NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
627149 | 5ydx | 36114 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 SER 7 HT1 SER 7 26.884 -0.090 -12.413 2 H2 SER 7 HT2 SER 7 25.289 0.372 -12.771 3 H3 SER 7 HT3 SER 7 26.079 -0.782 -13.737 4 HA SER 7 HA SER 7 25.495 -1.186 -10.858 5 HB2 SER 7 HB2 SER 7 23.980 -2.639 -12.968 6 HB3 SER 7 HB1 SER 7 23.456 -2.105 -11.373 7 HG SER 7 HG SER 7 24.020 0.058 -12.758 8 H PHE 8 HN PHE 8 27.734 -1.739 -13.007 9 HA PHE 8 HA PHE 8 27.946 -4.407 -13.698 10 HB2 PHE 8 HB2 PHE 8 29.947 -2.393 -12.749 11 HB3 PHE 8 HB1 PHE 8 30.466 -4.070 -12.917 12 HD1 PHE 8 HD1 PHE 8 30.934 -4.991 -15.044 13 HD2 PHE 8 HD2 PHE 8 28.810 -1.269 -14.748 14 HE1 PHE 8 HE1 PHE 8 31.118 -4.690 -17.500 15 HE2 PHE 8 HE2 PHE 8 28.994 -0.967 -17.202 16 HZ PHE 8 HZ PHE 8 30.147 -2.678 -18.578 17 H GLU 9 HN GLU 9 27.197 -6.031 -12.381 18 HA GLU 9 HA GLU 9 27.008 -6.216 -9.653 19 HB2 GLU 9 HB2 GLU 9 28.203 -8.630 -10.904 20 HB3 GLU 9 HB1 GLU 9 26.728 -8.471 -9.949 21 HG2 GLU 9 HG2 GLU 9 25.938 -8.944 -12.125 22 HG3 GLU 9 HG1 GLU 9 25.784 -7.192 -11.994 23 H ILE 10 HN ILE 10 28.438 -5.970 -8.009 24 HA ILE 10 HA ILE 10 31.276 -5.721 -8.506 25 HB ILE 10 HB ILE 10 30.066 -6.147 -5.778 26 HG12 ILE 10 HG12 ILE 10 29.913 -3.669 -7.522 27 HG13 ILE 10 HG11 ILE 10 28.558 -4.585 -6.862 28 HG21 ILE 10 HG21 ILE 10 32.583 -5.828 -6.279 29 HG22 ILE 10 HG22 ILE 10 31.865 -4.794 -5.043 30 HG23 ILE 10 HG23 ILE 10 32.161 -4.160 -6.662 31 HD11 ILE 10 HD11 ILE 10 28.714 -2.844 -5.322 32 HD12 ILE 10 HD12 ILE 10 30.472 -2.754 -5.451 33 HD13 ILE 10 HD13 ILE 10 29.719 -4.072 -4.553 34 HA PRO 11 HA PRO 11 31.864 -10.176 -8.158 35 HB2 PRO 11 HB2 PRO 11 34.429 -10.207 -9.061 36 HB3 PRO 11 HB1 PRO 11 33.034 -10.032 -10.144 37 HG2 PRO 11 HG2 PRO 11 34.933 -7.978 -9.157 38 HG3 PRO 11 HG1 PRO 11 34.133 -8.118 -10.729 39 HD2 PRO 11 HD2 PRO 11 33.325 -6.406 -8.689 40 HD3 PRO 11 HD1 PRO 11 32.288 -6.950 -10.026 41 H ASP 12 HN ASP 12 32.369 -11.185 -6.256 42 HA ASP 12 HA ASP 12 34.108 -9.851 -4.327 43 HB2 ASP 12 HB2 ASP 12 32.109 -11.982 -4.267 44 HB3 ASP 12 HB1 ASP 12 33.528 -12.358 -3.288 45 H ASP 13 HN ASP 13 34.743 -11.567 -6.929 46 HA ASP 13 HA ASP 13 37.036 -13.033 -5.724 47 HB2 ASP 13 HB2 ASP 13 35.436 -14.397 -7.072 48 HB3 ASP 13 HB1 ASP 13 35.806 -13.390 -8.472 49 H VAL 14 HN VAL 14 37.055 -10.166 -6.201 50 HA VAL 14 HA VAL 14 39.161 -10.056 -8.304 51 HB VAL 14 HB VAL 14 36.929 -8.864 -8.799 52 HG11 VAL 14 HG11 VAL 14 38.056 -6.720 -7.013 53 HG12 VAL 14 HG12 VAL 14 36.960 -7.937 -6.359 54 HG13 VAL 14 HG13 VAL 14 36.423 -6.876 -7.661 55 HG21 VAL 14 HG21 VAL 14 39.706 -7.945 -9.085 56 HG22 VAL 14 HG22 VAL 14 38.524 -6.644 -9.222 57 HG23 VAL 14 HG23 VAL 14 38.426 -8.040 -10.295 58 HA PRO 15 HA PRO 15 41.671 -9.175 -4.661 59 HB2 PRO 15 HB2 PRO 15 43.430 -8.124 -6.840 60 HB3 PRO 15 HB1 PRO 15 43.825 -9.215 -5.497 61 HG2 PRO 15 HG2 PRO 15 43.497 -10.108 -7.995 62 HG3 PRO 15 HG1 PRO 15 43.023 -11.062 -6.580 63 HD2 PRO 15 HD2 PRO 15 41.303 -9.666 -8.558 64 HD3 PRO 15 HD1 PRO 15 40.933 -11.065 -7.526 65 H LEU 16 HN LEU 16 42.816 -7.160 -3.833 66 HA LEU 16 HA LEU 16 41.101 -4.843 -4.193 67 HB2 LEU 16 HB2 LEU 16 43.713 -4.442 -2.895 68 HB3 LEU 16 HB1 LEU 16 42.111 -4.050 -2.303 69 HG LEU 16 HG LEU 16 43.649 -6.613 -2.076 70 HD11 LEU 16 HD11 LEU 16 42.166 -4.719 -0.286 71 HD12 LEU 16 HD12 LEU 16 43.772 -5.418 -0.091 72 HD13 LEU 16 HD13 LEU 16 42.342 -6.402 0.208 73 HD21 LEU 16 HD21 LEU 16 41.807 -7.817 -2.658 74 HD22 LEU 16 HD22 LEU 16 40.787 -6.378 -2.694 75 HD23 LEU 16 HD23 LEU 16 41.081 -7.213 -1.170 76 HA PRO 17 HA PRO 17 43.424 -2.307 -6.994 77 HB2 PRO 17 HB2 PRO 17 44.610 -0.485 -5.027 78 HB3 PRO 17 HB1 PRO 17 43.414 -0.154 -6.286 79 HG2 PRO 17 HG2 PRO 17 42.815 -0.188 -3.653 80 HG3 PRO 17 HG1 PRO 17 41.653 -0.597 -4.926 81 HD2 PRO 17 HD2 PRO 17 43.122 -2.408 -3.062 82 HD3 PRO 17 HD1 PRO 17 41.498 -2.586 -3.765 83 H ALA 18 HN ALA 18 45.870 -0.795 -6.338 84 HA ALA 18 HA ALA 18 47.720 -3.045 -6.737 85 HB1 ALA 18 HB1 ALA 18 48.231 -1.457 -8.296 86 HB2 ALA 18 HB2 ALA 18 49.265 -0.870 -6.994 87 HB3 ALA 18 HB3 ALA 18 47.689 -0.130 -7.270 88 H GLY 19 HN GLY 19 49.287 -3.652 -5.314 89 HA2 GLY 19 HA2 GLY 19 50.573 -3.733 -3.362 90 HA3 GLY 19 HA1 GLY 19 50.388 -1.985 -3.272 91 H TRP 20 HN TRP 20 47.490 -3.941 -3.299 92 HA TRP 20 HA TRP 20 47.069 -3.128 -0.479 93 HB2 TRP 20 HB2 TRP 20 45.236 -3.896 -2.719 94 HB3 TRP 20 HB1 TRP 20 44.664 -3.718 -1.056 95 HD1 TRP 20 HD1 TRP 20 45.886 -1.769 -4.032 96 HE1 TRP 20 HE1 TRP 20 45.642 0.743 -3.570 97 HE3 TRP 20 HE3 TRP 20 44.697 -1.959 0.895 98 HZ2 TRP 20 HZ2 TRP 20 45.018 2.471 -1.330 99 HZ3 TRP 20 HZ3 TRP 20 44.299 0.091 2.185 100 HH2 TRP 20 HH2 TRP 20 44.451 2.322 1.088 101 H GLU 21 HN GLU 21 46.111 -4.643 1.040 102 HA GLU 21 HA GLU 21 45.941 -7.466 0.289 103 HB2 GLU 21 HB2 GLU 21 48.445 -6.942 0.575 104 HB3 GLU 21 HB1 GLU 21 48.087 -6.762 2.292 105 HG2 GLU 21 HG2 GLU 21 48.727 -9.034 2.059 106 HG3 GLU 21 HG1 GLU 21 46.964 -9.075 2.119 107 H MET 22 HN MET 22 44.264 -8.207 1.520 108 HA MET 22 HA MET 22 43.222 -6.761 3.743 109 HB2 MET 22 HB2 MET 22 42.367 -8.877 2.168 110 HB3 MET 22 HB1 MET 22 42.593 -9.614 3.757 111 HG2 MET 22 HG2 MET 22 41.236 -7.835 4.778 112 HG3 MET 22 HG1 MET 22 41.000 -7.107 3.190 113 HE1 MET 22 HE1 MET 22 40.417 -11.281 4.269 114 HE2 MET 22 HE2 MET 22 39.255 -10.494 5.333 115 HE3 MET 22 HE3 MET 22 40.935 -9.966 5.332 116 H ALA 23 HN ALA 23 43.653 -6.922 5.906 117 HA ALA 23 HA ALA 23 45.226 -9.198 6.924 118 HB1 ALA 23 HB1 ALA 23 46.189 -6.332 6.924 119 HB2 ALA 23 HB2 ALA 23 47.003 -7.731 6.229 120 HB3 ALA 23 HB3 ALA 23 46.864 -7.571 7.981 121 H LYS 24 HN LYS 24 45.539 -8.776 9.434 122 HA LYS 24 HA LYS 24 43.069 -7.412 10.387 123 HB2 LYS 24 HB2 LYS 24 43.264 -10.006 10.569 124 HB3 LYS 24 HB1 LYS 24 44.350 -9.650 11.915 125 HG2 LYS 24 HG2 LYS 24 42.641 -8.352 13.034 126 HG3 LYS 24 HG1 LYS 24 41.570 -8.483 11.641 127 HD2 LYS 24 HD2 LYS 24 41.274 -10.111 13.711 128 HD3 LYS 24 HD1 LYS 24 41.053 -10.706 12.067 129 HE2 LYS 24 HE2 LYS 24 43.298 -11.607 12.020 130 HE3 LYS 24 HE1 LYS 24 43.680 -10.854 13.567 131 HZ1 LYS 24 HZ1 LYS 24 41.699 -13.006 13.077 132 HZ2 LYS 24 HZ2 LYS 24 41.890 -12.205 14.562 133 HZ3 LYS 24 HZ3 LYS 24 43.159 -13.141 13.929 134 H THR 25 HN THR 25 43.186 -6.441 12.487 135 HA THR 25 HA THR 25 45.647 -4.990 12.926 136 HB THR 25 HB THR 25 43.335 -4.147 13.431 137 HG1 THR 25 HG1 THR 25 45.416 -4.209 15.303 138 HG21 THR 25 HG21 THR 25 42.812 -6.486 14.471 139 HG22 THR 25 HG22 THR 25 42.055 -5.040 15.141 140 HG23 THR 25 HG23 THR 25 43.450 -5.759 15.946 141 H SER 26 HN SER 26 46.413 -4.972 15.416 142 HA SER 26 HA SER 26 48.052 -6.923 16.109 143 HB2 SER 26 HB2 SER 26 47.938 -5.916 18.121 144 HB3 SER 26 HB1 SER 26 46.396 -5.191 17.674 145 HG SER 26 HG SER 26 45.473 -6.559 18.961 146 H SER 27 HN SER 27 44.533 -7.359 16.214 147 HA SER 27 HA SER 27 44.339 -9.950 15.404 148 HB2 SER 27 HB2 SER 27 45.445 -9.829 18.170 149 HB3 SER 27 HB1 SER 27 44.254 -11.080 17.823 150 HG SER 27 HG SER 27 46.839 -10.983 17.154 151 H GLY 28 HN GLY 28 42.289 -8.782 14.955 152 HA2 GLY 28 HA2 GLY 28 40.100 -9.661 16.408 153 HA3 GLY 28 HA1 GLY 28 40.529 -8.140 17.185 154 H GLN 29 HN GLN 29 41.344 -6.698 14.836 155 HA GLN 29 HA GLN 29 38.684 -6.444 13.526 156 HB2 GLN 29 HB2 GLN 29 40.810 -4.305 13.587 157 HB3 GLN 29 HB1 GLN 29 39.088 -4.123 13.264 158 HG2 GLN 29 HG2 GLN 29 38.500 -4.411 15.517 159 HG3 GLN 29 HG1 GLN 29 40.021 -5.211 15.911 160 HE21 GLN 29 HE21 GLN 29 39.311 -3.086 17.540 161 HE22 GLN 29 HE22 GLN 29 40.278 -1.732 17.204 162 H ARG 30 HN ARG 30 38.556 -6.844 11.381 163 HA ARG 30 HA ARG 30 41.012 -7.488 9.902 164 HB2 ARG 30 HB2 ARG 30 38.167 -8.078 9.662 165 HB3 ARG 30 HB1 ARG 30 38.864 -7.576 8.121 166 HG2 ARG 30 HG2 ARG 30 40.516 -9.299 8.197 167 HG3 ARG 30 HG1 ARG 30 40.170 -9.653 9.889 168 HD2 ARG 30 HD2 ARG 30 37.703 -9.945 8.614 169 HD3 ARG 30 HD1 ARG 30 38.857 -10.662 7.491 170 HE ARG 30 HE ARG 30 38.211 -11.667 10.179 171 HH11 ARG 30 HH11 ARG 30 39.138 -13.669 10.668 172 HH12 ARG 30 HH12 ARG 30 40.378 -14.308 9.642 173 HH21 ARG 30 HH21 ARG 30 40.338 -11.610 7.466 174 HH22 ARG 30 HH22 ARG 30 41.057 -13.143 7.828 175 H TYR 31 HN TYR 31 41.905 -6.178 8.303 176 HA TYR 31 HA TYR 31 40.337 -3.884 7.338 177 HB2 TYR 31 HB2 TYR 31 42.326 -2.339 7.809 178 HB3 TYR 31 HB1 TYR 31 41.328 -2.778 9.186 179 HD1 TYR 31 HD1 TYR 31 43.122 -2.267 10.772 180 HD2 TYR 31 HD2 TYR 31 43.661 -5.236 7.717 181 HE1 TYR 31 HE1 TYR 31 45.150 -3.094 11.925 182 HE2 TYR 31 HE2 TYR 31 45.681 -6.057 8.881 183 HH TYR 31 HH TYR 31 46.945 -4.430 11.757 184 H PHE 32 HN PHE 32 42.160 -2.566 5.828 185 HA PHE 32 HA PHE 32 43.416 -4.767 4.242 186 HB2 PHE 32 HB2 PHE 32 42.273 -2.240 3.040 187 HB3 PHE 32 HB1 PHE 32 42.783 -3.700 2.202 188 HD1 PHE 32 HD1 PHE 32 40.438 -2.651 4.942 189 HD2 PHE 32 HD2 PHE 32 41.149 -5.239 1.591 190 HE1 PHE 32 HE1 PHE 32 38.159 -3.595 5.189 191 HE2 PHE 32 HE2 PHE 32 38.870 -6.184 1.836 192 HZ PHE 32 HZ PHE 32 37.376 -5.364 3.637 193 H LEU 33 HN LEU 33 45.540 -4.545 3.926 194 HA LEU 33 HA LEU 33 46.901 -2.152 4.927 195 HB2 LEU 33 HB2 LEU 33 48.207 -4.437 3.452 196 HB3 LEU 33 HB1 LEU 33 48.906 -3.392 4.685 197 HG LEU 33 HG LEU 33 46.776 -5.509 5.080 198 HD11 LEU 33 HD11 LEU 33 48.693 -6.720 5.317 199 HD12 LEU 33 HD12 LEU 33 48.749 -5.957 6.906 200 HD13 LEU 33 HD13 LEU 33 49.684 -5.285 5.570 201 HD21 LEU 33 HD21 LEU 33 47.508 -3.136 6.694 202 HD22 LEU 33 HD22 LEU 33 47.403 -4.650 7.584 203 HD23 LEU 33 HD23 LEU 33 46.012 -4.063 6.673 204 H ASN 34 HN ASN 34 48.221 -0.756 3.660 205 HA ASN 34 HA ASN 34 47.685 -0.876 0.719 206 HB2 ASN 34 HB2 ASN 34 46.603 1.030 2.126 207 HB3 ASN 34 HB1 ASN 34 48.240 1.682 2.209 208 HD21 ASN 34 HD21 ASN 34 46.673 3.368 0.872 209 HD22 ASN 34 HD22 ASN 34 46.829 3.224 -0.813 210 H HIS 35 HN HIS 35 49.590 -1.647 -0.095 211 HA HIS 35 HA HIS 35 52.154 -0.990 1.134 212 HB2 HIS 35 HB2 HIS 35 51.720 -2.244 -1.585 213 HB3 HIS 35 HB1 HIS 35 53.122 -2.408 -0.530 214 HD1 HIS 35 HD1 HIS 35 52.144 -5.052 -1.153 215 HD2 HIS 35 HD2 HIS 35 50.246 -2.806 1.808 216 HE1 HIS 35 HE1 HIS 35 50.873 -6.699 0.296 217 HE2 HIS 35 HE2 HIS 35 49.716 -5.343 2.099 218 H ILE 36 HN ILE 36 50.084 0.540 -1.068 219 HA ILE 36 HA ILE 36 52.183 1.914 -2.585 220 HB ILE 36 HB ILE 36 49.321 2.809 -2.448 221 HG12 ILE 36 HG12 ILE 36 49.802 0.176 -2.730 222 HG13 ILE 36 HG11 ILE 36 48.505 0.997 -3.582 223 HG21 ILE 36 HG21 ILE 36 49.822 3.078 -4.948 224 HG22 ILE 36 HG22 ILE 36 51.502 2.728 -4.541 225 HG23 ILE 36 HG23 ILE 36 50.706 4.145 -3.857 226 HD11 ILE 36 HD11 ILE 36 51.251 0.896 -4.798 227 HD12 ILE 36 HD12 ILE 36 49.689 1.061 -5.601 228 HD13 ILE 36 HD13 ILE 36 50.182 -0.498 -4.939 229 H ASP 37 HN ASP 37 49.663 2.852 -0.269 230 HA ASP 37 HA ASP 37 51.165 5.339 0.277 231 HB2 ASP 37 HB2 ASP 37 48.398 4.456 1.129 232 HB3 ASP 37 HB1 ASP 37 49.125 6.000 1.571 233 H GLN 38 HN GLN 38 51.459 2.378 1.278 234 HA GLN 38 HA GLN 38 52.112 1.318 3.274 235 HB2 GLN 38 HB2 GLN 38 53.320 4.069 3.350 236 HB3 GLN 38 HB1 GLN 38 53.561 2.961 4.701 237 HG2 GLN 38 HG2 GLN 38 54.764 1.436 3.412 238 HG3 GLN 38 HG1 GLN 38 54.039 1.989 1.903 239 HE21 GLN 38 HE21 GLN 38 55.684 3.847 4.521 240 HE22 GLN 38 HE22 GLN 38 56.848 4.540 3.498 241 H THR 39 HN THR 39 49.509 1.852 3.544 242 HA THR 39 HA THR 39 49.300 2.717 6.359 243 HB THR 39 HB THR 39 48.430 4.674 5.608 244 HG1 THR 39 HG1 THR 39 46.576 4.074 6.418 245 HG21 THR 39 HG21 THR 39 48.988 3.972 3.206 246 HG22 THR 39 HG22 THR 39 47.671 5.124 3.406 247 HG23 THR 39 HG23 THR 39 47.317 3.422 3.107 248 H THR 40 HN THR 40 46.671 2.420 6.767 249 HA THR 40 HA THR 40 46.085 -0.327 5.761 250 HB THR 40 HB THR 40 44.855 -0.568 8.039 251 HG1 THR 40 HG1 THR 40 45.992 1.872 8.231 252 HG21 THR 40 HG21 THR 40 47.605 -0.955 7.251 253 HG22 THR 40 HG22 THR 40 46.600 -1.958 8.296 254 HG23 THR 40 HG23 THR 40 47.513 -0.613 8.978 255 H THR 41 HN THR 41 43.562 -0.750 6.366 256 HA THR 41 HA THR 41 42.004 1.698 5.811 257 HB THR 41 HB THR 41 40.896 -0.039 4.036 258 HG1 THR 41 HG1 THR 41 42.715 -1.445 4.483 259 HG21 THR 41 HG21 THR 41 41.950 1.313 2.333 260 HG22 THR 41 HG22 THR 41 43.227 1.788 3.454 261 HG23 THR 41 HG23 THR 41 41.574 2.345 3.713 262 H TRP 42 HN TRP 42 40.128 1.648 6.958 263 HA TRP 42 HA TRP 42 39.372 -0.823 8.349 264 HB2 TRP 42 HB2 TRP 42 38.145 1.948 8.292 265 HB3 TRP 42 HB1 TRP 42 37.519 0.618 9.262 266 HD1 TRP 42 HD1 TRP 42 39.359 3.523 9.824 267 HE1 TRP 42 HE1 TRP 42 41.066 3.308 11.749 268 HE3 TRP 42 HE3 TRP 42 39.652 -1.570 10.169 269 HZ2 TRP 42 HZ2 TRP 42 42.375 1.239 13.237 270 HZ3 TRP 42 HZ3 TRP 42 41.132 -2.629 11.846 271 HH2 TRP 42 HH2 TRP 42 42.496 -1.234 13.376 272 H GLN 43 HN GLN 43 38.563 0.965 5.525 273 HA GLN 43 HA GLN 43 36.134 -0.708 5.103 274 HB2 GLN 43 HB2 GLN 43 35.938 1.824 5.025 275 HB3 GLN 43 HB1 GLN 43 36.943 1.775 3.576 276 HG2 GLN 43 HG2 GLN 43 35.316 0.632 2.329 277 HG3 GLN 43 HG1 GLN 43 34.483 0.051 3.771 278 HE21 GLN 43 HE21 GLN 43 32.936 1.461 4.783 279 HE22 GLN 43 HE22 GLN 43 32.474 2.946 4.104 280 H ASP 44 HN ASP 44 35.854 -1.591 2.893 281 HA ASP 44 HA ASP 44 38.394 -2.605 1.859 282 HB2 ASP 44 HB2 ASP 44 35.780 -3.024 0.452 283 HB3 ASP 44 HB1 ASP 44 37.118 -4.150 0.677 284 HA PRO 45 HA PRO 45 38.936 0.593 -1.163 285 HB2 PRO 45 HB2 PRO 45 40.311 -0.922 -3.048 286 HB3 PRO 45 HB1 PRO 45 41.052 -0.137 -1.642 287 HG2 PRO 45 HG2 PRO 45 40.269 -2.971 -2.032 288 HG3 PRO 45 HG1 PRO 45 41.638 -2.285 -1.140 289 HD2 PRO 45 HD2 PRO 45 39.419 -3.256 0.105 290 HD3 PRO 45 HD1 PRO 45 40.380 -1.916 0.772 291 H ARG 46 HN ARG 46 37.510 -2.502 -1.895 292 HA ARG 46 HA ARG 46 36.577 -1.832 -4.551 293 HB2 ARG 46 HB2 ARG 46 35.939 -3.969 -2.532 294 HB3 ARG 46 HB1 ARG 46 34.901 -3.766 -3.942 295 HG2 ARG 46 HG2 ARG 46 36.404 -5.193 -4.911 296 HG3 ARG 46 HG1 ARG 46 37.338 -3.716 -5.141 297 HD2 ARG 46 HD2 ARG 46 38.640 -5.602 -4.087 298 HD3 ARG 46 HD1 ARG 46 38.606 -4.123 -3.124 299 HE ARG 46 HE ARG 46 37.394 -5.299 -1.479 300 HH11 ARG 46 HH11 ARG 46 36.331 -7.126 -0.675 301 HH12 ARG 46 HH12 ARG 46 35.935 -8.425 -1.751 302 HH21 ARG 46 HH21 ARG 46 37.295 -6.880 -4.541 303 HH22 ARG 46 HH22 ARG 46 36.481 -8.285 -3.940 304 H LYS 47 HN LYS 47 36.031 -0.015 -2.199 305 HA LYS 47 HA LYS 47 33.097 -0.042 -2.010 306 HB2 LYS 47 HB2 LYS 47 33.474 2.017 -0.602 307 HB3 LYS 47 HB1 LYS 47 34.300 0.577 -0.006 308 HG2 LYS 47 HG2 LYS 47 36.155 1.885 0.014 309 HG3 LYS 47 HG1 LYS 47 36.167 1.629 -1.732 310 HD2 LYS 47 HD2 LYS 47 34.953 3.676 -2.116 311 HD3 LYS 47 HD1 LYS 47 34.661 3.887 -0.389 312 HE2 LYS 47 HE2 LYS 47 36.511 5.214 -0.480 313 HE3 LYS 47 HE1 LYS 47 37.383 3.681 -0.431 314 HZ1 LYS 47 HZ1 LYS 47 36.510 4.357 -3.068 315 HZ2 LYS 47 HZ2 LYS 47 38.062 3.938 -2.516 316 HZ3 LYS 47 HZ3 LYS 47 37.526 5.547 -2.413 317 H ALA 48 HN ALA 48 32.369 2.576 -2.103 318 HA ALA 48 HA ALA 48 33.446 4.104 -4.268 319 HB1 ALA 48 HB1 ALA 48 31.109 3.538 -5.598 320 HB2 ALA 48 HB2 ALA 48 31.559 1.953 -4.969 321 HB3 ALA 48 HB3 ALA 48 32.680 2.845 -5.998 322 H MET 49 HN MET 49 32.274 6.079 -4.537 323 HA MET 49 HA MET 49 30.817 7.795 -3.872 324 HB2 MET 49 HB2 MET 49 28.990 5.642 -2.796 325 HB3 MET 49 HB1 MET 49 28.552 7.230 -3.427 326 HG2 MET 49 HG2 MET 49 29.366 4.758 -4.919 327 HG3 MET 49 HG1 MET 49 28.041 5.875 -5.250 328 HE1 MET 49 HE1 MET 49 28.001 7.597 -6.752 329 HE2 MET 49 HE2 MET 49 29.329 8.616 -7.301 330 HE3 MET 49 HE3 MET 49 28.833 8.662 -5.612 331 H GLY 50 HN GLY 50 29.026 6.774 -1.385 332 HA2 GLY 50 HA2 GLY 50 30.971 6.629 0.760 333 HA3 GLY 50 HA1 GLY 50 30.269 8.242 0.629 334 H GLY 51 HN GLY 51 29.823 6.729 2.923 335 HA2 GLY 51 HA2 GLY 51 26.887 6.314 2.719 336 HA3 GLY 51 HA1 GLY 51 27.863 5.025 3.424 337 H GLY 52 HN GLY 52 29.618 6.215 5.043 338 HA2 GLY 52 HA2 GLY 52 29.682 8.124 6.695 339 HA3 GLY 52 HA1 GLY 52 27.940 7.898 6.862 340 H GLY 53 HN GLY 53 29.268 7.760 9.181 341 HA2 GLY 53 HA2 GLY 53 28.854 6.059 10.929 342 HA3 GLY 53 HA1 GLY 53 29.341 4.829 9.761 343 H ASN 54 HN ASN 54 30.485 5.401 12.435 344 HA ASN 54 HA ASN 54 33.199 6.384 11.715 345 HB2 ASN 54 HB2 ASN 54 32.868 5.612 14.494 346 HB3 ASN 54 HB1 ASN 54 33.278 7.190 13.820 347 HD21 ASN 54 HD21 ASN 54 30.874 7.598 12.265 348 HD22 ASN 54 HD22 ASN 54 29.583 7.797 13.348 349 H TYR 55 HN TYR 55 35.065 5.088 12.546 350 HA TYR 55 HA TYR 55 34.454 2.171 12.345 351 HB2 TYR 55 HB2 TYR 55 37.254 2.709 12.079 352 HB3 TYR 55 HB1 TYR 55 36.143 2.083 10.860 353 HD1 TYR 55 HD1 TYR 55 35.764 3.351 8.941 354 HD2 TYR 55 HD2 TYR 55 37.046 5.317 12.538 355 HE1 TYR 55 HE1 TYR 55 35.889 5.506 7.718 356 HE2 TYR 55 HE2 TYR 55 37.170 7.472 11.316 357 HH TYR 55 HH TYR 55 36.042 8.458 9.211 358 H GLN 56 HN GLN 56 36.961 1.282 13.345 359 HA GLN 56 HA GLN 56 36.454 1.565 16.208 360 HB2 GLN 56 HB2 GLN 56 38.927 0.203 15.311 361 HB3 GLN 56 HB1 GLN 56 37.688 -0.347 16.440 362 HG2 GLN 56 HG2 GLN 56 37.497 -0.327 13.414 363 HG3 GLN 56 HG1 GLN 56 37.605 -1.748 14.454 364 HE21 GLN 56 HE21 GLN 56 35.740 -1.924 16.131 365 HE22 GLN 56 HE22 GLN 56 34.199 -1.427 15.622 366 H GLY 57 HN GLY 57 37.517 3.815 14.478 367 HA2 GLY 57 HA2 GLY 57 38.718 5.688 15.575 368 HA3 GLY 57 HA1 GLY 57 39.833 4.494 16.241 369 HA PRO 58 HA PRO 58 41.667 6.153 12.309 370 HB2 PRO 58 HB2 PRO 58 44.087 6.839 13.370 371 HB3 PRO 58 HB1 PRO 58 42.686 7.925 13.378 372 HG2 PRO 58 HG2 PRO 58 43.804 6.262 15.569 373 HG3 PRO 58 HG1 PRO 58 43.071 7.873 15.631 374 HD2 PRO 58 HD2 PRO 58 41.756 5.545 16.347 375 HD3 PRO 58 HD1 PRO 58 40.939 7.035 15.826 376 HA PRO 59 HA PRO 59 43.677 2.176 11.883 377 HB2 PRO 59 HB2 PRO 59 44.098 2.292 9.208 378 HB3 PRO 59 HB1 PRO 59 42.493 2.015 9.909 379 HG2 PRO 59 HG2 PRO 59 43.658 4.501 8.770 380 HG3 PRO 59 HG1 PRO 59 42.006 3.871 8.660 381 HD2 PRO 59 HD2 PRO 59 42.794 5.875 10.405 382 HD3 PRO 59 HD1 PRO 59 41.371 4.837 10.643 383 HA PRO 60 HA PRO 60 47.928 3.747 11.982 384 HB2 PRO 60 HB2 PRO 60 49.019 1.468 13.041 385 HB3 PRO 60 HB1 PRO 60 48.184 2.687 14.021 386 HG2 PRO 60 HG2 PRO 60 47.242 0.044 13.075 387 HG3 PRO 60 HG1 PRO 60 46.878 0.907 14.578 388 HD2 PRO 60 HD2 PRO 60 45.171 0.760 12.392 389 HD3 PRO 60 HD1 PRO 60 45.092 2.008 13.652 390 HA PRO 61 HA PRO 61 49.681 1.965 8.343 391 HB2 PRO 61 HB2 PRO 61 52.313 1.455 9.019 392 HB3 PRO 61 HB1 PRO 61 51.680 3.052 8.577 393 HG2 PRO 61 HG2 PRO 61 52.242 1.910 11.256 394 HG3 PRO 61 HG1 PRO 61 52.470 3.562 10.657 395 HD2 PRO 61 HD2 PRO 61 50.372 2.883 12.260 396 HD3 PRO 61 HD1 PRO 61 50.244 4.149 11.019 397 H TYR 62 HN TYR 62 49.513 -0.034 7.498 398 HA TYR 62 HA TYR 62 48.886 -2.382 8.690 399 HB2 TYR 62 HB2 TYR 62 50.041 -3.542 6.806 400 HB3 TYR 62 HB1 TYR 62 49.151 -2.117 6.258 401 HD1 TYR 62 HD1 TYR 62 50.452 0.134 6.243 402 HD2 TYR 62 HD2 TYR 62 52.319 -3.728 6.281 403 HE1 TYR 62 HE1 TYR 62 52.546 1.148 5.420 404 HE2 TYR 62 HE2 TYR 62 54.417 -2.719 5.447 405 HH TYR 62 HH TYR 62 54.789 -0.209 3.952 406 HA PRO 63 HA PRO 63 52.147 -3.689 11.370 407 HB2 PRO 63 HB2 PRO 63 52.090 -6.425 10.893 408 HB3 PRO 63 HB1 PRO 63 50.986 -5.562 11.978 409 HG2 PRO 63 HG2 PRO 63 50.556 -6.500 9.193 410 HG3 PRO 63 HG1 PRO 63 49.425 -6.441 10.557 411 HD2 PRO 63 HD2 PRO 63 49.357 -4.620 8.540 412 HD3 PRO 63 HD1 PRO 63 48.908 -4.205 10.209 413 H LYS 64 HN LYS 64 54.334 -3.595 11.069 414 HA LYS 64 HA LYS 64 55.702 -3.553 8.683 415 HB2 LYS 64 HB2 LYS 64 56.577 -4.560 11.392 416 HB3 LYS 64 HB1 LYS 64 57.695 -4.496 10.028 417 HG2 LYS 64 HG2 LYS 64 57.715 -2.190 9.971 418 HG3 LYS 64 HG1 LYS 64 56.070 -2.056 10.597 419 HD2 LYS 64 HD2 LYS 64 56.967 -2.917 12.815 420 HD3 LYS 64 HD1 LYS 64 58.587 -2.699 12.150 421 HE2 LYS 64 HE2 LYS 64 58.403 -0.383 12.097 422 HE3 LYS 64 HE1 LYS 64 56.643 -0.423 11.986 423 HZ1 LYS 64 HZ1 LYS 64 56.440 -0.910 14.241 424 HZ2 LYS 64 HZ2 LYS 64 57.663 0.267 14.192 425 HZ3 LYS 64 HZ3 LYS 64 58.065 -1.370 14.398 426 H HIS 65 HN HIS 65 56.662 -5.078 7.297 427 HA HIS 65 HA HIS 65 56.689 -7.120 6.125 428 HB2 HIS 65 HB2 HIS 65 57.519 -7.611 8.904 429 HB3 HIS 65 HB1 HIS 65 56.930 -9.053 8.077 430 HD1 HIS 65 HD1 HIS 65 57.918 -8.157 5.190 431 HD2 HIS 65 HD2 HIS 65 60.266 -8.234 8.637 432 HE1 HIS 65 HE1 HIS 65 60.324 -8.325 4.415 433 HE2 HIS 65 HE2 HIS 65 61.761 -8.372 6.505 Start of MODEL 2 1 H1 SER 7 HT1 SER 7 29.207 -18.321 -13.426 2 H2 SER 7 HT2 SER 7 28.459 -18.759 -11.966 3 H3 SER 7 HT3 SER 7 30.090 -19.148 -12.239 4 HA SER 7 HA SER 7 30.678 -17.271 -11.253 5 HB2 SER 7 HB2 SER 7 29.073 -16.023 -13.503 6 HB3 SER 7 HB1 SER 7 30.201 -15.149 -12.471 7 HG SER 7 HG SER 7 30.901 -16.157 -14.619 8 H PHE 8 HN PHE 8 29.831 -16.873 -9.265 9 HA PHE 8 HA PHE 8 26.935 -16.409 -8.956 10 HB2 PHE 8 HB2 PHE 8 29.213 -16.626 -6.972 11 HB3 PHE 8 HB1 PHE 8 27.545 -16.298 -6.503 12 HD1 PHE 8 HD1 PHE 8 29.398 -18.665 -8.762 13 HD2 PHE 8 HD2 PHE 8 26.271 -18.135 -5.865 14 HE1 PHE 8 HE1 PHE 8 28.890 -21.089 -8.868 15 HE2 PHE 8 HE2 PHE 8 25.763 -20.560 -5.971 16 HZ PHE 8 HZ PHE 8 27.072 -22.037 -7.473 17 H GLU 9 HN GLU 9 26.295 -14.349 -9.454 18 HA GLU 9 HA GLU 9 26.510 -11.984 -9.698 19 HB2 GLU 9 HB2 GLU 9 25.725 -12.745 -7.241 20 HB3 GLU 9 HB1 GLU 9 27.212 -11.899 -6.808 21 HG2 GLU 9 HG2 GLU 9 26.463 -9.875 -7.876 22 HG3 GLU 9 HG1 GLU 9 25.076 -10.700 -8.589 23 H ILE 10 HN ILE 10 28.122 -10.483 -7.660 24 HA ILE 10 HA ILE 10 30.450 -10.003 -9.196 25 HB ILE 10 HB ILE 10 30.197 -9.587 -6.206 26 HG12 ILE 10 HG12 ILE 10 29.177 -7.931 -8.535 27 HG13 ILE 10 HG11 ILE 10 28.216 -8.654 -7.244 28 HG21 ILE 10 HG21 ILE 10 31.516 -7.594 -7.932 29 HG22 ILE 10 HG22 ILE 10 32.332 -9.156 -7.878 30 HG23 ILE 10 HG23 ILE 10 32.036 -8.263 -6.387 31 HD11 ILE 10 HD11 ILE 10 28.567 -6.256 -6.816 32 HD12 ILE 10 HD12 ILE 10 30.314 -6.492 -6.888 33 HD13 ILE 10 HD13 ILE 10 29.377 -7.229 -5.588 34 HA PRO 11 HA PRO 11 32.502 -13.942 -8.313 35 HB2 PRO 11 HB2 PRO 11 34.748 -12.434 -9.565 36 HB3 PRO 11 HB1 PRO 11 34.119 -14.047 -9.949 37 HG2 PRO 11 HG2 PRO 11 33.629 -11.929 -11.503 38 HG3 PRO 11 HG1 PRO 11 32.448 -13.230 -11.278 39 HD2 PRO 11 HD2 PRO 11 32.425 -10.462 -10.178 40 HD3 PRO 11 HD1 PRO 11 31.064 -11.537 -10.563 41 H ASP 12 HN ASP 12 33.510 -14.457 -6.413 42 HA ASP 12 HA ASP 12 34.615 -12.359 -4.738 43 HB2 ASP 12 HB2 ASP 12 35.248 -14.401 -3.270 44 HB3 ASP 12 HB1 ASP 12 33.532 -14.071 -3.515 45 H ASP 13 HN ASP 13 35.800 -13.745 -7.337 46 HA ASP 13 HA ASP 13 38.555 -14.168 -6.358 47 HB2 ASP 13 HB2 ASP 13 38.638 -14.428 -9.109 48 HB3 ASP 13 HB1 ASP 13 38.404 -15.756 -7.971 49 H VAL 14 HN VAL 14 37.384 -11.503 -6.279 50 HA VAL 14 HA VAL 14 39.060 -10.125 -8.323 51 HB VAL 14 HB VAL 14 36.577 -9.666 -8.364 52 HG11 VAL 14 HG11 VAL 14 36.847 -9.580 -5.629 53 HG12 VAL 14 HG12 VAL 14 35.470 -8.931 -6.520 54 HG13 VAL 14 HG13 VAL 14 36.793 -7.867 -6.041 55 HG21 VAL 14 HG21 VAL 14 37.749 -7.071 -7.572 56 HG22 VAL 14 HG22 VAL 14 37.022 -7.556 -9.104 57 HG23 VAL 14 HG23 VAL 14 38.698 -7.974 -8.754 58 HA PRO 15 HA PRO 15 41.326 -9.772 -4.262 59 HB2 PRO 15 HB2 PRO 15 43.328 -8.910 -6.305 60 HB3 PRO 15 HB1 PRO 15 43.531 -9.985 -4.909 61 HG2 PRO 15 HG2 PRO 15 43.353 -10.918 -7.411 62 HG3 PRO 15 HG1 PRO 15 42.712 -11.806 -6.019 63 HD2 PRO 15 HD2 PRO 15 41.241 -10.371 -8.161 64 HD3 PRO 15 HD1 PRO 15 40.706 -11.708 -7.121 65 H LEU 16 HN LEU 16 42.546 -7.824 -3.400 66 HA LEU 16 HA LEU 16 41.036 -5.423 -3.715 67 HB2 LEU 16 HB2 LEU 16 43.850 -5.810 -2.655 68 HB3 LEU 16 HB1 LEU 16 42.837 -4.405 -2.369 69 HG LEU 16 HG LEU 16 43.026 -6.552 -0.703 70 HD11 LEU 16 HD11 LEU 16 42.109 -4.542 0.094 71 HD12 LEU 16 HD12 LEU 16 40.747 -5.659 0.165 72 HD13 LEU 16 HD13 LEU 16 40.870 -4.502 -1.159 73 HD21 LEU 16 HD21 LEU 16 41.871 -8.123 -2.119 74 HD22 LEU 16 HD22 LEU 16 40.582 -6.966 -2.454 75 HD23 LEU 16 HD23 LEU 16 40.752 -7.656 -0.845 76 HA PRO 17 HA PRO 17 42.885 -3.240 -7.101 77 HB2 PRO 17 HB2 PRO 17 43.919 -1.056 -5.422 78 HB3 PRO 17 HB1 PRO 17 42.711 -1.012 -6.713 79 HG2 PRO 17 HG2 PRO 17 42.068 -0.733 -4.121 80 HG3 PRO 17 HG1 