE 96 HD11 ILE 96 30.522 -4.143 6.688 678 HD12 ILE 96 HD12 ILE 96 32.144 -4.461 6.080 679 HD13 ILE 96 HD13 ILE 96 30.847 -5.620 5.774 680 H GLN 97 HN GLN 97 33.105 -0.166 4.679 681 HA GLN 97 HA GLN 97 31.761 1.898 3.371 682 HB2 GLN 97 HB2 GLN 97 32.872 2.126 5.547 683 HB3 GLN 97 HB1 GLN 97 34.426 2.028 4.740 684 HG2 GLN 97 HG2 GLN 97 34.099 4.086 3.633 685 HG3 GLN 97 HG1 GLN 97 32.404 4.142 4.104 686 HE21 GLN 97 HE21 GLN 97 32.611 6.130 5.095 687 HE22 GLN 97 HE22 GLN 97 33.442 6.346 6.601 688 H ALA 98 HN ALA 98 34.943 0.528 2.806 689 HA ALA 98 HA ALA 98 35.794 2.280 0.810 690 HB1 ALA 98 HB1 ALA 98 37.049 0.397 2.081 691 HB2 ALA 98 HB2 ALA 98 37.532 0.787 0.429 692 HB3 ALA 98 HB3 ALA 98 36.509 -0.621 0.745 693 H LEU 99 HN LEU 99 34.203 -0.905 0.494 694 HA LEU 99 HA LEU 99 33.972 -0.850 -2.292 695 HB2 LEU 99 HB2 LEU 99 32.258 -2.232 -0.254 696 HB3 LEU 99 HB1 LEU 99 32.177 -2.538 -1.974 697 HG LEU 99 HG LEU 99 34.662 -2.962 -0.331 698 HD11 LEU 99 HD11 LEU 99 32.699 -5.044 -1.251 699 HD12 LEU 99 HD12 LEU 99 32.732 -4.377 0.378 700 HD13 LEU 99 HD13 LEU 99 34.121 -5.278 -0.231 701 HD21 LEU 99 HD21 LEU 99 35.602 -3.212 -2.322 702 HD22 LEU 99 HD22 LEU 99 34.050 -3.004 -3.120 703 HD23 LEU 99 HD23 LEU 99 34.554 -4.605 -2.590 704 H ARG 100 HN ARG 100 31.845 0.435 0.222 705 HA ARG 100 HA ARG 100 29.610 1.067 -1.324 706 HB2 ARG 100 HB2 ARG 100 30.871 2.454 1.033 707 HB3 ARG 100 HB1 ARG 100 29.382 3.037 0.299 708 HG2 ARG 100 HG2 ARG 100 28.233 1.026 0.855 709 HG3 ARG 100 HG1 ARG 100 29.730 0.252 1.379 710 HD2 ARG 100 HD2 ARG 100 29.927 1.709 3.240 711 HD3 ARG 100 HD1 ARG 100 28.612 2.736 2.660 712 HE ARG 100 HE ARG 100 27.727 0.065 3.062 713 HH11 ARG 100 HH11 ARG 100 28.469 3.044 4.750 714 HH12 ARG 100 HH12 ARG 100 27.474 2.657 6.123 715 HH21 ARG 100 HH21 ARG 100 26.454 -0.465 4.891 716 HH22 ARG 100 HH22 ARG 100 26.337 0.666 6.202 717 H ALA 101 HN ALA 101 32.549 2.897 -0.744 718 HA ALA 101 HA ALA 101 31.857 5.116 -2.382 719 HB1 ALA 101 HB1 ALA 101 34.410 5.491 -2.184 720 HB2 ALA 101 HB2 ALA 101 34.342 4.123 -1.061 721 HB3 ALA 101 HB3 ALA 101 33.410 5.586 -0.733 722 H THR 102 HN THR 102 33.759 2.177 -2.876 723 HA THR 102 HA THR 102 34.634 2.977 -5.495 724 HB THR 102 HB THR 102 35.900 0.947 -5.498 725 HG1 THR 102 HG1 THR 102 35.558 -0.652 -3.949 726 HG21 THR 102 HG21 THR 102 37.303 1.800 -3.984 727 HG22 THR 102 HG22 THR 102 36.211 1.472 -2.655 728 HG23 THR 102 HG23 THR 102 36.047 2.957 -3.593 729 H ASN 103 HN ASN 103 31.742 1.890 -4.500 730 HA ASN 103 HA ASN 103 29.975 0.792 -5.359 731 HB2 ASN 103 HB2 ASN 103 31.490 1.213 -7.940 732 HB3 ASN 103 HB1 ASN 103 29.855 0.578 -7.851 733 HD21 ASN 103 HD21 ASN 103 29.068 2.274 -5.641 734 HD22 ASN 103 HD22 ASN 103 28.888 3.867 -6.287 735 H ASN 104 HN ASN 104 31.252 -0.873 -4.040 736 HA ASN 104 HA ASN 104 31.922 -2.975 -3.629 737 HB2 ASN 104 HB2 ASN 104 30.666 -4.761 -4.588 738 HB3 ASN 104 HB1 ASN 104 29.593 -3.389 -4.412 739 HD21 ASN 104 HD21 ASN 104 28.641 -2.519 -6.195 740 HD22 ASN 104 HD22 ASN 104 28.778 -3.207 -7.780 741 H ASN 105 HN ASN 105 33.560 -1.407 -5.535 742 HA ASN 105 HA ASN 105 34.810 -3.464 -7.161 743 HB2 ASN 105 HB2 ASN 105 34.658 -0.977 -7.792 744 HB3 ASN 105 HB1 ASN 105 35.920 -0.711 -6.590 745 HD21 ASN 105 HD21 ASN 105 35.169 -1.839 -9.733 746 HD22 ASN 105 HD22 ASN 105 36.786 -2.240 -10.225 747 H LEU 106 HN LEU 106 35.969 -4.914 -6.177 748 HA LEU 106 HA LEU 106 36.866 -4.891 -3.550 749 HB2 LEU 106 HB2 LEU 106 36.585 -6.912 -4.862 750 HB3 LEU 106 HB1 LEU 106 37.863 -6.436 -5.952 751 HG LEU 106 HG LEU 106 38.574 -6.791 -3.082 752 HD11 LEU 106 HD11 LEU 106 38.447 -9.164 -4.899 753 HD12 LEU 106 HD12 LEU 106 37.058 -8.708 -3.920 754 HD13 LEU 106 HD13 LEU 106 38.586 -9.121 -3.137 755 HD21 LEU 106 HD21 LEU 106 40.624 -7.696 -4.072 756 HD22 LEU 106 HD22 LEU 106 40.262 -6.068 -4.653 757 HD23 LEU 106 HD23 LEU 106 39.936 -7.466 -5.681 758 H GLU 107 HN GLU 107 38.857 -4.653 -6.439 759 HA GLU 107 HA GLU 107 41.286 -4.065 -5.271 760 HB2 GLU 107 HB2 GLU 107 40.235 -3.102 -7.932 761 HB3 GLU 107 HB1 GLU 107 41.925 -3.165 -7.457 762 HG2 GLU 107 HG2 GLU 107 40.303 -5.642 -7.330 763 HG3 GLU 107 HG1 GLU 107 40.861 -5.067 -8.904 764 H ARG 108 HN ARG 108 38.849 -1.764 -6.478 765 HA ARG 108 HA ARG 108 40.326 0.546 -5.798 766 HB2 ARG 108 HB2 ARG 108 38.328 0.292 -7.389 767 HB3 ARG 108 HB1 ARG 108 37.331 0.412 -5.954 768 HG2 ARG 108 HG2 ARG 108 38.270 2.607 -5.483 769 HG3 ARG 108 HG1 ARG 108 39.259 2.490 -6.947 770 HD2 ARG 108 HD2 ARG 108 36.277 2.232 -6.899 771 HD3 ARG 108 HD1 ARG 108 37.113 3.757 -7.228 772 HE ARG 108 HE ARG 108 38.227 2.292 -9.085 773 HH11 ARG 108 HH11 ARG 108 34.869 2.133 -8.065 774 HH12 ARG 108 HH12 ARG 108 34.289 1.668 -9.629 775 HH21 ARG 108 HH21 ARG 108 37.448 1.683 -11.152 776 HH22 ARG 108 HH22 ARG 108 35.741 1.420 -11.381 777 H ALA 109 HN ALA 109 38.122 -1.507 -3.998 778 HA ALA 109 HA ALA 109 37.571 0.235 -1.876 779 HB1 ALA 109 HB1 ALA 109 36.936 -2.386 -2.499 780 HB2 ALA 109 HB2 ALA 109 36.455 -1.531 -1.036 781 HB3 ALA 109 HB3 ALA 109 37.907 -2.532 -1.038 782 H LEU 110 HN LEU 110 40.053 -2.265 -2.278 783 HA LEU 110 HA LEU 110 41.538 -1.761 0.046 784 HB2 LEU 110 HB2 LEU 110 42.549 -2.685 -2.643 785 HB3 LEU 110 HB1 LEU 110 43.331 -2.944 -1.098 786 HG LEU 110 HG LEU 110 40.593 -4.040 -1.665 787 HD11 LEU 110 HD11 LEU 110 43.259 -5.319 -2.269 788 HD12 LEU 110 HD12 LEU 110 42.002 -4.885 -3.432 789 HD13 LEU 110 HD13 LEU 110 41.712 -6.166 -2.251 790 HD21 LEU 110 HD21 LEU 110 41.233 -5.625 0.083 791 HD22 LEU 110 HD22 LEU 110 41.323 -3.955 0.651 792 HD23 LEU 110 HD23 LEU 110 42.799 -4.826 0.234 793 H ASP 111 HN ASP 111 41.696 -0.450 -3.196 794 HA ASP 111 HA ASP 111 43.829 1.323 -3.041 795 HB2 ASP 111 HB2 ASP 111 42.086 0.769 -4.972 796 HB3 ASP 111 HB1 ASP 111 41.270 2.177 -4.329 797 H TRP 112 HN TRP 112 40.445 1.852 -2.261 798 HA TRP 112 HA TRP 112 40.611 4.483 -1.313 799 HB2 TRP 112 HB2 TRP 112 38.539 3.239 -2.001 800 HB3 TRP 112 HB1 TRP 112 38.634 2.362 -0.480 801 HD1 TRP 112 HD1 TRP 112 37.748 5.767 -1.914 802 HE1 TRP 112 HE1 TRP 112 36.536 7.155 -0.118 803 HE3 TRP 112 HE3 TRP 112 38.454 2.681 2.101 804 HZ2 TRP 112 HZ2 TRP 112 35.962 6.964 2.641 805 HZ3 TRP 112 HZ3 TRP 112 37.544 3.359 4.283 806 HH2 TRP 112 HH2 TRP 112 36.324 5.456 4.547 807 H ILE 113 HN ILE 113 40.557 1.394 0.364 808 HA ILE 113 HA ILE 113 40.730 2.380 2.972 809 HB ILE 113 HB ILE 113 41.556 -0.295 1.852 810 HG12 ILE 113 HG12 ILE 113 39.041 0.689 3.218 811 HG13 ILE 113 HG11 ILE 113 39.193 0.183 1.544 812 HG21 ILE 113 HG21 ILE 113 41.130 0.529 4.727 813 HG22 ILE 113 HG22 ILE 113 42.680 0.153 3.982 814 HG23 ILE 113 HG23 ILE 113 41.461 -1.108 4.157 815 HD11 ILE 113 HD11 ILE 113 39.852 -1.736 3.714 816 HD12 ILE 113 HD12 ILE 113 39.253 -2.026 2.079 817 HD13 ILE 113 HD13 ILE 113 38.169 -1.402 3.316 818 H PHE 114 HN PHE 114 43.210 1.672 0.595 819 HA PHE 114 HA PHE 114 45.449 1.706 2.283 820 HB2 PHE 114 HB2 PHE 114 45.463 0.949 -0.085 821 HB3 PHE 114 HB1 PHE 114 45.266 2.623 -0.595 822 HD1 PHE 114 HD2 PHE 114 47.547 0.312 1.192 823 HD2 PHE 114 HD1 PHE 114 47.141 4.014 -0.871 824 HE1 PHE 114 HE2 PHE 114 49.993 0.579 1.194 825 HE2 PHE 114 HE1 PHE 114 49.585 4.285 -0.876 826 HZ PHE 114 HZ PHE 114 51.015 2.568 0.157 827 H SER 115 HN SER 115 43.522 4.262 0.957 828 HA SER 115 HA SER 115 45.391 6.342 1.695 829 HB2 SER 115 HB2 SER 115 43.927 6.549 -0.290 830 HB3 SER 115 HB1 SER 115 42.518 6.517 0.756 831 HG SER 115 HG SER 115 44.534 8.507 0.566 832 H HIS 116 HN HIS 116 43.385 4.364 3.353 833 HA HIS 116 HA HIS 116 43.352 6.208 5.623 834 HB2 HIS 116 HB2 HIS 116 40.908 4.657 4.727 835 HB3 HIS 116 HB1 HIS 116 41.052 5.487 6.267 836 HD1 HIS 116 HD1 HIS 116 41.285 8.179 6.086 837 HD2 HIS 116 HD2 HIS 116 39.978 6.177 2.680 838 HE1 HIS 116 HE1 HIS 116 40.185 9.926 4.647 839 HE2 HIS 116 HE2 HIS 116 39.228 8.651 2.692 840 HA PRO 117 HA PRO 117 45.392 1.944 5.902 841 HB2 PRO 117 HB2 PRO 117 46.703 2.963 8.208 842 HB3 PRO 117 HB1 PRO 117 47.396 2.682 6.614 843 HG2 PRO 117 HG2 PRO 117 46.287 5.184 7.790 844 HG3 PRO 117 HG1 PRO 117 47.613 4.978 6.626 845 HD2 PRO 117 HD2 PRO 117 45.272 5.887 5.793 846 HD3 PRO 117 HD1 PRO 117 46.117 4.655 4.838 847 H GLU 118 HN GLU 118 44.686 3.732 8.835 848 HA GLU 118 HA GLU 118 42.534 1.998 9.547 849 HB2 GLU 118 HB2 GLU 118 43.591 1.574 11.846 850 HB3 GLU 118 HB1 GLU 118 44.124 0.574 10.502 851 HG2 GLU 118 HG2 GLU 118 46.072 2.075 10.241 852 HG3 GLU 118 HG1 GLU 118 45.561 2.927 11.698 853 H PHE 119 HN PHE 119 44.829 4.282 10.990 854 HA PHE 119 HA PHE 119 42.789 6.300 11.147 855 HB2 PHE 119 HB2 PHE 119 42.493 4.792 13.183 856 HB3 PHE 119 HB1 PHE 119 44.050 5.391 13.734 857 HD1 PHE 119 HD1 PHE 119 40.685 6.576 12.686 858 HD2 PHE 119 HD2 PHE 119 44.155 7.300 15.039 859 HE1 PHE 119 HE1 PHE 119 39.572 8.509 13.728 860 HE2 PHE 119 HE2 PHE 119 43.048 9.227 16.087 861 HZ PHE 119 HZ PHE 119 40.753 9.827 15.450 862 H GLU 120 HN GLU 120 45.675 5.606 10.255 863 HA GLU 120 HA GLU 120 47.700 6.611 10.025 864 HB2 GLU 120 HB2 GLU 120 45.990 8.982 10.772 865 HB3 GLU 120 HB1 GLU 120 47.698 9.143 10.396 866 HG2 GLU 120 HG2 GLU 120 45.778 7.845 8.508 867 HG3 GLU 120 HG1 GLU 120 46.045 9.589 8.526 868 H GLU 121 HN GLU 121 49.116 8.459 11.451 869 HA GLU 121 HA GLU 121 48.718 7.829 14.281 870 HB2 GLU 121 HB2 GLU 121 51.021 7.416 14.669 871 HB3 GLU 121 HB1 GLU 121 50.557 6.407 13.305 872 HG2 GLU 121 HG2 GLU 121 51.560 8.006 11.771 873 HG3 GLU 121 HG1 GLU 121 51.997 9.037 13.135 874 H ASP 122 HN ASP 122 50.014 9.327 15.670 875 HA ASP 122 HA ASP 122 50.188 11.426 16.456 876 HB2 ASP 122 HB2 ASP 122 52.277 11.302 15.168 877 HB3 ASP 122 HB1 ASP 122 51.441 11.954 13.761 878 H SER 123 HN SER 123 47.857 11.611 16.427 879 HA SER 123 HA SER 123 46.724 13.146 14.231 880 HB2 SER 123 HB2 SER 123 45.513 11.171 15.180 881 HB3 SER 123 HB1 SER 123 45.331 12.063 16.690 882 HG SER 123 HG SER 123 43.684 13.029 15.842 883 H ASP 124 HN ASP 124 47.113 15.252 14.335 884 HA ASP 124 HA ASP 124 47.182 16.591 16.937 885 HB2 ASP 124 HB2 ASP 124 48.266 18.413 15.838 886 HB3 ASP 124 HB1 ASP 124 49.014 16.939 15.233 887 H PHE 125 HN PHE 125 45.285 16.344 14.030 888 HA PHE 125 HA PHE 125 43.690 18.688 14.695 889 HB2 PHE 125 HB2 PHE 125 44.278 18.154 12.337 890 HB3 PHE 125 HB1 PHE 125 43.330 16.678 12.460 891 HD1 PHE 125 HD2 PHE 125 43.214 20.318 12.201 892 HD2 PHE 125 HD1 PHE 125 40.905 16.753 12.479 893 HE1 PHE 125 HE2 PHE 125 41.214 21.561 11.493 894 HE2 PHE 125 HE1 PHE 125 38.901 17.993 11.773 895 HZ PHE 125 HZ PHE 125 39.054 20.400 11.279 896 H VAL 126 HN VAL 126 43.269 15.178 14.446 897 HA VAL 126 HA VAL 126 40.569 15.383 15.518 898 HB VAL 126 HB VAL 126 42.087 12.893 14.712 899 HG11 VAL 126 HG11 VAL 126 40.248 12.455 16.242 900 HG12 VAL 126 HG12 VAL 126 39.863 11.862 14.627 901 HG13 VAL 126 HG13 VAL 126 39.150 13.367 15.208 902 HG21 VAL 126 HG21 VAL 126 40.127 14.554 13.130 903 HG22 VAL 126 HG22 VAL 126 40.759 12.982 12.641 904 HG23 VAL 126 HG23 VAL 126 41.847 14.361 12.796 Start of MODEL 15 1 H1 ASP 1 HT1 ASP 1 -28.929 15.289 -3.612 2 H2 ASP 1 HT2 ASP 1 -29.120 15.982 -5.147 3 H3 ASP 1 HT3 ASP 1 -28.536 14.396 -5.001 4 HA ASP 1 HA ASP 1 -31.246 15.349 -4.289 5 HB2 ASP 1 HB2 ASP 1 -30.257 13.541 -6.505 6 HB3 ASP 1 HB1 ASP 1 -31.954 13.760 -6.096 7 H ILE 2 HN ILE 2 -30.050 12.202 -5.282 8 HA ILE 2 HA ILE 2 -31.368 11.026 -2.966 9 HB ILE 2 HB ILE 2 -30.411 9.831 -5.574 10 HG12 ILE 2 HG12 ILE 2 -33.213 10.387 -4.563 11 HG13 ILE 2 HG11 ILE 2 -32.362 11.338 -5.775 12 HG21 ILE 2 HG21 ILE 2 -31.751 7.849 -4.852 13 HG22 ILE 2 HG22 ILE 2 -31.841 8.591 -3.256 14 HG23 ILE 2 HG23 ILE 2 -30.279 8.136 -3.924 15 HD11 ILE 2 HD11 ILE 2 -33.160 8.450 -6.050 16 HD12 ILE 2 HD12 ILE 2 -32.318 9.411 -7.266 17 HD13 ILE 2 HD13 ILE 2 -33.966 9.830 -6.798 18 H ASP 3 HN ASP 3 -30.209 10.118 -1.339 19 HA ASP 3 HA ASP 3 -27.352 9.967 -1.464 20 HB2 ASP 3 HB2 ASP 3 -29.376 9.158 0.591 21 HB3 ASP 3 HB1 ASP 3 -27.727 8.566 0.715 22 H GLU 4 HN GLU 4 -27.340 8.663 -3.441 23 HA GLU 4 HA GLU 4 -28.030 5.900 -3.290 24 HB2 GLU 4 HB2 GLU 4 -26.241 7.412 -5.193 25 HB3 GLU 4 HB1 GLU 4 -26.693 5.716 -5.381 26 HG2 GLU 4 HG2 GLU 4 -29.049 6.357 -5.429 27 HG3 GLU 4 HG1 GLU 4 -28.585 8.053 -5.291 28 H SER 5 HN SER 5 -25.594 7.722 -1.910 29 HA SER 5 HA SER 5 -23.571 5.814 -1.591 30 HB2 SER 5 HB2 SER 5 -24.561 7.778 0.494 31 HB3 SER 5 HB1 SER 5 -22.949 7.067 0.389 32 HG SER 5 HG SER 5 -22.414 8.539 -1.008 33 H SER 6 HN SER 6 -26.732 6.214 -0.083 34 HA SER 6 HA SER 6 -26.491 4.384 2.022 35 HB2 SER 6 HB2 SER 6 -28.384 5.950 1.754 36 HB3 SER 6 HB1 SER 6 -28.943 5.021 0.364 37 HG SER 6 HG SER 6 -29.279 3.251 1.746 38 H VAL 7 HN VAL 7 -27.710 3.881 -1.298 39 HA VAL 7 HA VAL 7 -28.187 1.129 -0.910 40 HB VAL 7 HB VAL 7 -29.387 2.196 -2.663 41 HG11 VAL 7 HG11 VAL 7 -26.717 2.860 -3.855 42 HG12 VAL 7 HG12 VAL 7 -27.993 3.973 -3.350 43 HG13 VAL 7 HG13 VAL 7 -28.229 2.937 -4.758 44 HG21 VAL 7 HG21 VAL 7 -29.034 0.664 -4.483 45 HG22 VAL 7 HG22 VAL 7 -28.779 -0.179 -2.946 46 HG23 VAL 7 HG23 VAL 7 -27.395 0.329 -3.922 47 H MET 8 HN MET 8 -25.467 2.913 -2.252 48 HA MET 8 HA MET 8 -23.977 0.671 -3.072 49 HB2 MET 8 HB2 MET 8 -23.266 3.499 -2.414 50 HB3 MET 8 HB1 MET 8 -21.993 2.322 -2.712 51 HG2 MET 8 HG2 MET 8 -22.722 1.938 -4.908 52 HG3 MET 8 HG1 MET 8 -24.259 2.749 -4.628 53 HE1 MET 8 HE1 MET 8 -20.370 3.200 -5.022 54 HE2 MET 8 HE2 MET 8 -20.689 3.986 -3.475 55 HE3 MET 8 