PRO 17 40.984 -1.478 -5.307 81 HD2 PRO 17 HD2 PRO 17 42.647 -2.776 -3.195 82 HD3 PRO 17 HD1 PRO 17 41.059 -3.259 -3.832 83 H ALA 18 HN ALA 18 45.169 -1.388 -6.736 84 HA ALA 18 HA ALA 18 47.248 -3.449 -6.996 85 HB1 ALA 18 HB1 ALA 18 48.570 -1.275 -7.623 86 HB2 ALA 18 HB2 ALA 18 46.960 -0.559 -7.704 87 HB3 ALA 18 HB3 ALA 18 47.371 -1.927 -8.740 88 H GLY 19 HN GLY 19 48.897 -3.755 -5.565 89 HA2 GLY 19 HA2 GLY 19 50.262 -3.476 -3.680 90 HA3 GLY 19 HA1 GLY 19 49.858 -1.762 -3.737 91 H TRP 20 HN TRP 20 47.255 -4.067 -3.511 92 HA TRP 20 HA TRP 20 46.793 -3.117 -0.729 93 HB2 TRP 20 HB2 TRP 20 44.936 -4.167 -2.845 94 HB3 TRP 20 HB1 TRP 20 44.439 -3.883 -1.172 95 HD1 TRP 20 HD1 TRP 20 45.289 -2.132 -4.375 96 HE1 TRP 20 HE1 TRP 20 44.883 0.387 -4.106 97 HE3 TRP 20 HE3 TRP 20 44.531 -1.976 0.627 98 HZ2 TRP 20 HZ2 TRP 20 44.310 2.258 -1.965 99 HZ3 TRP 20 HZ3 TRP 20 44.076 0.144 1.780 100 HH2 TRP 20 HH2 TRP 20 43.956 2.279 0.498 101 H GLU 21 HN GLU 21 45.924 -4.614 0.845 102 HA GLU 21 HA GLU 21 45.937 -7.474 0.268 103 HB2 GLU 21 HB2 GLU 21 48.389 -6.955 0.465 104 HB3 GLU 21 HB1 GLU 21 48.092 -6.407 2.116 105 HG2 GLU 21 HG2 GLU 21 47.147 -8.653 2.652 106 HG3 GLU 21 HG1 GLU 21 47.575 -9.189 1.027 107 H MET 22 HN MET 22 44.165 -8.063 1.472 108 HA MET 22 HA MET 22 43.225 -6.534 3.698 109 HB2 MET 22 HB2 MET 22 41.451 -7.762 2.993 110 HB3 MET 22 HB1 MET 22 42.482 -9.032 2.332 111 HG2 MET 22 HG2 MET 22 42.800 -10.008 4.503 112 HG3 MET 22 HG1 MET 22 42.010 -8.642 5.290 113 HE1 MET 22 HE1 MET 22 39.762 -8.187 5.528 114 HE2 MET 22 HE2 MET 22 38.371 -8.980 4.792 115 HE3 MET 22 HE3 MET 22 39.410 -7.951 3.810 116 H ALA 23 HN ALA 23 43.617 -6.788 5.882 117 HA ALA 23 HA ALA 23 45.177 -9.129 6.794 118 HB1 ALA 23 HB1 ALA 23 46.136 -6.267 6.932 119 HB2 ALA 23 HB2 ALA 23 46.940 -7.626 6.153 120 HB3 ALA 23 HB3 ALA 23 46.825 -7.561 7.911 121 H LYS 24 HN LYS 24 45.517 -8.875 9.306 122 HA LYS 24 HA LYS 24 43.065 -7.575 10.399 123 HB2 LYS 24 HB2 LYS 24 43.562 -10.241 10.492 124 HB3 LYS 24 HB1 LYS 24 44.310 -9.715 12.001 125 HG2 LYS 24 HG2 LYS 24 42.302 -8.771 12.811 126 HG3 LYS 24 HG1 LYS 24 41.549 -8.791 11.218 127 HD2 LYS 24 HD2 LYS 24 42.338 -11.281 12.761 128 HD3 LYS 24 HD1 LYS 24 40.705 -10.622 12.705 129 HE2 LYS 24 HE2 LYS 24 40.363 -11.798 10.818 130 HE3 LYS 24 HE1 LYS 24 41.552 -10.767 10.022 131 HZ1 LYS 24 HZ1 LYS 24 42.872 -12.687 11.607 132 HZ2 LYS 24 HZ2 LYS 24 42.950 -12.460 9.925 133 HZ3 LYS 24 HZ3 LYS 24 41.764 -13.477 10.593 134 H THR 25 HN THR 25 43.195 -6.743 12.493 135 HA THR 25 HA THR 25 45.713 -5.378 13.050 136 HB THR 25 HB THR 25 43.294 -4.494 13.229 137 HG1 THR 25 HG1 THR 25 44.694 -3.127 14.091 138 HG21 THR 25 HG21 THR 25 43.467 -5.811 15.927 139 HG22 THR 25 HG22 THR 25 42.642 -6.552 14.558 140 HG23 THR 25 HG23 THR 25 42.082 -5.006 15.193 141 H SER 26 HN SER 26 46.602 -5.443 15.329 142 HA SER 26 HA SER 26 47.083 -8.155 16.158 143 HB2 SER 26 HB2 SER 26 47.694 -6.519 18.344 144 HB3 SER 26 HB1 SER 26 48.809 -7.026 17.079 145 HG SER 26 HG SER 26 47.654 -4.594 17.546 146 H SER 27 HN SER 27 44.246 -7.449 16.050 147 HA SER 27 HA SER 27 43.539 -8.255 18.814 148 HB2 SER 27 HB2 SER 27 43.334 -5.657 18.285 149 HB3 SER 27 HB1 SER 27 41.830 -6.167 17.523 150 HG SER 27 HG SER 27 42.613 -6.890 20.154 151 H GLY 28 HN GLY 28 42.899 -8.252 15.391 152 HA2 GLY 28 HA2 GLY 28 41.738 -10.321 14.595 153 HA3 GLY 28 HA1 GLY 28 40.597 -10.090 15.918 154 H GLN 29 HN GLN 29 41.345 -7.065 14.707 155 HA GLN 29 HA GLN 29 38.742 -6.920 13.359 156 HB2 GLN 29 HB2 GLN 29 40.796 -4.709 13.548 157 HB3 GLN 29 HB1 GLN 29 39.051 -4.555 13.344 158 HG2 GLN 29 HG2 GLN 29 40.180 -5.920 15.780 159 HG3 GLN 29 HG1 GLN 29 40.059 -4.161 15.716 160 HE21 GLN 29 HE21 GLN 29 38.132 -7.160 15.641 161 HE22 GLN 29 HE22 GLN 29 36.651 -6.413 15.997 162 H ARG 30 HN ARG 30 38.575 -7.426 11.240 163 HA ARG 30 HA ARG 30 40.898 -7.725 9.539 164 HB2 ARG 30 HB2 ARG 30 38.022 -8.231 9.375 165 HB3 ARG 30 HB1 ARG 30 38.689 -7.627 7.858 166 HG2 ARG 30 HG2 ARG 30 40.509 -9.361 8.062 167 HG3 ARG 30 HG1 ARG 30 39.633 -10.030 9.438 168 HD2 ARG 30 HD2 ARG 30 37.669 -9.768 7.488 169 HD3 ARG 30 HD1 ARG 30 39.082 -10.310 6.582 170 HE ARG 30 HE ARG 30 37.565 -11.910 8.458 171 HH11 ARG 30 HH11 ARG 30 38.360 -13.982 8.885 172 HH12 ARG 30 HH12 ARG 30 39.994 -14.372 8.466 173 HH21 ARG 30 HH21 ARG 30 40.695 -11.228 7.181 174 HH22 ARG 30 HH22 ARG 30 41.316 -12.813 7.500 175 H TYR 31 HN TYR 31 41.821 -6.232 8.204 176 HA TYR 31 HA TYR 31 40.221 -3.903 7.381 177 HB2 TYR 31 HB2 TYR 31 42.213 -2.377 7.914 178 HB3 TYR 31 HB1 TYR 31 41.200 -2.876 9.258 179 HD1 TYR 31 HD1 TYR 31 43.631 -5.178 7.654 180 HD2 TYR 31 HD2 TYR 31 42.886 -2.512 10.940 181 HE1 TYR 31 HE1 TYR 31 45.642 -6.033 8.820 182 HE2 TYR 31 HE2 TYR 31 44.900 -3.378 12.094 183 HH TYR 31 HH TYR 31 46.761 -4.618 11.857 184 H PHE 32 HN PHE 32 42.053 -2.471 5.974 185 HA PHE 32 HA PHE 32 43.151 -4.527 4.106 186 HB2 PHE 32 HB2 PHE 32 42.073 -1.789 3.397 187 HB3 PHE 32 HB1 PHE 32 42.616 -3.030 2.267 188 HD1 PHE 32 HD1 PHE 32 41.393 -5.254 2.203 189 HD2 PHE 32 HD2 PHE 32 39.872 -1.825 4.293 190 HE1 PHE 32 HE1 PHE 32 39.135 -6.277 2.237 191 HE2 PHE 32 HE2 PHE 32 37.614 -2.847 4.329 192 HZ PHE 32 HZ PHE 32 37.244 -5.074 3.300 193 H LEU 33 HN LEU 33 45.283 -4.421 3.721 194 HA LEU 33 HA LEU 33 46.822 -2.137 4.800 195 HB2 LEU 33 HB2 LEU 33 47.922 -4.550 3.345 196 HB3 LEU 33 HB1 LEU 33 48.760 -3.497 4.484 197 HG LEU 33 HG LEU 33 46.539 -5.462 5.096 198 HD11 LEU 33 HD11 LEU 33 49.480 -5.250 5.690 199 HD12 LEU 33 HD12 LEU 33 48.566 -6.640 5.106 200 HD13 LEU 33 HD13 LEU 33 48.424 -6.136 6.790 201 HD21 LEU 33 HD21 LEU 33 47.501 -3.059 6.535 202 HD22 LEU 33 HD22 LEU 33 47.321 -4.513 7.513 203 HD23 LEU 33 HD23 LEU 33 45.940 -3.869 6.625 204 H ASN 34 HN ASN 34 47.488 -0.474 3.507 205 HA ASN 34 HA ASN 34 47.213 -0.850 0.561 206 HB2 ASN 34 HB2 ASN 34 46.099 1.092 1.909 207 HB3 ASN 34 HB1 ASN 34 47.716 1.795 1.895 208 HD21 ASN 34 HD21 ASN 34 46.335 3.450 0.502 209 HD22 ASN 34 HD22 ASN 34 46.322 3.163 -1.171 210 H HIS 35 HN HIS 35 49.093 -1.367 -0.432 211 HA HIS 35 HA HIS 35 51.674 -0.754 0.798 212 HB2 HIS 35 HB2 HIS 35 50.974 -1.944 -1.905 213 HB3 HIS 35 HB1 HIS 35 52.606 -1.830 -1.249 214 HD1 HIS 35 HD1 HIS 35 52.243 -4.594 -1.571 215 HD2 HIS 35 HD2 HIS 35 50.302 -2.730 1.617 216 HE1 HIS 35 HE1 HIS 35 51.640 -6.427 0.073 217 HE2 HIS 35 HE2 HIS 35 50.458 -5.303 2.017 218 H ILE 36 HN ILE 36 49.463 0.856 -1.174 219 HA ILE 36 HA ILE 36 51.437 2.476 -2.625 220 HB ILE 36 HB ILE 36 48.551 3.238 -2.384 221 HG12 ILE 36 HG12 ILE 36 49.144 0.614 -2.857 222 HG13 ILE 36 HG11 ILE 36 47.728 1.432 -3.500 223 HG21 ILE 36 HG21 ILE 36 49.892 4.658 -3.760 224 HG22 ILE 36 HG22 ILE 36 48.974 3.642 -4.872 225 HG23 ILE 36 HG23 ILE 36 50.668 3.283 -4.544 226 HD11 ILE 36 HD11 ILE 36 50.372 1.435 -4.960 227 HD12 ILE 36 HD12 ILE 36 48.775 1.826 -5.599 228 HD13 ILE 36 HD13 ILE 36 49.179 0.157 -5.192 229 H ASP 37 HN ASP 37 48.876 3.081 -0.236 230 HA ASP 37 HA ASP 37 50.110 5.637 0.488 231 HB2 ASP 37 HB2 ASP 37 47.593 5.250 0.441 232 HB3 ASP 37 HB1 ASP 37 47.809 4.265 1.887 233 H GLN 38 HN GLN 38 50.790 2.583 1.106 234 HA GLN 38 HA GLN 38 51.892 1.415 2.816 235 HB2 GLN 38 HB2 GLN 38 53.035 4.172 2.743 236 HB3 GLN 38 HB1 GLN 38 53.546 3.085 4.037 237 HG2 GLN 38 HG2 GLN 38 54.374 1.472 2.501 238 HG3 GLN 38 HG1 GLN 38 53.537 2.225 1.143 239 HE21 GLN 38 HE21 GLN 38 56.371 2.473 3.248 240 HE22 GLN 38 HE22 GLN 38 57.154 3.683 2.351 241 H THR 39 HN THR 39 49.532 1.549 3.810 242 HA THR 39 HA THR 39 49.858 1.976 6.630 243 HB THR 39 HB THR 39 49.415 4.211 6.434 244 HG1 THR 39 HG1 THR 39 47.470 4.430 7.276 245 HG21 THR 39 HG21 THR 39 48.463 3.472 3.836 246 HG22 THR 39 HG22 THR 39 48.944 5.066 4.412 247 HG23 THR 39 HG23 THR 39 47.278 4.526 4.605 248 H THR 40 HN THR 40 47.365 2.080 7.504 249 HA THR 40 HA THR 40 46.027 -0.222 6.152 250 HB THR 40 HB THR 40 45.050 -0.641 8.490 251 HG1 THR 40 HG1 THR 40 46.934 1.382 8.964 252 HG21 THR 40 HG21 THR 40 47.711 -1.178 7.432 253 HG22 THR 40 HG22 THR 40 46.593 -2.262 8.263 254 HG23 THR 40 HG23 THR 40 47.674 -1.226 9.194 255 H THR 41 HN THR 41 43.666 -0.173 6.173 256 HA THR 41 HA THR 41 42.441 2.417 6.909 257 HB THR 41 HB THR 41 42.540 2.980 4.725 258 HG1 THR 41 HG1 THR 41 40.348 2.534 5.049 259 HG21 THR 41 HG21 THR 41 43.988 1.464 3.770 260 HG22 THR 41 HG22 THR 41 42.497 0.983 2.959 261 HG23 THR 41 HG23 THR 41 43.073 0.075 4.356 262 H TRP 42 HN TRP 42 40.243 2.297 7.365 263 HA TRP 42 HA TRP 42 39.232 -0.419 7.926 264 HB2 TRP 42 HB2 TRP 42 37.976 2.287 8.491 265 HB3 TRP 42 HB1 TRP 42 37.414 0.736 9.107 266 HD1 TRP 42 HD1 TRP 42 39.398 3.577 10.120 267 HE1 TRP 42 HE1 TRP 42 40.952 2.999 12.096 268 HE3 TRP 42 HE3 TRP 42 39.154 -1.521 9.965 269 HZ2 TRP 42 HZ2 TRP 42 41.956 0.676 13.434 270 HZ3 TRP 42 HZ3 TRP 42 40.415 -2.891 11.600 271 HH2 TRP 42 HH2 TRP 42 41.816 -1.800 13.332 272 H GLN 43 HN GLN 43 39.245 1.784 5.429 273 HA GLN 43 HA GLN 43 36.510 1.172 4.487 274 HB2 GLN 43 HB2 GLN 43 37.442 3.472 4.248 275 HB3 GLN 43 HB1 GLN 43 38.684 2.826 3.175 276 HG2 GLN 43 HG2 GLN 43 36.647 1.832 1.855 277 HG3 GLN 43 HG1 GLN 43 35.727 3.073 2.706 278 HE21 GLN 43 HE21 GLN 43 39.102 3.268 1.486 279 HE22 GLN 43 HE22 GLN 43 38.809 4.571 0.438 280 H ASP 44 HN ASP 44 36.096 -0.022 2.581 281 HA ASP 44 HA ASP 44 38.283 -1.853 1.807 282 HB2 ASP 44 HB2 ASP 44 35.451 -2.034 0.810 283 HB3 ASP 44 HB1 ASP 44 36.621 -3.332 1.055 284 HA PRO 45 HA PRO 45 38.948 0.843 -1.738 285 HB2 PRO 45 HB2 PRO 45 40.342 -1.393 -2.973 286 HB3 PRO 45 HB1 PRO 45 40.995 0.155 -2.423 287 HG2 PRO 45 HG2 PRO 45 41.296 -2.364 -1.212 288 HG3 PRO 45 HG1 PRO 45 41.817 -0.797 -0.588 289 HD2 PRO 45 HD2 PRO 45 39.703 -2.473 0.396 290 HD3 PRO 45 HD1 PRO 45 40.224 -0.896 1.022 291 H ARG 46 HN ARG 46 37.395 -2.203 -1.575 292 HA ARG 46 HA ARG 46 36.657 -2.308 -4.398 293 HB2 ARG 46 HB2 ARG 46 36.305 -3.999 -2.007 294 HB3 ARG 46 HB1 ARG 46 34.943 -4.029 -3.126 295 HG2 ARG 46 HG2 ARG 46 36.214 -4.910 -4.867 296 HG3 ARG 46 HG1 ARG 46 37.727 -4.280 -4.216 297 HD2 ARG 46 HD2 ARG 46 36.119 -6.628 -3.183 298 HD3 ARG 46 HD1 ARG 46 37.752 -6.655 -3.848 299 HE ARG 46 HE ARG 46 37.990 -4.958 -1.690 300 HH11 ARG 46 HH11 ARG 46 38.457 -5.668 0.404 301 HH12 ARG 46 HH12 ARG 46 38.043 -7.284 0.869 302 HH21 ARG 46 HH21 ARG 46 36.691 -8.109 -2.216 303 HH22 ARG 46 HH22 ARG 46 37.043 -8.666 -0.614 304 H LYS 47 HN LYS 47 35.944 0.043 -2.690 305 HA LYS 47 HA LYS 47 33.061 0.085 -3.389 306 HB2 LYS 47 HB2 LYS 47 34.199 1.027 -0.740 307 HB3 LYS 47 HB1 LYS 47 32.520 1.192 -1.253 308 HG2 LYS 47 HG2 LYS 47 33.919 -1.484 -1.098 309 HG3 LYS 47 HG1 LYS 47 33.015 -0.804 0.254 310 HD2 LYS 47 HD2 LYS 47 31.078 -0.526 -1.440 311 HD3 LYS 47 HD1 LYS 47 31.987 -1.651 -2.451 312 HE2 LYS 47 HE2 LYS 47 30.736 -3.178 -1.264 313 HE3 LYS 47 HE1 LYS 47 32.095 -3.019 -0.151 314 HZ1 LYS 47 HZ1 LYS 47 29.482 -2.565 0.450 315 HZ2 LYS 47 HZ2 LYS 47 30.103 -0.999 0.233 316 HZ3 LYS 47 HZ3 LYS 47 30.813 -2.048 1.365 317 H ALA 48 HN ALA 48 32.349 2.582 -2.811 318 HA ALA 48 HA ALA 48 34.487 4.320 -3.979 319 HB1 ALA 48 HB1 ALA 48 31.568 4.794 -4.526 320 HB2 ALA 48 HB2 ALA 48 32.462 3.618 -5.489 321 HB3 ALA 48 HB3 ALA 48 32.970 5.307 -5.464 322 H MET 49 HN MET 49 34.786 6.255 -2.923 323 HA MET 49 HA MET 49 34.311 8.067 -1.474 324 HB2 MET 49 HB2 MET 49 31.800 7.291 -2.187 325 HB3 MET 49 HB1 MET 49 31.770 6.932 -0.459 326 HG2 MET 49 HG2 MET 49 32.445 9.209 0.073 327 HG3 MET 49 HG1 MET 49 32.640 9.587 -1.639 328 HE1 MET 49 HE1 MET 49 30.218 10.760 -3.024 329 HE2 MET 49 HE2 MET 49 29.385 9.220 -3.217 330 HE3 MET 49 HE3 MET 49 31.145 9.274 -3.272 331 H GLY 50 HN GLY 50 34.297 8.377 0.903 332 HA2 GLY 50 HA2 GLY 50 33.953 6.801 3.018 333 HA3 GLY 50 HA1 GLY 50 35.292 5.934 2.262 334 H GLY 51 HN GLY 51 34.688 8.092 4.632 335 HA2 GLY 51 HA2 GLY 51 37.279 9.526 4.198 336 HA3 GLY 51 HA1 GLY 51 35.925 10.224 5.089 337 H GLY 52 HN GLY 52 38.472 9.990 6.259 338 HA2 GLY 52 HA2 GLY 52 38.359 7.610 8.014 339 HA3 GLY 52 HA1 GLY 52 39.674 8.785 7.954 340 H GLY 53 HN GLY 53 38.430 7.903 10.380 341 HA2 GLY 53 HA2 GLY 53 38.250 9.616 12.238 342 HA3 GLY 53 HA1 GLY 53 37.048 10.420 11.227 343 H ASN 54 HN ASN 54 34.990 9.351 10.901 344 HA ASN 54 HA ASN 54 33.955 8.065 13.230 345 HB2 ASN 54 HB2 ASN 54 32.876 8.196 10.399 346 HB3 ASN 54 HB1 ASN 54 31.961 7.587 11.779 347 HD21 ASN 54 HD21 ASN 54 32.589 9.393 13.796 348 HD22 ASN 54 HD22 ASN 54 32.102 10.958 13.358 349 H TYR 55 HN TYR 55 34.980 6.149 13.792 350 HA TYR 55 HA TYR 55 34.233 3.730 12.524 351 HB2 TYR 55 HB2 TYR 55 36.428 5.070 11.234 352 HB3 TYR 55 HB1 TYR 55 37.016 3.578 11.968 353 HD1 TYR 55 HD1 TYR 55 35.359 4.978 9.155 354 HD2 TYR 55 HD2 TYR 55 35.515 1.451 11.601 355 HE1 TYR 55 HE1 TYR 55 34.315 3.664 7.328 356 HE2 TYR 55 HE2 TYR 55 34.471 0.137 9.774 357 HH TYR 55 HH TYR 55 33.132 0.462 7.813 358 H GLN 56 HN GLN 56 36.303 2.033 13.160 359 HA GLN 56 HA GLN 56 36.194 2.016 16.038 360 HB2 GLN 56 HB2 GLN 56 37.786 0.087 15.831 361 HB3 GLN 56 HB1 GLN 56 36.353 -0.087 14.817 362 HG2 GLN 56 HG2 GLN 56 37.984 1.242 13.104 363 HG3 GLN 56 HG1 GLN 56 39.180 0.337 14.033 364 HE21 GLN 56 HE21 GLN 56 36.854 0.087 11.505 365 HE22 GLN 56 HE22 GLN 56 36.891 -1.602 11.335 366 H GLY 57 HN GLY 57 37.542 4.296 14.565 367 HA2 GLY 57 HA2 GLY 57 39.163 5.801 15.521 368 HA3 GLY 57 HA1 GLY 57 39.890 4.437 16.369 369 HA PRO 58 HA PRO 58 41.826 5.788 12.017 370 HB2 PRO 58 HB2 PRO 58 43.973 6.539 13.963 371 HB3 PRO 58 HB1 PRO 58 43.522 7.310 12.430 372 HG2 PRO 58 HG2 PRO 58 42.821 8.325 14.815 373 HG3 PRO 58 HG1 PRO 58 41.813 8.491 13.368 374 HD2 PRO 58 HD2 PRO 58 41.346 6.849 15.781 375 HD3 PRO 58 HD1 PRO 58 40.188 7.407 14.554 376 HA PRO 59 HA PRO 59 43.758 1.768 12.576 377 HB2 PRO 59 HB2 PRO 59 44.302 1.307 9.950 378 HB3 PRO 59 HB1 PRO 59 42.679 1.147 10.639 379 HG2 PRO 59 HG2 PRO 59 43.826 3.317 8.983 380 HG3 PRO 59 HG1 PRO 59 42.175 2.683 9.034 381 HD2 PRO 59 HD2 PRO 59 43.012 5.040 10.264 382 HD3 PRO 59 HD1 PRO 59 41.543 4.134 10.685 383 HA PRO 60 HA PRO 60 48.009 3.373 12.658 384 HB2 PRO 60 HB2 PRO 60 48.627 0.709 13.762 385 HB3 PRO 60 HB1 PRO 60 48.877 2.309 14.484 386 HG2 PRO 60 HG2 PRO 60 46.998 0.579 15.350 387 HG3 PRO 60 HG1 PRO 60 46.822 2.338 15.454 388 HD2 PRO 60 HD2 PRO 60 45.529 0.425 13.557 389 HD3 PRO 60 HD1 PRO 60 44.906 1.946 14.237 390 HA PRO 61 HA PRO 61 49.427 1.774 8.751 391 HB2 PRO 61 HB2 PRO 61 52.083 1.983 10.129 392 HB3 PRO 61 HB1 PRO 61 51.607 2.534 8.510 393 HG2 PRO 61 HG2 PRO 61 51.830 4.225 10.562 394 HG3 PRO 61 HG1 PRO 61 50.606 4.431 9.298 395 HD2 PRO 61 HD2 PRO 61 50.243 3.614 12.125 396 HD3 PRO 61 HD1 PRO 61 49.066 4.317 10.994 397 H TYR 62 HN TYR 62 49.621 -0.308 8.058 398 HA TYR 62 HA TYR 62 49.478 -2.595 9.521 399 HB2 TYR 62 HB2 TYR 62 50.984 -3.642 7.664 400 HB3 TYR 62 HB1 TYR 62 49.473 -2.875 7.181 401 HD1 TYR 62 HD1 TYR 62 53.020 -1.870 7.907 402 HD2 TYR 62 HD2 TYR 62 49.572 -1.424 5.390 403 HE1 TYR 62 HE1 TYR 62 54.268 -0.280 6.485 404 HE2 TYR 62 HE2 TYR 62 50.818 0.159 3.965 405 HH TYR 62 HH TYR 62 53.321 0.586 3.438 406 HA PRO 63 HA PRO 63 52.971 -3.375 12.077 407 HB2 PRO 63 HB2 PRO 63 53.830 -5.846 11.001 408 HB3 PRO 63 HB1 PRO 63 52.667 -5.618 12.319 409 HG2 PRO 63 HG2 PRO 63 52.186 -6.126 9.436 410 HG3 PRO 63 HG1 PRO 63 51.254 -6.648 10.850 411 HD2 PRO 63 HD2 PRO 63 50.364 -4.664 9.277 412 HD3 PRO 63 HD1 PRO 63 50.140 -4.597 11.040 413 H LYS 64 HN LYS 64 55.014 -2.531 11.953 414 HA LYS 64 HA LYS 64 56.287 -1.541 9.736 415 HB2 LYS 64 HB2 LYS 64 57.305 -2.647 12.314 416 HB3 LYS 64 HB1 LYS 64 58.488 -2.335 11.045 417 HG2 LYS 64 HG2 LYS 64 58.211 -0.069 11.159 418 HG3 LYS 64 HG1 LYS 64 56.484 -0.194 11.491 419 HD2 LYS 64 HD2 LYS 64 58.393 -1.145 13.589 420 HD3 LYS 64 HD1 LYS 64 58.186 0.594 13.379 421 HE2 LYS 64 HE2 LYS 64 55.856 -1.310 13.700 422 HE3 LYS 64 HE1 LYS 64 56.612 -0.482 15.060 423 HZ1 LYS 64 HZ1 LYS 64 55.837 1.531 14.392 424 HZ2 LYS 64 HZ2 LYS 64 54.592 0.557 13.771 425 HZ3 LYS 64 HZ3 LYS 64 55.823 1.123 12.747 426 H HIS 65 HN HIS 65 56.262 -2.724 7.831 427 HA HIS 65 HA HIS 65 57.658 -5.371 7.901 428 HB2 HIS 65 HB2 HIS 65 55.175 -5.343 7.262 429 HB3 HIS 65 HB1 HIS 65 55.671 -4.499 5.796 430 HD1 HIS 65 HD1 HIS 65 54.816 -7.738 6.664 431 HD2 HIS 65 HD2 HIS 65 58.199 -6.182 4.785 432 HE1 HIS 65 HE1 HIS 65 55.886 -9.660 5.406 433 HE2 HIS 65 HE2 HIS 65 57.945 -8.724 4.259 Start of MODEL 3 1 H1 SER 7 HT1 SER 7 29.930 -11.730 -20.220 2 H2 SER 7 HT2 SER 7 31.527 -11.271 -19.866 3 H3 SER 7 HT3 SER 7 31.099 -11.723 -21.447 4 HA SER 7 HA SER 7 31.245 -9.380 -21.455 5 HB2 SER 7 HB2 SER 7 29.351 -10.157 -22.718 6 HB3 SER 7 HB1 SER 7 28.397 -10.394 -21.256 7 HG SER 7 HG SER 7 27.776 -8.451 -22.071 8 H PHE 8 HN PHE 8 31.673 -7.766 -20.035 9 HA PHE 8 HA PHE 8 31.748 -6.677 -17.931 10 HB2 PHE 8 HB2 PHE 8 28.754 -6.737 -17.986 11 HB3 PHE 8 HB1 PHE 8 29.839 -5.387 -17.656 12 HD1 PHE 8 HD1 PHE 8 31.699 -5.886 -20.059 13 HD2 PHE 8 HD2 PHE 8 27.425 -5.653 -19.693 14 HE1 PHE 8 HE1 PHE 8 31.534 -5.172 -22.428 15 HE2 PHE 8 HE2 PHE 8 27.261 -4.939 -22.062 16 HZ PHE 8 HZ PHE 8 29.317 -4.698 -23.430 17 H GLU 9 HN GLU 9 32.448 -8.786 -16.898 18 HA GLU 9 HA GLU 9 30.292 -9.992 -15.226 19 HB2 GLU 9 HB2 GLU 9 32.651 -11.433 -14.806 20 HB3 GLU 9 HB1 GLU 9 31.315 -11.905 -15.858 21 HG2 GLU 9 HG2 GLU 9 32.345 -10.882 -17.769 22 HG3 GLU 9 HG1 GLU 9 33.561 -10.090 -16.765 23 H ILE 10 HN ILE 10 30.249 -9.529 -13.074 24 HA ILE 10 HA ILE 10 32.626 -8.153 -11.920 25 HB ILE 10 HB ILE 10 29.933 -7.989 -10.634 26 HG12 ILE 10 HG12 ILE 10 30.751 -6.686 -13.231 27 HG13 ILE 10 HG11 ILE 10 29.233 -7.495 -12.839 28 HG21 ILE 10 HG21 ILE 10 32.105 -6.972 -9.746 29 HG22 ILE 10 HG22 ILE 10 30.743 -5.863 -9.904 30 HG23 ILE 10 HG23 ILE 10 32.028 -5.859 -11.112 31 HD11 ILE 10 HD11 ILE 10 29.240 -5.530 -10.958 32 HD12 ILE 10 HD12 ILE 10 28.476 -5.362 -12.538 33 HD13 ILE 10 HD13 ILE 10 30.096 -4.719 -12.271 34 HA PRO 11 HA PRO 11 32.262 -12.145 -9.655 35 HB2 PRO 11 HB2 PRO 11 34.923 -12.702 -9.614 36 HB3 PRO 11 HB1 PRO 11 33.885 -13.085 -11.001 37 HG2 PRO 11 HG2 PRO 11 35.818 -10.864 -10.641 38 HG3 PRO 11 HG1 PRO 11 35.409 -11.784 -12.096 39 HD2 PRO 11 HD2 PRO 11 34.443 -9.241 -11.510 40 HD3 PRO 11 HD1 PRO 11 33.684 -10.377 -12.645 41 H ASP 12 HN ASP 12 32.104 -12.021 -7.455 42 HA ASP 12 HA ASP 12 33.176 -9.867 -5.939 43 HB2 ASP 12 HB2 ASP 12 31.246 -11.613 -5.404 44 HB3 ASP 12 HB1 ASP 12 32.562 -12.466 -4.596 45 H ASP 13 HN ASP 13 34.827 -12.151 -7.407 46 HA ASP 13 HA ASP 13 36.852 -12.498 -5.261 47 HB2 ASP 13 HB2 ASP 13 36.001 -14.108 -7.583 48 HB3 ASP 13 HB1 ASP 13 37.747 -14.026 -7.349 49 H VAL 14 HN VAL 14 36.570 -9.965 -6.580 50 HA VAL 14 HA VAL 14 38.769 -9.830 -8.532 51 HB VAL 14 HB VAL 14 36.823 -8.462 -9.001 52 HG11 VAL 14 HG11 VAL 14 35.669 -7.333 -7.411 53 HG12 VAL 14 HG12 VAL 14 37.136 -6.631 -6.727 54 HG13 VAL 14 HG13 VAL 14 36.628 -8.251 -6.250 55 HG21 VAL 14 HG21 VAL 14 38.052 -6.670 -9.673 56 HG22 VAL 14 HG22 VAL 14 39.411 -7.530 -8.950 57 HG23 VAL 14 HG23 VAL 14 38.562 -6.290 -8.028 58 HA PRO 15 HA PRO 15 41.674 -9.421 -5.091 59 HB2 PRO 15 HB2 PRO 15 43.306 -8.387 -7.372 60 HB3 PRO 15 HB1 PRO 15 43.725 -9.594 -6.140 61 HG2 PRO 15 HG2 PRO 15 43.082 -10.284 -8.642 62 HG3 PRO 15 HG1 PRO 15 42.664 -11.290 -7.246 63 HD2 PRO 15 HD2 PRO 15 40.890 -9.627 -8.952 64 HD3 PRO 15 HD1 PRO 15 40.499 -11.055 -7.970 65 H LEU 16 HN LEU 16 42.831 -7.609 -4.083 66 HA LEU 16 HA LEU 16 41.410 -5.124 -4.175 67 HB2 LEU 16 HB2 LEU 16 44.204 -5.677 -3.136 68 HB3 LEU 16 HB1 LEU 16 43.195 -4.305 -2.709 69 HG LEU 16 HG LEU 16 43.375 -6.638 -1.292 70 HD11 LEU 16 HD11 LEU 16 42.543 -4.641 -0.320 71 HD12 LEU 16 HD12 LEU 16 41.209 -5.791 -0.223 72 HD13 LEU 16 HD13 LEU 16 41.209 -4.543 -1.469 73 HD21 LEU 16 HD21 LEU 16 40.904 -6.779 -3.048 74 HD22 LEU 16 HD22 LEU 16 41.045 -7.631 -1.517 75 HD23 LEU 16 HD23 LEU 16 42.145 -8.014 -2.835 76 HA PRO 17 HA PRO 17 43.448 -2.767 -7.335 77 HB2 PRO 17 HB2 PRO 17 44.447 -0.730 -5.462 78 HB3 PRO 17 HB1 PRO 17 43.289 -0.568 -6.789 79 HG2 PRO 17 HG2 PRO 17 42.552 -0.462 -4.207 80 HG3 PRO 17 HG1 PRO 17 41.502 -1.102 -5.482 81 HD2 PRO 17 HD2 PRO 17 43.077 -2.578 -3.416 82 HD3 PRO 17 HD1 PRO 17 41.496 -2.978 -4.125 83 H ALA 18 HN ALA 18 45.766 -1.014 -6.741 84 HA ALA 18 HA ALA 18 47.789 -3.130 -7.009 85 HB1 ALA 18 HB1 ALA 18 48.828 -1.653 -8.347 86 HB2 ALA 18 HB2 ALA 18 48.718 -0.372 -7.139 87 HB3 ALA 18 HB3 ALA 18 47.361 -0.684 -8.221 88 H GLY 19 HN GLY 19 49.335 -3.582 -5.518 89 HA2 GLY 19 HA2 GLY 19 50.614 -3.461 -3.560 90 HA3 GLY 19 HA1 GLY 19 50.293 -1.729 -3.550 91 H TRP 20 HN TRP 20 47.598 -3.952 -3.542 92 HA TRP 20 HA TRP 20 47.030 -3.070 -0.758 93 HB2 TRP 20 HB2 TRP 20 45.259 -3.997 -2.995 94 HB3 TRP 20 HB1 TRP 20 44.679 -3.770 -1.341 95 HD1 TRP 20 HD1 TRP 20 45.741 -1.911 -4.415 96 HE1 TRP 20 HE1 TRP 20 45.401 0.606 -4.057 97 HE3 TRP 20 HE3 TRP 20 44.739 -1.930 0.551 98 HZ2 TRP 20 HZ2 TRP 20 44.780 2.406 -1.874 99 HZ3 TRP 20 HZ3 TRP 20 44.295 0.160 1.767 100 HH2 TRP 20 HH2 TRP 20 44.307 2.342 0.568 101 H GLU 21 HN GLU 21 46.137 -4.556 0.775 102 HA GLU 21 HA GLU 21 46.044 -7.407 0.158 103 HB2 GLU 21 HB2 GLU 21 48.564 -6.623 0.557 104 HB3 GLU 21 HB1 GLU 21 48.080 -6.752 2.248 105 HG2 GLU 21 HG2 GLU 21 48.800 -8.923 1.845 106 HG3 GLU 21 HG1 GLU 21 47.086 -9.073 1.457 107 H MET 22 HN MET 22 44.253 -7.958 1.349 108 HA MET 22 HA MET 22 43.328 -6.411 3.565 109 HB2 MET 22 HB2 MET 22 41.540 -7.595 2.810 110 HB3 MET 22 HB1 MET 22 42.552 -8.904 2.196 111 HG2 MET 22 HG2 MET 22 42.793 -9.844 4.398 112 HG3 MET 22 HG1 MET 22 42.000 -8.451 5.133 113 HE1 MET 22 HE1 MET 22 39.641 -9.043 6.138 114 HE2 MET 22 HE2 MET 22 40.838 -10.317 6.355 115 HE3 MET 22 HE3 MET 22 39.187 -10.737 5.904 116 H ALA 23 HN ALA 23 43.638 -6.716 5.771 117 HA ALA 23 HA ALA 23 45.132 -9.086 6.699 118 HB1 ALA 23 HB1 ALA 23 46.936 -7.603 6.047 119 HB2 ALA 23 HB2 ALA 23 46.843 -7.622 7.808 120 HB3 ALA 23 HB3 ALA 23 46.187 -6.260 6.903 121 H LYS 24 HN LYS 24 45.447 -8.815 9.218 122 HA LYS 24 HA LYS 24 43.060 -7.369 10.257 123 HB2 LYS 24 HB2 LYS 24 42.993 -9.949 10.250 124 HB3 LYS 24 HB1 LYS 24 44.177 -9.840 11.556 125 HG2 LYS 24 HG2 LYS 24 42.606 -8.273 12.747 126 HG3 LYS 24 HG1 LYS 24 41.405 -8.624 11.506 127 HD2 LYS 24 HD2 LYS 24 42.629 -10.551 13.489 128 HD3 LYS 24 HD1 LYS 24 40.929 -10.124 13.307 129 HE2 LYS 24 HE2 LYS 24 41.051 -12.196 12.215 130 HE3 LYS 24 HE1 LYS 24 41.206 -11.050 10.883 131 HZ1 LYS 24 HZ1 LYS 24 42.947 -13.045 11.448 132 HZ2 LYS 24 HZ2 LYS 24 43.709 -11.690 12.134 133 HZ3 LYS 24 HZ3 LYS 24 43.288 -11.688 10.488 134 H THR 25 HN THR 25 43.231 -6.581 12.433 135 HA THR 25 HA THR 25 45.772 -5.339 12.999 136 HB THR 25 HB THR 25 43.534 -4.400 13.603 137 HG1 THR 25 HG1 THR 25 45.412 -4.891 15.666 138 HG21 THR 25 HG21 THR 25 42.835 -6.793 14.374 139 HG22 THR 25 HG22 THR 25 42.174 -5.379 15.197 140 HG23 THR 25 HG23 THR 25 43.504 -6.281 15.923 141 H SER 26 HN SER 26 46.552 -5.602 15.468 142 HA SER 26 HA SER 26 48.081 -7.702 15.953 143 HB2 SER 26 HB2 SER 26 48.012 -7.083 18.127 144 HB3 SER 26 HB1 SER 26 46.740 -5.955 17.669 145 HG SER 26 HG SER 26 46.517 -7.950 19.304 146 H SER 27 HN SER 27 44.545 -7.941 16.033 147 HA SER 27 HA SER 27 44.188 -10.427 14.994 148 HB2 SER 27 HB2 SER 27 45.325 -10.638 17.743 149 HB3 SER 27 HB1 SER 27 44.060 -11.777 17.294 150 HG SER 27 HG SER 27 46.378 -12.296 16.795 151 H GLY 28 HN GLY 28 42.216 -9.079 14.702 152 HA2 GLY 28 HA2 GLY 28 39.998 -9.971 16.131 153 HA3 GLY 28 HA1 GLY 28 40.520 -8.524 16.989 154 H GLN 29 HN GLN 29 41.377 -6.981 14.737 155 HA GLN 29 HA GLN 29 38.725 -6.512 13.470 156 HB2 GLN 29 HB2 GLN 29 40.965 -4.498 13.672 157 HB3 GLN 29 HB1 GLN 29 39.261 -4.198 13.336 158 HG2 GLN 29 HG2 GLN 29 38.616 -4.635 15.561 159 HG3 GLN 29 HG1 GLN 29 40.120 -5.482 15.926 160 HE21 GLN 29 HE21 GLN 29 39.091 -2.198 14.809 161 HE22 GLN 29 HE22 GLN 29 40.224 -1.366 15.761 162 H ARG 30 HN ARG 30 38.579 -6.860 11.319 163 HA ARG 30 HA ARG 30 41.004 -7.476 9.784 164 HB2 ARG 30 HB2 ARG 30 38.088 -7.832 9.452 165 HB3 ARG 30 HB1 ARG 30 38.970 -7.497 7.960 166 HG2 ARG 30 HG2 ARG 30 40.421 -9.377 8.293 167 HG3 ARG 30 HG1 ARG 30 39.841 -9.612 9.942 168 HD2 ARG 30 HD2 ARG 30 38.032 -9.812 7.524 169 HD3 ARG 30 HD1 ARG 30 38.867 -11.204 8.214 170 HE ARG 30 HE ARG 30 37.473 -11.028 10.170 171 HH11 ARG 30 HH11 ARG 30 35.499 -10.375 11.052 172 HH12 ARG 30 HH12 ARG 30 34.613 -9.090 10.303 173 HH21 ARG 30 HH21 ARG 30 36.947 -8.586 7.790 174 HH22 ARG 30 HH22 ARG 30 35.432 -8.078 8.457 175 H TYR 31 HN TYR 31 41.875 -6.137 8.170 176 HA TYR 31 HA TYR 31 40.375 -3.739 7.396 177 HB2 TYR 31 HB2 TYR 31 42.447 -2.293 7.900 178 HB3 TYR 31 HB1 TYR 31 41.405 -2.727 9.247 179 HD1 TYR 31 HD1 TYR 31 43.780 -5.088 7.621 180 HD2 TYR 31 HD2 TYR 31 43.046 -2.522 10.988 181 HE1 TYR 31 HE1 TYR 31 45.743 -6.041 8.787 182 HE2 TYR 31 HE2 TYR 31 45.014 -3.483 12.142 183 HH TYR 31 HH TYR 31 47.158 -5.777 10.509 184 H PHE 32 HN PHE 32 42.204 -2.371 5.964 185 HA PHE 32 HA PHE 32 43.243 -4.442 4.080 186 HB2 PHE 32 HB2 PHE 32 42.223 -1.665 3.428 187 HB3 PHE 32 HB1 PHE 32 42.763 -2.876 2.264 188 HD1 PHE 32 HD1 PHE 32 41.175 -4.277 1.299 189 HD2 PHE 32 HD2 PHE 32 40.357 -2.511 5.126 190 HE1 PHE 32 HE1 PHE 32 38.910 -5.285 1.277 191 HE2 PHE 32 HE2 PHE 32 38.091 -3.517 5.105 192 HZ PHE 32 HZ PHE 32 37.367 -4.904 3.181 193 H LEU 33 HN LEU 33 45.381 -4.370 3.639 194 HA LEU 33 HA LEU 33 46.962 -2.135 4.777 195 HB2 LEU 33 HB2 LEU 33 48.028 -4.584 3.359 196 HB3 LEU 33 HB1 LEU 33 48.874 -3.540 4.502 197 HG LEU 33 HG LEU 33 46.627 -5.480 5.080 198 HD11 LEU 33 HD11 LEU 33 49.532 -5.206 5.823 199 HD12 LEU 33 HD12 LEU 33 48.679 -6.619 5.201 200 HD13 LEU 33 HD13 LEU 33 48.431 -6.102 6.869 201 HD21 LEU 33 HD21 LEU 33 45.941 -3.843 6.532 202 HD22 LEU 33 HD22 LEU 33 47.507 -3.035 6.515 203 HD23 LEU 33 HD23 LEU 33 47.269 -4.470 7.509 204 H ASN 34 HN ASN 34 47.721 -0.504 3.514 205 HA ASN 34 HA ASN 34 47.518 -0.859 0.558 206 HB2 ASN 34 HB2 ASN 34 46.404 1.105 1.893 207 HB3 ASN 34 HB1 ASN 34 48.035 1.775 1.904 208 HD21 ASN 34 HD21 ASN 34 48.037 -0.002 -0.851 209 HD22 ASN 34 HD22 ASN 34 47.489 1.159 -1.961 210 H HIS 35 HN HIS 35 49.437 -1.496 -0.300 211 HA HIS 35 HA HIS 35 51.978 -0.910 1.000 212 HB2 HIS 35 HB2 HIS 35 51.287 -2.113 -1.698 213 HB3 HIS 35 HB1 HIS 35 52.938 -1.933 -1.105 214 HD1 HIS 35 HD1 HIS 35 52.817 -4.678 -1.289 215 HD2 HIS 35 HD2 HIS 35 50.613 -2.899 1.773 216 HE1 HIS 35 HE1 HIS 35 52.298 -6.513 0.381 217 HE2 HIS 35 HE2 HIS 35 50.957 -5.441 2.248 218 H ILE 36 HN ILE 36 49.877 0.732 -1.081 219 HA ILE 36 HA ILE 36 51.935 2.352 -2.409 220 HB ILE 36 HB ILE 36 49.039 3.116 -2.298 221 HG12 ILE 36 HG12 ILE 36 49.654 0.508 -2.784 222 HG13 ILE 36 HG11 ILE 36 48.284 1.337 -3.504 223 HG21 ILE 36 HG21 ILE 36 51.284 3.241 -4.316 224 HG22 ILE 36 HG22 ILE 36 50.398 4.579 -3.584 225 HG23 ILE 36 HG23 ILE 36 49.606 3.541 -4.771 226 HD11 ILE 36 HD11 ILE 36 51.011 1.380 -4.798 227 HD12 ILE 36 HD12 ILE 36 49.448 1.739 -5.532 228 HD13 ILE 36 HD13 ILE 36 49.862 0.079 -5.107 229 H ASP 37 HN ASP 37 49.268 2.941 -0.136 230 HA ASP 37 HA ASP 37 50.466 5.489 0.672 231 HB2 ASP 37 HB2 ASP 37 48.091 4.073 1.906 232 HB3 ASP 37 HB1 ASP 37 48.509 5.778 2.071 233 H GLN 38 HN GLN 38 51.195 2.460 1.250 234 HA GLN 38 HA GLN 38 52.180 1.253 3.014 235 HB2 GLN 38 HB2 GLN 38 53.369 3.987 2.961 236 HB3 GLN 38 HB1 GLN 38 53.799 2.927 4.306 237 HG2 GLN 38 HG2 GLN 38 54.577 1.212 2.794 238 HG3 GLN 38 HG1 GLN 38 53.970 2.102 1.398 239 HE21 GLN 38 HE21 GLN 38 55.160 4.388 3.538 240 HE22 GLN 38 HE22 GLN 38 56.731 4.547 2.915 241 H THR 39 HN THR 39 49.764 1.467 3.903 242 HA THR 39 HA THR 39 50.000 1.852 6.740 243 HB THR 39 HB THR 39 49.626 4.097 6.561 244 HG1 THR 39 HG1 THR 39 46.996 3.121 6.295 245 HG21 THR 39 HG21 THR 39 47.555 4.332 4.563 246 HG22 THR 39 HG22 THR 39 48.959 3.498 3.904 247 HG23 THR 39 HG23 THR 39 49.139 5.103 4.608 248 H THR 40 HN THR 40 47.476 2.018 7.521 249 HA THR 40 HA THR 40 46.137 -0.237 6.092 250 HB THR 40 HB THR 40 45.057 -0.690 8.351 251 HG1 THR 40 HG1 THR 40 47.080 1.123 9.165 252 HG21 THR 40 HG21 THR 40 47.779 -1.182 7.475 253 HG22 THR 40 HG22 THR 40 46.650 -2.271 8.286 254 HG23 THR 40 HG23 THR 40 47.661 -1.181 9.235 255 H THR 41 HN THR 41 43.760 -0.151 6.094 256 HA THR 41 HA THR 41 42.584 2.488 6.728 257 HB THR 41 HB THR 41 42.777 2.992 4.530 258 HG1 THR 41 HG1 THR 41 40.621 1.185 4.638 259 HG21 THR 41 HG21 THR 41 43.244 0.080 4.272 260 HG22 THR 41 HG22 THR 41 44.132 1.427 3.559 261 HG23 THR 41 HG23 THR 41 42.612 0.894 2.842 262 H TRP 42 HN TRP 42 40.370 2.432 7.111 263 HA TRP 42 HA TRP 42 39.289 -0.242 7.730 264 HB2 TRP 42 HB2 TRP 42 38.054 2.502 8.139 265 HB3 TRP 42 HB1 TRP 42 37.460 0.984 8.810 266 HD1 TRP 42 HD1 TRP 42 39.443 3.848 9.756 267 HE1 TRP 42 HE1 TRP 42 40.950 3.337 11.788 268 HE3 TRP 42 HE3 TRP 42 39.166 -1.249 9.794 269 HZ2 TRP 42 HZ2 TRP 42 41.909 1.060 13.234 270 HZ3 TRP 42 HZ3 TRP 42 40.384 -2.564 11.506 271 HH2 TRP 42 HH2 TRP 42 41.755 -1.416 13.223 272 H GLN 43 HN GLN 43 39.442 1.845 5.145 273 HA GLN 43 HA GLN 43 36.732 1.314 4.115 274 HB2 GLN 43 HB2 GLN 43 38.058 3.489 3.763 275 HB3 GLN 43 HB1 GLN 43 39.015 2.576 2.595 276 HG2 GLN 43 HG2 GLN 43 37.411 2.826 1.040 277 HG3 GLN 43 HG1 GLN 43 36.230 2.066 2.109 278 HE21 GLN 43 HE21 GLN 43 36.040 4.555 0.304 279 HE22 GLN 43 HE22 GLN 43 35.463 5.770 1.338 280 H ASP 44 HN ASP 44 36.416 0.200 2.039 281 HA ASP 44 HA ASP 44 38.594 -1.732 1.425 282 HB2 ASP 44 HB2 ASP 44 35.688 -2.427 1.100 283 HB3 ASP 44 HB1 ASP 44 37.069 -3.509 1.288 284 HA PRO 45 HA PRO 45 38.143 0.441 -2.515 285 HB2 PRO 45 HB2 PRO 45 39.603 -1.732 -3.750 286 HB3 PRO 45 HB1 PRO 45 40.137 -0.070 -3.459 287 HG2 PRO 45 HG2 PRO 45 40.828 -2.466 -2.034 288 HG3 PRO 45 HG1 PRO 45 41.483 -0.836 -1.855 289 HD2 PRO 45 HD2 PRO 45 39.869 -2.166 0.007 290 HD3 PRO 45 HD1 PRO 45 40.211 -0.424 -0.008 291 H ARG 46 HN ARG 46 37.074 -2.646 -1.556 292 HA ARG 46 HA ARG 46 35.815 -3.325 -4.116 293 HB2 ARG 46 HB2 ARG 46 35.976 -4.590 -1.397 294 HB3 ARG 46 HB1 ARG 46 34.737 -5.127 -2.532 295 HG2 ARG 46 HG2 ARG 46 36.671 -6.539 -2.847 296 HG3 ARG 46 HG1 ARG 46 36.565 -5.461 -4.240 297 HD2 ARG 46 HD2 ARG 46 38.224 -4.743 -1.824 298 HD3 ARG 46 HD1 ARG 46 38.881 -5.730 -3.131 299 HE ARG 46 HE ARG 46 38.475 -2.882 -3.235 300 HH11 ARG 46 HH11 ARG 46 38.789 -1.866 -5.231 301 HH12 ARG 46 HH12 ARG 46 38.786 -2.814 -6.680 302 HH21 ARG 46 HH21 ARG 46 38.230 -5.814 -5.031 303 HH22 ARG 46 HH22 ARG 46 38.469 -5.049 -6.567 304 H LYS 47 HN LYS 47 35.123 -0.833 -2.608 305 HA LYS 47 HA LYS 47 32.195 -1.340 -2.395 306 HB2 LYS 47 HB2 LYS 47 32.025 0.179 -0.562 307 HB3 LYS 47 HB1 LYS 47 33.398 -0.862 -0.185 308 HG2 LYS 47 HG2 LYS 47 34.469 1.126 0.157 309 HG3 LYS 47 HG1 LYS 47 34.650 1.091 -1.597 310 HD2 LYS 47 HD2 LYS 47 33.691 3.183 -1.344 311 HD3 LYS 47 HD1 LYS 47 32.235 2.202 -1.521 312 HE2 LYS 47 HE2 LYS 47 33.472 3.231 1.041 313 HE3 LYS 47 HE1 LYS 47 31.869 3.588 0.396 314 HZ1 LYS 47 HZ1 LYS 47 31.357 1.191 0.631 315 HZ2 LYS 47 HZ2 LYS 47 31.650 1.970 2.112 316 HZ3 LYS 47 HZ3 LYS 47 32.843 0.978 1.421 317 H ALA 48 HN ALA 48 30.861 0.551 -2.977 318 HA ALA 48 HA ALA 48 32.307 2.400 -4.835 319 HB1 ALA 48 HB1 ALA 48 30.319 2.406 -6.249 320 HB2 ALA 48 HB2 ALA 48 29.459 1.387 -5.094 321 HB3 ALA 48 HB3 ALA 48 30.834 0.739 -5.989 322 H MET 49 HN MET 49 32.424 3.659 -2.695 323 HA MET 49 HA MET 49 31.557 5.280 -1.207 324 HB2 MET 49 HB2 MET 49 30.475 6.013 -3.931 325 HB3 MET 49 HB1 MET 49 30.215 7.040 -2.522 326 HG2 MET 49 HG2 MET 49 32.986 6.081 -3.191 327 HG3 MET 49 HG1 MET 49 32.306 7.474 -4.034 328 HE1 MET 49 HE1 MET 49 34.746 8.540 -2.704 329 HE2 MET 49 HE2 MET 49 34.779 6.893 -2.081 330 HE3 MET 49 HE3 MET 49 34.910 8.251 -0.967 331 H GLY 50 HN GLY 50 30.184 4.186 0.221 332 HA2 GLY 50 HA2 GLY 50 27.307 4.060 -0.595 333 HA3 GLY 50 HA1 GLY 50 28.047 2.897 0.506 334 H GLY 51 HN GLY 51 29.521 4.605 2.151 335 HA2 GLY 51 HA2 GLY 51 28.551 6.930 3.173 336 HA3 GLY 51 HA1 GLY 51 27.350 5.776 3.752 337 H GLY 52 HN GLY 52 27.774 5.044 5.768 338 HA2 GLY 52 HA2 GLY 52 29.457 3.638 7.059 339 HA3 GLY 52 HA1 GLY 52 30.639 4.871 6.615 340 H GLY 53 HN GLY 53 30.633 4.668 9.187 341 HA2 GLY 53 HA2 GLY 53 29.535 7.145 10.173 342 HA3 GLY 53 HA1 GLY 53 28.609 5.773 10.784 343 H ASN 54 HN ASN 54 31.477 7.609 11.160 344 HA ASN 54 HA ASN 54 33.301 7.396 12.626 345 HB2 ASN 54 HB2 ASN 54 31.168 5.862 14.143 346 HB3 ASN 54 HB1 ASN 54 32.712 6.365 14.834 347 HD21 ASN 54 HD21 ASN 54 32.119 8.800 12.739 348 HD22 ASN 54 HD22 ASN 54 31.225 9.850 13.728 349 H TYR 55 HN TYR 55 34.572 5.583 13.946 350 HA TYR 55 HA TYR 55 34.309 2.880 12.870 351 HB2 TYR 55 HB2 TYR 55 36.202 4.833 11.699 352 HB3 TYR 55 HB1 TYR 55 36.900 3.265 12.108 353 HD1 TYR 55 HD1 TYR 55 36.163 1.223 11.002 354 HD2 TYR 55 HD2 TYR 55 34.403 5.021 10.040 355 HE1 TYR 55 HE1 TYR 55 35.122 0.229 8.982 356 HE2 TYR 55 HE2 TYR 55 33.362 4.027 8.020 357 HH TYR 55 HH TYR 55 34.301 1.224 6.661 358 H GLN 56 HN GLN 56 36.574 1.698 13.529 359 HA GLN 56 HA GLN 56 36.694 1.919 16.398 360 HB2 GLN 56 HB2 GLN 56 38.680 0.323 16.106 361 HB3 GLN 56 HB1 GLN 56 37.133 -0.241 15.474 362 HG2 GLN 56 HG2 GLN 56 38.564 1.334 13.493 363 HG3 GLN 56 HG1 GLN 56 39.532 -0.031 14.047 364 HE21 GLN 56 HE21 GLN 56 36.160 0.679 12.969 365 HE22 GLN 56 HE22 GLN 56 35.946 -0.808 12.179 366 H GLY 57 HN GLY 57 37.514 4.250 14.645 367 HA2 GLY 57 HA2 GLY 57 38.933 6.080 15.262 368 HA3 GLY 57 HA1 GLY 57 39.893 4.972 16.241 369 HA PRO 58 HA PRO 58 41.824 6.124 11.961 370 HB2 PRO 58 HB2 PRO 58 44.044 6.705 13.873 371 HB3 PRO 58 HB1 PRO 58 43.556 7.581 12.410 372 HG2 PRO 58 HG2 PRO 58 42.995 8.493 14.859 373 HG3 PRO 58 HG1 PRO 58 41.902 8.736 13.487 374 HD2 PRO 58 HD2 PRO 58 41.608 6.915 15.821 375 HD3 PRO 58 HD1 PRO 58 40.356 7.656 14.799 376 HA PRO 59 HA PRO 59 43.582 2.012 12.248 377 HB2 PRO 59 HB2 PRO 59 44.296 1.775 9.628 378 HB3 PRO 59 HB1 PRO 59 42.622 1.619 10.192 379 HG2 PRO 59 HG2 PRO 59 43.965 3.908 8.862 380 HG3 PRO 59 HG1 PRO 59 42.304 3.318 8.699 381 HD2 PRO 59 HD2 PRO 59 43.028 5.514 10.221 382 HD3 PRO 59 HD1 PRO 59 41.554 4.556 10.481 383 HA PRO 60 HA PRO 60 47.890 3.269 12.634 384 HB2 PRO 60 HB2 PRO 60 48.759 1.008 13.882 385 HB3 PRO 60 HB1 PRO 60 47.841 2.276 14.719 386 HG2 PRO 60 HG2 PRO 60 46.934 -0.361 13.701 387 HG3 PRO 60 HG1 PRO 60 46.444 0.522 15.156 388 HD2 PRO 60 HD2 PRO 60 44.964 0.427 12.812 389 HD3 PRO 60 HD1 PRO 60 44.817 1.700 14.043 390 HA PRO 61 HA PRO 61 49.632 1.663 8.869 391 HB2 PRO 61 HB2 PRO 61 52.129 1.678 10.529 392 HB3 PRO 61 HB1 PRO 61 51.866 2.293 8.884 393 HG2 PRO 61 HG2 PRO 61 51.960 3.921 10.995 394 HG3 PRO 61 HG1 PRO 61 50.895 4.229 9.613 395 HD2 PRO 61 HD2 PRO 61 50.180 3.373 12.359 396 HD3 PRO 61 HD1 PRO 61 49.176 4.171 11.130 397 H TYR 62 HN TYR 62 49.714 -0.411 8.156 398 HA TYR 62 HA TYR 62 49.324 -2.718 9.542 399 HB2 TYR 62 HB2 TYR 62 50.936 -3.791 7.761 400 HB3 TYR 62 HB1 TYR 62 49.461 -2.994 7.220 401 HD1 TYR 62 HD1 TYR 62 49.689 -1.556 5.427 402 HD2 TYR 62 HD2 TYR 62 52.957 -2.006 8.174 403 HE1 TYR 62 HE1 TYR 62 51.029 0.032 4.097 404 HE2 TYR 62 HE2 TYR 62 54.300 -0.413 6.846 405 HH TYR 62 HH TYR 62 53.989 1.363 5.249 406 HA PRO 63 HA PRO 63 52.568 -3.837 12.293 407 HB2 PRO 63 HB2 PRO 63 53.406 -6.273 11.111 408 HB3 PRO 63 HB1 PRO 63 52.170 -6.076 12.366 409 HG2 PRO 63 HG2 PRO 63 51.857 -6.380 9.432 410 HG3 PRO 63 HG1 PRO 63 50.811 -6.941 10.748 411 HD2 PRO 63 HD2 PRO 63 50.111 -4.826 9.254 412 HD3 PRO 63 HD1 PRO 63 49.786 -4.849 11.003 413 H LYS 64 HN LYS 64 54.971 -4.346 12.371 414 HA LYS 64 HA LYS 64 56.395 -2.723 10.456 415 HB2 LYS 64 HB2 LYS 64 58.369 -3.298 11.696 416 HB3 LYS 64 HB1 LYS 64 57.066 -3.146 12.874 417 HG2 LYS 64 HG2 LYS 64 56.736 -5.606 12.802 418 HG3 LYS 64 HG1 LYS 64 58.088 -5.737 11.677 419 HD2 LYS 64 HD2 LYS 64 58.278 -4.550 14.460 420 HD3 LYS 64 HD1 LYS 64 58.764 -6.192 14.034 421 HE2 LYS 64 HE2 LYS 64 60.007 -3.581 13.201 422 HE3 LYS 64 HE1 LYS 64 60.785 -5.012 13.876 423 HZ1 LYS 64 HZ1 LYS 64 61.284 -4.957 11.578 424 HZ2 LYS 64 HZ2 LYS 64 59.663 -4.681 11.152 425 HZ3 LYS 64 HZ3 LYS 64 60.132 -6.184 11.790 426 H HIS 65 HN HIS 65 57.823 -3.399 8.798 427 HA HIS 65 HA HIS 65 57.633 -6.293 8.066 428 HB2 HIS 65 HB2 HIS 65 56.234 -4.898 6.571 429 HB3 HIS 65 HB1 HIS 65 57.647 -3.917 6.179 430 HD1 HIS 65 HD1 HIS 65 55.806 -6.718 4.931 431 HD2 HIS 65 HD2 HIS 65 59.863 -5.765 5.122 432 HE1 HIS 65 HE1 HIS 65 56.971 -8.197 3.234 433 HE2 HIS 65 HE2 HIS 65 59.440 -7.625 3.342 Start of MODEL 4 1 H1 SER 7 HT1 SER 7 29.826 -8.197 0.784 2 H2 SER 7 HT2 SER 7 28.773 -6.965 1.294 3 H3 SER 7 HT3 SER 7 28.237 -8.145 0.194 4 HA SER 7 HA SER 7 29.011 -8.626 3.021 5 HB2 SER 7 HB2 SER 7 26.293 -8.860 1.707 6 HB3 SER 7 HB1 SER 7 26.666 -8.980 3.424 7 HG SER 7 HG SER 7 26.664 -6.881 3.541 8 H PHE 8 HN PHE 8 27.351 -10.867 3.276 9 HA PHE 8 HA PHE 8 27.527 -13.195 2.983 10 HB2 PHE 8 HB2 PHE 8 27.455 -12.161 0.139 11 HB3 PHE 8 HB1 PHE 8 27.416 -13.882 0.526 12 HD1 PHE 8 HD1 PHE 8 25.541 -14.819 1.885 13 HD2 PHE 8 HD2 PHE 8 25.541 -10.756 0.492 14 HE1 PHE 8 HE1 PHE 8 23.107 -14.665 2.335 15 HE2 PHE 8 HE2 PHE 8 23.107 -10.601 0.943 16 HZ PHE 8 HZ PHE 8 21.890 -12.556 1.865 17 H GLU 9 HN GLU 9 28.964 -14.951 1.924 18 HA GLU 9 HA GLU 9 31.654 -14.565 2.599 19 HB2 GLU 9 HB2 GLU 9 30.666 -16.402 0.399 20 HB3 GLU 9 HB1 GLU 9 32.132 -16.595 1.362 21 HG2 GLU 9 HG2 GLU 9 29.277 -16.714 2.377 22 HG3 GLU 9 HG1 GLU 9 30.407 -18.062 2.257 23 H ILE 10 HN ILE 10 33.041 -13.093 1.751 24 HA ILE 10 HA ILE 10 32.637 -11.872 -0.834 25 HB ILE 10 HB ILE 10 35.289 -11.837 0.578 26 HG12 ILE 10 HG12 ILE 10 32.704 -10.552 1.498 27 HG13 ILE 10 HG11 ILE 10 33.780 -11.596 2.428 28 HG21 ILE 10 HG21 ILE 10 35.279 -9.517 -0.194 29 HG22 ILE 10 HG22 ILE 10 33.619 -9.689 -0.763 30 HG23 ILE 10 HG23 ILE 10 34.917 -10.588 -1.548 31 HD11 ILE 10 HD11 ILE 10 33.951 -8.711 1.937 32 HD12 ILE 10 HD12 ILE 10 35.462 -9.558 1.604 33 HD13 ILE 10 HD13 ILE 10 34.714 -9.683 3.196 34 HA PRO 11 HA PRO 11 34.622 -15.138 -3.147 35 HB2 PRO 11 HB2 PRO 11 34.553 -13.917 -5.585 36 HB3 PRO 11 HB1 PRO 11 33.124 -14.648 -4.829 37 HG2 PRO 11 HG2 PRO 11 33.919 -11.791 -5.007 38 HG3 PRO 11 HG1 PRO 11 32.311 -12.527 -5.107 39 HD2 PRO 11 HD2 PRO 11 33.292 -11.283 -2.846 40 HD3 PRO 11 HD1 PRO 11 32.029 -12.535 -2.824 41 H ASP 12 HN ASP 12 36.739 -15.575 -3.778 42 HA ASP 12 HA ASP 12 38.714 -13.483 -3.343 43 HB2 ASP 12 HB2 ASP 12 40.368 -15.273 -3.864 44 HB3 ASP 12 HB1 ASP 12 39.218 -15.770 -2.622 45 H ASP 13 HN ASP 13 36.765 -14.024 -5.793 46 HA ASP 13 HA ASP 13 38.686 -13.728 -7.999 47 HB2 ASP 13 HB2 ASP 13 36.261 -14.923 -7.909 48 HB3 ASP 13 HB1 ASP 13 35.782 -13.325 -8.482 49 H VAL 14 HN VAL 14 38.490 -11.656 -5.920 50 HA VAL 14 HA VAL 14 38.024 -9.363 -7.734 51 HB VAL 14 HB VAL 14 36.936 -9.440 -4.907 52 HG11 VAL 14 HG11 VAL 14 36.408 -7.504 -7.180 53 HG12 VAL 14 HG12 VAL 14 37.595 -7.216 -5.908 54 HG13 VAL 14 HG13 VAL 14 35.883 -7.347 -5.504 55 HG21 VAL 14 HG21 VAL 14 35.586 -10.961 -6.166 56 HG22 VAL 14 HG22 VAL 14 35.610 -9.917 -7.586 57 HG23 VAL 14 HG23 VAL 14 34.699 -9.436 -6.155 58 HA PRO 15 HA PRO 15 42.050 -9.503 -5.220 59 HB2 PRO 15 HB2 PRO 15 42.879 -8.316 -7.831 60 HB3 PRO 15 HB1 PRO 15 43.707 -9.520 -6.825 61 HG2 PRO 15 HG2 PRO 15 42.419 -10.197 -9.064 62 HG3 PRO 15 HG1 PRO 15 42.468 -11.259 -7.647 63 HD2 PRO 15 HD2 PRO 15 40.203 -9.644 -8.703 64 HD3 PRO 15 HD1 PRO 15 40.173 -11.148 -7.758 65 H LEU 16 HN LEU 16 42.981 -7.688 -4.206 66 HA LEU 16 HA LEU 16 41.476 -5.225 -4.252 67 HB2 LEU 16 HB2 LEU 16 44.256 -5.714 -3.151 68 HB3 LEU 16 HB1 LEU 16 43.167 -4.414 -2.699 69 HG LEU 16 HG LEU 16 43.443 -6.811 -1.383 70 HD11 LEU 16 HD11 LEU 16 42.481 -4.642 -0.587 71 HD12 LEU 16 HD12 LEU 16 41.563 -6.055 -0.067 72 HD13 LEU 16 HD13 LEU 16 40.973 -5.064 -1.399 73 HD21 LEU 16 HD21 LEU 16 41.131 -7.846 -1.660 74 HD22 LEU 16 HD22 LEU 16 42.254 -8.155 -2.978 75 HD23 LEU 16 HD23 LEU 16 40.988 -6.938 -3.161 76 HA PRO 17 HA PRO 17 43.518 -2.812 -7.361 77 HB2 PRO 17 HB2 PRO 17 44.412 -0.779 -5.426 78 HB3 PRO 17 HB1 PRO 17 43.319 -0.618 -6.806 79 HG2 PRO 17 HG2 PRO 17 42.470 -0.561 -4.251 80 HG3 PRO 17 HG1 PRO 17 41.479 -1.157 -5.592 81 HD2 PRO 17 HD2 PRO 17 42.882 -2.690 -3.461 82 HD3 PRO 17 HD1 PRO 17 41.391 -3.088 -4.341 83 H ALA 18 HN ALA 18 45.773 -1.015 -6.674 84 HA ALA 18 HA ALA 18 47.854 -3.081 -6.892 85 HB1 ALA 18 HB1 ALA 18 49.208 -0.815 -7.216 86 HB2 ALA 18 HB2 ALA 18 47.587 -0.188 -7.525 87 HB3 ALA 18 HB3 ALA 18 48.228 -1.501 -8.512 88 H GLY 19 HN GLY 19 49.371 -3.498 -5.360 89 HA2 GLY 19 HA2 GLY 19 50.582 -3.358 -3.359 90 HA3 GLY 19 HA1 GLY 19 50.215 -1.635 -3.353 91 H TRP 20 HN TRP 20 47.582 -3.930 -3.432 92 HA TRP 20 HA TRP 20 46.905 -3.063 -0.668 93 HB2 TRP 20 HB2 TRP 20 45.239 -4.044 -2.962 94 HB3 TRP 20 HB1 TRP 20 44.596 -3.849 -1.326 95 HD1 TRP 20 HD1 TRP 20 45.708 -1.931 -4.349 96 HE1 TRP 20 HE1 TRP 20 45.271 0.570 -3.987 97 HE3 TRP 20 HE3 TRP 20 44.504 -2.029 0.570 98 HZ2 TRP 20 HZ2 TRP 20 44.500 2.330 -1.816 99 HZ3 TRP 20 HZ3 TRP 20 43.937 0.034 1.782 100 HH2 TRP 20 HH2 TRP 20 43.925 2.227 0.603 101 H GLU 21 HN GLU 21 46.065 -4.567 0.865 102 HA GLU 21 HA GLU 21 46.040 -7.419 0.244 103 HB2 GLU 21 HB2 GLU 21 48.532 -6.642 0.614 104 HB3 GLU 21 HB1 GLU 21 48.072 -6.652 2.317 105 HG2 GLU 21 HG2 GLU 21 47.043 -9.034 1.573 106 HG3 GLU 21 HG1 GLU 21 48.377 -8.925 0.425 107 H MET 22 HN MET 22 44.259 -8.019 1.415 108 HA MET 22 HA MET 22 43.249 -6.532 3.626 109 HB2 MET 22 HB2 MET 22 42.346 -8.638 2.045 110 HB3 MET 22 HB1 MET 22 42.493 -9.348 3.654 111 HG2 MET 22 HG2 MET 22 41.207 -7.431 4.579 112 HG3 MET 22 HG1 MET 22 40.989 -6.822 2.939 113 HE1 MET 22 HE1 MET 22 40.078 -9.186 5.656 114 HE2 MET 22 HE2 MET 22 40.865 -10.412 4.666 115 HE3 MET 22 HE3 MET 22 39.125 -10.488 4.931 116 H ALA 23 HN ALA 23 43.639 -6.722 5.807 117 HA ALA 23 HA ALA 23 45.139 -9.059 6.807 118 HB1 ALA 23 HB1 ALA 23 46.962 -7.638 6.179 119 HB2 ALA 23 HB2 ALA 23 46.786 -7.474 7.925 120 HB3 ALA 23 HB3 ALA 23 46.167 -6.218 6.853 121 H LYS 24 HN LYS 24 45.414 -8.731 9.321 122 HA LYS 24 HA LYS 24 43.001 -7.279 10.293 123 HB2 LYS 24 HB2 LYS 24 42.958 -9.865 10.319 124 HB3 LYS 24 HB1 LYS 24 44.099 -9.720 11.660 125 HG2 LYS 24 HG2 LYS 24 42.496 -8.204 12.816 126 HG3 LYS 24 HG1 LYS 24 41.343 -8.469 11.511 127 HD2 LYS 24 HD2 LYS 24 42.535 -10.779 13.046 128 HD3 LYS 24 HD1 LYS 24 41.085 -9.944 13.610 129 HE2 LYS 24 HE2 LYS 24 40.132 -10.342 11.262 130 HE3 LYS 24 HE1 LYS 24 41.471 -11.466 11.027 131 HZ1 LYS 24 HZ1 LYS 24 40.303 -11.992 13.514 132 HZ2 LYS 24 HZ2 LYS 24 40.344 -12.989 12.139 133 HZ3 LYS 24 HZ3 LYS 24 39.055 -11.906 12.368 134 H THR 25 HN THR 25 43.125 -6.442 12.438 135 HA THR 25 HA THR 25 45.659 -5.205 13.065 136 HB THR 25 HB THR 25 43.386 -4.247 13.557 137 HG1 THR 25 HG1 THR 25 44.167 -3.241 15.281 138 HG21 THR 25 HG21 THR 25 42.100 -5.116 15.370 139 HG22 THR 25 HG22 THR 25 43.383 -6.243 15.812 140 HG23 THR 25 HG23 THR 25 42.493 -6.466 14.307 141 H SER 26 HN SER 26 46.335 -5.423 15.573 142 HA SER 26 HA SER 26 47.813 -7.508 16.198 143 HB2 SER 26 HB2 SER 26 47.409 -6.075 18.030 144 HB3 SER 26 HB1 SER 26 45.669 -6.331 17.963 145 HG SER 26 HG SER 26 47.257 -7.539 19.541 146 H SER 27 HN SER 27 44.262 -7.761 16.204 147 HA SER 27 HA SER 27 43.955 -10.223 15.065 148 HB2 SER 27 HB2 SER 27 43.738 -11.522 17.455 149 HB3 SER 27 HB1 SER 27 45.145 -11.618 16.400 150 HG SER 27 HG SER 27 44.793 -9.624 18.387 151 H GLY 28 HN GLY 28 41.995 -8.906 14.715 152 HA2 GLY 28 HA2 GLY 28 39.713 -9.814 15.993 153 HA3 GLY 28 HA1 GLY 28 40.200 -8.422 16.958 154 H GLN 29 HN GLN 29 41.263 -6.895 14.699 155 HA GLN 29 HA GLN 29 38.656 -6.201 13.438 156 HB2 GLN 29 HB2 GLN 29 41.053 -4.379 13.672 157 HB3 GLN 29 HB1 GLN 29 39.386 -3.935 13.310 158 HG2 GLN 29 HG2 GLN 29 38.683 -4.220 15.512 159 HG3 GLN 29 HG1 GLN 29 39.994 -5.337 15.893 160 HE21 GLN 29 HE21 GLN 29 39.276 -2.837 17.358 161 HE22 GLN 29 HE22 GLN 29 40.658 -1.853 17.300 162 H ARG 30 HN ARG 30 38.514 -6.789 11.338 163 HA ARG 30 HA ARG 30 40.919 -7.408 9.788 164 HB2 ARG 30 HB2 ARG 30 39.471 -8.294 8.177 165 HB3 ARG 30 HB1 ARG 30 38.542 -8.530 9.658 166 HG2 ARG 30 HG2 ARG 30 37.601 -6.144 9.142 167 HG3 ARG 30 HG1 ARG 30 38.166 -6.469 7.503 168 HD2 ARG 30 HD2 ARG 30 36.892 -8.682 7.656 169 HD3 ARG 30 HD1 ARG 30 36.137 -8.031 9.111 170 HE ARG 30 HE ARG 30 35.608 -7.164 6.360 171 HH11 ARG 30 HH11 ARG 30 33.952 -5.638 6.157 172 HH12 ARG 30 HH12 ARG 30 33.364 -4.824 7.568 173 HH21 ARG 30 HH21 ARG 30 35.518 -6.465 9.735 174 HH22 ARG 30 HH22 ARG 30 34.250 -5.293 9.594 175 H TYR 31 HN TYR 31 41.795 -6.102 8.154 176 HA TYR 31 HA TYR 31 40.296 -3.726 7.324 177 HB2 TYR 31 HB2 TYR 31 42.365 -2.263 7.808 178 HB3 TYR 31 HB1 TYR 31 41.309 -2.663 9.157 179 HD1 TYR 31 HD1 TYR 31 43.743 -5.011 7.585 180 HD2 TYR 31 HD2 TYR 31 42.887 -2.465 10.939 181 HE1 TYR 31 HE1 TYR 31 45.692 -5.932 8.793 182 HE2 TYR 31 HE2 TYR 31 44.843 -3.399 12.137 183 HH TYR 31 HH TYR 31 47.270 -4.791 10.880 184 H PHE 32 HN PHE 32 42.140 -2.398 5.872 185 HA PHE 32 HA PHE 32 43.280 -4.526 4.118 186 HB2 PHE 32 HB2 PHE 32 42.103 -1.891 3.201 187 HB3 PHE 32 HB1 PHE 32 42.612 -3.244 2.186 188 HD1 PHE 32 HD1 PHE 32 40.336 -2.514 5.083 189 HD2 PHE 32 HD2 PHE 32 41.017 -4.809 1.520 190 HE1 PHE 32 HE1 PHE 32 38.107 -3.569 5.338 191 HE2 PHE 32 HE2 PHE 32 38.788 -5.863 1.771 192 HZ PHE 32 HZ PHE 32 37.331 -5.243 3.679 193 H LEU 33 HN LEU 33 45.406 -4.336 3.745 194 HA LEU 33 HA LEU 33 46.814 -1.948 4.743 195 HB2 LEU 33 HB2 LEU 33 48.091 -4.285 3.326 196 HB3 LEU 33 HB1 LEU 33 48.797 -3.221 4.543 197 HG LEU 33 HG LEU 33 46.521 -5.165 5.051 198 HD11 LEU 33 HD11 LEU 33 48.479 -6.121 6.566 199 HD12 LEU 33 HD12 LEU 33 49.496 -5.336 5.358 200 HD13 LEU 33 HD13 LEU 33 48.351 -6.583 4.868 201 HD21 LEU 33 HD21 LEU 33 47.403 -2.868 6.459 202 HD22 LEU 33 HD22 LEU 33 47.945 -4.266 7.383 203 HD23 LEU 33 HD23 LEU 33 46.236 -4.071 6.996 204 H ASN 34 HN ASN 34 47.826 -0.427 3.456 205 HA ASN 34 HA ASN 34 47.411 -0.746 0.511 206 HB2 ASN 34 HB2 ASN 34 46.162 1.125 1.694 207 HB3 ASN 34 HB1 ASN 34 47.736 1.855 2.016 208 HD21 ASN 34 HD21 ASN 34 48.254 0.326 -0.837 209 HD22 ASN 34 HD22 ASN 34 47.822 1.555 -1.925 210 H HIS 35 HN HIS 35 49.389 -1.558 -0.142 211 HA HIS 35 HA HIS 35 51.907 -0.722 0.996 212 HB2 HIS 35 HB2 HIS 35 51.644 -1.786 -1.810 213 HB3 HIS 35 HB1 HIS 35 52.922 -2.081 -0.631 214 HD1 HIS 35 HD1 HIS 35 51.647 -4.537 -1.853 215 HD2 HIS 35 HD2 HIS 35 50.139 -2.713 1.584 216 HE1 HIS 35 HE1 HIS 35 50.293 -6.303 -0.639 217 HE2 HIS 35 HE2 HIS 35 49.372 -5.204 1.454 218 H ILE 36 HN ILE 36 49.729 0.627 -1.269 219 HA ILE 36 HA ILE 36 51.657 2.331 -2.647 220 HB ILE 36 HB ILE 36 48.714 2.918 -2.407 221 HG12 ILE 36 HG12 ILE 36 49.474 0.388 -2.944 222 HG13 ILE 36 HG11 ILE 36 48.069 1.135 -3.686 223 HG21 ILE 36 HG21 ILE 36 49.936 4.515 -3.698 224 HG22 ILE 36 HG22 ILE 36 49.133 3.472 -4.871 225 HG23 ILE 36 HG23 ILE 36 50.848 3.252 -4.526 226 HD11 ILE 36 HD11 ILE 36 49.811 -0.025 -5.237 227 HD12 ILE 36 HD12 ILE 36 50.790 1.411 -4.947 228 HD13 ILE 36 HD13 ILE 36 49.204 1.564 -5.703 229 H ASP 37 HN ASP 37 49.171 2.728 -0.162 230 HA ASP 37 HA ASP 37 50.285 5.366 0.548 231 HB2 ASP 37 HB2 ASP 37 47.792 3.867 1.315 232 HB3 ASP 37 HB1 ASP 37 48.345 5.224 2.297 233 H GLN 38 HN GLN 38 51.253 2.459 1.043 234 HA GLN 38 HA GLN 38 52.245 1.217 2.791 235 HB2 GLN 38 HB2 GLN 38 54.194 2.329 3.498 236 HB3 GLN 38 HB1 GLN 38 53.779 3.172 2.009 237 HG2 GLN 38 HG2 GLN 38 52.416 4.745 3.547 238 HG3 GLN 38 HG1 GLN 38 53.392 4.069 4.847 239 HE21 GLN 38 HE21 GLN 38 55.913 3.884 3.908 240 HE22 GLN 38 HE22 GLN 38 56.487 5.366 3.309 241 H THR 39 HN THR 39 49.652 1.862 3.613 242 HA THR 39 HA THR 39 50.069 2.030 6.509 243 HB THR 39 HB THR 39 49.676 4.296 6.318 244 HG1 THR 39 HG1 THR 39 46.996 3.521 6.262 