HE3 MET 8 -20.193 4.950 -4.865 56 H GLN 9 HN GLN 9 -24.285 2.248 0.066 57 HA GLN 9 HA GLN 9 -22.241 0.857 1.390 58 HB2 GLN 9 HB2 GLN 9 -24.862 1.979 2.365 59 HB3 GLN 9 HB1 GLN 9 -23.763 1.134 3.446 60 HG2 GLN 9 HG2 GLN 9 -23.162 3.631 1.877 61 HG3 GLN 9 HG1 GLN 9 -23.439 3.520 3.616 62 HE21 GLN 9 HE21 GLN 9 -21.841 2.623 4.931 63 HE22 GLN 9 HE22 GLN 9 -20.216 2.416 4.385 64 H LEU 10 HN LEU 10 -25.716 0.031 1.131 65 HA LEU 10 HA LEU 10 -25.587 -2.504 2.308 66 HB2 LEU 10 HB2 LEU 10 -27.303 -2.046 -0.099 67 HB3 LEU 10 HB1 LEU 10 -27.635 -3.026 1.304 68 HG LEU 10 HG LEU 10 -27.795 -0.036 1.086 69 HD11 LEU 10 HD11 LEU 10 -29.902 -2.099 1.649 70 HD12 LEU 10 HD12 LEU 10 -29.583 -1.399 0.061 71 HD13 LEU 10 HD13 LEU 10 -30.138 -0.368 1.387 72 HD21 LEU 10 HD21 LEU 10 -28.756 -0.212 3.407 73 HD22 LEU 10 HD22 LEU 10 -27.024 -0.453 3.286 74 HD23 LEU 10 HD23 LEU 10 -28.086 -1.841 3.478 75 H ALA 11 HN ALA 11 -25.036 -1.432 -0.972 76 HA ALA 11 HA ALA 11 -25.051 -3.918 -2.252 77 HB1 ALA 11 HB1 ALA 11 -23.445 -1.581 -3.225 78 HB2 ALA 11 HB2 ALA 11 -25.211 -1.549 -3.243 79 HB3 ALA 11 HB3 ALA 11 -24.333 -2.781 -4.165 80 H GLU 12 HN GLU 12 -22.291 -1.952 -1.162 81 HA GLU 12 HA GLU 12 -20.276 -3.708 -1.974 82 HB2 GLU 12 HB2 GLU 12 -20.335 -1.689 0.246 83 HB3 GLU 12 HB1 GLU 12 -18.884 -2.561 -0.214 84 HG2 GLU 12 HG2 GLU 12 -20.482 -0.767 -2.028 85 HG3 GLU 12 HG1 GLU 12 -18.999 -0.313 -1.189 86 H MET 13 HN MET 13 -22.365 -3.798 0.810 87 HA MET 13 HA MET 13 -20.803 -6.058 1.843 88 HB2 MET 13 HB2 MET 13 -21.961 -5.614 4.038 89 HB3 MET 13 HB1 MET 13 -20.796 -4.404 3.522 90 HG2 MET 13 HG2 MET 13 -22.561 -2.953 2.799 91 HG3 MET 13 HG1 MET 13 -23.780 -4.164 3.179 92 HE1 MET 13 HE1 MET 13 -23.787 -1.117 4.228 93 HE2 MET 13 HE2 MET 13 -24.304 -1.354 5.898 94 HE3 MET 13 HE3 MET 13 -25.065 -2.276 4.602 95 H GLY 14 HN GLY 14 -22.898 -6.158 -0.260 96 HA2 GLY 14 HA2 GLY 14 -23.818 -8.558 -0.158 97 HA3 GLY 14 HA1 GLY 14 -24.772 -7.927 1.172 98 H PHE 15 HN PHE 15 -24.329 -8.002 -2.258 99 HA PHE 15 HA PHE 15 -25.893 -8.085 -3.895 100 HB2 PHE 15 HB2 PHE 15 -27.871 -7.543 -1.684 101 HB3 PHE 15 HB1 PHE 15 -28.310 -7.893 -3.348 102 HD1 PHE 15 HD2 PHE 15 -27.716 -10.134 -4.310 103 HD2 PHE 15 HD1 PHE 15 -27.385 -9.257 -0.160 104 HE1 PHE 15 HE2 PHE 15 -27.668 -12.539 -3.810 105 HE2 PHE 15 HE1 PHE 15 -27.332 -11.662 0.347 106 HZ PHE 15 HZ PHE 15 -27.541 -13.307 -1.479 107 HA PRO 16 HA PRO 16 -26.208 -3.790 -5.129 108 HB2 PRO 16 HB2 PRO 16 -27.362 -4.317 -7.545 109 HB3 PRO 16 HB1 PRO 16 -25.626 -4.466 -7.248 110 HG2 PRO 16 HG2 PRO 16 -27.732 -6.590 -7.307 111 HG3 PRO 16 HG1 PRO 16 -26.093 -6.621 -7.982 112 HD2 PRO 16 HD2 PRO 16 -26.718 -7.826 -5.645 113 HD3 PRO 16 HD1 PRO 16 -25.127 -7.094 -5.940 114 H LEU 17 HN LEU 17 -27.821 -3.408 -3.484 115 HA LEU 17 HA LEU 17 -30.540 -4.218 -3.948 116 HB2 LEU 17 HB2 LEU 17 -29.304 -2.557 -1.738 117 HB3 LEU 17 HB1 LEU 17 -30.977 -3.094 -1.781 118 HG LEU 17 HG LEU 17 -28.562 -4.905 -1.677 119 HD11 LEU 17 HD11 LEU 17 -28.974 -3.663 0.406 120 HD12 LEU 17 HD12 LEU 17 -29.249 -5.393 0.577 121 HD13 LEU 17 HD13 LEU 17 -30.621 -4.295 0.435 122 HD21 LEU 17 HD21 LEU 17 -31.502 -5.550 -1.538 123 HD22 LEU 17 HD22 LEU 17 -30.176 -6.695 -1.343 124 HD23 LEU 17 HD23 LEU 17 -30.431 -5.896 -2.895 125 H GLU 18 HN GLU 18 -30.414 -2.873 -6.089 126 HA GLU 18 HA GLU 18 -30.714 -0.113 -6.061 127 HB2 GLU 18 HB2 GLU 18 -30.713 -1.857 -8.049 128 HB3 GLU 18 HB1 GLU 18 -32.461 -1.685 -7.893 129 HG2 GLU 18 HG2 GLU 18 -31.907 0.875 -7.908 130 HG3 GLU 18 HG1 GLU 18 -30.416 0.322 -8.668 131 H ALA 19 HN ALA 19 -32.870 -2.559 -4.921 132 HA ALA 19 HA ALA 19 -35.274 -1.146 -4.803 133 HB1 ALA 19 HB1 ALA 19 -34.341 -2.881 -2.548 134 HB2 ALA 19 HB2 ALA 19 -34.727 -3.570 -4.122 135 HB3 ALA 19 HB3 ALA 19 -35.967 -2.695 -3.214 136 H CYS 20 HN CYS 20 -32.374 -0.963 -2.881 137 HA CYS 20 HA CYS 20 -33.360 0.859 -0.905 138 HB2 CYS 20 HB2 CYS 20 -31.252 -0.513 -0.646 139 HB3 CYS 20 HB1 CYS 20 -30.511 0.516 -1.857 140 HG CYS 20 HG CYS 20 -31.712 2.576 0.293 141 H ARG 21 HN ARG 21 -31.558 1.103 -3.896 142 HA ARG 21 HA ARG 21 -31.104 3.831 -4.050 143 HB2 ARG 21 HB2 ARG 21 -30.236 2.100 -5.587 144 HB3 ARG 21 HB1 ARG 21 -31.835 1.912 -6.272 145 HG2 ARG 21 HG2 ARG 21 -31.743 3.985 -7.343 146 HG3 ARG 21 HG1 ARG 21 -30.350 4.517 -6.384 147 HD2 ARG 21 HD2 ARG 21 -29.010 2.718 -7.425 148 HD3 ARG 21 HD1 ARG 21 -30.398 2.283 -8.414 149 HE ARG 21 HE ARG 21 -29.157 4.953 -8.587 150 HH11 ARG 21 HH11 ARG 21 -30.238 1.963 -10.072 151 HH12 ARG 21 HH12 ARG 21 -29.910 2.487 -11.693 152 HH21 ARG 21 HH21 ARG 21 -28.701 5.648 -10.731 153 HH22 ARG 21 HH22 ARG 21 -29.025 4.579 -12.067 154 H LYS 22 HN LYS 22 -33.927 2.051 -5.306 155 HA LYS 22 HA LYS 22 -35.399 4.422 -5.889 156 HB2 LYS 22 HB2 LYS 22 -37.262 2.929 -6.360 157 HB3 LYS 22 HB1 LYS 22 -35.787 2.311 -7.084 158 HG2 LYS 22 HG2 LYS 22 -35.568 0.809 -5.073 159 HG3 LYS 22 HG1 LYS 22 -37.204 1.304 -4.640 160 HD2 LYS 22 HD2 LYS 22 -37.490 -0.703 -5.817 161 HD3 LYS 22 HD1 LYS 22 -37.859 0.552 -6.999 162 HE2 LYS 22 HE2 LYS 22 -35.112 -0.638 -6.756 163 HE3 LYS 22 HE1 LYS 22 -36.366 -1.393 -7.740 164 HZ1 LYS 22 HZ1 LYS 22 -34.916 0.061 -9.041 165 HZ2 LYS 22 HZ2 LYS 22 -35.370 1.388 -8.088 166 HZ3 LYS 22 HZ3 LYS 22 -36.522 0.609 -9.056 167 H ALA 23 HN ALA 23 -35.000 2.438 -3.066 168 HA ALA 23 HA ALA 23 -37.298 3.281 -1.643 169 HB1 ALA 23 HB1 ALA 23 -36.167 2.445 0.347 170 HB2 ALA 23 HB2 ALA 23 -34.652 2.333 -0.553 171 HB3 ALA 23 HB3 ALA 23 -36.017 1.301 -0.986 172 H VAL 24 HN VAL 24 -33.953 4.447 -1.741 173 HA VAL 24 HA VAL 24 -34.195 6.521 0.106 174 HB VAL 24 HB VAL 24 -32.548 6.535 -2.441 175 HG11 VAL 24 HG11 VAL 24 -31.169 8.206 -1.327 176 HG12 VAL 24 HG12 VAL 24 -32.263 8.194 0.062 177 HG13 VAL 24 HG13 VAL 24 -32.831 8.775 -1.503 178 HG21 VAL 24 HG21 VAL 24 -30.697 5.838 -0.973 179 HG22 VAL 24 HG22 VAL 24 -31.987 4.636 -1.051 180 HG23 VAL 24 HG23 VAL 24 -31.841 5.681 0.361 181 H TYR 25 HN TYR 25 -34.811 6.542 -3.414 182 HA TYR 25 HA TYR 25 -35.827 9.169 -3.505 183 HB2 TYR 25 HB2 TYR 25 -35.296 7.982 -5.558 184 HB3 TYR 25 HB1 TYR 25 -36.546 6.785 -5.225 185 HD1 TYR 25 HD2 TYR 25 -36.042 10.411 -5.905 186 HD2 TYR 25 HD1 TYR 25 -38.737 7.119 -5.986 187 HE1 TYR 25 HE2 TYR 25 -37.666 11.777 -7.143 188 HE2 TYR 25 HE1 TYR 25 -40.366 8.477 -7.229 189 HH TYR 25 HH TYR 25 -40.902 10.871 -7.557 190 H PHE 26 HN PHE 26 -37.459 6.074 -2.935 191 HA PHE 26 HA PHE 26 -40.086 7.077 -2.907 192 HB2 PHE 26 HB2 PHE 26 -39.437 4.679 -3.194 193 HB3 PHE 26 HB1 PHE 26 -39.062 4.616 -1.477 194 HD1 PHE 26 HD2 PHE 26 -41.776 5.092 -3.927 195 HD2 PHE 26 HD1 PHE 26 -40.764 4.320 0.135 196 HE1 PHE 26 HE2 PHE 26 -44.123 4.521 -3.455 197 HE2 PHE 26 HE1 