245 HG21 THR 39 HG21 THR 39 47.402 4.482 4.564 246 HG22 THR 39 HG22 THR 39 48.710 3.622 3.755 247 HG23 THR 39 HG23 THR 39 48.983 5.242 4.397 248 H THR 40 HN THR 40 47.574 2.193 7.386 249 HA THR 40 HA THR 40 46.212 -0.091 6.028 250 HB THR 40 HB THR 40 45.220 -0.540 8.324 251 HG1 THR 40 HG1 THR 40 45.857 0.641 9.966 252 HG21 THR 40 HG21 THR 40 47.908 -0.917 9.086 253 HG22 THR 40 HG22 THR 40 47.874 -1.040 7.328 254 HG23 THR 40 HG23 THR 40 46.842 -2.085 8.308 255 H THR 41 HN THR 41 43.855 -0.024 6.065 256 HA THR 41 HA THR 41 42.616 2.546 6.802 257 HB THR 41 HB THR 41 42.751 3.226 4.669 258 HG1 THR 41 HG1 THR 41 40.584 1.853 5.035 259 HG21 THR 41 HG21 THR 41 43.376 1.816 2.800 260 HG22 THR 41 HG22 THR 41 43.048 0.365 3.749 261 HG23 THR 41 HG23 THR 41 44.397 1.416 4.180 262 H TRP 42 HN TRP 42 40.430 2.382 7.245 263 HA TRP 42 HA TRP 42 39.423 -0.347 7.670 264 HB2 TRP 42 HB2 TRP 42 38.081 2.326 8.193 265 HB3 TRP 42 HB1 TRP 42 37.538 0.758 8.785 266 HD1 TRP 42 HD1 TRP 42 39.514 3.640 9.813 267 HE1 TRP 42 HE1 TRP 42 40.986 3.085 11.857 268 HE3 TRP 42 HE3 TRP 42 39.163 -1.454 9.789 269 HZ2 TRP 42 HZ2 TRP 42 41.892 0.778 13.291 270 HZ3 TRP 42 HZ3 TRP 42 40.337 -2.804 11.503 271 HH2 TRP 42 HH2 TRP 42 41.700 -1.696 13.253 272 H GLN 43 HN GLN 43 39.531 1.808 5.153 273 HA GLN 43 HA GLN 43 36.844 1.181 4.094 274 HB2 GLN 43 HB2 GLN 43 37.938 3.474 3.883 275 HB3 GLN 43 HB1 GLN 43 39.043 2.738 2.721 276 HG2 GLN 43 HG2 GLN 43 37.361 2.359 1.154 277 HG3 GLN 43 HG1 GLN 43 36.085 2.361 2.373 278 HE21 GLN 43 HE21 GLN 43 38.419 4.561 0.746 279 HE22 GLN 43 HE22 GLN 43 37.462 5.952 0.921 280 H ASP 44 HN ASP 44 36.526 -0.062 2.196 281 HA ASP 44 HA ASP 44 38.871 -1.724 1.417 282 HB2 ASP 44 HB2 ASP 44 36.236 -2.713 0.609 283 HB3 ASP 44 HB1 ASP 44 37.525 -3.546 1.480 284 HA PRO 45 HA PRO 45 38.709 0.041 -2.624 285 HB2 PRO 45 HB2 PRO 45 39.378 -2.238 -4.089 286 HB3 PRO 45 HB1 PRO 45 40.538 -1.142 -3.319 287 HG2 PRO 45 HG2 PRO 45 39.532 -3.776 -2.410 288 HG3 PRO 45 HG1 PRO 45 41.126 -3.035 -2.194 289 HD2 PRO 45 HD2 PRO 45 39.293 -3.171 -0.182 290 HD3 PRO 45 HD1 PRO 45 40.472 -1.847 -0.316 291 H ARG 46 HN ARG 46 36.893 -2.826 -1.821 292 HA ARG 46 HA ARG 46 35.268 -2.731 -4.257 293 HB2 ARG 46 HB2 ARG 46 35.329 -4.422 -1.776 294 HB3 ARG 46 HB1 ARG 46 33.886 -4.430 -2.790 295 HG2 ARG 46 HG2 ARG 46 35.190 -6.187 -3.673 296 HG3 ARG 46 HG1 ARG 46 35.525 -4.838 -4.758 297 HD2 ARG 46 HD2 ARG 46 37.594 -6.050 -4.032 298 HD3 ARG 46 HD1 ARG 46 37.598 -4.344 -3.587 299 HE ARG 46 HE ARG 46 37.649 -5.025 -1.339 300 HH11 ARG 46 HH11 ARG 46 37.450 -6.531 0.336 301 HH12 ARG 46 HH12 ARG 46 36.816 -8.106 -0.005 302 HH21 ARG 46 HH21 ARG 46 36.354 -7.479 -3.385 303 HH22 ARG 46 HH22 ARG 46 36.197 -8.643 -2.111 304 H LYS 47 HN LYS 47 35.419 -0.446 -2.307 305 HA LYS 47 HA LYS 47 32.589 -0.320 -1.420 306 HB2 LYS 47 HB2 LYS 47 35.018 1.356 -0.747 307 HB3 LYS 47 HB1 LYS 47 33.386 1.778 -0.229 308 HG2 LYS 47 HG2 LYS 47 34.680 -0.899 0.352 309 HG3 LYS 47 HG1 LYS 47 34.710 0.461 1.475 310 HD2 LYS 47 HD2 LYS 47 32.104 0.467 1.072 311 HD3 LYS 47 HD1 LYS 47 32.380 -1.204 0.580 312 HE2 LYS 47 HE2 LYS 47 31.843 -1.003 3.007 313 HE3 LYS 47 HE1 LYS 47 33.436 -1.703 2.723 314 HZ1 LYS 47 HZ1 LYS 47 33.140 0.218 4.423 315 HZ2 LYS 47 HZ2 LYS 47 33.182 1.205 3.041 316 HZ3 LYS 47 HZ3 LYS 47 34.495 0.191 3.404 317 H ALA 48 HN ALA 48 31.475 1.828 -1.798 318 HA ALA 48 HA ALA 48 32.020 2.706 -4.583 319 HB1 ALA 48 HB1 ALA 48 29.655 2.205 -3.100 320 HB2 ALA 48 HB2 ALA 48 29.776 2.798 -4.756 321 HB3 ALA 48 HB3 ALA 48 29.692 3.939 -3.414 322 H MET 49 HN MET 49 33.346 4.451 -4.734 323 HA MET 49 HA MET 49 34.242 6.579 -4.325 324 HB2 MET 49 HB2 MET 49 31.761 7.063 -2.657 325 HB3 MET 49 HB1 MET 49 32.760 8.265 -3.476 326 HG2 MET 49 HG2 MET 49 32.040 6.521 -5.519 327 HG3 MET 49 HG1 MET 49 30.578 6.636 -4.538 328 HE1 MET 49 HE1 MET 49 30.206 10.171 -3.806 329 HE2 MET 49 HE2 MET 49 29.787 8.479 -3.548 330 HE3 MET 49 HE3 MET 49 28.968 9.399 -4.808 331 H GLY 50 HN GLY 50 33.153 7.736 -1.533 332 HA2 GLY 50 HA2 GLY 50 34.585 6.034 0.365 333 HA3 GLY 50 HA1 GLY 50 35.426 7.540 -0.005 334 H GLY 51 HN GLY 51 34.805 7.467 2.533 335 HA2 GLY 51 HA2 GLY 51 32.742 9.510 2.831 336 HA3 GLY 51 HA1 GLY 51 32.303 7.969 3.569 337 H GLY 52 HN GLY 52 32.575 8.294 5.740 338 HA2 GLY 52 HA2 GLY 52 35.099 8.322 6.962 339 HA3 GLY 52 HA1 GLY 52 34.601 10.013 6.860 340 H GLY 53 HN GLY 53 34.928 8.658 9.339 341 HA2 GLY 53 HA2 GLY 53 32.689 9.417 10.797 342 HA3 GLY 53 HA1 GLY 53 32.354 7.748 10.330 343 H ASN 54 HN ASN 54 32.677 8.444 13.028 344 HA ASN 54 HA ASN 54 35.403 7.948 13.904 345 HB2 ASN 54 HB2 ASN 54 34.165 7.537 16.151 346 HB3 ASN 54 HB1 ASN 54 34.099 9.156 15.457 347 HD21 ASN 54 HD21 ASN 54 32.057 8.122 17.240 348 HD22 ASN 54 HD22 ASN 54 30.614 8.007 16.355 349 H TYR 55 HN TYR 55 35.770 5.956 12.625 350 HA TYR 55 HA TYR 55 34.238 3.560 13.227 351 HB2 TYR 55 HB2 TYR 55 36.547 4.292 11.540 352 HB3 TYR 55 HB1 TYR 55 36.603 2.648 12.177 353 HD1 TYR 55 HD1 TYR 55 33.886 4.932 10.942 354 HD2 TYR 55 HD2 TYR 55 35.761 1.077 10.683 355 HE1 TYR 55 HE1 TYR 55 32.201 4.226 9.265 356 HE2 TYR 55 HE2 TYR 55 34.075 0.370 9.007 357 HH TYR 55 HH TYR 55 32.360 1.006 7.745 358 H GLN 56 HN GLN 56 36.482 1.742 13.558 359 HA GLN 56 HA GLN 56 36.673 1.746 16.412 360 HB2 GLN 56 HB2 GLN 56 38.708 0.318 14.737 361 HB3 GLN 56 HB1 GLN 56 37.866 -0.239 16.184 362 HG2 GLN 56 HG2 GLN 56 36.756 0.009 13.380 363 HG3 GLN 56 HG1 GLN 56 36.915 -1.453 14.353 364 HE21 GLN 56 HE21 GLN 56 35.975 -0.020 16.838 365 HE22 GLN 56 HE22 GLN 56 34.299 0.158 16.642 366 H GLY 57 HN GLY 57 37.721 4.130 14.856 367 HA2 GLY 57 HA2 GLY 57 39.301 5.754 15.645 368 HA3 GLY 57 HA1 GLY 57 40.163 4.468 16.490 369 HA PRO 58 HA PRO 58 41.886 5.859 12.099 370 HB2 PRO 58 HB2 PRO 58 44.127 6.542 13.961 371 HB3 PRO 58 HB1 PRO 58 43.599 7.368 12.482 372 HG2 PRO 58 HG2 PRO 58 43.026 8.301 14.931 373 HG3 PRO 58 HG1 PRO 58 41.939 8.513 13.549 374 HD2 PRO 58 HD2 PRO 58 41.616 6.778 15.922 375 HD3 PRO 58 HD1 PRO 58 40.385 7.393 14.798 376 HA PRO 59 HA PRO 59 43.829 1.827 12.398 377 HB2 PRO 59 HB2 PRO 59 44.355 1.514 9.745 378 HB3 PRO 59 HB1 PRO 59 42.732 1.328 10.433 379 HG2 PRO 59 HG2 PRO 59 43.896 3.596 8.918 380 HG3 PRO 59 HG1 PRO 59 42.245 2.958 8.911 381 HD2 PRO 59 HD2 PRO 59 43.047 5.232 10.294 382 HD3 PRO 59 HD1 PRO 59 41.599 4.276 10.672 383 HA PRO 60 HA PRO 60 48.103 3.246 12.418 384 HB2 PRO 60 HB2 PRO 60 49.163 1.023 13.583 385 HB3 PRO 60 HB1 PRO 60 48.263 2.247 14.497 386 HG2 PRO 60 HG2 PRO 60 47.388 -0.422 13.538 387 HG3 PRO 60 HG1 PRO 60 46.984 0.431 15.036 388 HD2 PRO 60 HD2 PRO 60 45.316 0.285 12.827 389 HD3 PRO 60 HD1 PRO 60 45.226 1.551 14.070 390 HA PRO 61 HA PRO 61 49.861 1.733 8.650 391 HB2 PRO 61 HB2 PRO 61 52.322 1.339 10.317 392 HB3 PRO 61 HB1 PRO 61 52.149 2.115 8.731 393 HG2 PRO 61 HG2 PRO 61 52.387 3.542 10.969 394 HG3 PRO 61 HG1 PRO 61 51.374 4.073 9.617 395 HD2 PRO 61 HD2 PRO 61 50.548 3.063 12.281 396 HD3 PRO 61 HD1 PRO 61 49.645 4.071 11.128 397 H TYR 62 HN TYR 62 49.909 -0.269 7.715 398 HA TYR 62 HA TYR 62 49.158 -2.630 8.834 399 HB2 TYR 62 HB2 TYR 62 50.836 -3.714 7.118 400 HB3 TYR 62 HB1 TYR 62 49.485 -2.751 6.532 401 HD1 TYR 62 HD1 TYR 62 52.162 -0.958 8.235 402 HD2 TYR 62 HD2 TYR 62 50.799 -2.405 4.429 403 HE1 TYR 62 HE1 TYR 62 53.748 0.542 7.102 404 HE2 TYR 62 HE2 TYR 62 52.388 -0.900 3.293 405 HH TYR 62 HH TYR 62 54.385 1.391 5.133 406 HA PRO 63 HA PRO 63 51.961 -4.347 11.749 407 HB2 PRO 63 HB2 PRO 63 52.708 -6.729 10.403 408 HB3 PRO 63 HB1 PRO 63 51.365 -6.533 11.542 409 HG2 PRO 63 HG2 PRO 63 51.347 -6.524 8.578 410 HG3 PRO 63 HG1 PRO 63 50.116 -7.095 9.717 411 HD2 PRO 63 HD2 PRO 63 49.787 -4.789 8.386 412 HD3 PRO 63 HD1 PRO 63 49.261 -4.945 10.078 413 H LYS 64 HN LYS 64 54.067 -3.787 12.129 414 HA LYS 64 HA LYS 64 55.882 -3.499 9.794 415 HB2 LYS 64 HB2 LYS 64 57.338 -2.281 11.456 416 HB3 LYS 64 HB1 LYS 64 55.755 -1.542 11.214 417 HG2 LYS 64 HG2 LYS 64 55.149 -1.910 13.360 418 HG3 LYS 64 HG1 LYS 64 55.720 -3.578 13.311 419 HD2 LYS 64 HD2 LYS 64 56.960 -2.122 14.952 420 HD3 LYS 64 HD1 LYS 64 57.995 -2.883 13.745 421 HE2 LYS 64 HE2 LYS 64 58.650 -0.881 12.945 422 HE3 LYS 64 HE1 LYS 64 56.979 -0.346 12.772 423 HZ1 LYS 64 HZ1 LYS 64 57.844 1.101 14.334 424 HZ2 LYS 64 HZ2 LYS 64 58.771 -0.099 15.100 425 HZ3 LYS 64 HZ3 LYS 64 57.085 -0.064 15.306 426 H HIS 65 HN HIS 65 57.768 -4.704 9.609 427 HA HIS 65 HA HIS 65 57.923 -7.148 11.203 428 HB2 HIS 65 HB2 HIS 65 58.777 -6.361 8.649 429 HB3 HIS 65 HB1 HIS 65 60.263 -6.623 9.562 430 HD1 HIS 65 HD1 HIS 65 60.963 -8.913 8.759 431 HD2 HIS 65 HD2 HIS 65 56.959 -8.808 9.926 432 HE1 HIS 65 HE1 HIS 65 60.138 -11.310 8.713 433 HE2 HIS 65 HE2 HIS 65 57.703 -11.257 9.421 Start of MODEL 5 1 H1 SER 7 HT1 SER 7 27.869 0.623 -13.621 2 H2 SER 7 HT2 SER 7 29.007 0.800 -14.870 3 H3 SER 7 HT3 SER 7 29.235 1.602 -13.390 4 HA SER 7 HA SER 7 30.119 -0.947 -14.140 5 HB2 SER 7 HB2 SER 7 30.368 0.957 -11.868 6 HB3 SER 7 HB1 SER 7 30.804 -0.718 -11.543 7 HG SER 7 HG SER 7 31.829 1.013 -13.546 8 H PHE 8 HN PHE 8 29.037 -2.844 -13.945 9 HA PHE 8 HA PHE 8 27.391 -3.276 -11.503 10 HB2 PHE 8 HB2 PHE 8 26.493 -3.381 -14.349 11 HB3 PHE 8 HB1 PHE 8 25.866 -4.611 -13.251 12 HD1 PHE 8 HD1 PHE 8 26.408 -0.907 -13.474 13 HD2 PHE 8 HD2 PHE 8 24.024 -4.114 -11.896 14 HE1 PHE 8 HE1 PHE 8 24.809 0.741 -12.537 15 HE2 PHE 8 HE2 PHE 8 22.426 -2.465 -10.960 16 HZ PHE 8 HZ PHE 8 22.818 -0.038 -11.281 17 H GLU 9 HN GLU 9 26.702 -5.764 -11.561 18 HA GLU 9 HA GLU 9 27.492 -7.964 -11.392 19 HB2 GLU 9 HB2 GLU 9 28.049 -7.040 -14.052 20 HB3 GLU 9 HB1 GLU 9 29.369 -8.081 -13.518 21 HG2 GLU 9 HG2 GLU 9 27.522 -9.701 -12.721 22 HG3 GLU 9 HG1 GLU 9 26.431 -8.743 -13.723 23 H ILE 10 HN ILE 10 29.031 -5.606 -10.311 24 HA ILE 10 HA ILE 10 31.791 -5.846 -10.390 25 HB ILE 10 HB ILE 10 30.142 -5.485 -7.870 26 HG12 ILE 10 HG12 ILE 10 30.934 -3.649 -10.119 27 HG13 ILE 10 HG11 ILE 10 29.378 -3.792 -9.299 28 HG21 ILE 10 HG21 ILE 10 32.919 -4.466 -8.520 29 HG22 ILE 10 HG22 ILE 10 32.625 -5.952 -7.619 30 HG23 ILE 10 HG23 ILE 10 32.091 -4.403 -6.965 31 HD11 ILE 10 HD11 ILE 10 30.574 -2.943 -7.199 32 HD12 ILE 10 HD12 ILE 10 30.334 -1.764 -8.489 33 HD13 ILE 10 HD13 ILE 10 31.915 -2.513 -8.263 34 HA PRO 11 HA PRO 11 32.102 -10.289 -9.493 35 HB2 PRO 11 HB2 PRO 11 34.966 -9.441 -9.400 36 HB3 PRO 11 HB1 PRO 11 34.219 -10.803 -10.259 37 HG2 PRO 11 HG2 PRO 11 34.986 -8.583 -11.531 38 HG3 PRO 11 HG1 PRO 11 33.552 -9.501 -12.020 39 HD2 PRO 11 HD2 PRO 11 33.715 -6.874 -10.633 40 HD3 PRO 11 HD1 PRO 11 32.438 -7.517 -11.688 41 H ASP 12 HN ASP 12 31.876 -11.115 -7.458 42 HA ASP 12 HA ASP 12 32.706 -9.559 -5.145 43 HB2 ASP 12 HB2 ASP 12 31.640 -11.291 -3.817 44 HB3 ASP 12 HB1 ASP 12 30.598 -10.929 -5.193 45 H ASP 13 HN ASP 13 34.396 -11.328 -7.176 46 HA ASP 13 HA ASP 13 36.268 -12.295 -5.068 47 HB2 ASP 13 HB2 ASP 13 35.916 -13.488 -7.832 48 HB3 ASP 13 HB1 ASP 13 36.923 -14.119 -6.527 49 H VAL 14 HN VAL 14 36.284 -9.661 -6.215 50 HA VAL 14 HA VAL 14 38.546 -9.723 -8.124 51 HB VAL 14 HB VAL 14 36.703 -8.231 -8.697 52 HG11 VAL 14 HG11 VAL 14 36.550 -7.862 -5.926 53 HG12 VAL 14 HG12 VAL 14 35.588 -7.029 -7.147 54 HG13 VAL 14 HG13 VAL 14 37.079 -6.300 -6.551 55 HG21 VAL 14 HG21 VAL 14 38.075 -6.528 -9.366 56 HG22 VAL 14 HG22 VAL 14 39.341 -7.546 -8.680 57 HG23 VAL 14 HG23 VAL 14 38.661 -6.226 -7.730 58 HA PRO 15 HA PRO 15 41.237 -9.483 -4.490 59 HB2 PRO 15 HB2 PRO 15 43.098 -8.669 -6.685 60 HB3 PRO 15 HB1 PRO 15 43.334 -9.857 -5.388 61 HG2 PRO 15 HG2 PRO 15 42.797 -10.595 -7.900 62 HG3 PRO 15 HG1 PRO 15 42.198 -11.502 -6.501 63 HD2 PRO 15 HD2 PRO 15 40.699 -9.763 -8.386 64 HD3 PRO 15 HD1 PRO 15 40.117 -11.111 -7.386 65 H LEU 16 HN LEU 16 42.640 -7.730 -3.558 66 HA LEU 16 HA LEU 16 41.371 -5.159 -3.718 67 HB2 LEU 16 HB2 LEU 16 44.126 -5.834 -2.656 68 HB3 LEU 16 HB1 LEU 16 43.181 -4.407 -2.266 69 HG LEU 16 HG LEU 16 43.258 -6.733 -0.804 70 HD11 LEU 16 HD11 LEU 16 40.939 -4.791 -0.864 71 HD12 LEU 16 HD12 LEU 16 42.515 -4.405 -0.172 72 HD13 LEU 16 HD13 LEU 16 41.541 -5.700 0.522 73 HD21 LEU 16 HD21 LEU 16 40.853 -7.556 -0.973 74 HD22 LEU 16 HD22 LEU 16 41.910 -8.050 -2.289 75 HD23 LEU 16 HD23 LEU 16 40.759 -6.733 -2.525 76 HA PRO 17 HA PRO 17 43.455 -3.053 -7.016 77 HB2 PRO 17 HB2 PRO 17 44.510 -0.990 -5.200 78 HB3 PRO 17 HB1 PRO 17 43.407 -0.827 -6.571 79 HG2 PRO 17 HG2 PRO 17 42.621 -0.601 -3.998 80 HG3 PRO 17 HG1 PRO 17 41.562 -1.160 -5.301 81 HD2 PRO 17 HD2 PRO 17 42.833 -2.717 -3.119 82 HD3 PRO 17 HD1 PRO 17 41.340 -3.049 -4.021 83 H ALA 18 HN ALA 18 45.803 -1.340 -6.430 84 HA ALA 18 HA ALA 18 47.794 -3.496 -6.617 85 HB1 ALA 18 HB1 ALA 18 47.907 -1.806 -8.299 86 HB2 ALA 18 HB2 ALA 18 49.288 -1.551 -7.231 87 HB3 ALA 18 HB3 ALA 18 47.862 -0.520 -7.094 88 H GLY 19 HN GLY 19 49.443 -3.823 -5.152 89 HA2 GLY 19 HA2 GLY 19 50.647 -3.683 -3.150 90 HA3 GLY 19 HA1 GLY 19 50.309 -1.955 -3.182 91 H TRP 20 HN TRP 20 47.628 -4.190 -3.160 92 HA TRP 20 HA TRP 20 47.025 -3.272 -0.398 93 HB2 TRP 20 HB2 TRP 20 45.285 -4.248 -2.639 94 HB3 TRP 20 HB1 TRP 20 44.690 -4.003 -0.992 95 HD1 TRP 20 HD1 TRP 20 45.771 -2.172 -4.083 96 HE1 TRP 20 HE1 TRP 20 45.397 0.344 -3.763 97 HE3 TRP 20 HE3 TRP 20 44.673 -2.149 0.861 98 HZ2 TRP 20 HZ2 TRP 20 44.705 2.162 -1.612 99 HZ3 TRP 20 HZ3 TRP 20 44.172 -0.052 2.043 100 HH2 TRP 20 HH2 TRP 20 44.179 2.118 0.820 101 H GLU 21 HN GLU 21 46.169 -4.755 1.158 102 HA GLU 21 HA GLU 21 46.086 -7.608 0.540 103 HB2 GLU 21 HB2 GLU 21 48.587 -6.964 0.813 104 HB3 GLU 21 HB1 GLU 21 48.203 -6.790 2.527 105 HG2 GLU 21 HG2 GLU 21 48.983 -9.048 2.194 106 HG3 GLU 21 HG1 GLU 21 47.239 -9.125 2.459 107 H MET 22 HN MET 22 44.408 -8.299 1.810 108 HA MET 22 HA MET 22 43.418 -6.736 3.997 109 HB2 MET 22 HB2 MET 22 41.685 -8.035 3.306 110 HB3 MET 22 HB1 MET 22 42.756 -9.304 2.707 111 HG2 MET 22 HG2 MET 22 43.081 -10.181 4.917 112 HG3 MET 22 HG1 MET 22 42.257 -8.801 5.643 113 HE1 MET 22 HE1 MET 22 40.927 -10.459 2.249 114 HE2 MET 22 HE2 MET 22 40.376 -11.985 2.936 115 HE3 MET 22 HE3 MET 22 42.072 -11.526 3.075 116 H ALA 23 HN ALA 23 43.840 -6.923 6.177 117 HA ALA 23 HA ALA 23 45.436 -9.208 7.153 118 HB1 ALA 23 HB1 ALA 23 46.388 -6.342 7.153 119 HB2 ALA 23 HB2 ALA 23 47.193 -7.736 6.437 120 HB3 ALA 23 HB3 ALA 23 47.087 -7.584 8.191 121 H LYS 24 HN LYS 24 45.798 -8.835 9.653 122 HA LYS 24 HA LYS 24 43.380 -7.443 10.693 123 HB2 LYS 24 HB2 LYS 24 43.413 -10.019 10.784 124 HB3 LYS 24 HB1 LYS 24 44.627 -9.820 12.051 125 HG2 LYS 24 HG2 LYS 24 43.012 -8.241 13.204 126 HG3 LYS 24 HG1 LYS 24 41.795 -8.757 12.038 127 HD2 LYS 24 HD2 LYS 24 43.324 -10.636 13.862 128 HD3 LYS 24 HD1 LYS 24 41.687 -10.057 14.168 129 HE2 LYS 24 HE2 LYS 24 41.315 -12.120 13.110 130 HE3 LYS 24 HE1 LYS 24 41.170 -10.968 11.782 131 HZ1 LYS 24 HZ1 LYS 24 42.860 -13.110 11.883 132 HZ2 LYS 24 HZ2 LYS 24 43.871 -11.786 12.213 133 HZ3 LYS 24 HZ3 LYS 24 42.947 -11.818 10.788 134 H THR 25 HN THR 25 43.562 -6.555 12.819 135 HA THR 25 HA THR 25 46.050 -5.187 13.297 136 HB THR 25 HB THR 25 43.779 -4.340 13.928 137 HG1 THR 25 HG1 THR 25 44.704 -3.245 15.470 138 HG21 THR 25 HG21 THR 25 42.490 -5.357 15.538 139 HG22 THR 25 HG22 THR 25 43.879 -6.100 16.330 140 HG23 THR 25 HG23 THR 25 43.266 -6.765 14.816 141 H SER 26 HN SER 26 46.894 -5.342 15.757 142 HA SER 26 HA SER 26 48.536 -7.340 16.272 143 HB2 SER 26 HB2 SER 26 47.722 -7.428 18.716 144 HB3 SER 26 HB1 SER 26 48.187 -5.852 18.086 145 HG SER 26 HG SER 26 45.555 -6.919 18.227 146 H SER 27 HN SER 27 45.018 -7.779 16.449 147 HA SER 27 HA SER 27 44.785 -10.300 15.450 148 HB2 SER 27 HB2 SER 27 45.984 -10.395 18.180 149 HB3 SER 27 HB1 SER 27 44.782 -11.616 17.772 150 HG SER 27 HG SER 27 46.716 -12.420 17.101 151 H GLY 28 HN GLY 28 42.748 -9.022 15.191 152 HA2 GLY 28 HA2 GLY 28 40.604 -10.030 16.669 153 HA3 GLY 28 HA1 GLY 28 41.062 -8.542 17.495 154 H GLN 29 HN GLN 29 41.807 -7.020 15.170 155 HA GLN 29 HA GLN 29 39.101 -6.688 13.974 156 HB2 GLN 29 HB2 GLN 29 41.252 -4.574 14.004 157 HB3 GLN 29 HB1 GLN 29 39.516 -4.366 13.787 158 HG2 GLN 29 HG2 GLN 29 39.064 -4.555 16.038 159 HG3 GLN 29 HG1 GLN 29 40.435 -5.625 16.333 160 HE21 GLN 29 HE21 GLN 29 41.545 -4.429 17.948 161 HE22 GLN 29 HE22 GLN 29 42.133 -2.855 17.708 162 H ARG 30 HN ARG 30 38.915 -7.178 11.854 163 HA ARG 30 HA ARG 30 41.317 -7.707 10.259 164 HB2 ARG 30 HB2 ARG 30 38.559 -8.482 10.185 165 HB3 ARG 30 HB1 ARG 30 38.963 -7.718 8.647 166 HG2 ARG 30 HG2 ARG 30 40.839 -9.224 8.327 167 HG3 ARG 30 HG1 ARG 30 40.613 -9.910 9.936 168 HD2 ARG 30 HD2 ARG 30 38.609 -10.993 9.328 169 HD3 ARG 30 HD1 ARG 30 38.386 -9.973 7.906 170 HE ARG 30 HE ARG 30 40.795 -11.649 7.831 171 HH11 ARG 30 HH11 ARG 30 40.811 -13.198 6.186 172 HH12 ARG 30 HH12 ARG 30 39.347 -13.548 5.329 173 HH21 ARG 30 HH21 ARG 30 37.442 -11.273 7.122 174 HH22 ARG 30 HH22 ARG 30 37.440 -12.457 5.859 175 H TYR 31 HN TYR 31 42.072 -6.383 8.575 176 HA TYR 31 HA TYR 31 40.444 -4.092 7.751 177 HB2 TYR 31 HB2 TYR 31 42.417 -2.508 8.195 178 HB3 TYR 31 HB1 TYR 31 41.438 -2.980 9.576 179 HD1 TYR 31 HD1 TYR 31 43.117 -2.613 11.263 180 HD2 TYR 31 HD2 TYR 31 43.916 -5.228 7.949 181 HE1 TYR 31 HE1 TYR 31 45.171 -3.419 12.384 182 HE2 TYR 31 HE2 TYR 31 45.959 -6.031 9.086 183 HH TYR 31 HH TYR 31 47.582 -5.068 10.836 184 H PHE 32 HN PHE 32 42.189 -2.678 6.255 185 HA PHE 32 HA PHE 32 43.392 -4.760 4.481 186 HB2 PHE 32 HB2 PHE 32 42.050 -2.170 3.668 187 HB3 PHE 32 HB1 PHE 32 42.780 -3.339 2.566 188 HD1 PHE 32 HD1 PHE 32 41.905 -5.776 2.677 189 HD2 PHE 32 HD2 PHE 32 39.809 -2.415 4.334 190 HE1 PHE 32 HE1 PHE 32 39.800 -7.088 2.672 191 HE2 PHE 32 HE2 PHE 32 37.703 -3.725 4.329 192 HZ PHE 32 HZ PHE 32 37.699 -6.062 3.499 193 H LEU 33 HN LEU 33 45.499 -4.516 4.029 194 HA LEU 33 HA LEU 33 46.896 -2.115 5.045 195 HB2 LEU 33 HB2 LEU 33 48.172 -4.463 3.645 196 HB3 LEU 33 HB1 LEU 33 48.891 -3.379 4.831 197 HG LEU 33 HG LEU 33 46.727 -5.441 5.329 198 HD11 LEU 33 HD11 LEU 33 49.649 -5.200 5.956 199 HD12 LEU 33 HD12 LEU 33 48.739 -6.605 5.403 200 HD13 LEU 33 HD13 LEU 33 48.604 -6.070 7.077 201 HD21 LEU 33 HD21 LEU 33 47.341 -4.564 7.790 202 HD22 LEU 33 HD22 LEU 33 46.054 -3.833 6.834 203 HD23 LEU 33 HD23 LEU 33 47.643 -3.077 6.897 204 H ASN 34 HN ASN 34 47.798 -0.548 3.736 205 HA ASN 34 HA ASN 34 47.457 -0.926 0.789 206 HB2 ASN 34 HB2 ASN 34 46.274 1.005 2.071 207 HB3 ASN 34 HB1 ASN 34 47.877 1.735 2.129 208 HD21 ASN 34 HD21 ASN 34 48.047 -0.007 -0.632 209 HD22 ASN 34 HD22 ASN 34 47.471 1.131 -1.752 210 H HIS 35 HN HIS 35 49.403 -1.670 0.052 211 HA HIS 35 HA HIS 35 51.926 -0.866 1.256 212 HB2 HIS 35 HB2 HIS 35 51.559 -2.220 -1.422 213 HB3 HIS 35 HB1 HIS 35 52.954 -2.307 -0.347 214 HD1 HIS 35 HD1 HIS 35 52.019 -4.996 -0.922 215 HD2 HIS 35 HD2 HIS 35 50.104 -2.713 1.998 216 HE1 HIS 35 HE1 HIS 35 50.791 -6.630 0.576 217 HE2 HIS 35 HE2 HIS 35 49.622 -5.251 2.356 218 H ILE 36 HN ILE 36 49.835 0.459 -1.083 219 HA ILE 36 HA ILE 36 51.865 1.865 -2.635 220 HB ILE 36 HB ILE 36 48.990 2.725 -2.376 221 HG12 ILE 36 HG12 ILE 36 49.511 0.118 -2.719 222 HG13 ILE 36 HG11 ILE 36 48.184 0.920 -3.542 223 HG21 ILE 36 HG21 ILE 36 50.247 4.132 -3.812 224 HG22 ILE 36 HG22 ILE 36 49.415 3.024 -4.903 225 HG23 ILE 36 HG23 ILE 36 51.117 2.771 -4.520 226 HD11 ILE 36 HD11 ILE 36 50.909 0.908 -4.806 227 HD12 ILE 36 HD12 ILE 36 49.327 1.021 -5.578 228 HD13 ILE 36 HD13 ILE 36 49.887 -0.522 -4.935 229 H ASP 37 HN ASP 37 49.546 2.687 -0.102 230 HA ASP 37 HA ASP 37 51.074 5.186 0.388 231 HB2 ASP 37 HB2 ASP 37 48.225 4.408 1.014 232 HB3 ASP 37 HB1 ASP 37 48.992 5.817 1.749 233 H GLN 38 HN GLN 38 51.331 2.242 1.350 234 HA GLN 38 HA GLN 38 51.810 1.121 3.377 235 HB2 GLN 38 HB2 GLN 38 53.487 2.341 4.738 236 HB3 GLN 38 HB1 GLN 38 53.860 2.429 3.016 237 HG2 GLN 38 HG2 GLN 38 52.952 4.668 2.877 238 HG3 GLN 38 HG1 GLN 38 52.348 4.574 4.531 239 HE21 GLN 38 HE21 GLN 38 53.698 5.549 6.038 240 HE22 GLN 38 HE22 GLN 38 55.376 5.740 5.868 241 H THR 39 HN THR 39 49.228 1.998 3.528 242 HA THR 39 HA THR 39 49.070 2.910 6.349 243 HB THR 39 HB THR 39 48.229 4.838 5.471 244 HG1 THR 39 HG1 THR 39 46.136 4.745 5.773 245 HG21 THR 39 HG21 THR 39 46.983 3.479 3.097 246 HG22 THR 39 HG22 THR 39 48.697 3.882 3.102 247 HG23 THR 39 HG23 THR 39 47.493 5.158 3.259 248 H THR 40 HN THR 40 46.462 2.697 6.793 249 HA THR 40 HA THR 40 45.635 0.004 5.849 250 HB THR 40 HB THR 40 44.839 -0.359 8.296 251 HG1 THR 40 HG1 THR 40 45.741 0.897 9.795 252 HG21 THR 40 HG21 THR 40 47.666 -0.497 8.643 253 HG22 THR 40 HG22 THR 40 47.299 -0.885 6.963 254 HG23 THR 40 HG23 THR 40 46.548 -1.807 8.266 255 H THR 41 HN THR 41 43.274 -0.296 6.037 256 HA THR 41 HA THR 41 41.753 2.150 6.714 257 HB THR 41 HB THR 41 41.535 2.550 4.513 258 HG1 THR 41 HG1 THR 41 39.497 1.765 4.959 259 HG21 THR 41 HG21 THR 41 41.775 0.457 2.875 260 HG22 THR 41 HG22 THR 41 42.621 -0.209 4.273 261 HG23 THR 41 HG23 THR 41 43.186 1.287 3.531 262 H TRP 42 HN TRP 42 39.718 1.766 7.504 263 HA TRP 42 HA TRP 42 39.154 -0.977 8.378 264 HB2 TRP 42 HB2 TRP 42 37.493 1.547 8.685 265 HB3 TRP 42 HB1 TRP 42 37.242 0.027 9.542 266 HD1 TRP 42 HD1 TRP 42 38.702 3.260 10.076 267 HE1 TRP 42 HE1 TRP 42 40.469 3.224 11.956 268 HE3 TRP 42 HE3 TRP 42 39.489 -1.771 10.433 269 HZ2 TRP 42 HZ2 TRP 42 42.010 1.303 13.420 270 HZ3 TRP 42 HZ3 TRP 42 41.106 -2.677 12.078 271 HH2 TRP 42 HH2 TRP 42 42.370 -1.148 13.568 272 H GLN 43 HN GLN 43 38.618 0.867 5.637 273 HA GLN 43 HA GLN 43 36.149 -0.667 4.959 274 HB2 GLN 43 HB2 GLN 43 35.839 1.772 4.901 275 HB3 GLN 43 HB1 GLN 43 37.194 1.923 3.782 276 HG2 GLN 43 HG2 GLN 43 36.028 0.787 2.049 277 HG3 GLN 43 HG1 GLN 43 34.799 0.188 3.164 278 HE21 GLN 43 HE21 GLN 43 33.172 1.261 1.708 279 HE22 GLN 43 HE22 GLN 43 32.915 2.934 1.843 280 H ASP 44 HN ASP 44 36.022 -1.502 2.742 281 HA ASP 44 HA ASP 44 38.605 -2.549 1.851 282 HB2 ASP 44 HB2 ASP 44 35.951 -2.875 0.441 283 HB3 ASP 44 HB1 ASP 44 37.346 -3.954 0.400 284 HA PRO 45 HA PRO 45 39.448 0.574 -1.156 285 HB2 PRO 45 HB2 PRO 45 40.688 -1.028 -3.062 286 HB3 PRO 45 HB1 PRO 45 41.485 -0.358 -1.626 287 HG2 PRO 45 HG2 PRO 45 40.416 -3.085 -2.099 288 HG3 PRO 45 HG1 PRO 45 41.843 -2.570 -1.183 289 HD2 PRO 45 HD2 PRO 45 39.528 -3.332 0.029 290 HD3 PRO 45 HD1 PRO 45 40.615 -2.112 0.730 291 H ARG 46 HN ARG 46 37.548 -2.221 -1.849 292 HA ARG 46 HA ARG 46 36.782 -1.327 -4.536 293 HB2 ARG 46 HB2 ARG 46 36.073 -3.656 -2.770 294 HB3 ARG 46 HB1 ARG 46 35.069 -3.277 -4.170 295 HG2 ARG 46 HG2 ARG 46 36.802 -4.908 -4.784 296 HG3 ARG 46 HG1 ARG 46 37.072 -3.381 -5.624 297 HD2 ARG 46 HD2 ARG 46 39.170 -4.318 -4.652 298 HD3 ARG 46 HD1 ARG 46 38.765 -2.736 -3.987 299 HE ARG 46 HE ARG 46 38.476 -3.766 -1.887 300 HH11 ARG 46 HH11 ARG 46 38.382 -5.557 -0.512 301 HH12 ARG 46 HH12 ARG 46 38.293 -7.150 -1.189 302 HH21 ARG 46 HH21 ARG 46 38.346 -6.041 -4.474 303 HH22 ARG 46 HH22 ARG 46 38.273 -7.423 -3.433 304 H LYS 47 HN LYS 47 36.261 0.327 -2.101 305 HA LYS 47 HA LYS 47 33.340 0.675 -2.549 306 HB2 LYS 47 HB2 LYS 47 34.773 0.823 0.119 307 HB3 LYS 47 HB1 LYS 47 33.078 1.232 -0.145 308 HG2 LYS 47 HG2 LYS 47 32.955 -1.175 -1.199 309 HG3 LYS 47 HG1 LYS 47 34.410 -1.457 -0.242 310 HD2 LYS 47 HD2 LYS 47 33.198 -0.671 1.784 311 HD3 LYS 47 HD1 LYS 47 31.736 -0.493 0.814 312 HE2 LYS 47 HE2 LYS 47 31.318 -2.715 0.848 313 HE3 LYS 47 HE1 LYS 47 32.998 -3.117 0.490 314 HZ1 LYS 47 HZ1 LYS 47 32.154 -2.164 3.160 315 HZ2 LYS 47 HZ2 LYS 47 33.581 -2.981 2.731 316 HZ3 LYS 47 HZ3 LYS 47 32.097 -3.807 2.741 317 H ALA 48 HN ALA 48 32.687 2.826 -2.709 318 HA ALA 48 HA ALA 48 34.248 4.825 -3.675 319 HB1 ALA 48 HB1 ALA 48 32.734 6.439 -2.252 320 HB2 ALA 48 HB2 ALA 48 31.908 4.948 -1.797 321 HB3 ALA 48 HB3 ALA 48 31.999 5.424 -3.492 322 H MET 49 HN MET 49 35.751 6.320 -2.917 323 HA MET 49 HA MET 49 37.383 5.691 -0.717 324 HB2 MET 49 HB2 MET 49 36.881 8.437 -1.908 325 HB3 MET 49 HB1 MET 49 38.268 7.984 -0.916 326 HG2 MET 49 HG2 MET 49 37.690 6.304 -3.313 327 HG3 MET 49 HG1 MET 49 38.369 7.908 -3.590 328 HE1 MET 49 HE1 MET 49 39.606 6.104 -4.753 329 HE2 MET 49 HE2 MET 49 40.521 4.806 -3.992 330 HE3 MET 49 HE3 MET 49 41.309 6.342 -4.340 331 H GLY 50 HN GLY 50 37.280 6.139 1.462 332 HA2 GLY 50 HA2 GLY 50 35.908 8.252 2.715 333 HA3 GLY 50 HA1 GLY 50 34.763 6.912 2.618 334 H GLY 51 HN GLY 51 35.110 5.073 3.908 335 HA2 GLY 51 HA2 GLY 51 35.915 3.883 5.762 336 HA3 GLY 51 HA1 GLY 51 37.516 4.454 5.291 337 H GLY 52 HN GLY 52 35.355 4.516 7.782 338 HA2 GLY 52 HA2 GLY 52 36.797 6.265 9.427 339 HA3 GLY 52 HA1 GLY 52 35.555 7.258 8.661 340 H GLY 53 HN GLY 53 35.164 3.849 9.503 341 HA2 GLY 53 HA2 GLY 53 32.646 4.252 10.765 342 HA3 GLY 53 HA1 GLY 53 33.645 2.811 10.960 343 H ASN 54 HN ASN 54 32.190 3.830 13.122 344 HA ASN 54 HA ASN 54 33.896 5.533 14.764 345 HB2 ASN 54 HB2 ASN 54 31.723 3.809 15.911 346 HB3 ASN 54 HB1 ASN 54 32.183 5.458 16.341 347 HD21 ASN 54 HD21 ASN 54 30.604 6.917 15.693 348 HD22 ASN 54 HD22 ASN 54 29.683 6.796 14.273 349 H TYR 55 HN TYR 55 35.530 3.523 13.964 350 HA TYR 55 HA TYR 55 35.541 1.397 16.010 351 HB2 TYR 55 HB2 TYR 55 37.324 2.011 13.640 352 HB3 TYR 55 HB1 TYR 55 37.650 0.695 14.768 353 HD1 TYR 55 HD1 TYR 55 35.692 -0.973 15.214 354 HD2 TYR 55 HD2 TYR 55 35.883 1.657 11.823 355 HE1 TYR 55 HE1 TYR 55 34.074 -2.412 14.007 356 HE2 TYR 55 HE2 TYR 55 34.264 0.218 10.616 357 HH TYR 55 HH TYR 55 33.578 -2.844 11.413 358 H GLN 56 HN GLN 56 38.497 1.287 16.062 359 HA GLN 56 HA GLN 56 38.930 2.938 18.370 360 HB2 GLN 56 HB2 GLN 56 41.356 2.068 16.958 361 HB3 GLN 56 HB1 GLN 56 40.831 1.714 18.604 362 HG2 GLN 56 HG2 GLN 56 39.171 0.082 17.649 363 HG3 GLN 56 HG1 GLN 56 39.903 0.345 16.065 364 HE21 GLN 56 HE21 GLN 56 42.540 0.219 16.325 365 HE22 GLN 56 HE22 GLN 56 43.068 -1.173 17.141 366 H GLY 57 HN GLY 57 38.233 4.215 15.709 367 HA2 GLY 57 HA2 GLY 57 38.656 6.492 15.075 368 HA3 GLY 57 HA1 GLY 57 40.189 6.420 15.946 369 HA PRO 58 HA PRO 58 41.511 5.951 11.635 370 HB2 PRO 58 HB2 PRO 58 43.973 7.054 11.967 371 HB3 PRO 58 HB1 PRO 58 42.501 8.032 11.805 372 HG2 PRO 58 HG2 PRO 58 44.074 7.367 14.229 373 HG3 PRO 58 HG1 PRO 58 43.189 8.845 13.823 374 HD2 PRO 58 HD2 PRO 58 42.262 6.839 15.534 375 HD3 PRO 58 HD1 PRO 58 41.244 8.068 14.752 376 HA PRO 59 HA PRO 59 43.739 2.152 12.412 377 HB2 PRO 59 HB2 PRO 59 44.106 1.421 9.820 378 HB3 PRO 59 HB1 PRO 59 42.535 1.311 10.629 379 HG2 PRO 59 HG2 PRO 59 43.548 3.367 8.734 380 HG3 PRO 59 HG1 PRO 59 41.935 2.644 8.862 381 HD2 PRO 59 HD2 PRO 59 42.577 5.131 9.860 382 HD3 PRO 59 HD1 PRO 59 41.264 4.119 10.499 383 HA PRO 60 HA PRO 60 47.937 3.881 12.104 384 HB2 PRO 60 HB2 PRO 60 48.648 1.233 13.233 385 HB3 PRO 60 HB1 PRO 60 49.015 2.853 13.850 386 HG2 PRO 60 HG2 PRO 60 47.201 1.247 15.002 387 HG3 PRO 60 HG1 PRO 60 47.046 3.011 14.992 388 HD2 PRO 60 HD2 PRO 60 45.561 0.982 13.381 389 HD3 PRO 60 HD1 PRO 60 45.024 2.567 13.984 390 HA PRO 61 HA PRO 61 49.522 2.227 8.326 391 HB2 PRO 61 HB2 PRO 61 52.061 1.767 9.843 392 HB3 PRO 61 HB1 PRO 61 51.818 2.520 8.254 393 HG2 PRO 61 HG2 PRO 61 52.258 3.980 10.417 394 HG3 PRO 61 HG1 PRO 61 51.145 4.510 9.143 395 HD2 PRO 61 HD2 PRO 61 50.515 3.533 11.888 396 HD3 PRO 61 HD1 PRO 61 49.567 4.597 10.826 397 H TYR 62 HN TYR 62 49.666 0.265 7.373 398 HA TYR 62 HA TYR 62 48.886 -2.118 8.534 399 HB2 TYR 62 HB2 TYR 62 50.097 -3.192 6.602 400 HB3 TYR 62 HB1 TYR 62 49.060 -1.842 6.145 401 HD1 TYR 62 HD1 TYR 62 50.936 -2.429 4.174 402 HD2 TYR 62 HD2 TYR 62 51.608 -0.242 7.805 403 HE1 TYR 62 HE1 TYR 62 52.856 -1.275 3.142 404 HE2 TYR 62 HE2 TYR 62 53.516 0.909 6.779 405 HH TYR 62 HH TYR 62 55.171 -0.030 4.428 406 HA PRO 63 HA PRO 63 52.110 -3.655 11.117 407 HB2 PRO 63 HB2 PRO 63 52.207 -6.313 10.314 408 HB3 PRO 63 HB1 PRO 63 51.017 -5.640 11.443 409 HG2 PRO 63 HG2 PRO 63 50.755 -6.220 8.537 410 HG3 PRO 63 HG1 PRO 63 49.572 -6.424 9.843 411 HD2 PRO 63 HD2 PRO 63 49.432 -4.349 8.118 412 HD3 PRO 63 HD1 PRO 63 48.956 -4.178 9.821 413 H LYS 64 HN LYS 64 54.358 -3.956 11.067 414 HA LYS 64 HA LYS 64 55.781 -3.377 8.682 415 HB2 LYS 64 HB2 LYS 64 56.553 -4.517 11.355 416 HB3 LYS 64 HB1 LYS 64 57.740 -4.482 10.050 417 HG2 LYS 64 HG2 LYS 64 57.089 -2.001 9.769 418 HG3 LYS 64 HG1 LYS 64 56.323 -2.155 11.350 419 HD2 LYS 64 HD2 LYS 64 58.350 -1.744 12.253 420 HD3 LYS 64 HD1 LYS 64 58.833 -3.341 11.681 421 HE2 LYS 64 HE2 LYS 64 59.313 -2.168 9.424 422 HE3 LYS 64 HE1 LYS 64 59.247 -0.668 10.347 423 HZ1 LYS 64 HZ1 LYS 64 61.208 -2.828 10.445 424 HZ2 LYS 64 HZ2 LYS 64 60.839 -2.053 11.910 425 HZ3 LYS 64 HZ3 LYS 64 61.431 -1.153 10.595 426 H HIS 65 HN HIS 65 55.324 -4.737 6.950 427 HA HIS 65 HA HIS 65 55.594 -7.666 7.355 428 HB2 HIS 65 HB2 HIS 65 54.067 -5.967 5.580 429 HB3 HIS 65 HB1 HIS 65 55.031 -7.110 4.646 430 HD1 HIS 65 HD1 HIS 65 53.933 -8.128 8.057 431 HD2 HIS 65 HD2 HIS 65 52.650 -8.665 4.124 432 HE1 HIS 65 HE1 HIS 65 52.205 -9.981 8.113 433 HE2 HIS 65 HE2 HIS 65 51.417 -10.315 5.724 Start of MODEL 6 1 H1 SER 7 HT1 SER 7 20.650 -14.457 -2.849 2 H2 SER 7 HT2 SER 7 22.287 -14.007 -2.890 3 H3 SER 7 HT3 SER 7 21.405 -13.883 -1.444 4 HA SER 7 HA SER 7 21.851 -15.966 -0.885 5 HB2 SER 7 HB2 SER 7 21.518 -17.272 -3.491 6 HB3 SER 7 HB1 SER 7 20.700 -17.591 -1.964 7 HG SER 7 HG SER 7 19.286 -15.940 -2.395 8 H PHE 8 HN PHE 8 22.853 -16.185 -4.308 9 HA PHE 8 HA PHE 8 25.234 -17.524 -4.014 10 HB2 PHE 8 HB2 PHE 8 25.817 -15.387 -5.808 11 HB3 PHE 8 HB1 PHE 8 25.327 -17.033 -6.209 12 HD1 PHE 8 HD1 PHE 8 23.401 -17.271 -7.488 13 HD2 PHE 8 HD2 PHE 8 23.766 -13.888 -4.866 14 HE1 PHE 8 HE1 PHE 8 21.204 -16.430 -8.269 15 HE2 PHE 8 HE2 PHE 8 21.568 -13.047 -5.647 16 HZ PHE 8 HZ PHE 8 20.286 -14.317 -7.348 17 H GLU 9 HN GLU 9 27.518 -16.695 -3.966 18 HA GLU 9 HA GLU 9 27.795 -14.155 -2.430 19 HB2 GLU 9 HB2 GLU 9 29.749 -15.905 -1.412 20 HB3 GLU 9 HB1 GLU 9 28.315 -15.318 -0.570 21 HG2 GLU 9 HG2 GLU 9 28.293 -17.744 -0.507 22 HG3 GLU 9 HG1 GLU 9 27.015 -17.206 -1.596 23 H ILE 10 HN ILE 10 28.985 -12.947 -3.844 24 HA ILE 10 HA ILE 10 30.635 -13.818 -5.914 25 HB ILE 10 HB ILE 10 31.370 -11.423 -4.230 26 HG12 ILE 10 HG12 ILE 10 28.936 -11.910 -5.927 27 HG13 ILE 10 HG11 ILE 10 29.064 -11.062 -4.386 28 HG21 ILE 10 HG21 ILE 10 32.200 -10.541 -6.246 29 HG22 ILE 10 HG22 ILE 10 31.232 -11.636 -7.233 30 HG23 ILE 10 HG23 ILE 10 32.633 -12.247 -6.354 31 HD11 ILE 10 HD11 ILE 10 30.453 -9.308 -5.608 32 HD12 ILE 10 HD12 ILE 10 28.745 -9.368 -6.047 33 HD13 ILE 10 HD13 ILE 10 29.953 -10.089 -7.109 34 HA PRO 11 HA PRO 11 33.744 -16.214 -3.738 35 HB2 PRO 11 HB2 PRO 11 35.274 -15.416 -6.184 36 HB3 PRO 11 HB1 PRO 11 35.093 -17.016 -5.440 37 HG2 PRO 11 HG2 PRO 11 33.743 -16.315 -7.639 38 HG3 PRO 11 HG1 PRO 11 33.057 -17.389 -6.410 39 HD2 PRO 11 HD2 PRO 11 32.349 -14.580 -7.039 40 HD3 PRO 11 HD1 PRO 11 31.379 -15.838 -6.243 41 H ASP 12 HN ASP 12 35.056 -15.418 -2.153 42 HA ASP 12 HA ASP 12 35.857 -12.689 -2.024 43 HB2 ASP 12 HB2 ASP 12 37.578 -14.478 -0.489 44 HB3 ASP 12 HB1 ASP 12 36.471 -13.232 0.088 45 H ASP 13 HN ASP 13 36.847 -14.847 -4.130 46 HA ASP 13 HA ASP 13 39.725 -14.526 -4.086 47 HB2 ASP 13 HB2 ASP 13 37.842 -16.052 -5.573 48 HB3 ASP 13 HB1 ASP 13 38.757 -15.091 -6.735 49 H VAL 14 HN VAL 14 37.982 -12.113 -4.026 50 HA VAL 14 HA VAL 14 38.511 -10.767 -6.578 51 HB VAL 14 HB VAL 14 36.454 -10.158 -5.522 52 HG11 VAL 14 HG11 VAL 14 36.365 -10.543 -3.293 53 HG12 VAL 14 HG12 VAL 14 37.052 -8.930 -3.110 54 HG13 VAL 14 HG13 VAL 14 38.108 -10.343 -3.108 55 HG21 VAL 14 HG21 VAL 14 38.484 -7.981 -4.925 56 HG22 VAL 14 HG22 VAL 14 36.750 -7.748 -5.143 57 HG23 VAL 14 HG23 VAL 14 37.746 -8.273 -6.500 58 HA PRO 15 HA PRO 15 42.538 -9.647 -4.871 59 HB2 PRO 15 HB2 PRO 15 43.560 -8.657 -7.206 60 HB3 PRO 15 HB1 PRO 15 43.494 -10.389 -6.824 61 HG2 PRO 15 HG2 PRO 15 41.735 -8.770 -8.582 62 HG3 PRO 15 HG1 PRO 15 42.293 -10.440 -8.766 63 HD2 PRO 15 HD2 PRO 15 39.776 -9.746 -7.867 64 HD3 PRO 15 HD1 PRO 15 40.575 -11.288 -7.493 65 H LEU 16 HN LEU 16 42.988 -7.762 -3.812 66 HA LEU 16 HA LEU 16 41.440 -5.373 -4.176 67 HB2 LEU 16 HB2 LEU 16 44.143 -5.750 -2.859 68 HB3 LEU 16 HB1 LEU 16 43.077 -4.373 -2.628 69 HG LEU 16 HG LEU 16 43.164 -6.582 -1.030 70 HD11 LEU 16 HD11 LEU 16 40.988 -4.569 -1.589 71 HD12 LEU 16 HD12 LEU 16 42.165 -4.574 -0.276 72 HD13 LEU 16 HD13 LEU 16 40.844 -5.743 -0.282 73 HD21 LEU 16 HD21 LEU 16 40.885 -6.949 -3.001 74 HD22 LEU 16 HD22 LEU 16 40.916 -7.695 -1.408 75 HD23 LEU 16 HD23 LEU 16 42.150 -8.109 -2.593 76 HA PRO 17 HA PRO 17 43.318 -3.006 -7.407 77 HB2 PRO 17 HB2 PRO 17 44.345 -0.911 -5.714 78 HB3 PRO 17 HB1 PRO 17 42.956 -0.869 -6.806 79 HG2 PRO 17 HG2 PRO 17 43.011 -1.168 -3.925 80 HG3 PRO 17 HG1 PRO 17 41.648 -0.822 -4.996 81 HD2 PRO 17 HD2 PRO 17 41.985 -3.207 -3.650 82 HD3 PRO 17 HD1 PRO 17 41.037 -3.031 -5.139 83 H ALA 18 HN ALA 18 45.594 -1.233 -6.868 84 HA ALA 18 HA ALA 18 47.666 -3.306 -7.093 85 HB1 ALA 18 HB1 ALA 18 47.542 -0.349 -7.633 86 HB2 ALA 18 HB2 ALA 18 47.749 -1.666 -8.788 87 HB3 ALA 18 HB3 ALA 18 49.062 -1.241 -7.690 88 H GLY 19 HN GLY 19 49.225 -3.683 -5.590 89 HA2 GLY 19 HA2 GLY 19 50.512 -3.469 -3.643 90 HA3 GLY 19 HA1 GLY 19 50.139 -1.747 -3.680 91 H TRP 20 HN TRP 20 47.461 -3.968 -3.618 92 HA TRP 20 HA TRP 20 46.918 -3.072 -0.838 93 HB2 TRP 20 HB2 TRP 20 45.145 -4.067 -3.044 94 HB3 TRP 20 HB1 TRP 20 44.578 -3.805 -1.390 95 HD1 TRP 20 HD1 TRP 20 45.612 -2.003 -4.518 96 HE1 TRP 20 HE1 TRP 20 45.216 0.516 -4.219 97 HE3 TRP 20 HE3 TRP 20 44.591 -1.938 0.440 98 HZ2 TRP 20 HZ2 TRP 20 44.553 2.350 -2.070 99 HZ3 TRP 20 HZ3 TRP 20 44.099 0.164 1.613 100 HH2 TRP 20 HH2 TRP 20 44.072 2.325 0.371 101 H GLU 21 HN GLU 21 46.043 -4.567 0.715 102 HA GLU 21 HA GLU 21 46.019 -7.424 0.105 103 HB2 GLU 21 HB2 GLU 21 48.519 -6.491 0.577 104 HB3 GLU 21 HB1 GLU 21 48.001 -6.822 2.230 105 HG2 GLU 21 HG2 GLU 21 48.769 -8.923 1.697 106 HG3 GLU 21 HG1 GLU 21 47.127 -9.080 1.071 107 H MET 22 HN MET 22 44.277 -8.063 1.310 108 HA MET 22 HA MET 22 43.274 -6.536 3.509 109 HB2 MET 22 HB2 MET 22 41.543 -7.812 2.774 110 HB3 MET 22 HB1 MET 22 42.615 -9.076 2.168 111 HG2 MET 22 HG2 MET 22 42.887 -10.011 4.353 112 HG3 MET 22 HG1 MET 22 42.097 -8.628 5.108 113 HE1 MET 22 HE1 MET 22 40.025 -11.465 2.158 114 HE2 MET 22 HE2 MET 22 41.743 -11.090 2.267 115 HE3 MET 22 HE3 MET 22 40.619 -9.870 1.675 116 H ALA 23 HN ALA 23 43.612 -6.789 5.711 117 HA ALA 23 HA ALA 23 45.206 -9.084 6.663 118 HB1 ALA 23 HB1 ALA 23 46.937 -7.512 6.007 119 HB2 ALA 23 HB2 ALA 23 46.844 -7.540 7.767 120 HB3 ALA 23 HB3 ALA 23 46.122 -6.208 6.865 121 H LYS 24 HN LYS 24 45.484 -8.791 9.184 122 HA LYS 24 HA LYS 24 43.032 -7.439 10.198 123 HB2 LYS 24 HB2 LYS 24 43.028 -10.014 10.168 124 HB3 LYS 24 HB1 LYS 24 44.209 -9.897 11.477 125 HG2 LYS 24 HG2 LYS 24 42.585 -8.353 12.663 126 HG3 LYS 24 HG1 LYS 24 41.393 -8.792 11.440 127 HD2 LYS 24 HD2 LYS 24 42.834 -10.756 13.247 128 HD3 LYS 24 HD1 LYS 24 41.174 -10.204 13.469 129 HE2 LYS 24 HE2 LYS 24 40.592 -11.974 12.181 130 HE3 LYS 24 HE1 LYS 24 41.192 -11.016 10.828 131 HZ1 LYS 24 HZ1 LYS 24 42.437 -12.893 10.594 132 HZ2 LYS 24 HZ2 LYS 24 42.476 -13.226 12.260 133 HZ3 LYS 24 HZ3 LYS 24 43.465 -12.007 11.611 134 H THR 25 HN THR 25 43.151 -6.633 12.356 135 HA THR 25 HA THR 25 45.641 -5.333 12.988 136 HB THR 25 HB THR 25 43.355 -4.481 13.564 137 HG1 THR 25 HG1 THR 25 44.957 -3.559 14.728 138 HG21 THR 25 HG21 THR 25 42.017 -5.522 15.136 139 HG22 THR 25 HG22 THR 25 43.373 -6.372 15.876 140 HG23 THR 25 HG23 THR 25 42.743 -6.904 14.317 141 H SER 26 HN SER 26 46.387 -5.600 15.467 142 HA SER 26 HA SER 26 47.981 -7.636 15.971 143 HB2 SER 26 HB2 SER 26 47.831 -6.815 18.064 144 HB3 SER 26 HB1 SER 26 46.257 -6.111 17.702 145 HG SER 26 HG SER 26 46.098 -7.643 19.370 146 H SER 27 HN SER 27 44.452 -8.048 16.008 147 HA SER 27 HA SER 27 44.241 -10.519 14.875 148 HB2 SER 27 HB2 SER 27 45.333 -10.748 17.640 149 HB3 SER 27 HB1 SER 27 44.135 -11.937 17.135 150 HG SER 27 HG SER 27 46.657 -12.007 16.612 151 H GLY 28 HN GLY 28 42.231 -9.178 14.607 152 HA2 GLY 28 HA2 GLY 28 40.018 -10.245 15.941 153 HA3 GLY 28 HA1 GLY 28 40.457 -8.809 16.863 154 H GLN 29 HN GLN 29 41.319 -7.191 14.629 155 HA GLN 29 HA GLN 29 38.659 -6.746 13.371 156 HB2 GLN 29 HB2 GLN 29 40.857 -4.690 13.562 157 HB3 GLN 29 HB1 GLN 29 39.136 -4.427 13.291 158 HG2 GLN 29 HG2 GLN 29 39.958 -5.805 15.816 159 HG3 GLN 29 HG1 GLN 29 40.217 -4.064 15.699 160 HE21 GLN 29 HE21 GLN 29 37.856 -6.468 16.352 161 HE22 GLN 29 HE22 GLN 29 36.490 -5.461 16.316 162 H ARG 30 HN ARG 30 38.530 -7.171 11.238 163 HA ARG 30 HA ARG 30 40.966 -7.675 9.687 164 HB2 ARG 30 HB2 ARG 30 38.111 -8.245 9.439 165 HB3 ARG 30 HB1 ARG 30 38.810 -7.678 7.922 166 HG2 ARG 30 HG2 ARG 30 40.687 -9.365 8.311 167 HG3 ARG 30 HG1 ARG 30 39.682 -10.042 9.594 168 HD2 ARG 30 HD2 ARG 30 38.350 -9.592 6.974 169 HD3 ARG 30 HD1 ARG 30 39.541 -10.893 7.037 170 HE ARG 30 HE ARG 30 38.096 -12.094 8.492 171 HH11 ARG 30 HH11 ARG 30 36.082 -12.389 9.476 172 HH12 ARG 30 HH12 ARG 30 34.980 -11.058 9.582 173 HH21 ARG 30 HH21 ARG 30 37.107 -8.830 7.988 174 HH22 ARG 30 HH22 ARG 30 35.560 -9.042 8.738 175 H TYR 31 HN TYR 31 41.790 -6.297 8.082 176 HA TYR 31 HA TYR 31 40.201 -3.963 7.296 177 HB2 TYR 31 HB2 TYR 31 42.215 -2.436 7.816 178 HB3 TYR 31 HB1 TYR 31 41.171 -2.901 9.151 179 HD1 TYR 31 HD1 TYR 31 42.751 -2.671 10.936 180 HD2 TYR 31 HD2 TYR 31 43.681 -5.141 7.546 181 HE1 TYR 31 HE1 TYR 31 44.740 -3.555 12.115 182 HE2 TYR 31 HE2 TYR 31 45.658 -6.023 8.741 183 HH TYR 31 HH TYR 31 46.927 -4.592 11.506 184 H PHE 32 HN PHE 32 41.980 -2.526 5.867 185 HA PHE 32 HA PHE 32 43.136 -4.566 4.018 186 HB2 PHE 32 HB2 PHE 32 41.969 -1.856 3.328 187 HB3 PHE 32 HB1 PHE 32 42.619 -3.025 2.177 188 HD1 PHE 32 HD1 PHE 32 41.455 -5.154 1.744 189 HD2 PHE 32 HD2 PHE 32 39.819 -2.202 4.401 190 HE1 PHE 32 HE1 PHE 32 39.258 -6.301 1.667 191 HE2 PHE 32 HE2 PHE 32 37.623 -3.349 4.323 192 HZ PHE 32 HZ PHE 32 37.341 -5.399 2.956 193 H LEU 33 HN LEU 33 45.263 -4.386 3.564 194 HA LEU 33 HA LEU 33 46.738 -2.078 4.703 195 HB2 LEU 33 HB2 LEU 33 47.914 -4.493 3.313 196 HB3 LEU 33 HB1 LEU 33 48.712 -3.401 4.444 197 HG LEU 33 HG LEU 33 46.542 -5.422 5.045 198 HD11 LEU 33 HD11 LEU 33 48.369 -5.969 6.827 199 HD12 LEU 33 HD12 LEU 33 49.437 -5.031 5.783 200 HD13 LEU 33 HD13 LEU 33 48.642 -6.477 5.160 201 HD21 LEU 33 HD21 LEU 33 47.345 -2.938 6.457 202 HD22 LEU 33 HD22 LEU 33 47.144 -4.371 7.460 203 HD23 LEU 33 HD23 LEU 33 45.803 -3.787 6.473 204 H ASN 34 HN ASN 34 47.568 -0.467 3.434 205 HA ASN 34 HA ASN 34 47.324 -0.831 0.477 206 HB2 ASN 34 HB2 ASN 34 46.184 1.121 1.793 207 HB3 ASN 34 HB1 ASN 34 47.806 1.814 1.817 208 HD21 ASN 34 HD21 ASN 34 47.799 0.008 -0.940 209 HD22 ASN 34 HD22 ASN 34 47.266 1.171 -2.055 210 H HIS 35 HN HIS 35 49.238 -1.361 -0.458 211 HA HIS 35 HA HIS 35 51.778 -0.763 0.862 212 HB2 HIS 35 HB2 HIS 35 51.387 -1.809 -1.952 213 HB3 HIS 35 HB1 HIS 35 52.801 -2.001 -0.918 214 HD1 HIS 35 HD1 HIS 35 51.908 -4.622 -1.755 215 HD2 HIS 35 HD2 HIS 35 49.972 -2.694 1.397 216 HE1 HIS 35 HE1 HIS 35 50.716 -6.427 -0.433 217 HE2 HIS 35 HE2 HIS 35 49.535 -5.264 1.487 218 H ILE 36 HN ILE 36 49.659 0.861 -1.209 219 HA ILE 36 HA ILE 36 51.702 2.454 -2.588 220 HB ILE 36 HB ILE 36 48.818 3.253 -2.425 221 HG12 ILE 36 HG12 ILE 36 49.391 0.633 -2.901 222 HG13 ILE 36 HG11 ILE 36 48.019 1.475 -3.605 223 HG21 ILE 36 HG21 ILE 36 50.986 3.290 -4.538 224 HG22 ILE 36 HG22 ILE 36 50.243 4.673 -3.733 225 HG23 ILE 36 HG23 ILE 36 49.308 3.712 -4.878 226 HD11 ILE 36 HD11 ILE 36 50.724 1.471 -4.944 227 HD12 ILE 36 HD12 ILE 36 49.154 1.847 -5.654 228 HD13 ILE 36 HD13 ILE 36 49.552 0.184 -5.225 229 H ASP 37 HN ASP 37 49.073 3.118 -0.292 230 HA ASP 37 HA ASP 37 50.330 5.648 0.473 231 HB2 ASP 37 HB2 ASP 37 47.823 4.217 1.350 232 HB3 ASP 37 HB1 ASP 37 48.402 5.657 2.190 233 H GLN 38 HN GLN 38 50.930 2.577 1.114 234 HA GLN 38 HA GLN 38 51.974 1.393 2.849 235 HB2 GLN 38 HB2 GLN 38 53.177 4.111 2.748 236 HB3 GLN 38 HB1 GLN 38 53.595 3.095 4.129 237 HG2 GLN 38 HG2 GLN 38 54.234 1.271 2.575 238 HG3 GLN 38 HG1 GLN 38 53.862 2.323 1.210 239 HE21 GLN 38 HE21 GLN 38 55.068 4.608 1.445 240 HE22 GLN 38 HE22 GLN 38 56.702 4.507 1.898 241 H THR 39 HN THR 39 49.574 1.596 3.765 242 HA THR 39 HA THR 39 49.840 2.044 6.602 243 HB THR 39 HB THR 39 49.362 4.266 6.364 244 HG1 THR 39 HG1 THR 39 46.968 4.449 6.479 245 HG21 THR 39 HG21 THR 39 49.010 5.047 4.285 246 HG22 THR 39 HG22 THR 39 47.320 4.579 4.458 247 HG23 THR 39 HG23 THR 39 48.476 3.456 3.744 248 H THR 40 HN THR 40 47.321 2.127 7.405 249 HA THR 40 HA THR 40 46.042 -0.208 6.048 250 HB THR 40 HB THR 40 45.058 -0.687 8.344 251 HG1 THR 40 HG1 THR 40 47.105 0.771 9.488 252 HG21 THR 40 HG21 THR 40 47.732 -1.019 9.133 253 HG22 THR 40 HG22 THR 40 47.749 -1.096 7.372 254 HG23 THR 40 HG23 THR 40 46.719 -2.192 8.296 255 H THR 41 HN THR 41 43.639 -0.218 6.203 256 HA THR 41 HA THR 41 42.395 2.373 6.863 257 HB THR 41 HB THR 41 42.493 2.943 4.689 258 HG1 THR 41 HG1 THR 41 40.542 2.640 4.012 259 HG21 THR 41 HG21 THR 41 42.550 0.985 2.903 260 HG22 THR 41 HG22 THR 41 43.080 0.048 4.298 261 HG23 THR 41 HG23 THR 41 44.006 1.455 3.777 262 H TRP 42 HN TRP 42 40.236 2.213 7.390 263 HA TRP 42 HA TRP 42 39.240 -0.497 7.947 264 HB2 TRP 42 HB2 TRP 42 37.895 2.194 8.366 265 HB3 TRP 42 HB1 TRP 42 37.355 0.652 9.023 266 HD1 TRP 42 HD1 TRP 42 39.147 3.582 10.045 267 HE1 TRP 42 HE1 TRP 42 40.673 3.126 12.074 268 HE3 TRP 42 HE3 TRP 42 39.227 -1.521 9.949 269 HZ2 TRP 42 HZ2 TRP 42 41.779 0.886 13.472 270 HZ3 TRP 42 HZ3 TRP 42 40.522 -2.790 11.639 271 HH2 TRP 42 HH2 TRP 42 41.797 -1.594 13.397 272 H GLN 43 HN GLN 43 39.229 1.670 5.389 273 HA GLN 43 HA GLN 43 36.719 0.485 4.289 274 HB2 GLN 43 HB2 GLN 43 36.620 2.946 4.653 275 HB3 GLN 43 HB1 GLN 43 38.005 3.136 3.579 276 HG2 GLN 43 HG2 GLN 43 36.159 3.506 2.163 277 HG3 GLN 43 HG1 GLN 43 36.583 1.822 1.855 278 HE21 GLN 43 HE21 GLN 43 34.642 3.501 4.407 279 HE22 GLN 43 HE22 GLN 43 33.305 2.465 4.269 280 H ASP 44 HN ASP 44 36.775 -0.144 2.053 281 HA ASP 44 HA ASP 44 39.520 -0.362 0.918 282 HB2 ASP 44 HB2 ASP 44 37.876 -2.467 1.762 283 HB3 ASP 44 HB1 ASP 44 37.705 -2.442 0.006 284 HA PRO 45 HA PRO 45 37.990 1.695 -2.661 285 HB2 PRO 45 HB2 PRO 45 39.274 0.072 -4.584 286 HB3 PRO 45 HB1 PRO 45 39.922 1.548 -3.849 287 HG2 PRO 45 HG2 PRO 45 40.499 -1.276 -3.230 288 HG3 PRO 45 HG1 PRO 45 41.519 0.159 -3.044 289 HD2 PRO 45 HD2 PRO 45 40.351 -1.106 -0.929 290 HD3 PRO 45 HD1 PRO 45 40.692 0.638 -0.937 291 H ARG 46 HN ARG 46 37.593 -1.737 -2.232 292 HA ARG 46 HA ARG 46 35.679 -1.961 -4.455 293 HB2 ARG 46 HB2 ARG 46 36.467 -3.968 -2.321 294 HB3 ARG 46 HB1 ARG 46 35.478 -4.315 -3.739 295 HG2 ARG 46 HG2 ARG 46 37.528 -4.938 -4.584 296 HG3 ARG 46 HG1 ARG 46 37.580 -3.222 -4.989 297 HD2 ARG 46 HD2 ARG 46 39.653 -4.093 -3.823 298 HD3 ARG 46 HD1 ARG 46 38.884 -2.719 -3.031 299 HE ARG 46 HE ARG 46 38.526 -4.120 -1.181 300 HH11 ARG 46 HH11 ARG 46 38.355 -6.120 -0.143 301 HH12 ARG 46 HH12 ARG 46 38.422 -7.576 -1.079 302 HH21 ARG 46 HH21 ARG 46 38.809 -5.926 -4.104 303 HH22 ARG 46 HH22 ARG 46 38.679 -7.465 -3.322 304 H LYS 47 HN LYS 47 35.228 -0.186 -2.089 305 HA LYS 47 HA LYS 47 32.455 -1.023 -1.591 306 HB2 LYS 47 HB2 LYS 47 34.555 -0.864 0.568 307 HB3 LYS 47 HB1 LYS 47 32.853 -0.581 0.934 308 HG2 LYS 47 HG2 LYS 47 32.335 -2.797 -0.159 309 HG3 LYS 47 HG1 LYS 47 34.073 -3.083 -0.261 310 HD2 LYS 47 HD2 LYS 47 33.786 -2.332 2.366 311 HD3 LYS 47 HD1 LYS 47 32.286 -3.213 2.077 312 HE2 LYS 47 HE2 LYS 47 34.990 -4.314 1.290 313 HE3 LYS 47 HE1 LYS 47 34.264 -4.622 2.866 314 HZ1 LYS 47 HZ1 LYS 47 32.470 -5.063 0.663 315 HZ2 LYS 47 HZ2 LYS 47 32.816 -6.055 1.998 316 HZ3 LYS 47 HZ3 LYS 47 33.827 -6.081 0.634 317 H ALA 48 HN ALA 48 31.291 0.805 -1.918 318 HA ALA 48 HA ALA 48 32.284 3.358 -0.781 319 HB1 ALA 48 HB1 ALA 48 31.801 4.538 -2.925 320 HB2 ALA 48 HB2 ALA 48 31.520 2.976 -3.692 321 HB3 ALA 48 HB3 ALA 48 33.123 3.380 -3.078 322 H MET 49 HN MET 49 30.523 3.303 0.677 323 HA MET 49 HA MET 49 27.799 3.256 -0.533 324 HB2 MET 49 HB2 MET 49 28.581 3.127 2.394 325 HB3 MET 49 HB1 MET 49 26.979 2.836 1.716 326 HG2 MET 49 HG2 MET 49 29.470 1.179 1.229 327 HG3 MET 49 HG1 MET 49 28.051 0.693 2.155 328 HE1 MET 49 HE1 MET 49 27.492 -1.670 0.213 329 HE2 MET 49 HE2 MET 49 29.111 -1.042 0.508 330 HE3 MET 49 HE3 MET 49 28.561 -1.298 -1.146 331 H GLY 50 HN GLY 50 27.614 5.391 -1.289 332 HA2 GLY 50 HA2 GLY 50 27.313 7.715 -1.146 333 HA3 GLY 50 HA1 GLY 50 26.740 7.393 0.491 334 H GLY 51 HN GLY 51 28.280 7.467 2.236 335 HA2 GLY 51 HA2 GLY 51 31.004 8.432 1.588 336 HA3 GLY 51 HA1 GLY 51 29.982 9.505 2.547 337 H GLY 52 HN GLY 52 29.835 9.132 4.731 338 HA2 GLY 52 HA2 GLY 52 29.801 7.702 6.689 339 HA3 GLY 52 HA1 GLY 52 30.698 6.487 5.778 340 H GLY 53 HN GLY 53 32.071 6.575 7.815 341 HA2 GLY 53 HA2 GLY 53 34.583 7.285 7.688 342 HA3 GLY 53 HA1 GLY 53 33.919 8.915 7.820 343 H ASN 54 HN ASN 54 33.036 5.875 9.478 344 HA ASN 54 HA ASN 54 33.905 7.079 12.049 345 HB2 ASN 54 HB2 ASN 54 31.177 5.814 11.851 346 HB3 ASN 54 HB1 ASN 54 31.806 6.894 13.096 347 HD21 ASN 54 HD21 ASN 54 29.408 7.110 11.126 348 HD22 ASN 54 HD22 ASN 54 29.605 8.647 10.433 349 H TYR 55 HN TYR 55 35.314 5.524 12.730 350 HA TYR 55 HA TYR 55 34.298 2.733 12.892 351 HB2 TYR 55 HB2 TYR 55 37.113 2.686 12.297 352 HB3 TYR 55 HB1 TYR 55 35.788 1.942 11.401 353 HD1 TYR 55 HD1 TYR 55 35.216 2.751 9.276 354 HD2 TYR 55 HD2 TYR 55 37.459 5.250 11.955 355 HE1 TYR 55 HE1 TYR 55 35.483 4.437 7.478 356 HE2 TYR 55 HE2 TYR 55 37.726 6.937 10.156 357 HH TYR 55 HH TYR 55 36.077 6.590 7.053 358 H GLN 56 HN GLN 56 36.717 1.648 13.916 359 HA GLN 56 HA GLN 56 36.552 2.577 16.652 360 HB2 GLN 56 HB2 GLN 56 38.120 0.837 17.165 361 HB3 GLN 56 HB1 GLN 56 37.072 0.196 15.899 362 HG2 GLN 56 HG2 GLN 56 38.760 0.827 14.197 363 HG3 GLN 56 HG1 GLN 56 39.816 1.420 15.480 364 HE21 GLN 56 HE21 GLN 56 37.831 -1.439 16.032 365 HE22 GLN 56 HE22 GLN 56 39.107 -2.557 16.006 366 H GLY 57 HN GLY 57 37.573 4.379 14.440 367 HA2 GLY 57 HA2 GLY 57 38.952 6.334 14.825 368 HA3 GLY 57 HA1 GLY 57 39.915 5.391 15.965 369 HA PRO 58 HA PRO 58 41.790 5.783 11.525 370 HB2 PRO 58 HB2 PRO 58 44.032 6.744 13.243 371 HB3 PRO 58 HB1 PRO 58 43.491 7.334 11.661 372 HG2 PRO 58 HG2 PRO 58 42.972 8.662 13.922 373 HG3 PRO 58 HG1 PRO 58 41.844 8.641 12.557 374 HD2 PRO 58 HD2 PRO 58 41.637 7.257 15.182 375 HD3 PRO 58 HD1 PRO 58 40.349 7.798 14.084 376 HA PRO 59 HA PRO 59 43.642 1.839 12.602 377 HB2 PRO 59 HB2 PRO 59 44.204 1.049 10.051 378 HB3 PRO 59 HB1 PRO 59 42.580 0.979 10.751 379 HG2 PRO 59 HG2 PRO 59 43.730 2.913 8.832 380 HG3 PRO 59 HG1 PRO 59 42.073 2.310 8.980 381 HD2 PRO 59 HD2 PRO 59 42.953 4.797 9.884 382 HD3 PRO 59 HD1 PRO 59 41.475 3.976 10.427 383 HA PRO 60 HA PRO 60 47.912 3.373 12.684 384 HB2 PRO 60 HB2 PRO 60 48.389 0.656 13.785 385 HB3 PRO 60 HB1 PRO 60 48.817 2.237 14.462 386 HG2 PRO 60 HG2 PRO 60 46.822 0.746 15.449 387 HG3 PRO 60 HG1 PRO 60 46.778 2.517 15.449 388 HD2 PRO 60 HD2 PRO 60 45.287 0.599 13.716 389 HD3 PRO 60 HD1 PRO 60 44.819 2.219 14.279 390 HA PRO 61 HA PRO 61 49.498 1.807 8.843 391 HB2 PRO 61 HB2 PRO 61 52.083 1.761 10.359 392 HB3 PRO 61 HB1 PRO 61 51.732 2.428 8.753 393 HG2 PRO 61 HG2 PRO 61 51.968 3.986 10.910 394 HG3 PRO 61 HG1 PRO 61 50.839 4.355 9.597 395 HD2 PRO 61 HD2 PRO 61 50.252 3.424 12.348 396 HD3 PRO 61 HD1 PRO 61 49.200 4.274 11.196 397 H TYR 62 HN TYR 62 49.616 -0.261 8.064 398 HA TYR 62 HA TYR 62 49.220 -2.586 9.421 399 HB2 TYR 62 HB2 TYR 62 50.836 -3.640 7.624 400 HB3 TYR 62 HB1 TYR 62 49.344 -2.859 7.105 401 HD1 TYR 62 HD1 TYR 62 52.823 -1.800 8.046 402 HD2 TYR 62 HD2 TYR 62 49.550 -1.443 5.293 403 HE1 TYR 62 HE1 TYR 62 54.131 -0.185 6.708 404 HE2 TYR 62 HE2 TYR 62 50.854 0.166 3.953 405 HH TYR 62 HH TYR 62 54.206 0.662 4.422 406 HA PRO 63 HA PRO 63 52.434 -3.790 12.163 407 HB2 PRO 63 HB2 PRO 63 53.325 -6.151 10.843 408 HB3 PRO 63 HB1 PRO 63 52.125 -6.041 12.142 409 HG2 PRO 63 HG2 PRO 63 51.731 -6.244 9.215 