PHE 26 -43.108 3.748 0.613 198 HZ PHE 26 HZ PHE 26 -44.792 3.847 -1.180 199 H THR 27 HN THR 27 -37.715 6.691 -0.306 200 HA THR 27 HA THR 27 -39.504 7.277 1.811 201 HB THR 27 HB THR 27 -37.465 7.804 3.150 202 HG1 THR 27 HG1 THR 27 -36.036 7.062 0.797 203 HG21 THR 27 HG21 THR 27 -37.321 5.242 1.570 204 HG22 THR 27 HG22 THR 27 -38.321 5.515 2.995 205 HG23 THR 27 HG23 THR 27 -36.563 5.543 3.132 206 H GLY 28 HN GLY 28 -37.995 9.192 -0.573 207 HA2 GLY 28 HA2 GLY 28 -38.464 11.458 -0.987 208 HA3 GLY 28 HA1 GLY 28 -38.992 11.632 0.683 209 H ASN 29 HN ASN 29 -36.020 10.036 -0.143 210 HA ASN 29 HA ASN 29 -33.845 10.465 0.308 211 HB2 ASN 29 HB2 ASN 29 -34.689 13.363 0.060 212 HB3 ASN 29 HB1 ASN 29 -33.024 12.798 0.125 213 HD21 ASN 29 HD21 ASN 29 -34.462 14.284 -1.931 214 HD22 ASN 29 HD22 ASN 29 -34.314 13.353 -3.382 215 H MET 30 HN MET 30 -35.107 9.699 2.435 216 HA MET 30 HA MET 30 -35.039 11.653 4.557 217 HB2 MET 30 HB2 MET 30 -35.775 8.747 4.431 218 HB3 MET 30 HB1 MET 30 -35.616 9.577 5.971 219 HG2 MET 30 HG2 MET 30 -37.480 10.351 3.740 220 HG3 MET 30 HG1 MET 30 -37.930 9.503 5.219 221 HE1 MET 30 HE1 MET 30 -39.815 11.311 5.711 222 HE2 MET 30 HE2 MET 30 -39.382 12.151 4.222 223 HE3 MET 30 HE3 MET 30 -39.517 13.049 5.733 224 H GLY 31 HN GLY 31 -32.786 9.507 3.191 225 HA2 GLY 31 HA2 GLY 31 -30.485 10.064 4.050 226 HA3 GLY 31 HA1 GLY 31 -31.137 9.671 5.634 227 H ALA 32 HN ALA 32 -28.958 8.378 5.014 228 HA ALA 32 HA ALA 32 -29.250 6.011 3.470 229 HB1 ALA 32 HB1 ALA 32 -27.242 6.625 5.637 230 HB2 ALA 32 HB2 ALA 32 -27.074 7.058 3.934 231 HB3 ALA 32 HB3 ALA 32 -27.110 5.361 4.414 232 H GLU 33 HN GLU 33 -29.281 6.629 6.972 233 HA GLU 33 HA GLU 33 -29.627 4.065 7.912 234 HB2 GLU 33 HB2 GLU 33 -29.269 6.219 9.202 235 HB3 GLU 33 HB1 GLU 33 -31.002 6.496 9.040 236 HG2 GLU 33 HG2 GLU 33 -31.391 4.319 10.156 237 HG3 GLU 33 HG1 GLU 33 -29.649 4.211 10.410 238 H VAL 34 HN VAL 34 -32.113 6.407 6.973 239 HA VAL 34 HA VAL 34 -34.346 4.868 7.648 240 HB VAL 34 HB VAL 34 -34.072 7.041 5.565 241 HG11 VAL 34 HG11 VAL 34 -36.535 5.772 6.753 242 HG12 VAL 34 HG12 VAL 34 -36.053 5.805 5.053 243 HG13 VAL 34 HG13 VAL 34 -36.538 7.295 5.865 244 HG21 VAL 34 HG21 VAL 34 -33.503 7.800 7.794 245 HG22 VAL 34 HG22 VAL 34 -34.990 7.105 8.439 246 HG23 VAL 34 HG23 VAL 34 -35.065 8.466 7.320 247 H ALA 35 HN ALA 35 -32.475 5.026 4.656 248 HA ALA 35 HA ALA 35 -34.296 3.329 3.235 249 HB1 ALA 35 HB1 ALA 35 -32.849 5.050 2.155 250 HB2 ALA 35 HB2 ALA 35 -32.813 3.449 1.420 251 HB3 ALA 35 HB3 ALA 35 -31.475 3.978 2.442 252 H PHE 36 HN PHE 36 -31.237 2.864 4.952 253 HA PHE 36 HA PHE 36 -30.796 0.163 4.369 254 HB2 PHE 36 HB2 PHE 36 -29.142 1.334 5.621 255 HB3 PHE 36 HB1 PHE 36 -30.296 1.784 6.874 256 HD1 PHE 36 HD2 PHE 36 -28.589 -1.147 5.355 257 HD2 PHE 36 HD1 PHE 36 -30.533 0.471 8.778 258 HE1 PHE 36 HE2 PHE 36 -27.937 -3.130 6.657 259 HE2 PHE 36 HE1 PHE 36 -29.884 -1.508 10.084 260 HZ PHE 36 HZ PHE 36 -28.588 -3.313 9.024 261 H ASN 37 HN ASN 37 -32.814 1.697 6.850 262 HA ASN 37 HA ASN 37 -33.940 -0.665 7.896 263 HB2 ASN 37 HB2 ASN 37 -34.877 2.200 7.849 264 HB3 ASN 37 HB1 ASN 37 -35.788 0.926 8.642 265 HD21 ASN 37 HD21 ASN 37 -35.549 1.953 10.636 266 HD22 ASN 37 HD22 ASN 37 -34.047 1.915 11.500 267 H TRP 38 HN TRP 38 -34.873 1.468 5.238 268 HA TRP 38 HA TRP 38 -37.431 0.360 4.816 269 HB2 TRP 38 HB2 TRP 38 -36.299 2.553 3.851 270 HB3 TRP 38 HB1 TRP 38 -35.851 1.481 2.530 271 HD1 TRP 38 HD1 TRP 38 -37.719 0.826 0.810 272 HE1 TRP 38 HE1 TRP 38 -40.188 1.511 0.500 273 HE3 TRP 38 HE3 TRP 38 -38.446 3.227 5.260 274 HZ2 TRP 38 HZ2 TRP 38 -42.167 2.895 1.962 275 HZ3 TRP 38 HZ3 TRP 38 -40.653 4.201 5.729 276 HH2 TRP 38 HH2 TRP 38 -42.474 4.039 4.114 277 H ILE 39 HN ILE 39 -34.229 -0.537 3.701 278 HA ILE 39 HA ILE 39 -35.187 -2.319 1.680 279 HB ILE 39 HB ILE 39 -32.891 -1.153 1.760 280 HG12 ILE 39 HG12 ILE 39 -31.863 -2.968 0.457 281 HG13 ILE 39 HG11 ILE 39 -33.059 -4.097 1.090 282 HG21 ILE 39 HG21 ILE 39 -32.131 -3.626 3.297 283 HG22 ILE 39 HG22 ILE 39 -32.279 -2.028 4.024 284 HG23 ILE 39 HG23 ILE 39 -31.068 -2.319 2.772 285 HD11 ILE 39 HD11 ILE 39 -33.565 -3.344 -1.183 286 HD12 ILE 39 HD12 ILE 39 -33.685 -1.686 -0.591 287 HD13 ILE 39 HD13 ILE 39 -34.825 -2.910 -0.030 288 H ILE 40 HN ILE 40 -34.013 -2.726 4.990 289 HA ILE 40 HA ILE 40 -34.058 -5.564 4.861 290 HB ILE 40 HB ILE 40 -33.812 -5.547 7.278 291 HG12 ILE 40 HG12 ILE 40 -33.452 -3.092 8.234 292 HG13 ILE 40 HG11 ILE 40 -34.639 -2.695 6.995 293 HG21 ILE 40 HG21 ILE 40 -31.788 -3.822 7.242 294 HG22 ILE 40 HG22 ILE 40 -32.131 -3.863 5.515 295 HG23 ILE 40 HG23 ILE 40 -31.740 -5.353 6.371 296 HD11 ILE 40 HD11 ILE 40 -34.970 -4.598 9.299 297 HD12 ILE 40 HD12 ILE 40 -36.129 -4.431 7.979 298 HD13 ILE 40 HD13 ILE 40 -35.797 -3.058 9.042 299 H VAL 41 HN VAL 41 -36.468 -3.167 5.499 300 HA VAL 41 HA VAL 41 -38.453 -5.061 6.349 301 HB VAL 41 HB VAL 41 -38.796 -2.256 5.266 302 HG11 VAL 41 HG11 VAL 41 -40.780 -4.038 6.675 303 HG12 VAL 41 HG12 VAL 41 -40.817 -3.601 4.968 304 HG13 VAL 41 HG13 VAL 41 -41.047 -2.361 6.201 305 HG21 VAL 41 HG21 VAL 41 -37.542 -2.344 7.366 306 HG22 VAL 41 HG22 VAL 41 -38.838 -3.293 8.097 307 HG23 VAL 41 HG23 VAL 41 -39.138 -1.628 7.601 308 H HIS 42 HN HIS 42 -37.514 -3.583 3.256 309 HA HIS 42 HA HIS 42 -39.753 -4.969 1.957 310 HB2 HIS 42 HB2 HIS 42 -38.074 -2.621 1.108 311 HB3 HIS 42 HB1 HIS 42 -39.147 -3.463 -0.007 312 HD1 HIS 42 HD1 HIS 42 -39.164 -1.145 2.923 313 HD2 HIS 42 HD2 HIS 42 -41.889 -3.094 0.464 314 HE1 HIS 42 HE1 HIS 42 -41.399 -0.105 3.429 315 HE2 HIS 42 HE2 HIS 42 -43.051 -1.420 2.051 316 H MET 43 HN MET 43 -36.940 -6.001 2.721 317 HA MET 43 HA MET 43 -35.722 -6.869 0.349 318 HB2 MET 43 HB2 MET 43 -34.785 -8.707 1.750 319 HB3 MET 43 HB1 MET 43 -34.559 -7.106 2.436 320 HG2 MET 43 HG2 MET 43 -36.385 -7.474 3.985 321 HG3 MET 43 HG1 MET 43 -36.705 -9.051 3.260 322 HE1 MET 43 HE1 MET 43 -33.701 -10.079 2.737 323 HE2 MET 43 HE2 MET 43 -35.020 -11.076 3.355 324 HE3 MET 43 HE3 MET 43 -33.473 -11.039 4.200 325 H GLU 44 HN GLU 44 -38.647 -7.739 1.838 326 HA GLU 44 HA GLU 44 -38.997 -10.374 0.911 327 HB2 GLU 44 HB2 GLU 44 -41.442 -9.848 1.331 328 HB3 GLU 44 HB1 GLU 44 -40.351 -9.647 2.699 329 HG2 GLU 44 HG2 GLU 44 -40.276 -7.226 2.248 330 HG3 GLU 44 HG1 GLU 44 -41.429 -7.457 0.935 331 H GLU 45 HN GLU 45 -38.985 -7.451 -0.814 332 HA GLU 45 HA GLU 45 -40.891 -8.090 -2.823 333 HB2 GLU 45 HB2 GLU 45 -38.473 -6.277 -2.968 334 HB3 GLU 45 HB1 GLU 45 -39.774 -6.332 -4.148 335 HG2 GLU 45 HG2 GLU 45 -40.069 -5.539 -1.259 336 HG3 GLU 45 HG1 GLU 45 -39.965 -4.430 -2.623 337 HA PRO 46 HA PRO 46 -38.792 -11.293 -4.991 338 HB2 PRO 46 HB2 PRO 46 -39.769 -10.815 -7.518 339 HB3 PRO 46 HB1 PRO 46 -40.667 -11.651 -6.245 340 HG2 PRO 46 HG2 PRO 46 -40.812 -8.790 -7.115 341 HG3 PRO 46 HG1 PRO 46 -42.132 -9.901 -6.690 342 HD2 PRO 46 HD2 PRO 46 -41.268 -8.040 -4.970 343 HD3 PRO 46 HD1 PRO 46 -41.777 -9.649 -4.412 344 H ASP 47 HN ASP 47 -38.818 -8.166 -6.686 345 HA ASP 47 HA ASP 47 -36.315 -8.934 -8.037 346 HB2 ASP 47 HB2 ASP 47 -38.217 -8.682 -9.533 347 HB3 ASP 47 HB1 ASP 47 -38.556 -7.084 -8.897 348 H PHE 48 HN PHE 48 -36.639 -7.704 -5.386 349 HA PHE 48 HA PHE 48 -36.170 -4.940 -5.412 350 HB2 PHE 48 HB2 PHE 48 -35.619 -5.155 -3.105 351 HB3 PHE 48 HB1 PHE 48 -36.892 -6.318 -3.439 352 HD1 PHE 48 HD2 PHE 48 -35.751 -8.675 -4.326 353 HD2 PHE 48 HD1 PHE 48 -34.058 -5.901 -1.579 354 HE1 PHE 48 HE2 PHE 48 -34.365 -10.472 -3.372 355 HE2 PHE 48 HE1 PHE 48 -32.668 -7.693 -0.624 356 HZ PHE 48 HZ PHE 48 -32.815 -9.937 -1.450 357 H ALA 49 HN ALA 49 -34.012 -7.573 -6.030 358 HA ALA 49 HA ALA 49 -31.815 -5.695 -6.250 359 HB1 ALA 49 HB1 ALA 49 -31.567 -6.717 -4.040 360 HB2 ALA 49 HB2 ALA 49 -30.266 -7.200 -5.126 361 HB3 ALA 49 HB3 ALA 49 -31.583 -8.319 -4.778 362 H GLU 50 HN GLU 50 -31.119 -5.856 -8.216 363 HA GLU 50 HA GLU 50 -31.562 -7.912 -10.047 364 HB2 GLU 50 HB2 GLU 50 -29.193 -6.040 -10.085 365 HB3 GLU 50 HB1 GLU 50 -29.975 -6.806 -11.463 366 HG2 GLU 50 HG2 GLU 50 -32.009 -5.483 -10.994 367 HG3 GLU 50 HG1 GLU 50 -31.148 -4.672 -9.689 368 HA PRO 51 HA PRO 51 -28.701 -10.822 -8.185 369 HB2 PRO 51 HB2 PRO 51 -29.605 -12.731 -10.163 370 HB3 PRO 51 HB1 PRO 51 -29.925 -12.707 -8.429 371 HG2 PRO 51 HG2 PRO 51 -31.842 -12.258 -10.317 372 HG3 PRO 51 HG1 PRO 51 -31.903 -11.577 -8.682 373 HD2 PRO 51 HD2 PRO 51 -31.051 -10.283 -11.248 374 HD3 PRO 51 HD1 PRO 51 -32.018 -9.614 -9.914 375 H LEU 52 HN LEU 52 -27.087 -9.352 -9.340 376 HA LEU 52 HA LEU 52 -25.772 -10.902 -11.472 377 HB2 LEU 52 HB2 LEU 52 -26.861 -8.820 -12.306 378 HB3 LEU 52 HB1 LEU 52 -25.829 -7.892 -11.237 379 HG LEU 52 HG LEU 52 -23.846 -8.752 -12.463 380 HD11 LEU 52 HD11 LEU 52 -24.789 -10.822 -13.305 381 HD12 LEU 52 HD12 LEU 52 -24.190 -9.831 -14.637 382 HD13 LEU 52 HD13 LEU 52 -25.921 -9.919 -14.311 383 HD21 LEU 52 HD21 LEU 52 -24.164 -7.375 -14.451 384 HD22 LEU 52 HD22 LEU 52 -24.813 -6.583 -13.015 385 HD23 LEU 52 HD23 LEU 52 -25.904 -7.356 -14.165 386 H THR 53 HN THR 53 -24.830 -11.786 -9.395 387 HA THR 53 HA THR 53 -22.999 -12.125 -8.108 388 HB THR 53 HB THR 53 -21.761 -9.861 -9.678 389 HG1 THR 53 HG1 THR 53 -22.413 -11.627 -10.998 390 HG21 THR 53 HG21 THR 53 -19.625 -10.890 -8.996 391 HG22 THR 53 HG22 THR 53 -20.511 -12.041 -7.997 392 HG23 THR 53 HG23 THR 53 -20.551 -10.322 -7.607 393 H MET 54 HN MET 54 -23.251 -11.679 -6.027 394 HA MET 54 HA MET 54 -23.682 -8.945 -5.141 395 HB2 MET 54 HB2 MET 54 -24.040 -9.897 -2.928 396 HB3 MET 54 HB1 MET 54 -25.000 -10.762 -4.121 397 HG2 MET 54 HG2 MET 54 -23.634 -12.658 -4.016 398 HG3 MET 54 HG1 MET 54 -22.321 -11.775 -3.242 399 HE1 MET 54 HE1 MET 54 -23.773 -10.111 -1.055 400 HE2 MET 54 HE2 MET 54 -22.324 -11.045 -0.676 401 HE3 MET 54 HE3 MET 54 -23.755 -11.179 0.347 402 HA PRO 55 HA PRO 55 -19.340 -8.347 -4.210 403 HB2 PRO 55 HB2 PRO 55 -20.246 -5.959 -2.775 404 HB3 PRO 55 HB1 PRO 55 -19.220 -6.079 -4.208 405 HG2 PRO 55 HG2 PRO 55 -21.735 -5.116 -4.324 406 HG3 PRO 55 HG1 PRO 55 -21.013 -6.036 -5.655 407 HD2 PRO 55 HD2 PRO 55 -22.929 -6.955 -3.540 408 HD3 PRO 55 HD1 PRO 55 -22.926 -7.302 -5.284 409 H GLY 56 HN GLY 56 -18.031 -8.557 -2.409 410 HA2 GLY 56 HA2 GLY 56 -19.432 -8.994 0.157 411 HA3 GLY 56 HA1 GLY 56 -18.097 -10.004 -0.388 412 H TYR 57 HN TYR 57 -18.911 -7.477 1.575 413 HA TYR 57 HA TYR 57 -16.656 -5.772 1.247 414 HB2 TYR 57 HB2 TYR 57 -18.828 -5.114 2.330 415 HB3 TYR 57 HB1 TYR 57 -18.368 -6.096 3.718 416 HD1 TYR 57 HD1 TYR 57 -17.403 -3.142 1.709 417 HD2 TYR 57 HD2 TYR 57 -16.914 -5.238 5.381 418 HE1 TYR 57 HE1 TYR 57 -16.193 -1.218 2.636 419 HE2 TYR 57 HE2 TYR 57 -15.698 -3.317 6.320 420 HH TYR 57 HH TYR 57 -15.651 -0.267 4.811 421 H GLY 58 HN GLY 58 -14.646 -5.992 1.977 422 HA2 GLY 58 HA2 GLY 58 -14.126 -8.027 4.050 423 HA3 GLY 58 HA1 GLY 58 -13.086 -7.829 2.646 424 H GLY 59 HN GLY 59 -11.896 -7.712 5.037 425 HA2 GLY 59 HA2 GLY 59 -11.821 -5.048 6.110 426 HA3 GLY 59 HA1 GLY 59 -10.760 -6.382 6.545 427 H ALA 60 HN ALA 60 -9.699 -3.915 6.364 428 HA ALA 60 HA ALA 60 -8.704 -3.038 3.939 429 HB1 ALA 60 HB1 ALA 60 -8.470 -1.791 6.032 430 HB2 ALA 60 HB2 ALA 60 -6.927 -1.959 5.194 431 HB3 ALA 60 HB3 ALA 60 -7.282 -2.968 6.597 432 H ALA 61 HN ALA 61 -7.114 -3.595 2.605 433 HA ALA 61 HA ALA 61 -5.403 -5.872 3.325 434 HB1 ALA 61 HB1 ALA 61 -5.868 -6.953 1.181 435 HB2 ALA 61 HB2 ALA 61 -7.034 -5.688 0.791 436 HB3 ALA 61 HB3 ALA 61 -7.337 -6.782 2.140 437 H SER 62 HN SER 62 -4.987 -2.972 3.011 438 HA SER 62 HA SER 62 -2.980 -3.081 0.864 439 HB2 SER 62 HB2 SER 62 -4.896 -1.629 0.223 440 HB3 SER 62 HB1 SER 62 -4.611 -0.654 1.665 441 HG SER 62 HG SER 62 -3.111 -0.845 -0.702 442 H ALA 63 HN ALA 63 -0.993 -2.218 1.320 443 HA ALA 63 HA ALA 63 -0.366 -1.700 4.096 444 HB1 ALA 63 HB1 ALA 63 1.950 -1.515 3.313 445 HB2 ALA 63 HB2 ALA 63 1.392 -1.594 1.641 446 HB3 ALA 63 HB3 ALA 63 1.184 -2.983 2.705 447 H GLY 64 HN GLY 64 -1.507 0.184 4.553 448 HA2 GLY 64 HA2 GLY 64 -1.313 2.515 2.905 449 HA3 GLY 64 HA1 GLY 64 -2.047 2.417 4.499 450 H ALA 65 HN ALA 65 0.225 1.465 5.910 451 HA ALA 65 HA ALA 65 2.120 3.690 5.597 452 HB1 ALA 65 HB1 ALA 65 0.824 2.890 8.200 453 HB2 ALA 65 HB2 ALA 65 0.498 4.362 7.285 454 HB3 ALA 65 HB3 ALA 65 2.086 4.106 8.007 455 H SER 66 HN SER 66 1.479 0.742 7.516 456 HA SER 66 HA SER 66 2.866 -0.827 8.396 457 HB2 SER 66 HB2 SER 66 3.102 -1.377 5.988 458 HB3 SER 66 HB1 SER 66 4.480 -0.285 5.884 459 HG SER 66 HG SER 66 5.598 -1.619 7.324 460 H VAL 67 HN VAL 67 3.202 1.451 9.680 461 HA VAL 67 HA VAL 67 6.015 2.209 9.661 462 HB VAL 67 HB VAL 67 4.373 4.008 9.821 463 HG11 VAL 67 HG11 VAL 67 2.569 2.840 10.941 464 HG12 VAL 67 HG12 VAL 67 2.989 4.310 11.820 465 HG13 VAL 67 HG13 VAL 67 3.524 2.740 12.421 466 HG21 VAL 67 HG21 VAL 67 5.954 3.669 12.367 467 HG22 VAL 67 HG22 VAL 67 5.281 5.188 11.774 468 HG23 VAL 67 HG23 VAL 67 6.541 4.361 10.856 469 H PHE 68 HN PHE 68 3.696 0.452 11.595 470 HA PHE 68 HA PHE 68 5.699 -0.077 13.652 471 HB2 PHE 68 HB2 PHE 68 2.739 -0.267 13.487 472 HB3 PHE 68 HB1 PHE 68 3.560 -1.419 14.527 473 HD1 PHE 68 HD2 PHE 68 3.291 2.216 13.830 474 HD2 PHE 68 HD1 PHE 68 4.156 -0.811 16.694 475 HE1 PHE 68 HE2 PHE 68 3.423 3.927 15.592 476 HE2 PHE 68 HE1 PHE 68 4.296 0.898 18.459 477 HZ PHE 68 HZ PHE 68 3.908 3.250 17.930 478 H GLY 69 HN GLY 69 6.312 -1.136 11.196 479 HA2 GLY 69 HA2 GLY 69 6.642 -3.885 11.858 480 HA3 GLY 69 HA1 GLY 69 5.467 -3.678 10.566 481 H ALA 70 HN ALA 70 8.046 -4.979 10.423 482 HA ALA 70 HA ALA 70 9.650 -3.145 8.817 483 HB1 ALA 70 HB1 ALA 70 10.790 -4.548 10.474 484 HB2 ALA 70 HB2 ALA 70 11.339 -4.901 8.835 485 HB3 ALA 70 HB3 ALA 70 10.212 -5.992 9.644 486 H SER 71 HN SER 71 7.590 -5.928 8.567 487 HA SER 71 HA SER 71 6.569 -6.956 6.848 488 HB2 SER 71 HB2 SER 71 5.946 -4.667 6.176 489 HB3 SER 71 HB1 SER 71 7.426 -4.547 5.228 490 HG SER 71 HG SER 71 5.113 -6.052 4.752 491 H GLY 72 HN GLY 72 8.924 -5.478 4.679 492 HA2 GLY 72 HA2 GLY 72 10.243 -8.108 4.436 493 HA3 GLY 72 HA1 GLY 72 9.778 -7.182 3.015 494 H LEU 73 HN LEU 73 10.732 -5.206 5.554 495 HA LEU 73 HA LEU 73 12.505 -3.867 5.946 496 HB2 LEU 73 HB2 LEU 73 13.867 -6.351 5.022 497 HB3 LEU 73 HB1 LEU 73 14.818 -4.889 5.208 498 HG LEU 73 HG LEU 73 14.973 -6.248 7.210 499 HD11 LEU 73 HD11 LEU 73 13.274 -3.800 7.681 500 HD12 LEU 73 HD12 LEU 73 15.024 -3.816 7.464 501 HD13 LEU 73 HD13 LEU 73 14.303 -4.600 8.870 502 HD21 LEU 73 HD21 LEU 73 11.995 -6.203 7.029 503 HD22 LEU 73 HD22 LEU 73 12.777 -6.349 8.597 504 HD23 LEU 73 HD23 LEU 73 13.083 -7.556 7.349 505 H ASP 74 HN ASP 74 11.142 -3.042 3.853 506 HA ASP 74 HA ASP 74 12.844 -2.723 1.546 507 HB2 ASP 74 HB2 ASP 74 10.362 -2.829 1.314 508 HB3 ASP 74 HB1 ASP 74 10.243 -1.301 2.181 509 H ASN 75 HN ASN 75 14.616 -1.863 2.750 510 HA ASN 75 HA ASN 75 14.393 1.039 3.094 511 HB2 ASN 75 HB2 ASN 75 15.657 -0.926 5.006 512 HB3 ASN 75 HB1 ASN 75 16.100 0.778 4.988 513 HD21 ASN 75 HD21 ASN 75 14.632 2.304 5.710 514 HD22 ASN 75 HD22 ASN 75 13.213 1.883 6.610 515 H GLN 76 HN GLN 76 15.195 0.865 0.888 516 HA GLN 76 HA GLN 76 17.836 -0.070 0.397 517 HB2 GLN 76 HB2 GLN 76 16.046 0.344 -1.353 518 HB3 GLN 76 HB1 GLN 76 16.338 2.065 -1.136 519 HG2 GLN 76 HG2 GLN 76 18.738 1.631 -1.726 520 HG3 GLN 76 HG1 GLN 76 18.255 -0.004 -2.167 521 HE21 GLN 76 HE21 GLN 76 16.292 2.844 -2.698 522 HE22 GLN 76 HE22 GLN 76 16.389 2.820 -4.423 523 HA PRO 77 HA PRO 77 20.228 3.110 2.375 524 HB2 PRO 77 HB2 PRO 77 21.886 2.867 -0.081 525 HB3 PRO 77 HB1 PRO 77 22.384 2.844 1.613 526 HG2 PRO 77 HG2 PRO 77 22.274 0.602 0.245 527 HG3 PRO 77 HG1 PRO 77 21.680 0.660 1.913 528 HD2 PRO 77 HD2 PRO 77 20.143 0.630 -0.653 529 HD3 PRO 77 HD1 PRO 77 19.781 -0.170 0.886 530 HA PRO 78 HA PRO 78 19.108 6.956 0.569 531 HB2 PRO 78 HB2 PRO 78 21.180 8.541 1.355 532 HB3 PRO 78 HB1 PRO 78 19.919 7.986 2.461 533 HG2 PRO 78 HG2 PRO 78 22.651 6.877 2.003 534 HG3 PRO 78 HG1 PRO 78 21.824 7.169 3.540 535 HD2 PRO 78 HD2 PRO 78 21.977 4.735 2.449 536 HD3 PRO 78 HD1 PRO 78 20.538 5.263 3.333 537 H GLU 79 HN GLU 79 19.163 7.110 -1.576 538 HA GLU 79 HA GLU 79 21.264 6.399 -3.249 539 HB2 GLU 79 HB2 GLU 79 20.012 7.454 -5.016 540 HB3 GLU 79 HB1 GLU 79 18.899 6.613 -3.952 541 HG2 GLU 79 HG2 GLU 79 18.483 8.796 -2.826 542 HG3 GLU 79 HG1 GLU 79 19.425 9.560 -4.099 543 H GLU 80 HN GLU 80 20.512 9.398 -1.652 544 HA GLU 80 HA GLU 80 22.251 11.123 -2.967 545 HB2 GLU 80 HB2 GLU 80 20.958 12.255 -1.454 546 HB3 GLU 80 HB1 GLU 80 21.022 10.957 -0.275 547 HG2 GLU 80 HG2 GLU 80 23.327 11.618 0.293 548 HG3 GLU 80 HG1 GLU 80 23.179 12.979 -0.831 549 H ILE 81 HN ILE 81 22.825 8.976 -0.209 550 HA ILE 81 HA ILE 81 25.576 9.714 -0.022 551 HB ILE 81 HB ILE 81 23.985 7.568 1.345 552 HG12 ILE 81 HG12 ILE 81 25.227 10.145 2.330 553 HG13 ILE 81 HG11 ILE 81 23.516 9.911 1.982 554 HG21 ILE 81 HG21 ILE 81 26.125 7.578 2.846 555 HG22 ILE 81 HG22 ILE 81 26.907 8.150 1.365 556 HG23 ILE 81 HG23 ILE 81 26.070 6.599 1.379 557 HD11 ILE 81 HD11 ILE 81 25.159 8.891 4.240 558 HD12 ILE 81 HD12 ILE 81 23.762 7.966 3.705 559 HD13 ILE 81 HD13 ILE 81 23.555 9.631 4.255 560 H VAL 82 HN VAL 82 23.840 6.840 -1.238 561 HA VAL 82 HA VAL 82 26.088 5.288 -1.809 562 HB VAL 82 HB VAL 82 24.786 4.049 -3.372 563 HG11 VAL 82 HG11 VAL 82 22.690 3.626 -2.145 564 HG12 VAL 82 HG12 VAL 82 23.012 5.064 -1.173 565 HG13 VAL 82 HG13 VAL 82 24.113 3.687 -1.106 566 HG21 VAL 82 HG21 VAL 82 23.562 5.099 -4.888 567 HG22 VAL 82 HG22 VAL 82 23.547 6.579 -3.926 568 HG23 VAL 82 HG23 VAL 82 22.325 5.330 -3.648 569 H ALA 83 HN ALA 83 24.518 7.872 -3.568 570 HA ALA 83 HA ALA 83 26.053 7.952 -5.894 571 HB1 ALA 83 HB1 ALA 83 25.434 10.487 -5.666 572 HB2 ALA 83 HB2 ALA 83 24.437 9.898 -4.321 573 HB3 ALA 83 HB3 ALA 83 24.178 9.282 -5.960 574 H ILE 84 HN ILE 84 26.465 9.657 -2.800 575 HA ILE 84 HA ILE 84 28.807 11.047 -3.451 576 HB ILE 84 HB ILE 84 27.793 10.058 -0.780 577 HG12 ILE 84 HG12 ILE 84 27.779 12.911 -1.655 578 HG13 ILE 84 HG11 ILE 84 26.579 11.824 -2.335 579 HG21 ILE 84 HG21 ILE 84 29.966 12.080 -1.328 580 HG22 ILE 84 HG22 ILE 84 30.208 10.455 -0.681 581 HG23 ILE 84 HG23 ILE 84 29.312 11.654 0.255 582 HD11 ILE 84 HD11 ILE 84 26.993 12.156 0.615 583 HD12 ILE 84 HD12 ILE 84 25.640 11.387 -0.229 584 HD13 ILE 84 HD13 ILE 84 25.868 13.137 -0.327 585 H ILE 85 HN ILE 85 28.315 7.840 -2.056 586 HA ILE 85 HA ILE 85 31.011 7.300 -1.469 587 HB ILE 85 HB ILE 85 28.755 5.392 -2.061 588 HG12 ILE 85 HG12 ILE 85 29.870 6.377 0.573 589 HG13 ILE 85 HG11 ILE 85 28.403 6.992 -0.185 590 HG21 ILE 85 HG21 ILE 85 31.579 4.981 -1.426 591 HG22 ILE 85 HG22 ILE 85 30.387 3.863 -2.094 592 HG23 ILE 85 HG23 ILE 85 30.473 4.125 -0.353 593 HD11 ILE 85 HD11 ILE 85 28.038 5.330 1.637 594 HD12 ILE 85 HD12 ILE 85 28.786 4.117 0.595 595 HD13 ILE 85 HD13 ILE 85 27.298 4.911 0.091 596 H THR 86 HN THR 86 29.021 6.412 -4.304 597 HA THR 86 HA THR 86 31.268 5.247 -5.619 598 HB THR 86 HB THR 86 29.250 4.351 -6.357 599 HG1 THR 86 HG1 THR 86 30.722 4.798 -8.082 600 HG21 THR 86 HG21 THR 86 27.477 5.654 -5.887 601 HG22 THR 86 HG22 THR 86 27.610 6.019 -7.615 602 HG23 THR 86 HG23 THR 86 28.275 7.140 -6.425 603 H SER 87 HN SER 87 30.092 8.484 -5.319 604 HA SER 87 HA SER 87 31.704 9.552 -7.445 605 HB2 SER 87 HB2 SER 87 30.465 10.914 -5.040 606 HB3 SER 87 HB1 SER 87 31.226 11.748 -6.393 607 HG SER 87 HG SER 87 28.913 10.094 -6.477 608 H MET 88 HN MET 88 32.279 8.490 -4.228 609 HA MET 88 HA MET 88 34.746 9.890 -3.815 610 HB2 MET 88 HB2 MET 88 33.622 7.382 -2.564 611 HB3 MET 88 HB1 MET 88 35.140 8.118 -2.068 612 HG2 MET 88 HG2 MET 88 32.426 9.410 -1.922 613 HG3 MET 88 HG1 MET 88 33.305 8.700 -0.573 614 HE1 MET 88 HE1 MET 88 35.516 9.700 0.459 615 HE2 MET 88 HE2 MET 88 36.369 11.093 -0.211 616 HE3 MET 88 HE3 MET 88 36.289 9.585 -1.122 617 H GLY 89 HN GLY 89 33.718 7.096 -5.505 618 HA2 GLY 89 HA2 GLY 89 35.398 6.490 -7.303 619 HA3 GLY 89 HA1 GLY 89 36.494 6.251 -5.951 620 H PHE 90 HN PHE 90 33.571 5.354 -4.823 621 HA PHE 90 HA PHE 90 34.213 2.542 -5.202 622 HB2 PHE 90 HB2 PHE 90 32.222 3.885 -3.358 623 HB3 PHE 90 HB1 PHE 90 32.590 2.165 -3.369 624 HD1 PHE 90 HD1 PHE 90 35.404 1.936 -3.500 625 HD2 PHE 90 HD2 PHE 90 33.097 4.891 -1.493 626 HE1 PHE 90 HE1 PHE 90 37.258 2.311 -1.930 627 HE2 PHE 90 HE2 PHE 90 34.948 5.280 0.078 628 HZ PHE 90 HZ PHE 90 37.066 4.004 -0.180 629 H GLN 91 HN GLN 91 31.908 1.236 -5.029 630 HA GLN 91 HA GLN 91 30.535 1.942 -7.507 631 HB2 GLN 91 HB2 GLN 91 31.407 -0.308 -7.380 632 HB3 GLN 91 HB1 GLN 91 30.633 -0.571 -5.831 633 HG2 GLN 91 HG2 GLN 91 28.443 -0.358 -6.977 634 HG3 GLN 91 HG1 GLN 91 29.311 -0.296 -8.509 635 HE21 GLN 91 HE21 GLN 91 31.360 -2.164 -7.581 636 HE22 GLN 91 HE22 GLN 91 30.626 -3.735 -7.583 637 H ARG 92 HN ARG 92 28.280 2.308 -7.584 638 HA ARG 92 HA ARG 92 27.011 3.439 -5.351 639 HB2 ARG 92 HB2 ARG 92 26.209 3.808 -7.641 640 HB3 ARG 92 HB1 ARG 92 25.710 2.135 -7.745 641 HG2 ARG 92 HG2 ARG 92 24.419 2.898 -5.508 642 HG3 ARG 92 HG1 ARG 92 24.409 4.404 -6.426 643 HD2 ARG 92 HD2 ARG 92 23.498 1.748 -7.499 644 HD3 ARG 92 HD1 ARG 92 22.420 2.939 -6.779 645 HE ARG 92 HE ARG 92 24.032 3.902 -8.990 646 HH11 ARG 92 HH11 ARG 92 20.984 2.504 -7.963 647 HH12 ARG 92 HH12 ARG 92 20.134 2.995 -9.395 648 HH21 ARG 92 HH21 ARG 92 22.919 4.534 -10.868 649 HH22 ARG 92 HH22 ARG 92 21.231 4.141 -11.051 650 H ASN 93 HN ASN 93 26.450 0.241 -6.801 651 HA ASN 93 HA ASN 93 24.707 -0.744 -4.842 652 HB2 ASN 93 HB2 ASN 93 25.062 -1.777 -7.044 653 HB3 ASN 93 HB1 ASN 93 26.672 -2.293 -6.542 654 HD21 ASN 93 HD21 ASN 93 26.286 -4.453 -6.754 655 HD22 ASN 93 HD22 ASN 93 25.210 -5.339 -5.731 656 H GLN 94 HN GLN 94 28.202 -0.728 -4.998 657 HA GLN 94 HA GLN 94 28.718 -2.356 -2.748 658 HB2 GLN 94 HB2 GLN 94 30.562 -2.048 -4.123 659 HB3 GLN 94 HB1 GLN 94 30.240 -0.337 -4.329 660 HG2 GLN 94 HG2 GLN 94 31.175 0.201 -2.237 661 HG3 GLN 94 HG1 GLN 94 31.200 -1.485 -1.728 662 HE21 GLN 94 HE21 GLN 94 32.757 -2.864 -2.575 663 HE22 GLN 94 HE22 GLN 94 34.178 -2.266 -3.372 664 H ALA 95 HN ALA 95 28.258 1.086 -3.223 665 HA ALA 95 HA ALA 95 28.582 1.944 -0.573 666 HB1 ALA 95 HB1 ALA 95 26.864 3.062 -2.791 667 HB2 ALA 95 HB2 ALA 95 28.555 3.468 -2.466 668 HB3 ALA 95 HB3 ALA 95 27.293 3.910 -1.306 669 H ILE 96 HN ILE 96 25.765 0.704 -2.350 670 HA ILE 96 HA ILE 96 23.833 1.098 -0.378 671 HB ILE 96 HB ILE 96 24.066 -0.810 -2.663 672 HG12 ILE 96 HG12 ILE 96 21.563 0.501 -2.500 673 HG13 ILE 96 HG11 ILE 96 22.796 1.684 -2.093 674 HG21 ILE 96 HG21 ILE 96 21.742 -1.638 -2.047 675 HG22 ILE 96 HG22 ILE 96 22.094 -1.043 -0.420 676 HG23 ILE 96 HG23 ILE 96 23.099 -2.301 -1.136 677 HD11 ILE 96 HD11 ILE 96 22.549 0.065 -4.602 678 HD12 ILE 96 HD12 ILE 96 23.984 0.998 -4.185 679 HD13 ILE 96 HD13 ILE 96 22.439 1.818 -4.422 680 H GLN 97 HN GLN 97 25.798 -1.787 -1.037 681 HA GLN 97 HA GLN 97 24.899 -3.365 1.066 682 HB2 GLN 97 HB2 GLN 97 26.306 -4.197 -0.755 683 HB3 GLN 97 HB1 GLN 97 27.664 -3.286 -0.115 684 HG2 GLN 97 HG2 GLN 97 27.771 -4.625 1.825 685 HG3 GLN 97 HG1 GLN 97 26.233 -5.396 1.458 686 HE21 GLN 97 HE21 GLN 97 26.881 -5.665 -1.388 687 HE22 GLN 97 HE22 GLN 97 28.021 -6.962 -1.492 688 H ALA 98 HN ALA 98 27.566 -1.075 0.952 689 HA ALA 98 HA ALA 98 28.511 -1.444 3.545 690 HB1 ALA 98 HB1 ALA 98 29.454 -0.081 1.540 691 HB2 ALA 98 HB2 ALA 98 29.826 0.425 3.187 692 HB3 ALA 98 HB3 ALA 98 28.563 1.255 2.271 693 H LEU 99 HN LEU 99 26.213 1.025 2.330 694 HA LEU 99 HA LEU 99 25.643 2.148 4.832 695 HB2 LEU 99 HB2 LEU 99 23.922 2.004 2.379 696 HB3 LEU 99 HB1 LEU 99 23.585 3.015 3.762 697 HG LEU 99 HG LEU 99 26.083 3.256 2.108 698 HD11 LEU 99 HD11 LEU 99 23.615 4.961 1.963 699 HD12 LEU 99 HD12 LEU 99 24.010 3.685 0.817 700 HD13 LEU 99 HD13 LEU 99 25.069 5.087 0.969 701 HD21 LEU 99 HD21 LEU 99 26.720 4.561 3.782 702 HD22 LEU 99 HD22 LEU 99 25.146 4.425 4.549 703 HD23 LEU 99 HD23 LEU 99 25.417 5.661 3.327 704 H ARG 100 HN ARG 100 24.241 -0.625 3.183 705 HA ARG 100 HA ARG 100 22.005 -1.064 4.804 706 HB2 ARG 100 HB2 ARG 100 23.848 -2.964 3.368 707 HB3 ARG 100 HB1 ARG 100 22.440 -3.531 4.259 708 HG2 ARG 100 HG2 ARG 100 20.949 -2.356 2.824 709 HG3 ARG 100 HG1 ARG 100 22.281 -1.501 2.045 710 HD2 ARG 100 HD2 ARG 100 21.424 -3.318 0.648 711 HD3 ARG 100 HD1 ARG 100 23.103 -3.584 1.112 712 HE ARG 100 HE ARG 100 21.365 -4.879 2.942 713 HH11 ARG 100 HH11 ARG 100 22.559 -5.132 -0.340 714 HH12 ARG 100 HH12 ARG 100 22.408 -6.856 -0.402 715 HH21 ARG 100 HH21 ARG 100 21.151 -7.166 2.854 716 HH22 ARG 100 HH22 ARG 100 21.587 -8.005 1.396 717 H ALA 101 HN ALA 101 25.354 -2.048 5.194 718 HA ALA 101 HA ALA 101 24.934 -3.419 7.663 719 HB1 ALA 101 HB1 ALA 101 27.516 -3.176 7.704 720 HB2 ALA 101 HB2 ALA 101 27.298 -2.555 6.061 721 HB3 ALA 101 HB3 ALA 101 26.758 -4.184 6.469 722 H THR 102 HN THR 102 26.066 -0.197 6.737 723 HA THR 102 HA THR 102 26.787 0.510 9.429 724 HB THR 102 HB THR 102 27.566 2.569 8.489 725 HG1 THR 102 HG1 THR 102 27.075 3.142 6.358 726 HG21 THR 102 HG21 THR 102 29.291 1.514 7.522 727 HG22 THR 102 HG22 THR 102 28.299 0.843 6.244 728 HG23 THR 102 HG23 THR 102 28.401 0.032 7.808 729 H ASN 103 HN ASN 103 23.851 0.312 8.014 730 HA ASN 103 HA ASN 103 21.807 1.216 8.291 731 HB2 ASN 103 HB2 ASN 103 23.082 2.379 10.772 732 HB3 ASN 103 HB1 ASN 103 21.375 2.516 10.389 733 HD21 ASN 103 HD21 ASN 103 20.657 1.378 12.123 734 HD22 ASN 103 HD22 ASN 103 20.911 -0.324 12.319 735 H ASN 104 HN ASN 104 22.780 2.356 6.334 736 HA ASN 104 HA ASN 104 23.007 4.160 4.996 737 HB2 ASN 104 HB2 ASN 104 21.291 5.876 5.152 738 HB3 ASN 104 HB1 ASN 104 20.592 4.291 5.428 739 HD21 ASN 104 HD21 ASN 104 21.453 7.343 6.862 740 HD22 ASN 104 HD22 ASN 104 20.485 7.172 8.284 741 H ASN 105 HN ASN 105 24.766 4.045 7.330 742 HA ASN 105 HA ASN 105 25.350 6.840 7.897 743 HB2 ASN 105 HB2 ASN 105 25.614 4.996 9.614 744 HB3 ASN 105 HB1 ASN 105 26.930 4.365 8.640 745 HD21 ASN 105 HD21 ASN 105 26.747 5.513 11.389 746 HD22 ASN 105 HD22 ASN 105 27.988 6.725 11.438 747 H LEU 106 HN LEU 106 26.244 7.915 6.315 748 HA LEU 106 HA LEU 106 27.408 6.934 4.008 749 HB2 LEU 106 HB2 LEU 106 26.548 9.184 4.211 750 HB3 LEU 106 HB1 LEU 106 27.749 9.591 5.413 751 HG LEU 106 HG LEU 106 28.725 8.776 2.720 752 HD11 LEU 106 HD11 LEU 106 27.855 11.598 3.221 753 HD12 LEU 106 HD12 LEU 106 26.738 10.417 2.546 754 HD13 LEU 106 HD13 LEU 106 28.230 10.806 1.686 755 HD21 LEU 106 HD21 LEU 106 30.419 10.454 3.201 756 HD22 LEU 106 HD22 LEU 106 30.285 9.295 4.526 757 HD23 LEU 106 HD23 LEU 106 29.570 10.902 4.681 758 H GLU 107 HN GLU 107 29.082 8.554 6.668 759 HA GLU 107 HA GLU 107 31.694 8.068 5.899 760 HB2 GLU 107 HB2 GLU 107 30.509 8.370 8.653 761 HB3 GLU 107 HB1 GLU 107 32.238 8.293 8.347 762 HG2 GLU 107 HG2 GLU 107 30.446 10.286 7.035 763 HG3 GLU 107 HG1 GLU 107 31.260 10.592 8.572 764 H ARG 108 HN ARG 108 29.700 6.085 8.075 765 HA ARG 108 HA ARG 108 31.727 4.165 8.533 766 HB2 ARG 108 HB2 ARG 108 29.612 4.540 9.903 767 HB3 ARG 108 HB1 ARG 108 28.776 3.606 8.680 768 HG2 ARG 108 HG2 ARG 108 30.337 1.731 9.126 769 HG3 ARG 108 HG1 ARG 108 30.997 2.669 10.472 770 HD2 ARG 108 HD2 ARG 108 28.068 2.173 10.234 771 HD3 ARG 108 HD1 ARG 108 29.127 0.946 10.939 772 HE ARG 108 HE ARG 108 29.834 2.935 12.454 773 HH11 ARG 108 HH11 ARG 108 26.586 2.329 11.260 774 HH12 ARG 108 HH12 ARG 108 25.816 3.026 12.645 775 HH21 ARG 108 HH21 ARG 108 28.802 3.835 14.286 776 HH22 ARG 108 HH22 ARG 108 27.063 3.875 14.359 777 H ALA 109 HN ALA 109 29.331 4.545 6.008 778 HA ALA 109 HA ALA 109 29.457 1.957 4.925 779 HB1 ALA 109 HB1 ALA 109 28.167 4.330 4.279 780 HB2 ALA 109 HB2 ALA 109 28.043 2.805 3.406 781 HB3 ALA 109 HB3 ALA 109 29.222 4.016 2.898 782 H LEU 110 HN LEU 110 31.194 4.931 4.076 783 HA LEU 110 HA LEU 110 33.024 3.837 2.261 784 HB2 LEU 110 HB2 LEU 110 33.481 6.113 4.184 785 HB3 LEU 110 HB1 LEU 110 34.338 5.828 2.686 786 HG LEU 110 HG LEU 110 31.377 6.310 2.719 787 HD11 LEU 110 HD11 LEU 110 33.571 8.373 2.571 788 HD12 LEU 110 HD12 LEU 110 32.390 8.187 3.872 789 HD13 LEU 110 HD13 LEU 110 31.861 8.671 2.259 790 HD21 LEU 110 HD21 LEU 110 31.793 7.025 0.428 791 HD22 LEU 110 HD22 LEU 110 32.359 5.377 0.702 792 HD23 LEU 110 HD23 LEU 110 33.516 6.707 0.635 793 H ASP 111 HN ASP 111 33.098 4.232 5.738 794 HA ASP 111 HA ASP 111 35.603 3.241 6.404 795 HB2 ASP 111 HB2 ASP 111 33.608 4.108 7.905 796 HB3 ASP 111 HB1 ASP 111 33.173 2.415 7.942 797 H TRP 112 HN TRP 112 32.567 1.531 5.980 798 HA TRP 112 HA TRP 112 33.488 -1.078 6.412 799 HB2 TRP 112 HB2 TRP 112 31.122 -0.294 6.482 800 HB3 TRP 112 HB1 TRP 112 31.151 -0.184 4.728 801 HD1 TRP 112 HD1 TRP 112 30.897 -2.700 7.555 802 HE1 TRP 112 HE1 TRP 112 30.331 -5.014 6.581 803 HE3 TRP 112 HE3 TRP 112 31.457 -1.648 2.586 804 HZ2 TRP 112 HZ2 TRP 112 30.148 -6.230 4.037 805 HZ3 TRP 112 HZ3 TRP 112 31.068 -3.434 0.947 806 HH2 TRP 112 HH2 TRP 112 30.427 -5.683 1.660 807 H ILE 113 HN ILE 113 32.902 0.751 3.471 808 HA ILE 113 HA ILE 113 33.572 -1.257 1.640 809 HB ILE 113 HB ILE 113 33.622 1.751 1.358 810 HG12 ILE 113 HG12 ILE 113 31.558 -0.349 0.645 811 HG13 ILE 113 HG11 ILE 113 31.414 0.879 1.888 812 HG21 ILE 113 HG21 ILE 113 33.694 -0.369 -0.793 813 HG22 ILE 113 HG22 ILE 113 35.035 0.677 -0.334 814 HG23 ILE 113 HG23 ILE 113 33.585 1.371 -1.052 815 HD11 ILE 113 HD11 ILE 113 31.839 1.734 -0.921 816 HD12 ILE 113 HD12 ILE 113 30.980 2.530 0.398 817 HD13 ILE 113 HD13 ILE 113 30.253 1.155 -0.421 818 H PHE 114 HN PHE 114 35.516 1.194 3.249 819 HA PHE 114 HA PHE 114 37.889 0.858 1.755 820 HB2 PHE 114 HB2 PHE 114 37.368 2.789 3.267 821 HB3 PHE 114 HB1 PHE 114 37.637 1.725 4.642 822 HD1 PHE 114 HD1 PHE 114 39.316 3.145 1.642 823 HD2 PHE 114 HD2 PHE 114 39.766 1.454 5.521 824 HE1 PHE 114 HE1 PHE 114 41.713 3.691 1.597 825 HE2 PHE 114 HE2 PHE 114 42.167 1.991 5.479 826 HZ PHE 114 HZ PHE 114 43.135 3.141 3.503 827 H SER 115 HN SER 115 36.448 -0.965 4.298 828 HA SER 115 HA SER 115 38.854 -2.472 4.870 829 HB2 SER 115 HB2 SER 115 36.000 -2.748 5.813 830 HB3 SER 115 HB1 SER 115 37.325 -3.773 6.358 831 HG SER 115 HG SER 115 36.609 -1.501 7.396 832 H HIS 116 HN HIS 116 36.998 -2.410 2.291 833 HA HIS 116 HA HIS 116 37.541 -5.227 1.724 834 HB2 HIS 116 HB2 HIS 116 35.138 -5.053 2.308 835 HB3 HIS 116 HB1 HIS 116 34.926 -3.857 1.036 836 HD1 HIS 116 HD1 HIS 116 36.315 -7.426 1.198 837 HD2 HIS 116 HD2 HIS 116 33.910 -4.994 -1.177 838 HE1 HIS 116 HE1 HIS 116 35.510 -8.887 -0.685 839 HE2 HIS 116 HE2 HIS 116 34.171 -7.364 -2.181 840 HA PRO 117 HA PRO 117 39.602 -2.290 -1.298 841 HB2 PRO 117 HB2 PRO 117 41.246 -4.514 -1.901 842 HB3 PRO 117 HB1 PRO 117 41.683 -3.103 -0.938 843 HG2 PRO 117 HG2 PRO 117 40.727 -5.782 -0.076 844 HG3 PRO 117 HG1 PRO 117 41.864 -4.682 0.727 845 HD2 PRO 117 HD2 PRO 117 39.398 -4.951 1.666 846 HD3 PRO 117 HD1 PRO 117 40.147 -3.344 1.566 847 H GLU 118 HN GLU 118 39.351 -5.739 -1.852 848 HA GLU 118 HA GLU 118 37.419 -5.537 -3.920 849 HB2 GLU 118 HB2 GLU 118 39.012 -6.679 -5.602 850 HB3 GLU 118 HB1 GLU 118 39.112 -4.936 -5.420 851 HG2 GLU 118 HG2 GLU 118 41.055 -5.139 -4.046 852 HG3 GLU 118 HG1 GLU 118 40.917 -6.895 -4.022 853 H PHE 119 HN PHE 119 40.147 -7.526 -2.946 854 HA PHE 119 HA PHE 119 38.308 -9.609 -2.070 855 HB2 PHE 119 HB2 PHE 119 39.378 -10.369 -4.120 856 HB3 PHE 119 HB1 PHE 119 40.958 -9.970 -3.460 857 HD1 PHE 119 HD1 PHE 119 38.068 -12.242 -3.121 858 HD2 PHE 119 HD2 PHE 119 42.133 -11.505 -2.109 859 HE1 PHE 119 HE1 PHE 119 38.251 -14.525 -2.223 860 HE2 PHE 119 HE2 PHE 119 42.328 -13.790 -1.213 861 HZ PHE 119 HZ PHE 119 40.405 -15.315 -1.305 862 H GLU 120 HN GLU 120 41.354 -8.115 -1.802 863 HA GLU 120 HA GLU 120 41.994 -7.401 0.526 864 HB2 GLU 120 HB2 GLU 120 41.578 -10.331 0.838 865 HB3 GLU 120 HB1 GLU 120 42.965 -9.633 1.656 866 HG2 GLU 120 HG2 GLU 120 40.150 -8.639 1.952 867 HG3 GLU 120 HG1 GLU 120 40.920 -9.786 3.051 868 H GLU 121 HN GLU 121 44.317 -7.947 1.318 869 HA GLU 121 HA GLU 121 45.956 -8.965 -0.893 870 HB2 GLU 121 HB2 GLU 121 47.673 -7.246 -0.319 871 HB3 GLU 121 HB1 GLU 121 46.211 -6.593 -1.045 872 HG2 GLU 121 HG2 GLU 121 45.425 -5.899 1.146 873 HG3 GLU 121 HG1 GLU 121 46.876 -6.576 1.886 874 H ASP 122 HN ASP 122 47.918 -9.968 -0.240 875 HA ASP 122 HA ASP 122 48.102 -10.604 2.602 876 HB2 ASP 122 HB2 ASP 122 46.578 -12.272 1.893 877 HB3 ASP 122 HB1 ASP 122 47.466 -12.558 0.403 878 H SER 123 HN SER 123 49.389 -11.745 -0.509 879 HA SER 123 HA SER 123 51.738 -12.708 0.798 880 HB2 SER 123 HB2 SER 123 51.169 -12.543 -2.164 881 HB3 SER 123 HB1 SER 123 52.339 -13.595 -1.364 882 HG SER 123 HG SER 123 50.068 -14.049 -0.152 883 H ASP 124 HN ASP 124 50.979 -9.672 -0.565 884 HA ASP 124 HA ASP 124 53.728 -9.083 -1.278 885 HB2 ASP 124 HB2 ASP 124 51.979 -8.109 -2.650 886 HB3 ASP 124 HB1 ASP 124 51.294 -7.297 -1.244 887 H PHE 125 HN PHE 125 51.404 -8.173 1.219 888 HA PHE 125 HA PHE 125 53.283 -6.499 2.601 889 HB2 PHE 125 HB2 PHE 125 50.793 -6.168 2.672 890 HB3 PHE 125 HB1 PHE 125 50.675 -7.643 3.628 891 HD1 PHE 125 HD2 PHE 125 52.162 -4.249 3.605 892 HD2 PHE 125 HD1 PHE 125 50.947 -7.588 5.943 893 HE1 PHE 125 HE2 PHE 125 52.534 -2.938 5.653 894 HE2 PHE 125 HE1 PHE 125 51.312 -6.288 8.001 895 HZ PHE 125 HZ PHE 125 52.108 -3.959 7.855 896 H VAL 126 HN VAL 126 52.149 -9.800 2.825 897 HA VAL 126 HA VAL 126 52.931 -11.640 3.880 898 HB VAL 126 HB VAL 126 55.381 -9.991 4.537 899 HG11 VAL 126 HG11 VAL 126 55.223 -11.957 5.937 900 HG12 VAL 126 HG12 VAL 126 56.491 -12.184 4.732 901 HG13 VAL 126 HG13 VAL 126 54.928 -12.973 4.525 902 HG21 VAL 126 HG21 VAL 126 54.998 -10.071 2.136 903 HG22 VAL 126 HG22 VAL 126 54.843 -11.826 2.206 904 HG23 VAL 126 HG23 VAL 126 56.389 -11.063 2.576
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