410 HG3 PRO 63 HG1 PRO 63 50.714 -6.837 10.541 411 HD2 PRO 63 HD2 PRO 63 49.988 -4.685 9.108 412 HD3 PRO 63 HD1 PRO 63 49.688 -4.756 10.859 413 H LYS 64 HN LYS 64 54.844 -4.251 12.257 414 HA LYS 64 HA LYS 64 56.194 -2.929 9.945 415 HB2 LYS 64 HB2 LYS 64 57.375 -3.344 12.696 416 HB3 LYS 64 HB1 LYS 64 57.866 -2.186 11.461 417 HG2 LYS 64 HG2 LYS 64 55.874 -0.885 11.762 418 HG3 LYS 64 HG1 LYS 64 55.137 -2.134 12.766 419 HD2 LYS 64 HD2 LYS 64 57.551 -1.606 14.045 420 HD3 LYS 64 HD1 LYS 64 57.000 -0.014 13.521 421 HE2 LYS 64 HE2 LYS 64 56.137 -0.657 15.783 422 HE3 LYS 64 HE1 LYS 64 54.853 -0.340 14.615 423 HZ1 LYS 64 HZ1 LYS 64 55.325 -2.961 14.249 424 HZ2 LYS 64 HZ2 LYS 64 54.105 -2.332 15.250 425 HZ3 LYS 64 HZ3 LYS 64 55.593 -2.806 15.916 426 H HIS 65 HN HIS 65 57.676 -4.081 8.774 427 HA HIS 65 HA HIS 65 59.158 -6.314 9.879 428 HB2 HIS 65 HB2 HIS 65 56.578 -6.932 8.992 429 HB3 HIS 65 HB1 HIS 65 57.626 -7.404 7.654 430 HD1 HIS 65 HD1 HIS 65 60.106 -8.362 9.163 431 HD2 HIS 65 HD2 HIS 65 56.222 -9.347 10.324 432 HE1 HIS 65 HE1 HIS 65 60.285 -10.474 10.552 433 HE2 HIS 65 HE2 HIS 65 57.928 -11.082 11.263 Start of MODEL 7 1 H1 SER 7 HT1 SER 7 22.044 -7.757 -0.978 2 H2 SER 7 HT2 SER 7 20.898 -8.664 -0.112 3 H3 SER 7 HT3 SER 7 20.957 -8.761 -1.808 4 HA SER 7 HA SER 7 22.730 -9.967 0.193 5 HB2 SER 7 HB2 SER 7 21.027 -11.354 -0.858 6 HB3 SER 7 HB1 SER 7 21.540 -10.831 -2.460 7 HG SER 7 HG SER 7 23.557 -11.830 -0.882 8 H PHE 8 HN PHE 8 22.752 -8.931 -3.236 9 HA PHE 8 HA PHE 8 24.577 -8.526 -4.666 10 HB2 PHE 8 HB2 PHE 8 24.813 -6.962 -2.297 11 HB3 PHE 8 HB1 PHE 8 26.434 -7.513 -2.722 12 HD1 PHE 8 HD1 PHE 8 23.621 -5.395 -3.676 13 HD2 PHE 8 HD2 PHE 8 27.372 -7.029 -4.984 14 HE1 PHE 8 HE1 PHE 8 23.711 -3.724 -5.506 15 HE2 PHE 8 HE2 PHE 8 27.461 -5.358 -6.815 16 HZ PHE 8 HZ PHE 8 25.630 -3.706 -7.076 17 H GLU 9 HN GLU 9 25.030 -10.835 -4.933 18 HA GLU 9 HA GLU 9 26.836 -12.249 -3.194 19 HB2 GLU 9 HB2 GLU 9 26.610 -12.893 -6.118 20 HB3 GLU 9 HB1 GLU 9 26.712 -13.989 -4.740 21 HG2 GLU 9 HG2 GLU 9 24.455 -14.170 -5.275 22 HG3 GLU 9 HG1 GLU 9 24.410 -12.876 -4.076 23 H ILE 10 HN ILE 10 28.876 -11.476 -2.869 24 HA ILE 10 HA ILE 10 30.330 -10.265 -5.147 25 HB ILE 10 HB ILE 10 31.427 -10.443 -2.358 26 HG12 ILE 10 HG12 ILE 10 29.211 -8.633 -3.348 27 HG13 ILE 10 HG11 ILE 10 29.207 -9.663 -1.916 28 HG21 ILE 10 HG21 ILE 10 32.429 -8.300 -2.992 29 HG22 ILE 10 HG22 ILE 10 31.519 -8.300 -4.503 30 HG23 ILE 10 HG23 ILE 10 32.776 -9.507 -4.230 31 HD11 ILE 10 HD11 ILE 10 31.199 -8.254 -1.102 32 HD12 ILE 10 HD12 ILE 10 29.616 -7.477 -1.082 33 HD13 ILE 10 HD13 ILE 10 30.760 -7.114 -2.375 34 HA PRO 11 HA PRO 11 32.492 -14.146 -5.588 35 HB2 PRO 11 HB2 PRO 11 34.296 -13.313 -7.468 36 HB3 PRO 11 HB1 PRO 11 32.604 -13.691 -7.840 37 HG2 PRO 11 HG2 PRO 11 33.923 -11.055 -7.494 38 HG3 PRO 11 HG1 PRO 11 32.628 -11.537 -8.601 39 HD2 PRO 11 HD2 PRO 11 32.212 -10.125 -6.263 40 HD3 PRO 11 HD1 PRO 11 30.978 -11.131 -7.051 41 H ASP 12 HN ASP 12 34.417 -15.053 -4.786 42 HA ASP 12 HA ASP 12 36.031 -13.309 -3.095 43 HB2 ASP 12 HB2 ASP 12 35.533 -15.438 -2.136 44 HB3 ASP 12 HB1 ASP 12 36.036 -16.284 -3.599 45 H ASP 13 HN ASP 13 36.070 -13.820 -6.233 46 HA ASP 13 HA ASP 13 39.012 -14.017 -6.525 47 HB2 ASP 13 HB2 ASP 13 38.389 -14.041 -9.023 48 HB3 ASP 13 HB1 ASP 13 37.915 -15.448 -8.070 49 H VAL 14 HN VAL 14 37.801 -11.629 -5.389 50 HA VAL 14 HA VAL 14 38.245 -9.653 -7.568 51 HB VAL 14 HB VAL 14 37.025 -9.158 -4.843 52 HG11 VAL 14 HG11 VAL 14 38.008 -7.380 -6.678 53 HG12 VAL 14 HG12 VAL 14 36.712 -7.014 -5.539 54 HG13 VAL 14 HG13 VAL 14 36.324 -7.506 -7.188 55 HG21 VAL 14 HG21 VAL 14 35.816 -10.843 -6.401 56 HG22 VAL 14 HG22 VAL 14 35.496 -9.446 -7.430 57 HG23 VAL 14 HG23 VAL 14 34.877 -9.485 -5.780 58 HA PRO 15 HA PRO 15 42.087 -9.322 -5.115 59 HB2 PRO 15 HB2 PRO 15 43.651 -8.482 -7.190 60 HB3 PRO 15 HB1 PRO 15 43.288 -10.189 -6.874 61 HG2 PRO 15 HG2 PRO 15 42.122 -8.347 -8.887 62 HG3 PRO 15 HG1 PRO 15 42.483 -10.076 -9.008 63 HD2 PRO 15 HD2 PRO 15 39.954 -9.051 -8.576 64 HD3 PRO 15 HD1 PRO 15 40.456 -10.691 -8.114 65 H LEU 16 HN LEU 16 42.911 -7.492 -4.113 66 HA LEU 16 HA LEU 16 41.606 -4.965 -4.433 67 HB2 LEU 16 HB2 LEU 16 44.296 -5.604 -3.188 68 HB3 LEU 16 HB1 LEU 16 43.365 -4.140 -2.919 69 HG LEU 16 HG LEU 16 43.280 -6.364 -1.339 70 HD11 LEU 16 HD11 LEU 16 41.468 -4.037 -1.821 71 HD12 LEU 16 HD12 LEU 16 42.449 -4.421 -0.407 72 HD13 LEU 16 HD13 LEU 16 40.939 -5.286 -0.695 73 HD21 LEU 16 HD21 LEU 16 42.095 -7.774 -2.890 74 HD22 LEU 16 HD22 LEU 16 40.936 -6.496 -3.262 75 HD23 LEU 16 HD23 LEU 16 40.932 -7.256 -1.675 76 HA PRO 17 HA PRO 17 43.921 -2.854 -7.576 77 HB2 PRO 17 HB2 PRO 17 44.943 -0.773 -5.777 78 HB3 PRO 17 HB1 PRO 17 43.824 -0.632 -7.140 79 HG2 PRO 17 HG2 PRO 17 43.048 -0.366 -4.577 80 HG3 PRO 17 HG1 PRO 17 41.988 -0.992 -5.850 81 HD2 PRO 17 HD2 PRO 17 43.415 -2.471 -3.685 82 HD3 PRO 17 HD1 PRO 17 41.837 -2.812 -4.431 83 H ALA 18 HN ALA 18 46.267 -1.160 -6.931 84 HA ALA 18 HA ALA 18 48.235 -3.341 -7.045 85 HB1 ALA 18 HB1 ALA 18 48.271 -0.390 -7.612 86 HB2 ALA 18 HB2 ALA 18 48.522 -1.729 -8.732 87 HB3 ALA 18 HB3 ALA 18 49.763 -1.329 -7.543 88 H GLY 19 HN GLY 19 49.730 -3.763 -5.475 89 HA2 GLY 19 HA2 GLY 19 50.898 -3.615 -3.450 90 HA3 GLY 19 HA1 GLY 19 50.605 -1.879 -3.503 91 H TRP 20 HN TRP 20 47.867 -4.033 -3.591 92 HA TRP 20 HA TRP 20 47.169 -3.093 -0.856 93 HB2 TRP 20 HB2 TRP 20 45.505 -4.024 -3.179 94 HB3 TRP 20 HB1 TRP 20 44.840 -3.760 -1.562 95 HD1 TRP 20 HD1 TRP 20 46.154 -1.962 -4.589 96 HE1 TRP 20 HE1 TRP 20 45.811 0.563 -4.292 97 HE3 TRP 20 HE3 TRP 20 44.750 -1.912 0.273 98 HZ2 TRP 20 HZ2 TRP 20 45.033 2.398 -2.182 99 HZ3 TRP 20 HZ3 TRP 20 44.229 0.190 1.428 100 HH2 TRP 20 HH2 TRP 20 44.359 2.364 0.215 101 H GLU 21 HN GLU 21 46.173 -4.563 0.652 102 HA GLU 21 HA GLU 21 46.033 -7.405 -0.003 103 HB2 GLU 21 HB2 GLU 21 48.513 -6.974 0.348 104 HB3 GLU 21 HB1 GLU 21 48.126 -6.584 2.024 105 HG2 GLU 21 HG2 GLU 21 47.007 -8.842 2.202 106 HG3 GLU 21 HG1 GLU 21 47.656 -9.219 0.606 107 H MET 22 HN MET 22 44.243 -8.015 1.124 108 HA MET 22 HA MET 22 43.167 -6.508 3.294 109 HB2 MET 22 HB2 MET 22 42.274 -8.573 1.679 110 HB3 MET 22 HB1 MET 22 42.403 -9.334 3.268 111 HG2 MET 22 HG2 MET 22 41.197 -7.242 4.160 112 HG3 MET 22 HG1 MET 22 40.785 -6.921 2.477 113 HE1 MET 22 HE1 MET 22 38.802 -6.782 4.023 114 HE2 MET 22 HE2 MET 22 38.438 -8.068 5.171 115 HE3 MET 22 HE3 MET 22 37.514 -7.944 3.675 116 H ALA 23 HN ALA 23 43.500 -6.682 5.475 117 HA ALA 23 HA ALA 23 44.913 -9.042 6.550 118 HB1 ALA 23 HB1 ALA 23 46.000 -6.225 6.600 119 HB2 ALA 23 HB2 ALA 23 46.784 -7.669 5.964 120 HB3 ALA 23 HB3 ALA 23 46.558 -7.482 7.702 121 H LYS 24 HN LYS 24 45.114 -8.693 9.068 122 HA LYS 24 HA LYS 24 42.708 -7.174 9.945 123 HB2 LYS 24 HB2 LYS 24 42.605 -9.755 10.026 124 HB3 LYS 24 HB1 LYS 24 43.723 -9.611 11.385 125 HG2 LYS 24 HG2 LYS 24 42.098 -7.934 12.393 126 HG3 LYS 24 HG1 LYS 24 40.951 -8.427 11.147 127 HD2 LYS 24 HD2 LYS 24 42.265 -10.318 13.121 128 HD3 LYS 24 HD1 LYS 24 40.628 -9.680 13.280 129 HE2 LYS 24 HE2 LYS 24 39.944 -11.445 12.050 130 HE3 LYS 24 HE1 LYS 24 40.722 -10.669 10.671 131 HZ1 LYS 24 HZ1 LYS 24 42.564 -11.980 10.849 132 HZ2 LYS 24 HZ2 LYS 24 41.385 -13.071 11.405 133 HZ3 LYS 24 HZ3 LYS 24 42.372 -12.243 12.513 134 H THR 25 HN THR 25 42.788 -6.312 12.089 135 HA THR 25 HA THR 25 45.307 -5.074 12.740 136 HB THR 25 HB THR 25 43.043 -4.113 13.214 137 HG1 THR 25 HG1 THR 25 44.035 -3.038 14.706 138 HG21 THR 25 HG21 THR 25 41.595 -5.060 14.728 139 HG22 THR 25 HG22 THR 25 42.885 -5.872 15.613 140 HG23 THR 25 HG23 THR 25 42.347 -6.507 14.058 141 H SER 26 HN SER 26 45.973 -5.272 15.249 142 HA SER 26 HA SER 26 47.467 -7.358 15.866 143 HB2 SER 26 HB2 SER 26 46.180 -5.548 17.473 144 HB3 SER 26 HB1 SER 26 45.496 -7.067 18.045 145 HG SER 26 HG SER 26 47.351 -6.836 19.170 146 H SER 27 HN SER 27 43.927 -7.596 15.807 147 HA SER 27 HA SER 27 43.622 -10.107 14.799 148 HB2 SER 27 HB2 SER 27 44.621 -10.251 17.604 149 HB3 SER 27 HB1 SER 27 43.381 -11.403 17.118 150 HG SER 27 HG SER 27 44.841 -12.416 16.007 151 H GLY 28 HN GLY 28 41.676 -8.738 14.388 152 HA2 GLY 28 HA2 GLY 28 39.388 -9.611 15.728 153 HA3 GLY 28 HA1 GLY 28 39.868 -8.141 16.572 154 H GLN 29 HN GLN 29 40.838 -6.667 14.309 155 HA GLN 29 HA GLN 29 38.242 -6.226 12.920 156 HB2 GLN 29 HB2 GLN 29 40.479 -4.211 13.140 157 HB3 GLN 29 HB1 GLN 29 38.787 -3.920 12.743 158 HG2 GLN 29 HG2 GLN 29 39.516 -5.151 15.390 159 HG3 GLN 29 HG1 GLN 29 39.618 -3.405 15.169 160 HE21 GLN 29 HE21 GLN 29 37.755 -3.857 16.960 161 HE22 GLN 29 HE22 GLN 29 36.180 -3.884 16.327 162 H ARG 30 HN ARG 30 38.182 -6.674 10.786 163 HA ARG 30 HA ARG 30 40.661 -7.329 9.362 164 HB2 ARG 30 HB2 ARG 30 37.772 -7.727 8.959 165 HB3 ARG 30 HB1 ARG 30 38.650 -7.347 7.476 166 HG2 ARG 30 HG2 ARG 30 40.290 -9.148 8.040 167 HG3 ARG 30 HG1 ARG 30 39.292 -9.574 9.430 168 HD2 ARG 30 HD2 ARG 30 37.410 -9.565 7.470 169 HD3 ARG 30 HD1 ARG 30 38.825 -10.074 6.548 170 HE ARG 30 HE ARG 30 38.746 -11.610 8.938 171 HH11 ARG 30 HH11 ARG 30 37.919 -13.712 8.860 172 HH12 ARG 30 HH12 ARG 30 36.875 -14.170 7.555 173 HH21 ARG 30 HH21 ARG 30 36.990 -11.062 6.021 174 HH22 ARG 30 HH22 ARG 30 36.349 -12.669 5.949 175 H TYR 31 HN TYR 31 41.585 -6.045 7.723 176 HA TYR 31 HA TYR 31 40.140 -3.666 6.822 177 HB2 TYR 31 HB2 TYR 31 42.159 -2.189 7.414 178 HB3 TYR 31 HB1 TYR 31 41.060 -2.618 8.719 179 HD1 TYR 31 HD1 TYR 31 43.537 -4.970 7.242 180 HD2 TYR 31 HD2 TYR 31 42.617 -2.365 10.533 181 HE1 TYR 31 HE1 TYR 31 45.452 -5.882 8.509 182 HE2 TYR 31 HE2 TYR 31 44.538 -3.288 11.790 183 HH TYR 31 HH TYR 31 46.565 -4.452 11.457 184 H PHE 32 HN PHE 32 42.056 -2.335 5.465 185 HA PHE 32 HA PHE 32 43.254 -4.458 3.740 186 HB2 PHE 32 HB2 PHE 32 42.253 -1.749 2.832 187 HB3 PHE 32 HB1 PHE 32 42.794 -3.080 1.809 188 HD1 PHE 32 HD1 PHE 32 41.395 -5.024 1.420 189 HD2 PHE 32 HD2 PHE 32 40.112 -1.878 4.046 190 HE1 PHE 32 HE1 PHE 32 39.098 -5.955 1.411 191 HE2 PHE 32 HE2 PHE 32 37.814 -2.810 4.039 192 HZ PHE 32 HZ PHE 32 37.306 -4.848 2.721 193 H LEU 33 HN LEU 33 45.410 -4.336 3.483 194 HA LEU 33 HA LEU 33 46.851 -2.007 4.594 195 HB2 LEU 33 HB2 LEU 33 48.130 -4.361 3.209 196 HB3 LEU 33 HB1 LEU 33 48.794 -3.341 4.485 197 HG LEU 33 HG LEU 33 46.461 -5.250 4.820 198 HD11 LEU 33 HD11 LEU 33 48.327 -6.237 6.443 199 HD12 LEU 33 HD12 LEU 33 49.409 -5.462 5.288 200 HD13 LEU 33 HD13 LEU 33 48.272 -6.694 4.740 201 HD21 LEU 33 HD21 LEU 33 47.632 -4.506 7.286 202 HD22 LEU 33 HD22 LEU 33 46.036 -4.055 6.681 203 HD23 LEU 33 HD23 LEU 33 47.424 -3.016 6.369 204 H ASN 34 HN ASN 34 47.833 -0.441 3.338 205 HA ASN 34 HA ASN 34 47.616 -0.807 0.378 206 HB2 ASN 34 HB2 ASN 34 46.424 1.146 1.635 207 HB3 ASN 34 HB1 ASN 34 48.039 1.849 1.723 208 HD21 ASN 34 HD21 ASN 34 46.434 3.378 0.222 209 HD22 ASN 34 HD22 ASN 34 46.663 3.131 -1.442 210 H HIS 35 HN HIS 35 49.589 -1.534 -0.321 211 HA HIS 35 HA HIS 35 52.073 -0.792 0.992 212 HB2 HIS 35 HB2 HIS 35 51.877 -1.883 -1.815 213 HB3 HIS 35 HB1 HIS 35 53.151 -2.141 -0.623 214 HD1 HIS 35 HD1 HIS 35 52.024 -4.668 -1.733 215 HD2 HIS 35 HD2 HIS 35 50.251 -2.735 1.512 216 HE1 HIS 35 HE1 HIS 35 50.653 -6.419 -0.516 217 HE2 HIS 35 HE2 HIS 35 49.570 -5.253 1.459 218 H ILE 36 HN ILE 36 50.001 0.661 -1.271 219 HA ILE 36 HA ILE 36 52.042 2.298 -2.591 220 HB ILE 36 HB ILE 36 49.113 2.960 -2.564 221 HG12 ILE 36 HG12 ILE 36 49.831 0.376 -2.965 222 HG13 ILE 36 HG11 ILE 36 48.472 1.137 -3.778 223 HG21 ILE 36 HG21 ILE 36 51.380 3.118 -4.561 224 HG22 ILE 36 HG22 ILE 36 50.483 4.451 -3.834 225 HG23 ILE 36 HG23 ILE 36 49.698 3.398 -5.012 226 HD11 ILE 36 HD11 ILE 36 49.701 1.489 -5.762 227 HD12 ILE 36 HD12 ILE 36 50.209 -0.118 -5.241 228 HD13 ILE 36 HD13 ILE 36 51.249 1.274 -4.945 229 H ASP 37 HN ASP 37 49.327 2.860 -0.375 230 HA ASP 37 HA ASP 37 50.409 5.480 0.367 231 HB2 ASP 37 HB2 ASP 37 47.933 3.933 1.048 232 HB3 ASP 37 HB1 ASP 37 48.430 5.255 2.104 233 H GLN 38 HN GLN 38 51.258 2.505 1.018 234 HA GLN 38 HA GLN 38 52.287 1.375 2.809 235 HB2 GLN 38 HB2 GLN 38 53.333 4.178 2.763 236 HB3 GLN 38 HB1 GLN 38 53.855 3.094 4.054 237 HG2 GLN 38 HG2 GLN 38 54.414 1.396 2.253 238 HG3 GLN 38 HG1 GLN 38 54.143 2.676 1.072 239 HE21 GLN 38 HE21 GLN 38 55.371 3.914 4.022 240 HE22 GLN 38 HE22 GLN 38 56.996 4.057 3.554 241 H THR 39 HN THR 39 49.716 1.809 3.573 242 HA THR 39 HA THR 39 50.004 2.102 6.452 243 HB THR 39 HB THR 39 49.568 4.335 6.291 244 HG1 THR 39 HG1 THR 39 47.826 3.452 7.390 245 HG21 THR 39 HG21 THR 39 48.940 3.718 3.613 246 HG22 THR 39 HG22 THR 39 49.138 5.322 4.318 247 HG23 THR 39 HG23 THR 39 47.543 4.574 4.261 248 H THR 40 HN THR 40 47.496 2.207 7.256 249 HA THR 40 HA THR 40 46.182 -0.075 5.849 250 HB THR 40 HB THR 40 45.142 -0.515 8.143 251 HG1 THR 40 HG1 THR 40 45.784 1.651 8.871 252 HG21 THR 40 HG21 THR 40 47.769 -1.092 7.133 253 HG22 THR 40 HG22 THR 40 46.722 -2.103 8.130 254 HG23 THR 40 HG23 THR 40 47.829 -0.961 8.890 255 H THR 41 HN THR 41 43.813 -0.013 5.829 256 HA THR 41 HA THR 41 42.584 2.568 6.573 257 HB THR 41 HB THR 41 42.762 3.225 4.429 258 HG1 THR 41 HG1 THR 41 40.743 1.262 4.299 259 HG21 THR 41 HG21 THR 41 44.319 1.366 3.907 260 HG22 THR 41 HG22 THR 41 43.253 1.745 2.553 261 HG23 THR 41 HG23 THR 41 42.929 0.335 3.563 262 H TRP 42 HN TRP 42 40.409 2.433 7.015 263 HA TRP 42 HA TRP 42 39.338 -0.282 7.403 264 HB2 TRP 42 HB2 TRP 42 38.082 2.418 7.998 265 HB3 TRP 42 HB1 TRP 42 37.474 0.854 8.535 266 HD1 TRP 42 HD1 TRP 42 39.478 3.632 9.708 267 HE1 TRP 42 HE1 TRP 42 40.923 2.969 11.737 268 HE3 TRP 42 HE3 TRP 42 39.096 -1.450 9.427 269 HZ2 TRP 42 HZ2 TRP 42 41.797 0.589 13.069 270 HZ3 TRP 42 HZ3 TRP 42 40.241 -2.891 11.088 271 HH2 TRP 42 HH2 TRP 42 41.591 -1.880 12.905 272 H GLN 43 HN GLN 43 39.464 1.989 4.963 273 HA GLN 43 HA GLN 43 36.908 1.005 3.781 274 HB2 GLN 43 HB2 GLN 43 36.674 3.351 4.097 275 HB3 GLN 43 HB1 GLN 43 38.320 3.663 3.547 276 HG2 GLN 43 HG2 GLN 43 36.639 2.241 1.592 277 HG3 GLN 43 HG1 GLN 43 36.097 3.878 1.965 278 HE21 GLN 43 HE21 GLN 43 38.039 5.552 1.991 279 HE22 GLN 43 HE22 GLN 43 39.167 5.382 0.734 280 H ASP 44 HN ASP 44 36.975 0.369 1.579 281 HA ASP 44 HA ASP 44 39.634 0.365 0.267 282 HB2 ASP 44 HB2 ASP 44 38.369 -1.929 1.427 283 HB3 ASP 44 HB1 ASP 44 38.374 -2.118 -0.326 284 HA PRO 45 HA PRO 45 37.480 1.522 -3.378 285 HB2 PRO 45 HB2 PRO 45 38.706 -0.264 -5.183 286 HB3 PRO 45 HB1 PRO 45 39.277 1.361 -4.766 287 HG2 PRO 45 HG2 PRO 45 40.200 -1.273 -3.797 288 HG3 PRO 45 HG1 PRO 45 41.094 0.241 -3.997 289 HD2 PRO 45 HD2 PRO 45 40.345 -0.695 -1.554 290 HD3 PRO 45 HD1 PRO 45 40.475 1.043 -1.911 291 H ARG 46 HN ARG 46 37.565 -1.819 -2.383 292 HA ARG 46 HA ARG 46 35.471 -2.636 -4.265 293 HB2 ARG 46 HB2 ARG 46 36.316 -4.209 -1.838 294 HB3 ARG 46 HB1 ARG 46 35.728 -4.811 -3.388 295 HG2 ARG 46 HG2 ARG 46 38.337 -3.303 -3.105 296 HG3 ARG 46 HG1 ARG 46 38.233 -5.060 -2.997 297 HD2 ARG 46 HD2 ARG 46 38.574 -4.929 -5.256 298 HD3 ARG 46 HD1 ARG 46 36.830 -4.667 -5.275 299 HE ARG 46 HE ARG 46 38.118 -2.148 -4.928 300 HH11 ARG 46 HH11 ARG 46 38.312 -0.784 -6.723 301 HH12 ARG 46 HH12 ARG 46 38.188 -1.449 -8.317 302 HH21 ARG 46 HH21 ARG 46 37.685 -4.696 -7.209 303 HH22 ARG 46 HH22 ARG 46 37.833 -3.664 -8.592 304 H LYS 47 HN LYS 47 35.105 -0.471 -2.203 305 HA LYS 47 HA LYS 47 32.582 -1.551 -1.057 306 HB2 LYS 47 HB2 LYS 47 34.621 0.176 0.374 307 HB3 LYS 47 HB1 LYS 47 33.013 -0.191 0.997 308 HG2 LYS 47 HG2 LYS 47 34.652 -2.514 0.129 309 HG3 LYS 47 HG1 LYS 47 35.175 -1.688 1.597 310 HD2 LYS 47 HD2 LYS 47 33.125 -2.096 2.700 311 HD3 LYS 47 HD1 LYS 47 32.292 -2.475 1.192 312 HE2 LYS 47 HE2 LYS 47 34.604 -4.207 1.672 313 HE3 LYS 47 HE1 LYS 47 33.380 -4.335 2.935 314 HZ1 LYS 47 HZ1 LYS 47 31.841 -4.345 0.781 315 HZ2 LYS 47 HZ2 LYS 47 32.472 -5.763 1.472 316 HZ3 LYS 47 HZ3 LYS 47 33.230 -5.060 0.123 317 H ALA 48 HN ALA 48 31.542 0.708 0.052 318 HA ALA 48 HA ALA 48 31.707 2.803 -2.064 319 HB1 ALA 48 HB1 ALA 48 29.743 1.806 -2.791 320 HB2 ALA 48 HB2 ALA 48 29.095 2.939 -1.606 321 HB3 ALA 48 HB3 ALA 48 29.310 1.242 -1.176 322 H MET 49 HN MET 49 31.216 4.921 -1.301 323 HA MET 49 HA MET 49 31.914 5.483 1.398 324 HB2 MET 49 HB2 MET 49 30.847 7.013 -0.903 325 HB3 MET 49 HB1 MET 49 30.512 7.706 0.685 326 HG2 MET 49 HG2 MET 49 32.629 8.595 -0.075 327 HG3 MET 49 HG1 MET 49 32.960 7.452 1.226 328 HE1 MET 49 HE1 MET 49 34.719 5.692 1.046 329 HE2 MET 49 HE2 MET 49 35.332 7.295 0.651 330 HE3 MET 49 HE3 MET 49 35.861 5.902 -0.288 331 H GLY 50 HN GLY 50 30.349 6.772 2.893 332 HA2 GLY 50 HA2 GLY 50 28.497 6.590 4.328 333 HA3 GLY 50 HA1 GLY 50 27.557 6.513 2.836 334 H GLY 51 HN GLY 51 29.751 4.345 4.666 335 HA2 GLY 51 HA2 GLY 51 27.636 2.256 4.516 336 HA3 GLY 51 HA1 GLY 51 29.262 1.863 3.954 337 H GLY 52 HN GLY 52 28.708 4.009 6.673 338 HA2 GLY 52 HA2 GLY 52 28.973 1.973 8.715 339 HA3 GLY 52 HA1 GLY 52 30.507 2.793 8.422 340 H GLY 53 HN GLY 53 30.486 3.809 10.496 341 HA2 GLY 53 HA2 GLY 53 29.012 6.322 10.562 342 HA3 GLY 53 HA1 GLY 53 28.463 5.177 11.786 343 H ASN 54 HN ASN 54 30.005 4.474 13.407 344 HA ASN 54 HA ASN 54 32.151 6.495 13.843 345 HB2 ASN 54 HB2 ASN 54 31.851 4.826 16.120 346 HB3 ASN 54 HB1 ASN 54 31.358 6.511 15.951 347 HD21 ASN 54 HD21 ASN 54 30.204 3.154 15.509 348 HD22 ASN 54 HD22 ASN 54 28.553 3.545 15.569 349 H TYR 55 HN TYR 55 34.273 5.869 13.799 350 HA TYR 55 HA TYR 55 34.810 2.954 13.442 351 HB2 TYR 55 HB2 TYR 55 36.786 5.129 12.796 352 HB3 TYR 55 HB1 TYR 55 36.646 3.515 12.096 353 HD1 TYR 55 HD1 TYR 55 33.668 3.463 11.631 354 HD2 TYR 55 HD2 TYR 55 36.605 6.498 10.849 355 HE1 TYR 55 HE1 TYR 55 32.246 4.370 9.814 356 HE2 TYR 55 HE2 TYR 55 35.183 7.406 9.031 357 HH TYR 55 HH TYR 55 33.288 6.310 7.461 358 H GLN 56 HN GLN 56 36.700 2.070 14.537 359 HA GLN 56 HA GLN 56 36.966 3.021 17.246 360 HB2 GLN 56 HB2 GLN 56 39.071 1.215 16.231 361 HB3 GLN 56 HB1 GLN 56 38.013 1.030 17.629 362 HG2 GLN 56 HG2 GLN 56 36.129 0.642 15.890 363 HG3 GLN 56 HG1 GLN 56 37.442 0.371 14.744 364 HE21 GLN 56 HE21 GLN 56 36.154 -0.793 17.885 365 HE22 GLN 56 HE22 GLN 56 36.825 -2.348 17.759 366 H GLY 57 HN GLY 57 37.827 4.750 14.910 367 HA2 GLY 57 HA2 GLY 57 39.376 6.618 15.189 368 HA3 GLY 57 HA1 GLY 57 40.444 5.543 16.094 369 HA PRO 58 HA PRO 58 41.833 5.756 11.628 370 HB2 PRO 58 HB2 PRO 58 44.361 6.671 12.130 371 HB3 PRO 58 HB1 PRO 58 42.972 7.743 11.871 372 HG2 PRO 58 HG2 PRO 58 44.298 6.940 14.405 373 HG3 PRO 58 HG1 PRO 58 43.590 8.495 13.941 374 HD2 PRO 58 HD2 PRO 58 42.332 6.668 15.581 375 HD3 PRO 58 HD1 PRO 58 41.473 7.876 14.601 376 HA PRO 59 HA PRO 59 43.828 1.820 12.298 377 HB2 PRO 59 HB2 PRO 59 44.331 1.215 9.693 378 HB3 PRO 59 HB1 PRO 59 42.712 1.133 10.402 379 HG2 PRO 59 HG2 PRO 59 43.908 3.210 8.656 380 HG3 PRO 59 HG1 PRO 59 42.249 2.593 8.710 381 HD2 PRO 59 HD2 PRO 59 43.063 4.990 9.842 382 HD3 PRO 59 HD1 PRO 59 41.618 4.083 10.334 383 HA PRO 60 HA PRO 60 48.105 3.351 12.344 384 HB2 PRO 60 HB2 PRO 60 48.651 0.651 13.423 385 HB3 PRO 60 HB1 PRO 60 49.000 2.238 14.132 386 HG2 PRO 60 HG2 PRO 60 47.063 0.624 15.064 387 HG3 PRO 60 HG1 PRO 60 46.958 2.390 15.129 388 HD2 PRO 60 HD2 PRO 60 45.552 0.488 13.305 389 HD3 PRO 60 HD1 PRO 60 45.008 2.052 13.952 390 HA PRO 61 HA PRO 61 49.838 1.791 8.589 391 HB2 PRO 61 HB2 PRO 61 52.330 1.404 10.203 392 HB3 PRO 61 HB1 PRO 61 52.118 2.204 8.633 393 HG2 PRO 61 HG2 PRO 61 52.407 3.590 10.895 394 HG3 PRO 61 HG1 PRO 61 51.372 4.149 9.570 395 HD2 PRO 61 HD2 PRO 61 50.589 3.085 12.228 396 HD3 PRO 61 HD1 PRO 61 49.679 4.134 11.119 397 H TYR 62 HN TYR 62 49.943 -0.225 7.656 398 HA TYR 62 HA TYR 62 49.197 -2.581 8.813 399 HB2 TYR 62 HB2 TYR 62 50.923 -3.654 7.107 400 HB3 TYR 62 HB1 TYR 62 49.506 -2.784 6.527 401 HD1 TYR 62 HD1 TYR 62 50.667 -2.328 4.389 402 HD2 TYR 62 HD2 TYR 62 52.199 -0.899 8.133 403 HE1 TYR 62 HE1 TYR 62 52.136 -0.748 3.186 404 HE2 TYR 62 HE2 TYR 62 53.664 0.683 6.935 405 HH TYR 62 HH TYR 62 54.334 1.434 4.963 406 HA PRO 63 HA PRO 63 52.009 -4.310 11.708 407 HB2 PRO 63 HB2 PRO 63 52.890 -6.595 10.253 408 HB3 PRO 63 HB1 PRO 63 51.563 -6.521 11.424 409 HG2 PRO 63 HG2 PRO 63 51.482 -6.415 8.467 410 HG3 PRO 63 HG1 PRO 63 50.290 -7.054 9.612 411 HD2 PRO 63 HD2 PRO 63 49.860 -4.729 8.343 412 HD3 PRO 63 HD1 PRO 63 49.370 -4.943 10.038 413 H LYS 64 HN LYS 64 54.336 -4.778 12.078 414 HA LYS 64 HA LYS 64 56.125 -3.016 10.920 415 HB2 LYS 64 HB2 LYS 64 56.672 -5.805 11.975 416 HB3 LYS 64 HB1 LYS 64 57.936 -4.634 11.602 417 HG2 LYS 64 HG2 LYS 64 57.365 -3.246 13.367 418 HG3 LYS 64 HG1 LYS 64 55.682 -3.773 13.373 419 HD2 LYS 64 HD2 LYS 64 58.035 -5.469 14.258 420 HD3 LYS 64 HD1 LYS 64 56.926 -4.632 15.345 421 HE2 LYS 64 HE2 LYS 64 55.208 -6.007 13.675 422 HE3 LYS 64 HE1 LYS 64 56.549 -7.136 13.859 423 HZ1 LYS 64 HZ1 LYS 64 56.015 -7.519 15.970 424 HZ2 LYS 64 HZ2 LYS 64 54.534 -6.753 15.643 425 HZ3 LYS 64 HZ3 LYS 64 55.819 -5.871 16.321 426 H HIS 65 HN HIS 65 57.474 -3.015 9.104 427 HA HIS 65 HA HIS 65 56.605 -4.511 6.811 428 HB2 HIS 65 HB2 HIS 65 58.226 -3.318 5.614 429 HB3 HIS 65 HB1 HIS 65 57.899 -2.234 6.967 430 HD1 HIS 65 HD1 HIS 65 60.696 -2.875 5.255 431 HD2 HIS 65 HD2 HIS 65 59.803 -3.745 9.236 432 HE1 HIS 65 HE1 HIS 65 62.918 -3.125 6.451 433 HE2 HIS 65 HE2 HIS 65 62.384 -3.656 8.874 Start of MODEL 8 1 H1 SER 7 HT1 SER 7 34.349 -19.049 -8.696 2 H2 SER 7 HT2 SER 7 35.367 -19.052 -10.055 3 H3 SER 7 HT3 SER 7 35.039 -20.503 -9.232 4 HA SER 7 HA SER 7 33.660 -19.407 -11.392 5 HB2 SER 7 HB2 SER 7 32.472 -21.506 -11.301 6 HB3 SER 7 HB1 SER 7 34.137 -21.822 -10.819 7 HG SER 7 HG SER 7 31.792 -21.919 -9.355 8 H PHE 8 HN PHE 8 31.071 -20.693 -10.266 9 HA PHE 8 HA PHE 8 29.011 -19.790 -9.570 10 HB2 PHE 8 HB2 PHE 8 30.993 -18.942 -7.472 11 HB3 PHE 8 HB1 PHE 8 29.318 -18.403 -7.369 12 HD1 PHE 8 HD1 PHE 8 28.955 -19.699 -5.292 13 HD2 PHE 8 HD2 PHE 8 30.114 -21.607 -8.963 14 HE1 PHE 8 HE1 PHE 8 28.300 -21.900 -4.356 15 HE2 PHE 8 HE2 PHE 8 29.459 -23.806 -8.027 16 HZ PHE 8 HZ PHE 8 28.552 -23.953 -5.723 17 H GLU 9 HN GLU 9 28.308 -18.311 -11.100 18 HA GLU 9 HA GLU 9 28.255 -16.238 -12.282 19 HB2 GLU 9 HB2 GLU 9 26.845 -16.090 -10.111 20 HB3 GLU 9 HB1 GLU 9 28.165 -15.094 -9.497 21 HG2 GLU 9 HG2 GLU 9 27.789 -13.955 -11.938 22 HG3 GLU 9 HG1 GLU 9 26.144 -14.477 -11.571 23 H ILE 10 HN ILE 10 29.111 -13.761 -10.799 24 HA ILE 10 HA ILE 10 31.936 -13.864 -11.656 25 HB ILE 10 HB ILE 10 30.525 -11.403 -10.649 26 HG12 ILE 10 HG12 ILE 10 30.123 -12.883 -13.237 27 HG13 ILE 10 HG11 ILE 10 28.927 -12.074 -12.223 28 HG21 ILE 10 HG21 ILE 10 32.146 -10.253 -11.876 29 HG22 ILE 10 HG22 ILE 10 32.419 -11.606 -12.974 30 HG23 ILE 10 HG23 ILE 10 33.054 -11.663 -11.330 31 HD11 ILE 10 HD11 ILE 10 30.844 -10.890 -14.203 32 HD12 ILE 10 HD12 ILE 10 30.329 -9.918 -12.824 33 HD13 ILE 10 HD13 ILE 10 29.133 -10.541 -13.960 34 HA PRO 11 HA PRO 11 33.009 -14.734 -7.350 35 HB2 PRO 11 HB2 PRO 11 35.642 -13.830 -8.440 36 HB3 PRO 11 HB1 PRO 11 35.253 -15.271 -7.482 37 HG2 PRO 11 HG2 PRO 11 35.704 -15.403 -10.112 38 HG3 PRO 11 HG1 PRO 11 34.531 -16.454 -9.302 39 HD2 PRO 11 HD2 PRO 11 34.043 -14.147 -11.111 40 HD3 PRO 11 HD1 PRO 11 33.017 -15.559 -10.777 41 H ASP 12 HN ASP 12 32.736 -13.275 -5.715 42 HA ASP 12 HA ASP 12 33.154 -10.427 -6.241 43 HB2 ASP 12 HB2 ASP 12 31.858 -12.032 -4.082 44 HB3 ASP 12 HB1 ASP 12 32.416 -10.407 -3.678 45 H ASP 13 HN ASP 13 35.147 -12.793 -5.516 46 HA ASP 13 HA ASP 13 36.674 -11.531 -3.357 47 HB2 ASP 13 HB2 ASP 13 36.479 -14.070 -3.809 48 HB3 ASP 13 HB1 ASP 13 37.645 -13.792 -5.103 49 H VAL 14 HN VAL 14 36.229 -10.093 -5.900 50 HA VAL 14 HA VAL 14 38.390 -10.027 -7.653 51 HB VAL 14 HB VAL 14 36.999 -7.600 -6.481 52 HG11 VAL 14 HG11 VAL 14 37.527 -6.713 -8.824 53 HG12 VAL 14 HG12 VAL 14 38.620 -8.087 -8.987 54 HG13 VAL 14 HG13 VAL 14 38.901 -6.882 -7.731 55 HG21 VAL 14 HG21 VAL 14 35.279 -7.915 -8.039 56 HG22 VAL 14 HG22 VAL 14 35.621 -9.571 -7.539 57 HG23 VAL 14 HG23 VAL 14 36.265 -8.959 -9.063 58 HA PRO 15 HA PRO 15 41.799 -9.593 -4.727 59 HB2 PRO 15 HB2 PRO 15 43.079 -8.726 -7.291 60 HB3 PRO 15 HB1 PRO 15 43.665 -9.873 -6.069 61 HG2 PRO 15 HG2 PRO 15 42.611 -10.693 -8.382 62 HG3 PRO 15 HG1 PRO 15 42.387 -11.593 -6.872 63 HD2 PRO 15 HD2 PRO 15 40.417 -9.978 -8.396 64 HD3 PRO 15 HD1 PRO 15 40.141 -11.314 -7.257 65 H LEU 16 HN LEU 16 42.877 -7.811 -3.762 66 HA LEU 16 HA LEU 16 41.638 -5.248 -3.975 67 HB2 LEU 16 HB2 LEU 16 44.394 -5.930 -2.914 68 HB3 LEU 16 HB1 LEU 16 43.478 -4.477 -2.552 69 HG LEU 16 HG LEU 16 43.510 -6.752 -1.028 70 HD11 LEU 16 HD11 LEU 16 41.340 -5.700 -0.060 71 HD12 LEU 16 HD12 LEU 16 41.572 -4.466 -1.298 72 HD13 LEU 16 HD13 LEU 16 42.811 -4.729 -0.072 73 HD21 LEU 16 HD21 LEU 16 42.184 -8.110 -2.502 74 HD22 LEU 16 HD22 LEU 16 41.028 -6.804 -2.774 75 HD23 LEU 16 HD23 LEU 16 41.116 -7.590 -1.204 76 HA PRO 17 HA PRO 17 43.809 -3.168 -7.238 77 HB2 PRO 17 HB2 PRO 17 44.913 -1.082 -5.497 78 HB3 PRO 17 HB1 PRO 17 43.723 -0.946 -6.798 79 HG2 PRO 17 HG2 PRO 17 43.088 -0.676 -4.194 80 HG3 PRO 17 HG1 PRO 17 41.961 -1.298 -5.410 81 HD2 PRO 17 HD2 PRO 17 43.496 -2.784 -3.326 82 HD3 PRO 17 HD1 PRO 17 41.882 -3.119 -3.986 83 H ALA 18 HN ALA 18 46.175 -1.467 -6.700 84 HA ALA 18 HA ALA 18 48.147 -3.639 -6.889 85 HB1 ALA 18 HB1 ALA 18 48.890 -0.767 -7.105 86 HB2 ALA 18 HB2 ALA 18 47.825 -1.433 -8.343 87 HB3 ALA 18 HB3 ALA 18 49.418 -2.142 -8.075 88 H GLY 19 HN GLY 19 49.718 -4.039 -5.383 89 HA2 GLY 19 HA2 GLY 19 50.967 -3.872 -3.408 90 HA3 GLY 19 HA1 GLY 19 50.658 -2.138 -3.459 91 H TRP 20 HN TRP 20 47.943 -4.327 -3.422 92 HA TRP 20 HA TRP 20 47.337 -3.370 -0.672 93 HB2 TRP 20 HB2 TRP 20 45.602 -4.345 -2.920 94 HB3 TRP 20 HB1 TRP 20 44.995 -4.086 -1.280 95 HD1 TRP 20 HD1 TRP 20 46.202 -2.266 -4.349 96 HE1 TRP 20 HE1 TRP 20 45.809 0.250 -4.049 97 HE3 TRP 20 HE3 TRP 20 44.870 -2.238 0.536 98 HZ2 TRP 20 HZ2 TRP 20 45.020 2.070 -1.933 99 HZ3 TRP 20 HZ3 TRP 20 44.318 -0.144 1.694 100 HH2 TRP 20 HH2 TRP 20 44.382 2.027 0.472 101 H GLU 21 HN GLU 21 46.399 -4.827 0.877 102 HA GLU 21 HA GLU 21 46.302 -7.688 0.300 103 HB2 GLU 21 HB2 GLU 21 48.779 -7.223 0.570 104 HB3 GLU 21 HB1 GLU 21 48.437 -6.753 2.235 105 HG2 GLU 21 HG2 GLU 21 48.640 -8.934 2.777 106 HG3 GLU 21 HG1 GLU 21 47.117 -9.197 1.926 107 H MET 22 HN MET 22 44.543 -8.290 1.507 108 HA MET 22 HA MET 22 43.554 -6.691 3.669 109 HB2 MET 22 HB2 MET 22 41.787 -7.918 2.950 110 HB3 MET 22 HB1 MET 22 42.820 -9.212 2.342 111 HG2 MET 22 HG2 MET 22 43.071 -10.150 4.535 112 HG3 MET 22 HG1 MET 22 42.295 -8.753 5.281 113 HE1 MET 22 HE1 MET 22 40.247 -11.622 2.348 114 HE2 MET 22 HE2 MET 22 41.961 -11.234 2.469 115 HE3 MET 22 HE3 MET 22 40.838 -10.038 1.827 116 H ALA 23 HN ALA 23 43.899 -6.888 5.861 117 HA ALA 23 HA ALA 23 45.374 -9.232 6.888 118 HB1 ALA 23 HB1 ALA 23 47.211 -7.843 6.260 119 HB2 ALA 23 HB2 ALA 23 47.028 -7.645 8.002 120 HB3 ALA 23 HB3 ALA 23 46.426 -6.403 6.903 121 H LYS 24 HN LYS 24 45.656 -8.904 9.402 122 HA LYS 24 HA LYS 24 43.212 -7.499 10.379 123 HB2 LYS 24 HB2 LYS 24 43.607 -10.159 10.581 124 HB3 LYS 24 HB1 LYS 24 44.401 -9.624 12.064 125 HG2 LYS 24 HG2 LYS 24 42.438 -8.574 12.871 126 HG3 LYS 24 HG1 LYS 24 41.659 -8.629 11.291 127 HD2 LYS 24 HD2 LYS 24 42.395 -11.079 12.923 128 HD3 LYS 24 HD1 LYS 24 40.777 -10.380 12.840 129 HE2 LYS 24 HE2 LYS 24 41.259 -10.598 10.210 130 HE3 LYS 24 HE1 LYS 24 42.288 -11.911 10.781 131 HZ1 LYS 24 HZ1 LYS 24 39.462 -11.810 10.591 132 HZ2 LYS 24 HZ2 LYS 24 39.930 -12.127 12.192 133 HZ3 LYS 24 HZ3 LYS 24 40.464 -13.135 10.933 134 H THR 25 HN THR 25 43.307 -6.561 12.431 135 HA THR 25 HA THR 25 45.822 -5.207 12.992 136 HB THR 25 HB THR 25 43.416 -4.308 13.174 137 HG1 THR 25 HG1 THR 25 44.951 -4.022 15.531 138 HG21 THR 25 HG21 THR 25 43.537 -5.604 15.881 139 HG22 THR 25 HG22 THR 25 42.778 -6.397 14.503 140 HG23 THR 25 HG23 THR 25 42.157 -4.853 15.083 141 H SER 26 HN SER 26 46.747 -5.251 15.246 142 HA SER 26 HA SER 26 47.204 -7.954 16.123 143 HB2 SER 26 HB2 SER 26 48.462 -6.943 17.951 144 HB3 SER 26 HB1 SER 26 48.808 -6.057 16.469 145 HG SER 26 HG SER 26 47.579 -4.405 17.158 146 H SER 27 HN SER 27 44.373 -7.204 16.045 147 HA SER 27 HA SER 27 43.707 -7.925 18.844 148 HB2 SER 27 HB2 SER 27 42.473 -6.067 19.297 149 HB3 SER 27 HB1 SER 27 43.483 -5.322 18.061 150 HG SER 27 HG SER 27 41.620 -6.536 16.740 151 H GLY 28 HN GLY 28 42.992 -8.029 15.430 152 HA2 GLY 28 HA2 GLY 28 41.785 -10.129 14.763 153 HA3 GLY 28 HA1 GLY 28 40.665 -9.799 16.082 154 H GLN 29 HN GLN 29 41.478 -6.868 14.669 155 HA GLN 29 HA GLN 29 38.873 -6.790 13.296 156 HB2 GLN 29 HB2 GLN 29 40.863 -4.524 13.465 157 HB3 GLN 29 HB1 GLN 29 39.116 -4.428 13.253 158 HG2 GLN 29 HG2 GLN 29 40.247 -5.716 15.724 159 HG3 GLN 29 HG1 GLN 29 40.135 -3.959 15.621 160 HE21 GLN 29 HE21 GLN 29 38.526 -5.966 17.282 161 HE22 GLN 29 HE22 GLN 29 36.907 -5.618 16.909 162 H ARG 30 HN ARG 30 38.784 -7.353 11.183 163 HA ARG 30 HA ARG 30 41.166 -7.654 9.570 164 HB2 ARG 30 HB2 ARG 30 38.643 -8.677 9.435 165 HB3 ARG 30 HB1 ARG 30 38.575 -7.446 8.172 166 HG2 ARG 30 HG2 ARG 30 40.489 -8.389 7.048 167 HG3 ARG 30 HG1 ARG 30 40.792 -9.499 8.384 168 HD2 ARG 30 HD2 ARG 30 38.483 -9.526 6.433 169 HD3 ARG 30 HD1 ARG 30 39.670 -10.798 6.730 170 HE ARG 30 HE ARG 30 38.566 -10.793 9.124 171 HH11 ARG 30 HH11 ARG 30 36.546 -11.534 9.807 172 HH12 ARG 30 HH12 ARG 30 35.210 -11.511 8.705 173 HH21 ARG 30 HH21 ARG 30 37.047 -10.177 6.086 174 HH22 ARG 30 HH22 ARG 30 35.494 -10.742 6.601 175 H TYR 31 HN TYR 31 42.050 -6.265 8.114 176 HA TYR 31 HA TYR 31 40.518 -3.925 7.230 177 HB2 TYR 31 HB2 TYR 31 42.505 -2.401 7.771 178 HB3 TYR 31 HB1 TYR 31 41.469 -2.865 9.111 179 HD1 TYR 31 HD1 TYR 31 43.922 -5.199 7.584 180 HD2 TYR 31 HD2 TYR 31 43.121 -2.491 10.820 181 HE1 TYR 31 HE1 TYR 31 45.906 -6.044 8.797 182 HE2 TYR 31 HE2 TYR 31 45.108 -3.347 12.025 183 HH TYR 31 HH TYR 31 47.447 -4.574 11.057 184 H PHE 32 HN PHE 32 42.405 -2.563 5.827 185 HA PHE 32 HA PHE 32 43.558 -4.692 4.080 186 HB2 PHE 32 HB2 PHE 32 42.443 -2.013 3.216 187 HB3 PHE 32 HB1 PHE 32 43.056 -3.283 2.155 188 HD1 PHE 32 HD1 PHE 32 41.881 -5.500 2.054 189 HD2 PHE 32 HD2 PHE 32 40.238 -2.125 4.141 190 HE1 PHE 32 HE1 PHE 32 39.655 -6.594 2.070 191 HE2 PHE 32 HE2 PHE 32 38.011 -3.218 4.156 192 HZ PHE 32 HZ PHE 32 37.720 -5.452 3.121 193 H LEU 33 HN LEU 33 45.694 -4.572 3.739 194 HA LEU 33 HA LEU 33 47.186 -2.255 4.795 195 HB2 LEU 33 HB2 LEU 33 48.373 -4.639 3.372 196 HB3 LEU 33 HB1 LEU 33 49.129 -3.597 4.578 197 HG LEU 33 HG LEU 33 46.828 -5.506 5.081 198 HD11 LEU 33 HD11 LEU 33 49.794 -5.620 5.487 199 HD12 LEU 33 HD12 LEU 33 48.685 -6.899 4.995 200 HD13 LEU 33 HD13 LEU 33 48.753 -6.391 6.684 201 HD21 LEU 33 HD21 LEU 33 46.416 -4.119 6.821 202 HD22 LEU 33 HD22 LEU 33 47.913 -3.228 6.556 203 HD23 LEU 33 HD23 LEU 33 47.929 -4.714 7.503 204 H ASN 34 HN ASN 34 47.844 -0.597 3.502 205 HA ASN 34 HA ASN 34 47.678 -1.002 0.553 206 HB2 ASN 34 HB2 ASN 34 46.458 0.919 1.815 207 HB3 ASN 34 HB1 ASN 34 48.057 1.656 1.914 208 HD21 ASN 34 HD21 ASN 34 46.535 3.219 0.434 209 HD22 ASN 34 HD22 ASN 34 46.725 2.974 -1.235 210 H HIS 35 HN HIS 35 49.653 -1.672 -0.196 211 HA HIS 35 HA HIS 35 52.142 -0.882 1.088 212 HB2 HIS 35 HB2 HIS 35 51.559 -2.262 -1.548 213 HB3 HIS 35 HB1 HIS 35 53.187 -1.981 -0.932 214 HD1 HIS 35 HD1 HIS 35 53.563 -4.569 -0.673 215 HD2 HIS 35 HD2 HIS 35 50.458 -3.046 1.659 216 HE1 HIS 35 HE1 HIS 35 52.981 -6.371 1.012 217 HE2 HIS 35 HE2 HIS 35 51.093 -5.453 2.436 218 H ILE 36 HN ILE 36 50.011 0.524 -1.144 219 HA ILE 36 HA ILE 36 52.017 2.170 -2.512 220 HB ILE 36 HB ILE 36 49.081 2.782 -2.496 221 HG12 ILE 36 HG12 ILE 36 49.843 0.196 -2.833 222 HG13 ILE 36 HG11 ILE 36 48.459 0.912 -3.644 223 HG21 ILE 36 HG21 ILE 36 51.329 2.895 -4.521 224 HG22 ILE 36 HG22 ILE 36 50.455 4.249 -3.805 225 HG23 ILE 36 HG23 ILE 36 49.642 3.178 -4.947 226 HD11 ILE 36 HD11 ILE 36 49.667 1.258 -5.651 227 HD12 ILE 36 HD12 ILE 36 50.172 -0.344 -5.114 228 HD13 ILE 36 HD13 ILE 36 51.223 1.047 -4.847 229 H ASP 37 HN ASP 37 49.316 2.699 -0.270 230 HA ASP 37 HA ASP 37 50.373 5.355 0.413 231 HB2 ASP 37 HB2 ASP 37 47.963 3.861 1.482 232 HB3 ASP 37 HB1 ASP 37 48.365 5.537 1.856 233 H GLN 38 HN GLN 38 51.226 2.408 1.151 234 HA GLN 38 HA GLN 38 52.165 1.315 3.016 235 HB2 GLN 38 HB2 GLN 38 53.273 4.085 2.872 236 HB3 GLN 38 HB1 GLN 38 53.706 3.084 4.260 237 HG2 GLN 38 HG2 GLN 38 54.669 1.405 2.887 238 HG3 GLN 38 HG1 GLN 38 53.916 2.054 1.431 239 HE21 GLN 38 HE21 GLN 38 56.866 1.891 2.945 240 HE22 GLN 38 HE22 GLN 38 57.571 3.315 2.348 241 H THR 39 HN THR 39 49.825 1.329 3.909 242 HA THR 39 HA THR 39 49.926 1.948 6.688 243 HB THR 39 HB THR 39 49.444 4.155 6.364 244 HG1 THR 39 HG1 THR 39 47.737 3.639 7.535 245 HG21 THR 39 HG21 THR 39 47.418 4.093 4.280 246 HG22 THR 39 HG22 THR 39 48.945 3.405 3.735 247 HG23 THR 39 HG23 THR 39 48.895 5.049 4.366 248 H THR 40 HN THR 40 47.369 2.024 7.390 249 HA THR 40 HA THR 40 46.152 -0.326 6.004 250 HB THR 40 HB THR 40 45.132 -0.825 8.298 251 HG1 THR 40 HG1 THR 40 45.484 1.035 9.384 252 HG21 THR 40 HG21 THR 40 46.741 -2.384 8.115 253 HG22 THR 40 HG22 THR 40 47.765 -1.312 9.070 254 HG23 THR 40 HG23 THR 40 47.831 -1.256 7.309 255 H THR 41 HN THR 41 43.791 -0.339 5.982 256 HA THR 41 HA THR 41 42.503 2.235 6.686 257 HB THR 41 HB THR 41 42.561 2.744 4.489 258 HG1 THR 41 HG1 THR 41 40.785 1.814 3.366 259 HG21 THR 41 HG21 THR 41 43.187 -0.157 4.179 260 HG22 THR 41 HG22 THR 41 44.094 1.247 3.617 261 HG23 THR 41 HG23 THR 41 42.638 0.737 2.762 262 H TRP 42 HN TRP 42 40.321 2.075 7.186 263 HA TRP 42 HA TRP 42 39.382 -0.639 7.849 264 HB2 TRP 42 HB2 TRP 42 37.991 2.030 8.240 265 HB3 TRP 42 HB1 TRP 42 37.539 0.495 8.977 266 HD1 TRP 42 HD1 TRP 42 39.230 3.526 9.834 267 HE1 TRP 42 HE1 TRP 42 40.866 3.205 11.803 268 HE3 TRP 42 HE3 TRP 42 39.576 -1.566 9.857 269 HZ2 TRP 42 HZ2 TRP 42 42.153 1.058 13.200 270 HZ3 TRP 42 HZ3 TRP 42 41.010 -2.723 11.514 271 HH2 TRP 42 HH2 TRP 42 42.300 -1.419 13.182 272 H GLN 43 HN GLN 43 39.323 1.451 5.243 273 HA GLN 43 HA GLN 43 36.789 0.238 4.226 274 HB2 GLN 43 HB2 GLN 43 36.763 2.742 4.555 275 HB3 GLN 43 HB1 GLN 43 38.021 2.851 3.324 276 HG2 GLN 43 HG2 GLN 43 36.578 1.894 1.651 277 HG3 GLN 43 HG1 GLN 43 35.356 1.489 2.859 278 HE21 GLN 43 HE21 GLN 43 36.841 4.200 1.095 279 HE22 GLN 43 HE22 GLN 43 35.624 5.325 1.462 280 H ASP 44 HN ASP 44 36.774 -0.214 1.890 281 HA ASP 44 HA ASP 44 39.459 -0.422 0.652 282 HB2 ASP 44 HB2 ASP 44 37.961 -2.627 1.712 283 HB3 ASP 44 HB1 ASP 44 38.015 -2.774 -0.045 284 HA PRO 45 HA PRO 45 37.548 1.042 -3.014 285 HB2 PRO 45 HB2 PRO 45 38.639 -0.819 -4.835 286 HB3 PRO 45 HB1 PRO 45 39.352 0.733 -4.361 287 HG2 PRO 45 HG2 PRO 45 39.986 -2.000 -3.432 288 HG3 PRO 45 HG1 PRO 45 41.029 -0.575 -3.567 289 HD2 PRO 45 HD2 PRO 45 40.122 -1.487 -1.173 290 HD3 PRO 45 HD1 PRO 45 40.421 0.239 -1.484 291 H ARG 46 HN ARG 46 37.310 -2.373 -2.247 292 HA ARG 46 HA ARG 46 35.093 -2.776 -4.138 293 HB2 ARG 46 HB2 ARG 46 36.714 -4.513 -2.326 294 HB3 ARG 46 HB1 ARG 46 35.090 -5.058 -2.745 295 HG2 ARG 46 HG2 ARG 46 35.746 -5.647 -4.820 296 HG3 ARG 46 HG1 ARG 46 36.477 -4.065 -5.095 297 HD2 ARG 46 HD2 ARG 46 37.905 -5.991 -3.301 298 HD3 ARG 46 HD1 ARG 46 37.969 -6.260 -5.042 299 HE ARG 46 HE ARG 46 39.248 -4.059 -3.596 300 HH11 ARG 46 HH11 ARG 46 40.520 -2.696 -4.876 301 HH12 ARG 46 HH12 ARG 46 40.392 -2.784 -6.602 302 HH21 ARG 46 HH21 ARG 46 37.992 -5.286 -6.562 303 HH22 ARG 46 HH22 ARG 46 38.961 -4.249 -7.555 304 H LYS 47 HN LYS 47 34.914 -0.866 -1.858 305 HA LYS 47 HA LYS 47 32.295 -1.771 -0.880 306 HB2 LYS 47 HB2 LYS 47 34.658 -1.288 0.948 307 HB3 LYS 47 HB1 LYS 47 32.989 -1.217 1.516 308 HG2 LYS 47 HG2 LYS 47 32.815 -3.563 0.300 309 HG3 LYS 47 HG1 LYS 47 34.561 -3.576 0.546 310 HD2 LYS 47 HD2 LYS 47 32.510 -3.111 2.731 311 HD3 LYS 47 HD1 LYS 47 33.340 -4.640 2.436 312 HE2 LYS 47 HE2 LYS 47 35.491 -3.640 2.915 313 HE3 LYS 47 HE1 LYS 47 34.771 -2.032 3.012 314 HZ1 LYS 47 HZ1 LYS 47 33.294 -3.399 4.780 315 HZ2 LYS 47 HZ2 LYS 47 34.669 -2.485 5.187 316 HZ3 LYS 47 HZ3 LYS 47 34.797 -4.165 4.964 317 H ALA 48 HN ALA 48 31.428 0.088 0.668 318 HA ALA 48 HA ALA 48 32.438 2.711 0.585 319 HB1 ALA 48 HB1 ALA 48 30.483 3.224 -1.348 320 HB2 ALA 48 HB2 ALA 48 31.350 1.817 -1.966 321 HB3 ALA 48 HB3 ALA 48 32.229 3.298 -1.585 322 H MET 49 HN MET 49 30.815 0.950 2.229 323 HA MET 49 HA MET 49 29.037 2.698 3.437 324 HB2 MET 49 HB2 MET 49 27.986 1.709 0.907 325 HB3 MET 49 HB1 MET 49 26.935 1.277 2.256 326 HG2 MET 49 HG2 MET 49 26.563 3.508 2.854 327 HG3 MET 49 HG1 MET 49 28.028 4.070 2.047 328 HE1 MET 49 HE1 MET 49 27.929 5.374 0.024 329 HE2 MET 49 HE2 MET 49 26.683 6.026 1.086 330 HE3 MET 49 HE3 MET 49 26.362 5.857 -0.638 331 H GLY 50 HN GLY 50 26.851 1.022 4.076 332 HA2 GLY 50 HA2 GLY 50 26.597 -1.415 4.722 333 HA3 GLY 50 HA1 GLY 50 28.268 -1.323 5.281 334 H GLY 51 HN GLY 51 27.747 1.481 6.290 335 HA2 GLY 51 HA2 GLY 51 25.849 2.012 8.086 336 HA3 GLY 51 HA1 GLY 51 26.607 0.639 8.893 337 H GLY 52 HN GLY 52 28.389 2.983 6.958 338 HA2 GLY 52 HA2 GLY 52 30.462 3.399 8.777 339 HA3 GLY 52 HA1 GLY 52 29.964 4.612 7.596 340 H GLY 53 HN GLY 53 30.813 5.805 9.747 341 HA2 GLY 53 HA2 GLY 53 29.211 7.602 10.778 342 HA3 GLY 53 HA1 GLY 53 28.508 6.205 11.595 343 H ASN 54 HN ASN 54 30.178 4.825 12.821 344 HA ASN 54 HA ASN 54 32.299 6.580 13.987 345 HB2 ASN 54 HB2 ASN 54 30.835 4.561 15.666 346 HB3 ASN 54 HB1 ASN 54 31.696 6.014 16.175 347 HD21 ASN 54 HD21 ASN 54 30.182 7.473 16.982 348 HD22 ASN 54 HD22 ASN 54 28.680 7.812 16.269 349 H TYR 55 HN TYR 55 34.102 5.598 13.118 350 HA TYR 55 HA TYR 55 34.260 2.671 12.919 351 HB2 TYR 55 HB2 TYR 55 36.638 4.446 12.514 352 HB3 TYR 55 HB1 TYR 55 36.148 3.010 11.615 353 HD1 TYR 55 HD1 TYR 55 35.225 6.569 12.269 354 HD2 TYR 55 HD2 TYR 55 34.874 3.196 9.632 355 HE1 TYR 55 HE1 TYR 55 34.111 8.004 10.580 356 HE2 TYR 55 HE2 TYR 55 33.761 4.631 7.944 357 HH TYR 55 HH TYR 55 33.925 7.700 7.746 358 H GLN 56 HN GLN 56 36.222 1.553 13.871 359 HA GLN 56 HA GLN 56 36.331 2.012 16.704 360 HB2 GLN 56 HB2 GLN 56 38.571 0.486 15.557 361 HB3 GLN 56 HB1 GLN 56 37.382 -0.005 16.763 362 HG2 GLN 56 HG2 GLN 56 35.729 -0.003 14.715 363 HG3 GLN 56 HG1 GLN 56 37.211 -0.149 13.769 364 HE21 GLN 56 HE21 GLN 56 35.199 -2.262 14.014 365 HE22 GLN 56 HE22 GLN 56 35.949 -3.576 14.783 366 H GLY 57 HN GLY 57 37.254 4.165 14.782 367 HA2 GLY 57 HA2 GLY 57 38.716 5.991 15.456 368 HA3 GLY 57 HA1 GLY 57 39.756 4.813 16.257 369 HA PRO 58 HA PRO 58 40.974 6.142 11.699 370 HB2 PRO 58 HB2 PRO 58 43.379 6.880 13.321 371 HB3 PRO 58 HB1 PRO 58 42.692 7.682 11.896 372 HG2 PRO 58 HG2 PRO 58 42.346 8.630 14.381 373 HG3 PRO 58 HG1 PRO 58 41.123 8.806 13.114 374 HD2 PRO 58 HD2 PRO 58 41.072 7.090 15.522 375 HD3 PRO 58 HD1 PRO 58 39.723 7.668 14.520 376 HA PRO 59 HA PRO 59 43.043 2.210 11.591 377 HB2 PRO 59 HB2 PRO 59 43.892 2.265 9.003 378 HB3 PRO 59 HB1 PRO 59 42.197 2.006 9.458 379 HG2 PRO 59 HG2 PRO 59 43.535 4.467 8.465 380 HG3 PRO 59 HG1 PRO 59 41.915 3.842 8.117 381 HD2 PRO 59 HD2 PRO 59 42.416 5.881 9.908 382 HD3 PRO 59 HD1 PRO 59 40.994 4.818 9.986 383 HA PRO 60 HA PRO 60 47.263 3.669 12.296 384 HB2 PRO 60 HB2 PRO 60 48.089 1.500 13.712 385 HB3 PRO 60 HB1 PRO 60 47.069 2.767 14.417 386 HG2 PRO 60 HG2 PRO 60 46.333 0.057 13.467 387 HG3 PRO 60 HG1 PRO 60 45.689 0.995 14.823 388 HD2 PRO 60 HD2 PRO 60 44.444 0.726 12.344 389 HD3 PRO 60 HD1 PRO 60 44.108 2.018 13.517 390 HA PRO 61 HA PRO 61 48.991 1.827 8.587 391 HB2 PRO 61 HB2 PRO 61 51.498 2.537 10.069 392 HB3 PRO 61 HB1 PRO 61 51.076 2.824 8.369 393 HG2 PRO 61 HG2 PRO 61 50.949 4.763 10.193 394 HG3 PRO 61 HG1 PRO 61 49.796 4.656 8.852 395 HD2 PRO 61 HD2 PRO 61 49.350 4.138 11.739 396 HD3 PRO 61 HD1 PRO 61 48.173 4.555 10.473 397 H TYR 62 HN TYR 62 49.486 -0.271 8.167 398 HA TYR 62 HA TYR 62 49.522 -2.378 9.884 399 HB2 TYR 62 HB2 TYR 62 51.235 -3.445 8.258 400 HB3 TYR 62 HB1 TYR 62 49.716 -2.870 7.572 401 HD1 TYR 62 HD1 TYR 62 53.123 -1.546 8.431 402 HD2 TYR 62 HD2 TYR 62 49.825 -1.537 5.682 403 HE1 TYR 62 HE1 TYR 62 54.363 -0.001 6.954 404 HE2 TYR 62 HE2 TYR 62 51.066 0.002 4.201 405 HH TYR 62 HH TYR 62 54.429 0.784 4.763 406 HA PRO 63 HA PRO 63 52.882 -2.354 12.724 407 HB2 PRO 63 HB2 PRO 63 54.091 -4.825 12.053 408 HB3 PRO 63 HB1 PRO 63 52.830 -4.562 13.270 409 HG2 PRO 63 HG2 PRO 63 52.593 -5.526 10.477 410 HG3 PRO 63 HG1 PRO 63 51.630 -5.941 11.906 411 HD2 PRO 63 HD2 PRO 63 50.646 -4.320 10.001 412 HD3 PRO 63 HD1 PRO 63 50.285 -4.036 11.718 413 H LYS 64 HN LYS 64 54.791 -1.248 12.567 414 HA LYS 64 HA LYS 64 56.100 -0.647 10.151 415 HB2 LYS 64 HB2 LYS 64 58.076 -0.059 11.615 416 HB3 LYS 64 HB1 LYS 64 56.553 0.670 12.126 417 HG2 LYS 64 HG2 LYS 64 56.464 -1.696 13.482 418 HG3 LYS 64 HG1 LYS 64 58.202 -1.386 13.467 419 HD2 LYS 64 HD2 LYS 64 57.183 -0.361 15.451 420 HD3 LYS 64 HD1 LYS 64 57.787 0.891 14.363 421 HE2 LYS 64 HE2 LYS 64 55.701 1.674 13.907 422 HE3 LYS 64 HE1 LYS 64 55.005 0.055 13.841 423 HZ1 LYS 64 HZ1 LYS 64 54.247 1.484 15.735 424 HZ2 LYS 64 HZ2 LYS 64 55.815 1.358 16.375 425 HZ3 LYS 64 HZ3 LYS 64 54.860 -0.033 16.178 426 H HIS 65 HN HIS 65 56.855 -2.209 8.784 427 HA HIS 65 HA HIS 65 57.821 -4.275 8.125 428 HB2 HIS 65 HB2 HIS 65 60.039 -3.509 10.010 429 HB3 HIS 65 HB1 HIS 65 60.150 -4.188 8.386 430 HD1 HIS 65 HD1 HIS 65 60.710 -1.116 10.031 431 HD2 HIS 65 HD2 HIS 65 58.800 -2.126 6.462 432 HE1 HIS 65 HE1 HIS 65 60.629 0.999 8.635 433 HE2 HIS 65 HE2 HIS 65 59.469 0.395 6.462 Start of MODEL 9 1 H1 SER 7 HT1 SER 7 27.527 -21.497 -17.867 2 H2 SER 7 HT2 SER 7 27.308 -22.248 -16.360 3 H3 SER 7 HT3 SER 7 28.787 -21.500 -16.733 4 HA SER 7 HA SER 7 26.631 -19.669 -17.022 5 HB2 SER 7 HB2 SER 7 25.720 -21.248 -15.240 6 HB3 SER 7 HB1 SER 7 27.080 -20.758 -14.233 7 HG SER 7 HG SER 7 26.348 -18.589 -14.493 8 H PHE 8 HN PHE 8 29.732 -20.498 -16.782 9 HA PHE 8 HA PHE 8 31.695 -19.445 -15.955 10 HB2 PHE 8 HB2 PHE 8 29.996 -17.393 -17.339 11 HB3 PHE 8 HB1 PHE 8 31.512 -16.894 -16.588 12 HD1 PHE 8 HD1 PHE 8 33.003 -16.536 -18.378 13 HD2 PHE 8 HD2 PHE 8 30.631 -20.116 -18.269 14 HE1 PHE 8 HE1 PHE 8 34.261 -17.429 -20.320 15 HE2 PHE 8 HE2 PHE 8 31.888 -21.008 -20.212 16 HZ PHE 8 HZ PHE 8 33.703 -19.664 -21.237 17 H GLU 9 HN GLU 9 31.636 -19.644 -13.692 18 HA GLU 9 HA GLU 9 30.016 -17.797 -12.089 19 HB2 GLU 9 HB2 GLU 9 31.339 -18.919 -10.183 20 HB3 GLU 9 HB1 GLU 9 30.263 -19.953 -11.125 21 HG2 GLU 9 HG2 GLU 9 32.113 -20.774 -12.455 22 HG3 GLU 9 HG1 GLU 9 33.220 -19.625 -11.701 23 H ILE 10 HN ILE 10 30.697 -15.761 -11.652 24 HA ILE 10 HA ILE 10 33.373 -14.865 -12.264 25 HB ILE 10 HB ILE 10 31.540 -13.355 -10.423 26 HG12 ILE 10 HG12 ILE 10 31.063 -14.095 -13.299 27 HG13 ILE 10 HG11 ILE 10 29.905 -13.986 -11.973 28 HG21 ILE 10 HG21 ILE 10 32.999 -12.338 -12.852 29 HG22 ILE 10 HG22 ILE 10 33.874 -12.622 -11.348 30 HG23 ILE 10 HG23 ILE 10 32.542 -11.467 -11.388 31 HD11 ILE 10 HD11 ILE 10 31.051 -11.807 -13.673 32 HD12 ILE 10 HD12 ILE 10 30.636 -11.431 -12.001 33 HD13 ILE 10 HD13 ILE 10 29.396 -12.030 -13.102 34 HA PRO 11 HA PRO 11 35.267 -16.625 -8.572 35 HB2 PRO 11 HB2 PRO 11 37.250 -14.499 -9.272 36 HB3 PRO 11 HB1 PRO 11 37.519 -16.212 -8.895 37 HG2 PRO 11 HG2 PRO 11 37.613 -15.283 -11.399 38 HG3 PRO 11 HG1 PRO 11 37.003 -16.901 -11.014 39 HD2 PRO 11 HD2 PRO 11 35.499 -14.491 -11.880 40 HD3 PRO 11 HD1 PRO 11 35.073 -16.209 -12.044 41 H ASP 12 HN ASP 12 34.743 -16.023 -6.514 42 HA ASP 12 HA ASP 12 34.089 -13.227 -5.949 43 HB2 ASP 12 HB2 ASP 12 34.081 -15.565 -4.031 44 HB3 ASP 12 HB1 ASP 12 33.249 -14.024 -3.826 45 H ASP 13 HN ASP 13 36.845 -14.789 -6.166 46 HA ASP 13 HA ASP 13 38.130 -13.787 -3.714 47 HB2 ASP 13 HB2 ASP 13 40.216 -14.728 -5.036 48 HB3 ASP 13 HB1 ASP 13 39.077 -15.840 -4.274 49 H VAL 14 HN VAL 14 36.981 -11.897 -5.635 50 HA VAL 14 HA VAL 14 38.754 -10.668 -7.389 51 HB VAL 14 HB VAL 14 36.975 -9.206 -5.416 52 HG11 VAL 14 HG11 VAL 14 37.148 -7.356 -6.805 53 HG12 VAL 14 HG12 VAL 14 37.535 -8.329 -8.225 54 HG13 VAL 14 HG13 VAL 14 38.763 -8.041 -6.992 55 HG21 VAL 14 HG21 VAL 14 36.061 -11.153 -6.989 56 HG22 VAL 14 HG22 VAL 14 36.148 -9.885 -8.212 57 HG23 VAL 14 HG23 VAL 14 35.152 -9.657 -6.775 58 HA PRO 15 HA PRO 15 42.038 -9.825 -4.419 59 HB2 PRO 15 HB2 PRO 15 43.874 -8.993 -6.274 60 HB3 PRO 15 HB1 PRO 15 43.541 -10.697 -5.916 61 HG2 PRO 15 HG2 PRO 15 42.628 -9.026 -8.190 62 HG3 PRO 15 HG1 PRO 15 43.064 -10.743 -8.146 63 HD2 PRO 15 HD2 PRO 15 40.466 -9.819 -8.181 64 HD3 PRO 15 HD1 PRO 15 40.949 -11.397 -7.521 65 H LEU 16 HN LEU 16 42.905 -7.923 -3.494 66 HA LEU 16 HA LEU 16 41.482 -5.484 -3.860 67 HB2 LEU 16 HB2 LEU 16 44.252 -5.926 -2.710 68 HB3 LEU 16 HB1 LEU 16 43.251 -4.507 -2.449 69 HG LEU 16 HG LEU 16 43.358 -6.672 -0.791 70 HD11 LEU 16 HD11 LEU 16 41.323 -4.525 -1.287 71 HD12 LEU 16 HD12 LEU 16 42.456 -4.699 0.053 72 HD13 LEU 16 HD13 LEU 16 41.026 -5.728 -0.033 73 HD21 LEU 16 HD21 LEU 16 41.058 -7.716 -1.003 74 HD22 LEU 16 HD22 LEU 16 42.204 -8.209 -2.242 75 HD23 LEU 16 HD23 LEU 16 40.956 -7.018 -2.615 76 HA PRO 17 HA PRO 17 43.496 -3.339 -7.176 77 HB2 PRO 17 HB2 PRO 17 44.483 -1.163 -5.461 78 HB3 PRO 17 HB1 PRO 17 43.325 -1.108 -6.796 79 HG2 PRO 17 HG2 PRO 17 42.593 -0.820 -4.226 80 HG3 PRO 17 HG1 PRO 17 41.542 -1.546 -5.454 81 HD2 PRO 17 HD2 PRO 17 43.098 -2.872 -3.281 82 HD3 PRO 17 HD1 PRO 17 41.532 -3.331 -3.987 83 H ALA 18 HN ALA 18 45.776 -1.504 -6.706 84 HA ALA 18 HA ALA 18 47.852 -3.578 -6.870 85 HB1 ALA 18 HB1 ALA 18 48.412 -0.666 -7.166 86 HB2 ALA 18 HB2 ALA 18 47.419 -1.458 -8.390 87 HB3 ALA 18 HB3 ALA 18 49.058 -2.031 -8.076 88 H GLY 19 HN GLY 19 49.447 -3.880 -5.374 89 HA2 GLY 19 HA2 GLY 19 50.716 -3.611 -3.422 90 HA3 GLY 19 HA1 GLY 19 50.328 -1.896 -3.504 91 H TRP 20 HN TRP 20 47.708 -4.190 -3.386 92 HA TRP 20 HA TRP 20 47.109 -3.211 -0.641 93 HB2 TRP 20 HB2 TRP 20 45.371 -4.289 -2.842 94 HB3 TRP 20 HB1 TRP 20 44.784 -4.011 -1.198 95 HD1 TRP 20 HD1 TRP 20 45.823 -2.240 -4.342 96 HE1 TRP 20 HE1 TRP 20 45.366 0.270 -4.093 97 HE3 TRP 20 HE3 TRP 20 44.703 -2.115 0.594 98 HZ2 TRP 20 HZ2 TRP 20 44.612 2.126 -1.994 99 HZ3 TRP 20 HZ3 TRP 20 44.135 -0.005 1.717 100 HH2 TRP 20 HH2 TRP 20 44.079 2.131 0.437 101 H GLU 21 HN GLU 21 46.185 -4.685 0.916 102 HA GLU 21 HA GLU 21 46.216 -7.553 0.375 103 HB2 GLU 21 HB2 GLU 21 48.677 -6.883 0.735 104 HB3 GLU 21 HB1 GLU 21 48.223 -6.578 2.412 105 HG2 GLU 21 HG2 GLU 21 48.790 -8.793 2.630 106 HG3 GLU 21 HG1 GLU 21 47.117 -9.013 2.115 107 H MET 22 HN MET 22 44.363 -8.086 1.472 108 HA MET 22 HA MET 22 43.341 -6.537 3.647 109 HB2 MET 22 HB2 MET 22 41.584 -7.726 2.838 110 HB3 MET 22 HB1 MET 22 42.619 -9.032 2.255 111 HG2 MET 22 HG2 MET 22 42.771 -10.001 4.436 112 HG3 MET 22 HG1 MET 22 42.020 -8.590 5.180 113 HE1 MET 22 HE1 MET 22 40.617 -9.982 1.674 114 HE2 MET 22 HE2 MET 22 40.042 -11.532 2.286 115 HE3 MET 22 HE3 MET 22 41.746 -11.108 2.441 116 H ALA 23 HN ALA 23 43.657 -6.766 5.832 117 HA ALA 23 HA ALA 23 45.064 -9.163 6.839 118 HB1 ALA 23 HB1 ALA 23 46.694 -7.568 8.037 119 HB2 ALA 23 HB2 ALA 23 46.172 -6.363 6.858 120 HB3 ALA 23 HB3 ALA 23 46.957 -7.844 6.316 121 H LYS 24 HN LYS 24 45.307 -8.895 9.359 122 HA LYS 24 HA LYS 24 42.883 -7.453 10.326 123 HB2 LYS 24 HB2 LYS 24 43.199 -10.133 10.451 124 HB3 LYS 24 HB1 LYS 24 43.958 -9.663 11.973 125 HG2 LYS 24 HG2 LYS 24 42.007 -8.656 12.790 126 HG3 LYS 24 HG1 LYS 24 41.300 -8.503 11.184 127 HD2 LYS 24 HD2 LYS 24 41.855 -11.180 12.487 128 HD3 LYS 24 HD1 LYS 24 40.301 -10.357 12.605 129 HE2 LYS 24 HE2 LYS 24 41.101 -10.342 9.860 130 HE3 LYS 24 HE1 LYS 24 41.264 -11.988 10.471 131 HZ1 LYS 24 HZ1 LYS 24 38.998 -11.218 9.581 132 HZ2 LYS 24 HZ2 LYS 24 38.850 -10.405 11.065 133 HZ3 LYS 24 HZ3 LYS 24 39.041 -12.093 11.034 134 H THR 25 HN THR 25 42.963 -6.602 12.418 135 HA THR 25 HA THR 25 45.506 -5.347 13.080 136 HB THR 25 HB THR 25 43.132 -4.365 13.225 137 HG1 THR 25 HG1 THR 25 43.795 -3.556 15.513 138 HG21 THR 25 HG21 THR 25 41.797 -4.925 15.077 139 HG22 THR 25 HG22 THR 25 43.122 -5.759 15.886 140 HG23 THR 25 HG23 THR 25 42.375 -6.470 14.456 141 H SER 26 HN SER 26 46.376 -5.499 15.347 142 HA SER 26 HA SER 26 46.720 -8.237 16.150 143 HB2 SER 26 HB2 SER 26 48.257 -7.403 17.638 144 HB3 SER 26 HB1 SER 26 48.089 -5.952 16.654 145 HG SER 26 HG SER 26 47.127 -6.533 19.200 146 H SER 27 HN SER 27 43.912 -7.365 16.018 147 HA SER 27 HA SER 27 43.135 -8.177 18.766 148 HB2 SER 27 HB2 SER 27 41.734 -6.367 19.152 149 HB3 SER 27 HB1 SER 27 43.047 -5.581 18.277 150 HG SER 27 HG SER 27 41.334 -6.597 16.514 151 H GLY 28 HN GLY 28 42.508 -8.106 15.326 152 HA2 GLY 28 HA2 GLY 28 41.289 -10.163 14.536 153 HA3 GLY 28 HA1 GLY 28 40.133 -9.860 15.831 154 H GLN 29 HN GLN 29 41.046 -6.889 14.581 155 HA GLN 29 HA GLN 29 38.482 -6.669 13.159 156 HB2 GLN 29 HB2 GLN 29 40.605 -4.528 13.400 157 HB3 GLN 29 HB1 GLN 29 38.880 -4.314 13.111 158 HG2 GLN 29 HG2 GLN 29 39.755 -5.722 15.609 159 HG3 GLN 29 HG1 GLN 29 39.876 -3.964 15.537 160 HE21 GLN 29 HE21 GLN 29 37.477 -6.566 14.807 161 HE22 GLN 29 HE22 GLN 29 36.132 -5.668 15.322 162 H ARG 30 HN ARG 30 38.382 -7.215 11.040 163 HA ARG 30 HA ARG 30 40.765 -7.596 9.440 164 HB2 ARG 30 HB2 ARG 30 39.355 -8.513 7.866 165 HB3 ARG 30 HB1 ARG 30 38.300 -8.634 9.275 166 HG2 ARG 30 HG2 ARG 30 37.406 -6.335 8.658 167 HG3 ARG 30 HG1 ARG 30 38.278 -6.496 7.134 168 HD2 ARG 30 HD2 ARG 30 37.038 -8.822 7.016 169 HD3 ARG 30 HD1 ARG 30 35.917 -8.052 8.138 170 HE ARG 30 HE ARG 30 36.324 -7.305 5.316 171 HH11 ARG 30 HH11 ARG 30 34.810 -5.820 4.532 172 HH12 ARG 30 HH12 ARG 30 33.760 -5.007 5.643 173 HH21 ARG 30 HH21 ARG 30 35.072 -6.575 8.445 174 HH22 ARG 30 HH22 ARG 30 33.908 -5.434 7.858 175 H TYR 31 HN TYR 31 41.753 -6.169 8.078 176 HA TYR 31 HA TYR 31 40.258 -3.800 7.187 177 HB2 TYR 31 HB2 TYR 31 42.277 -2.326 7.773 178 HB3 TYR 31 HB1 TYR 31 41.200 -2.776 9.085 179 HD1 TYR 31 HD1 TYR 31 43.664 -5.114 7.567 180 HD2 TYR 31 HD2 TYR 31 42.788 -2.500 10.861 181 HE1 TYR 31 HE1 TYR 31 45.601 -6.015 8.812 182 HE2 TYR 31 HE2 TYR 31 44.730 -3.413 12.097 183 HH TYR 31 HH TYR 31 47.166 -4.853 10.873 184 H PHE 32 HN PHE 32 42.186 -2.453 5.820 185 HA PHE 32 HA PHE 32 43.368 -4.579 4.094 186 HB2 PHE 32 HB2 PHE 32 42.159 -1.962 3.173 187 HB3 PHE 32 HB1 PHE 32 42.819 -3.231 2.138 188 HD1 PHE 32 HD1 PHE 32 39.978 -2.170 4.170 189 HD2 PHE 32 HD2 PHE 32 41.708 -5.457 2.016 190 HE1 PHE 32 HE1 PHE 32 37.796 -3.347 4.213 191 HE2 PHE 32 HE2 PHE 32 39.525 -6.633 2.056 192 HZ PHE 32 HZ PHE 32 37.569 -5.578 3.155 193 H LEU 33 HN LEU 33 45.493 -4.401 3.771 194 HA LEU 33 HA LEU 33 46.902 -2.010 4.772 195 HB2 LEU 33 HB2 LEU 33 48.205 -4.352 3.394 196 HB3 LEU 33 HB1 LEU 33 48.866 -3.304 4.648 197 HG LEU 33 HG LEU 33 46.510 -5.147 5.112 198 HD11 LEU 33 HD11 LEU 33 49.448 -5.633 5.175 199 HD12 LEU 33 HD12 LEU 33 48.130 -6.757 4.841 200 HD13 LEU 33 HD13 LEU 33 48.502 -6.301 6.504 201 HD21 LEU 33 HD21 LEU 33 48.266 -4.337 7.328 202 HD22 LEU 33 HD22 LEU 33 46.506 -4.324 7.230 203 HD23 LEU 33 HD23 LEU 33 47.435 -2.992 6.554 204 H ASN 34 HN ASN 34 47.670 -0.400 3.463 205 HA ASN 34 HA ASN 34 47.429 -0.831 0.518 206 HB2 ASN 34 HB2 ASN 34 46.195 1.085 1.787 207 HB3 ASN 34 HB1 ASN 34 47.781 1.853 1.824 208 HD21 ASN 34 HD21 ASN 34 47.862 0.002 -0.914 209 HD22 ASN 34 HD22 ASN 34 47.306 1.136 -2.047 210 H HIS 35 HN HIS 35 49.399 -1.454 -0.266 211 HA HIS 35 HA HIS 35 51.894 -0.606 0.971 212 HB2 HIS 35 HB2 HIS 35 51.596 -1.789 -1.797 213 HB3 HIS 35 HB1 HIS 35 52.976 -1.909 -0.707 214 HD1 HIS 35 HD1 HIS 35 52.062 -4.569 -1.556 215 HD2 HIS 35 HD2 HIS 35 50.195 -2.596 1.611 216 HE1 HIS 35 HE1 HIS 35 50.891 -6.353 -0.188 217 HE2 HIS 35 HE2 HIS 35 49.752 -5.163 1.741 218 H ILE 36 HN ILE 36 49.686 0.733 -1.223 219 HA ILE 36 HA ILE 36 51.619 2.423 -2.642 220 HB ILE 36 HB ILE 36 48.671 2.971 -2.567 221 HG12 ILE 36 HG12 ILE 36 49.484 0.396 -2.908 222 HG13 ILE 36 HG11 ILE 36 48.059 1.077 -3.677 223 HG21 ILE 36 HG21 ILE 36 50.863 3.099 -4.653 224 HG22 ILE 36 HG22 ILE 36 50.005 4.451 -3.914 225 HG23 ILE 36 HG23 ILE 36 49.162 3.371 -5.025 226 HD11 ILE 36 HD11 ILE 36 49.203 1.454 -5.721 227 HD12 ILE 36 HD12 ILE 36 49.739 -0.145 -5.204 228 HD13 ILE 36 HD13 ILE 36 50.784 1.256 -4.964 229 H ASP 37 HN ASP 37 48.924 2.920 -0.382 230 HA ASP 37 HA ASP 37 49.909 5.600 0.276 231 HB2 ASP 37 HB2 ASP 37 47.574 3.963 1.283 232 HB3 ASP 37 HB1 ASP 37 47.976 5.551 1.939 233 H GLN 38 HN GLN 38 50.882 2.671 0.994 234 HA GLN 38 HA GLN 38 52.005 1.642 2.787 235 HB2 GLN 38 HB2 GLN 38 52.919 4.481 2.624 236 HB3 GLN 38 HB1 GLN 38 53.483 3.500 3.979 237 HG2 GLN 38 HG2 GLN 38 54.119 1.727 2.256 238 HG3 GLN 38 HG1 GLN 38 53.838 2.958 1.026 239 HE21 GLN 38 HE21 GLN 38 54.828 4.923 3.341 240 HE22 GLN 38 HE22 GLN 38 56.514 4.849 3.165 241 H THR 39 HN THR 39 49.432 1.948 3.592 242 HA THR 39 HA THR 39 49.745 2.338 6.458 243 HB THR 39 HB THR 39 49.193 4.538 6.246 244 HG1 THR 39 HG1 THR 39 46.890 4.731 6.478 245 HG21 THR 39 HG21 THR 39 47.141 4.643 4.240 246 HG22 THR 39 HG22 THR 39 48.551 3.810 3.591 247 HG23 THR 39 HG23 THR 39 48.713 5.439 4.243 248 H THR 40 HN THR 40 47.251 2.336 7.306 249 HA THR 40 HA THR 40 46.021 -0.036 5.974 250 HB THR 40 HB THR 40 45.031 -0.442 8.316 251 HG1 THR 40 HG1 THR 40 45.953 1.834 8.819 252 HG21 THR 40 HG21 THR 40 46.612 -2.028 8.229 253 HG22 THR 40 HG22 THR 40 47.733 -0.888 8.973 254 HG23 THR 40 HG23 THR 40 47.635 -1.007 7.217 255 H THR 41 HN THR 41 43.692 -0.056 5.870 256 HA THR 41 HA THR 41 42.339 2.477 6.606 257 HB THR 41 HB THR 41 42.409 3.026 4.418 258 HG1 THR 41 HG1 THR 41 40.442 1.033 4.606 259 HG21 THR 41 HG21 THR 41 42.927 0.098 3.944 260 HG22 THR 41 HG22 THR 41 44.024 1.455 3.690 261 HG23 THR 41 HG23 THR 41 42.649 1.219 2.610 262 H TRP 42 HN TRP 42 40.159 2.264 7.074 263 HA TRP 42 HA TRP 42 39.268 -0.486 7.660 264 HB2 TRP 42 HB2 TRP 42 37.903 2.171 8.208 265 HB3 TRP 42 HB1 TRP 42 37.416 0.603 8.849 266 HD1 TRP 42 HD1 TRP 42 39.343 3.537 9.768 267 HE1 TRP 42 HE1 TRP 42 40.931 3.042 11.739 268 HE3 TRP 42 HE3 TRP 42 39.192 -1.566 9.754 269 HZ2 TRP 42 HZ2 TRP 42 41.996 0.773 13.127 270 HZ3 TRP 42 HZ3 TRP 42 40.500 -2.868 11.407 271 HH2 TRP 42 HH2 TRP 42 41.901 -1.707 13.090 272 H GLN 43 HN GLN 43 39.193 1.645 5.116 273 HA GLN 43 HA GLN 43 36.488 0.843 4.198 274 HB2 GLN 43 HB2 GLN 43 36.917 3.178 3.897 275 HB3 GLN 43 HB1 GLN 43 38.498 2.860 3.181 276 HG2 GLN 43 HG2 GLN 43 37.545 1.992 1.189 277 HG3 GLN 43 HG1 GLN 43 35.955 1.815 1.932 278 HE21 GLN 43 HE21 GLN 43 35.098 4.089 2.837 279 HE22 GLN 43 HE22 GLN 43 35.294 5.397 1.774 280 H ASP 44 HN ASP 44 36.192 -0.316 2.235 281 HA ASP 44 HA ASP 44 38.584 -1.852 1.390 282 HB2 ASP 44 HB2 ASP 44 35.817 -2.503 0.452 283 HB3 ASP 44 HB1 ASP 44 37.156 -3.592 0.819 284 HA PRO 45 HA PRO 45 38.772 0.437 -2.395 285 HB2 PRO 45 HB2 PRO 45 39.804 -1.598 -4.000 286 HB3 PRO 45 HB1 PRO 45 40.765 -0.519 -2.973 287 HG2 PRO 45 HG2 PRO 45 39.914 -3.313 -2.505 288 HG3 PRO 45 HG1 PRO 45 41.380 -2.470 -1.984 289 HD2 PRO 45 HD2 PRO 45 39.296 -3.021 -0.297 290 HD3 PRO 45 HD1 PRO 45 40.382 -1.631 -0.078 291 H ARG 46 HN ARG 46 37.039 -2.541 -2.058 292 HA ARG 46 HA ARG 46 35.779 -2.406 -4.694 293 HB2 ARG 46 HB2 ARG 46 35.542 -4.173 -2.281 294 HB3 ARG 46 HB1 ARG 46 34.254 -4.189 -3.487 295 HG2 ARG 46 HG2 ARG 46 35.901 -5.914 -4.029 296 HG3 ARG 46 HG1 ARG 46 35.953 -4.642 -5.251 297 HD2 ARG 46 HD2 ARG 46 37.764 -4.489 -2.857 298 HD3 ARG 46 HD1 ARG 46 38.201 -5.512 -4.225 299 HE ARG 46 HE ARG 46 38.198 -2.589 -4.200 300 HH11 ARG 46 HH11 ARG 46 38.909 -1.614 -6.112 301 HH12 ARG 46 HH12 ARG 46 39.042 -2.564 -7.554 302 HH21 ARG 46 HH21 ARG 46 37.965 -5.493 -6.043 303 HH22 ARG 46 HH22 ARG 46 38.509 -4.760 -7.515 304 H LYS 47 HN LYS 47 35.555 -0.157 -2.731 305 HA LYS 47 HA LYS 47 32.622 0.148 -2.937 306 HB2 LYS 47 HB2 LYS 47 34.112 0.703 -0.357 307 HB3 LYS 47 HB1 LYS 47 32.374 0.841 -0.627 308 HG2 LYS 47 HG2 LYS 47 32.213 -1.569 -1.028 309 HG3 LYS 47 HG1 LYS 47 33.961 -1.734 -0.849 310 HD2 LYS 47 HD2 LYS 47 33.277 -2.287 1.296 311 HD3 LYS 47 HD1 LYS 47 33.498 -0.547 1.478 312 HE2 LYS 47 HE2 LYS 47 31.107 -0.179 1.069 313 HE3 LYS 47 HE1 LYS 47 30.868 -1.910 0.827 314 HZ1 LYS 47 HZ1 LYS 47 31.125 -0.423 3.269 315 HZ2 LYS 47 HZ2 LYS 47 32.139 -1.784 3.214 316 HZ3 LYS 47 HZ3 LYS 47 30.463 -1.961 3.002 317 H ALA 48 HN ALA 48 32.012 2.494 -2.423 318 HA ALA 48 HA ALA 48 33.946 4.572 -2.294 319 HB1 ALA 48 HB1 ALA 48 33.335 3.507 -5.017 320 HB2 ALA 48 HB2 ALA 48 34.825 4.221 -4.400 321 HB3 ALA 48 HB3 ALA 48 33.466 5.256 -4.835 322 H MET 49 HN MET 49 32.926 6.728 -2.878 323 HA MET 49 HA MET 49 31.115 8.207 -2.678 324 HB2 MET 49 HB2 MET 49 30.505 6.918 -4.817 325 HB3 MET 49 HB1 MET 49 29.410 5.978 -3.802 326 HG2 MET 49 HG2 MET 49 28.103 7.878 -3.256 327 HG3 MET 49 HG1 MET 49 29.347 8.996 -3.813 328 HE1 MET 49 HE1 MET 49 26.820 9.999 -6.143 329 HE2 MET 49 HE2 MET 49 27.100 9.832 -4.411 330 HE3 MET 49 HE3 MET 49 25.898 8.816 -5.204 331 H GLY 50 HN GLY 50 31.636 7.285 -0.290 332 HA2 GLY 50 HA2 GLY 50 28.963 6.667 0.856 333 HA3 GLY 50 HA1 GLY 50 30.321 5.635 1.306 334 H GLY 51 HN GLY 51 31.867 6.428 2.758 335 HA2 GLY 51 HA2 GLY 51 32.836 7.910 4.312 336 HA3 GLY 51 HA1 GLY 51 31.983 9.231 3.511 337 H GLY 52 HN GLY 52 32.197 7.698 6.399 338 HA2 GLY 52 HA2 GLY 52 29.429 8.530 7.125 339 HA3 GLY 52 HA1 GLY 52 30.009 6.939 7.623 340 H GLY 53 HN GLY 53 30.837 6.881 9.647 341 HA2 GLY 53 HA2 GLY 53 32.089 9.384 10.711 342 HA3 GLY 53 HA1 GLY 53 31.084 8.334 11.712 343 H ASN 54 HN ASN 54 34.135 8.451 9.901 344 HA ASN 54 HA ASN 54 36.035 7.051 10.064 345 HB2 ASN 54 HB2 ASN 54 37.011 7.136 12.229 346 HB3 ASN 54 HB1 ASN 54 36.007 8.583 12.133 347 HD21 ASN 54 HD21 ASN 54 33.906 8.537 13.292 348 HD22 ASN 54 HD22 ASN 54 33.651 7.435 14.556 349 H TYR 55 HN TYR 55 36.382 5.245 12.462 350 HA TYR 55 HA TYR 55 34.277 3.222 12.115 351 HB2 TYR 55 HB2 TYR 55 37.121 2.775 11.161 352 HB3 TYR 55 HB1 TYR 55 35.962 1.472 11.428 353 HD1 TYR 55 HD1 TYR 55 34.028 1.177 9.973 354 HD2 TYR 55 HD2 TYR 55 36.806 4.392 9.344 355 HE1 TYR 55 HE1 TYR 55 33.056 1.578 7.727 356 HE2 TYR 55 HE2 TYR 55 35.835 4.792 7.097 357 HH TYR 55 HH TYR 55 32.889 3.496 6.113 358 H GLN 56 HN GLN 56 36.479 1.226 12.985 359 HA GLN 56 HA GLN 56 36.022 1.481 15.810 360 HB2 GLN 56 HB2 GLN 56 38.357 -0.125 14.975 361 HB3 GLN 56 HB1 GLN 56 36.958 -0.596 15.940 362 HG2 GLN 56 HG2 GLN 56 37.107 -0.359 12.924 363 HG3 GLN 56 HG1 GLN 56 36.841 -1.824 13.870 364 HE21 GLN 56 HE21 GLN 56 35.049 -0.424 11.821 365 HE22 GLN 56 HE22 GLN 56 33.577 -0.197 12.634 366 H GLY 57 HN GLY 57 37.449 3.684 14.296 367 HA2 GLY 57 HA2 GLY 57 38.823 5.332 15.500 368 HA3 GLY 57 HA1 GLY 57 39.690 3.986 16.245 369 HA PRO 58 HA PRO 58 41.525 5.888 12.086 370 HB2 PRO 58 HB2 PRO 58 43.672 6.395 14.111 371 HB3 PRO 58 HB1 PRO 58 43.201 7.365 12.703 372 HG2 PRO 58 HG2 PRO 58 42.491 8.022 15.207 373 HG3 PRO 58 HG1 PRO 58 41.474 8.371 13.801 374 HD2 PRO 58 HD2 PRO 58 41.043 6.402 15.959 375 HD3 PRO 58 HD1 PRO 58 39.873 7.096 14.818 376 HA PRO 59 HA PRO 59 43.493 1.858 11.999 377 HB2 PRO 59 HB2 PRO 59 44.134 1.863 9.353 378 HB3 PRO 59 HB1 PRO 59 42.486 1.583 9.944 379 HG2 PRO 59 HG2 PRO 59 43.689 4.038 8.782 380 HG3 PRO 59 HG1 PRO 59 42.057 3.377 8.588 381 HD2 PRO 59 HD2 PRO 59 42.685 5.473 10.280 382 HD3 PRO 59 HD1 PRO 59 41.277 4.410 10.489 383 HA PRO 60 HA PRO 60 47.721 3.391 12.371 384 HB2 PRO 60 HB2 PRO 60 48.737 1.171 13.579 385 HB3 PRO 60 HB1 PRO 60 47.761 2.373 14.445 386 HG2 PRO 60 HG2 PRO 60 46.996 -0.302 13.418 387 HG3 PRO 60 HG1 PRO 60 46.470 0.542 14.882 388 HD2 PRO 60 HD2 PRO 60 44.980 0.372 12.542 389 HD3 PRO 60 HD1 PRO 60 44.756 1.611 13.795 390 HA PRO 61 HA PRO 61 49.604 1.973 8.615 391 HB2 PRO 61 HB2 PRO 61 52.047 1.876 10.353 392 HB3 PRO 61 HB1 PRO 61 51.846 2.568 8.731 393 HG2 PRO 61 HG2 PRO 61 51.877 4.099 10.910 394 HG3 PRO 61 HG1 PRO 61 50.854 4.473 9.514 395 HD2 PRO 61 HD2 PRO 61 50.055 3.499 12.198 396 HD3 PRO 61 HD1 PRO 61 49.089 4.350 10.975 397 H TYR 62 HN TYR 62 49.713 -0.042 7.775 398 HA TYR 62 HA TYR 62 49.266 -2.436 8.985 399 HB2 TYR 62 HB2 TYR 62 50.942 -3.383 7.186 400 HB3 TYR 62 HB1 TYR 62 49.467 -2.573 6.668 401 HD1 TYR 62 HD1 TYR 62 50.613 -2.124 4.486 402 HD2 TYR 62 HD2 TYR 62 52.047 -0.498 8.190 403 HE1 TYR 62 HE1 TYR 62 51.960 -0.467 3.243 404 HE2 TYR 62 HE2 TYR 62 53.389 1.157 6.954 405 HH TYR 62 HH TYR 62 54.166 1.746 4.930 406 HA PRO 63 HA PRO 63 52.440 -3.810 11.713 407 HB2 PRO 63 HB2 PRO 63 53.333 -6.127 10.346 408 HB3 PRO 63 HB1 PRO 63 52.054 -6.050 11.571 409 HG2 PRO 63 HG2 PRO 63 51.841 -6.096 8.613 410 HG3 PRO 63 HG1 PRO 63 50.755 -6.774 9.839 411 HD2 PRO 63 HD2 PRO 63 50.095 -4.538 8.511 412 HD3 PRO 63 HD1 PRO 63 49.701 -4.721 10.235 413 H LYS 64 HN LYS 64 54.770 -3.857 11.942 414 HA LYS 64 HA LYS 64 56.258 -2.207 10.234 415 HB2 LYS 64 HB2 LYS 64 58.117 -2.775 11.508 416 HB3 LYS 64 HB1 LYS 64 56.820 -3.267 12.596 417 HG2 LYS 64 HG2 LYS 64 56.967 -5.579 11.596 418 HG3 LYS 64 HG1 LYS 64 58.404 -5.046 10.724 419 HD2 LYS 64 HD2 LYS 64 59.387 -4.373 12.963 420 HD3 LYS 64 HD1 LYS 64 58.026 -5.199 13.724 421 HE2 LYS 64 HE2 LYS 64 60.163 -6.580 13.437 422 HE3 LYS 64 HE1 LYS 64 58.677 -7.310 12.832 423 HZ1 LYS 64 HZ1 LYS 64 60.870 -7.125 11.379 424 HZ2 LYS 64 HZ2 LYS 64 60.167 -5.632 10.975 425 HZ3 LYS 64 HZ3 LYS 64 59.319 -7.078 10.695 426 H HIS 65 HN HIS 65 57.530 -2.565 8.406 427 HA HIS 65 HA HIS 65 56.832 -4.681 6.646 428 HB2 HIS 65 HB2 HIS 65 59.526 -3.676 6.170 429 HB3 HIS 65 HB1 HIS 65 58.077 -3.495 5.181 430 HD1 HIS 65 HD1 HIS 65 56.475 -1.467 5.780 431 HD2 HIS 65 HD2 HIS 65 60.138 -1.452 7.777 432 HE1 HIS 65 HE1 HIS 65 56.748 0.854 6.763 433 HE2 HIS 65 HE2 HIS 65 58.973 0.874 7.979 Start of MODEL 10 1 H1 SER 7 HT1 SER 7 28.590 -1.687 -18.330 2 H2 SER 7 HT2 SER 7 28.096 -0.260 -17.550 3 H3 SER 7 HT3 SER 7 27.073 -1.616 -17.573 4 HA SER 7 HA SER 7 29.197 -0.968 -15.773 5 HB2 SER 7 HB2 SER 7 28.009 -2.610 -14.386 6 HB3 SER 7 HB1 SER 7 26.859 -1.507 -15.137 7 HG SER 7 HG SER 7 26.039 -3.469 -15.568 8 H PHE 8 HN PHE 8 28.889 -3.196 -18.365 9 HA PHE 8 HA PHE 8 30.209 -5.022 -19.028 10 HB2 PHE 8 HB2 PHE 8 32.162 -3.501 -17.279 11 HB3 PHE 8 HB1 PHE 8 32.617 -4.878 -18.283 12 HD1 PHE 8 HD1 PHE 8 30.670 -1.677 -18.587 13 HD2 PHE 8 HD2 PHE 8 33.425 -4.420 -20.416 14 HE1 PHE 8 HE1 PHE 8 30.851 -0.183 -20.558 15 HE2 PHE 8 HE2 PHE 8 33.605 -2.925 -22.387 16 HZ PHE 8 HZ PHE 8 32.318 -0.806 -22.458 17 H GLU 9 HN GLU 9 32.194 -6.434 -17.542 18 HA GLU 9 HA GLU 9 30.776 -7.315 -15.083 19 HB2 GLU 9 HB2 GLU 9 31.537 -9.121 -17.399 20 HB3 GLU 9 HB1 GLU 9 31.041 -9.703 -15.809 21 HG2 GLU 9 HG2 GLU 9 28.971 -8.111 -16.216 22 HG3 GLU 9 HG1 GLU 9 29.413 -8.317 -17.911 23 H ILE 10 HN ILE 10 32.288 -7.357 -13.500 24 HA ILE 10 HA ILE 10 35.138 -7.573 -14.235 25 HB ILE 10 HB ILE 10 34.258 -7.309 -11.397 26 HG12 ILE 10 HG12 ILE 10 33.788 -5.274 -13.579 27 HG13 ILE 10 HG11 ILE 10 32.679 -5.801 -12.311 28 HG21 ILE 10 HG21 ILE 10 36.654 -7.297 -12.150 29 HG22 ILE 10 HG22 ILE 10 36.179 -5.827 -11.299 30 HG23 ILE 10 HG23 ILE 10 36.315 -5.824 -13.058 31 HD11 ILE 10 HD11 ILE 10 34.998 -3.911 -12.132 32 HD12 ILE 10 HD12 ILE 10 34.554 -4.852 -10.708 33 HD13 ILE 10 HD13 ILE 10 33.381 -3.761 -11.446 34 HA PRO 11 HA PRO 11 35.262 -11.985 -13.591 35 HB2 PRO 11 HB2 PRO 11 37.961 -11.270 -12.514 36 HB3 PRO 11 HB1 PRO 11 37.513 -12.515 -13.696 37 HG2 PRO 11 HG2 PRO 11 38.627 -10.185 -14.417 38 HG3 PRO 11 HG1 PRO 11 37.455 -11.038 -15.434 39 HD2 PRO 11 HD2 PRO 11 37.117 -8.523 -13.914 40 HD3 PRO 11 HD1 PRO 11 36.181 -9.144 -15.292 41 H ASP 12 HN ASP 12 35.271 -13.464 -11.784 42 HA ASP 12 HA ASP 12 34.607 -12.190 -9.244 43 HB2 ASP 12 HB2 ASP 12 34.344 -14.891 -10.419 44 HB3 ASP 12 HB1 ASP 12 34.601 -14.851 -8.675 45 H ASP 13 HN ASP 13 37.399 -12.799 -10.643 46 HA ASP 13 HA ASP 13 38.766 -13.507 -8.090 47 HB2 ASP 13 HB2 ASP 13 39.800 -13.922 -10.910 48 HB3 ASP 13 HB1 ASP 13 40.582 -14.447 -9.419 49 H VAL 14 HN VAL 14 37.961 -10.838 -8.802 50 HA VAL 14 HA VAL 14 40.426 -9.511 -9.720 51 HB VAL 14 HB VAL 14 38.263 -8.693 -10.564 52 HG11 VAL 14 HG11 VAL 14 36.499 -8.110 -9.210 53 HG12 VAL 14 HG12 VAL 14 37.549 -7.565 -7.901 54 HG13 VAL 14 HG13 VAL 14 37.259 -9.288 -8.140 55 HG21 VAL 14 HG21 VAL 14 38.643 -6.305 -9.164 56 HG22 VAL 14 HG22 VAL 14 39.447 -6.770 -10.664 57 HG23 VAL 14 HG23 VAL 14 40.221 -7.091 -9.112 58 HA PRO 15 HA PRO 15 41.468 -9.238 -5.329 59 HB2 PRO 15 HB2 PRO 15 44.020 -8.314 -5.730 60 HB3 PRO 15 HB1 PRO 15 43.569 -10.027 -5.814 61 HG2 PRO 15 HG2 PRO 15 44.066 -8.089 -8.004 62 HG3 PRO 15 HG1 PRO 15 44.425 -9.822 -7.919 63 HD2 PRO 15 HD2 PRO 15 42.285 -8.766 -9.298 64 HD3 PRO 15 HD1 PRO 15 42.331 -10.424 -8.661 65 H LEU 16 HN LEU 16 42.353 -7.385 -3.936 66 HA LEU 16 HA LEU 16 40.895 -5.018 -4.282 67 HB2 LEU 16 HB2 LEU 16 43.533 -4.598 -3.064 68 HB3 LEU 16 HB1 LEU 16 41.944 -4.312 -2.385 69 HG LEU 16 HG LEU 16 43.575 -6.834 -2.401 70 HD11 LEU 16 HD11 LEU 16 42.411 -6.727 -0.003 71 HD12 LEU 16 HD12 LEU 16 42.296 -5.016 -0.410 72 HD13 LEU 16 HD13 LEU 16 43.871 -5.808 -0.363 73 HD21 LEU 16 HD21 LEU 16 40.699 -6.645 -2.830 74 HD22 LEU 16 HD22 LEU 16 41.051 -7.448 -1.302 75 HD23 LEU 16 HD23 LEU 16 41.719 -8.082 -2.803 76 HA PRO 17 HA PRO 17 43.088 -2.338 -7.055 77 HB2 PRO 17 HB2 PRO 17 44.298 -0.557 -5.070 78 HB3 PRO 17 HB1 PRO 17 43.041 -0.214 -6.266 79 HG2 PRO 17 HG2 PRO 17 42.566 -0.360 -3.607 80 HG3 PRO 17 HG1 PRO 17 41.355 -0.727 -4.845 81 HD2 PRO 17 HD2 PRO 17 42.912 -2.597 -3.119 82 HD3 PRO 17 HD1 PRO 17 41.269 -2.771 -3.776 83 H ALA 18 HN ALA 18 45.520 -0.799 -6.423 84 HA ALA 18 HA ALA 18 47.402 -2.998 -6.936 85 HB1 ALA 18 HB1 ALA 18 47.952 -0.035 -6.949 86 HB2 ALA 18 HB2 ALA 18 47.227 -0.879 -8.319 87 HB3 ALA 18 HB3 ALA 18 48.851 -1.307 -7.778 88 H GLY 19 HN GLY 19 48.964 -3.654 -5.545 89 HA2 GLY 19 HA2 GLY 19 50.322 -3.752 -3.642 90 HA3 GLY 19 HA1 GLY 19 50.121 -2.008 -3.506 91 H TRP 20 HN TRP 20 47.262 -4.022 -3.512 92 HA TRP 20 HA TRP 20 46.871 -3.255 -0.674 93 HB2 TRP 20 HB2 TRP 20 45.020 -4.022 -2.894 94 HB3 TRP 20 HB1 TRP 20 44.470 -3.905 -1.218 95 HD1 TRP 20 HD1 TRP 20 45.656 -1.842 -4.142 96 HE1 TRP 20 HE1 TRP 20 45.325 0.648 -3.619 97 HE3 TRP 20 HE3 TRP 20 44.392 -2.193 0.763 98 HZ2 TRP 20 HZ2 TRP 20 44.609 2.296 -1.351 99 HZ3 TRP 20 HZ3 TRP 20 43.908 -0.189 2.094 100 HH2 TRP 20 HH2 TRP 20 44.006 2.071 1.052 101 H GLU 21 HN GLU 21 46.012 -4.772 0.856 102 HA GLU 21 HA GLU 21 45.814 -7.598 0.144 103 HB2 GLU 21 HB2 GLU 21 48.340 -7.057 0.334 104 HB3 GLU 21 HB1 GLU 21 48.034 -6.905 2.066 105 HG2 GLU 21 HG2 GLU 21 48.503 -9.154 2.013 106 HG3 GLU 21 HG1 GLU 21 46.784 -9.245 1.630 107 H MET 22 HN MET 22 44.219 -8.349 1.495 108 HA MET 22 HA MET 22 43.271 -6.801 3.698 109 HB2 MET 22 HB2 MET 22 41.568 -8.159 3.034 110 HB3 MET 22 HB1 MET 22 42.665 -9.431 2.491 111 HG2 MET 22 HG2 MET 22 43.018 -10.193 4.737 112 HG3 MET 22 HG1 MET 22 42.167 -8.798 5.401 113 HE1 MET 22 HE1 MET 22 40.810 -10.663 2.096 114 HE2 MET 22 HE2 MET 22 40.381 -12.179 2.885 115 HE3 MET 22 HE3 MET 22 42.045 -11.603 2.944 116 H ALA 23 HN ALA 23 43.709 -6.972 5.879 117 HA ALA 23 HA ALA 23 45.426 -9.173 6.842 118 HB1 ALA 23 HB1 ALA 23 46.217 -6.252 6.947 119 HB2 ALA 23 HB2 ALA 23 47.077 -7.545 6.114 120 HB3 ALA 23 HB3 ALA 23 47.012 -7.521 7.876 121 H LYS 24 HN LYS 24 45.752 -8.766 9.360 122 HA LYS 24 HA LYS 24 43.204 -7.586 10.355 123 HB2 LYS 24 HB2 LYS 24 43.576 -10.160 10.517 124 HB3 LYS 24 HB1 LYS 24 44.656 -9.740 11.851 125 HG2 LYS 24 HG2 LYS 24 42.818 -8.415 12.883 126 HG3 LYS 24 HG1 LYS 24 41.742 -8.947 11.590 127 HD2 LYS 24 HD2 LYS 24 43.243 -10.915 13.328 128 HD3 LYS 24 HD1 LYS 24 41.655 -10.294 13.779 129 HE2 LYS 24 HE2 LYS 24 42.357 -11.827 11.261 130 HE3 LYS 24 HE1 LYS 24 41.336 -12.380 12.588 131 HZ1 LYS 24 HZ1 LYS 24 40.292 -9.959 11.791 132 HZ2 LYS 24 HZ2 LYS 24 39.634 -11.499 11.507 133 HZ3 LYS 24 HZ3 LYS 24 40.649 -10.779 10.350 134 H THR 25 HN THR 25 43.265 -6.613 12.443 135 HA THR 25 HA THR 25 45.616 -4.998 12.884 136 HB THR 25 HB THR 25 43.244 -4.343 13.400 137 HG1 THR 25 HG1 THR 25 45.454 -4.006 14.904 138 HG21 THR 25 HG21 THR 25 43.107 -6.770 14.584 139 HG22 THR 25 HG22 THR 25 41.995 -5.446 14.927 140 HG23 THR 25 HG23 THR 25 43.371 -5.741 15.990 141 H SER 26 HN SER 26 46.401 -4.942 15.366 142 HA SER 26 HA SER 26 48.190 -6.749 16.045 143 HB2 SER 26 HB2 SER 26 46.024 -5.651 17.808 144 HB3 SER 26 HB1 SER 26 47.149 -6.835 18.469 145 HG SER 26 HG SER 26 47.544 -4.210 17.721 146 H SER 27 HN SER 27 44.724 -7.505 16.151 147 HA SER 27 HA SER 27 44.744 -10.081 15.283 148 HB2 SER 27 HB2 SER 27 45.881 -9.935 18.039 149 HB3 SER 27 HB1 SER 27 44.810 -11.281 17.665 150 HG SER 27 HG SER 27 46.908 -10.546 15.928 151 H GLY 28 HN GLY 28 42.609 -9.016 14.919 152 HA2 GLY 28 HA2 GLY 28 40.522 -10.133 16.384 153 HA3 GLY 28 HA1 GLY 28 40.835 -8.591 17.174 154 H GLN 29 HN GLN 29 41.507 -7.066 14.830 155 HA GLN 29 HA GLN 29 38.820 -7.016 13.548 156 HB2 GLN 29 HB2 GLN 29 39.860 -5.008 14.941 157 HB3 GLN 29 HB1 GLN 29 40.662 -4.673 13.406 158 HG2 GLN 29 HG2 GLN 29 38.586 -3.451 13.406 159 HG3 GLN 29 HG1 GLN 29 38.395 -4.809 12.296 160 HE21 GLN 29 HE21 GLN 29 38.411 -6.329 15.190 161 HE22 GLN 29 HE22 GLN 29 36.757 -6.288 15.570 162 H ARG 30 HN ARG 30 38.675 -7.097 11.343 163 HA ARG 30 HA ARG 30 41.169 -7.685 9.878 164 HB2 ARG 30 HB2 ARG 30 39.853 -8.742 8.279 165 HB3 ARG 30 HB1 ARG 30 38.860 -8.975 9.719 166 HG2 ARG 30 HG2 ARG 30 37.687 -6.799 9.114 167 HG3 ARG 30 HG1 ARG 30 38.524 -6.881 7.563 168 HD2 ARG 30 HD2 ARG 30 37.275 -8.660 6.827 169 HD3 ARG 30 HD1 ARG 30 37.114 -9.349 8.442 170 HE ARG 30 HE ARG 30 35.216 -7.928 8.823 171 HH11 ARG 30 HH11 ARG 30 33.515 -6.717 7.960 172 HH12 ARG 30 HH12 ARG 30 33.647 -6.088 6.350 173 HH21 ARG 30 HH21 ARG 30 36.805 -7.413 5.806 174 HH22 ARG 30 HH22 ARG 30 35.508 -6.482 5.132 175 H TYR 31 HN TYR 31 41.994 -6.310 8.306 176 HA TYR 31 HA TYR 31 40.324 -4.063 7.401 177 HB2 TYR 31 HB2 TYR 31 42.288 -2.464 7.827 178 HB3 TYR 31 HB1 TYR 31 41.314 -2.920 9.216 179 HD1 TYR 31 HD1 TYR 31 43.668 -5.358 7.762 180 HD2 TYR 31 HD2 TYR 31 43.132 -2.324 10.753 181 HE1 TYR 31 HE1 TYR 31 45.728 -6.115 8.912 182 HE2 TYR 31 HE2 TYR 31 45.189 -3.090 11.895 183 HH TYR 31 HH TYR 31 47.059 -5.859 10.650 184 H PHE 32 HN PHE 32 42.062 -2.678 5.840 185 HA PHE 32 HA PHE 32 43.307 -4.851 4.212 186 HB2 PHE 32 HB2 PHE 32 41.835 -2.391 3.236 187 HB3 PHE 32 HB1 PHE 32 42.687 -3.532 2.195 188 HD1 PHE 32 HD1 PHE 32 39.776 -3.015 4.383 189 HD2 PHE 32 HD2 PHE 32 41.862 -5.822 1.891 190 HE1 PHE 32 HE1 PHE 32 37.802 -4.516 4.421 191 HE2 PHE 32 HE2 PHE 32 39.886 -7.321 1.925 192 HZ PHE 32 HZ PHE 32 37.856 -6.668 3.190 193 H LEU 33 HN LEU 33 45.395 -4.598 3.733 194 HA LEU 33 HA LEU 33 46.756 -2.176 4.701 195 HB2 LEU 33 HB2 LEU 33 48.033 -4.551 3.346 196 HB3 LEU 33 HB1 LEU 33 48.775 -3.412 4.471 197 HG LEU 33 HG LEU 33 46.701 -5.527 5.075 198 HD11 LEU 33 HD11 LEU 33 48.833 -6.482 5.260 199 HD12 LEU 33 HD12 LEU 33 48.521 -5.936 6.908 200 HD13 LEU 33 HD13 LEU 33 49.558 -4.983 5.845 201 HD21 LEU 33 HD21 LEU 33 47.219 -4.399 7.487 202 HD22 LEU 33 HD22 LEU 33 45.841 -3.941 6.487 203 HD23 LEU 33 HD23 LEU 33 47.313 -2.972 6.459 204 H ASN 34 HN ASN 34 47.735 -0.660 3.444 205 HA ASN 34 HA ASN 34 47.369 -0.920 0.491 206 HB2 ASN 34 HB2 ASN 34 46.258 1.005 1.854 207 HB3 ASN 34 HB1 ASN 34 47.889 1.672 1.934 208 HD21 ASN 34 HD21 ASN 34 46.460 3.371 0.557 209 HD22 ASN 34 HD22 ASN 34 46.568 3.171 -1.125 210 H HIS 35 HN HIS 35 49.307 -1.670 -0.294 211 HA HIS 35 HA HIS 35 51.845 -0.976 0.953 212 HB2 HIS 35 HB2 HIS 35 51.147 -2.338 -1.664 213 HB3 HIS 35 HB1 HIS 35 52.804 -2.091 -1.114 214 HD1 HIS 35 HD1 HIS 35 53.009 -4.747 -0.952 215 HD2 HIS 35 HD2 HIS 35 50.278 -3.021 1.688 216 HE1 HIS 35 HE1 HIS 35 52.482 -6.511 0.791 217 HE2 HIS 35 HE2 HIS 35 50.823 -5.470 2.402 218 H ILE 36 HN ILE 36 49.723 0.565 -1.170 219 HA ILE 36 HA ILE 36 51.761 2.111 -2.610 220 HB ILE 36 HB ILE 36 48.858 2.850 -2.500 221 HG12 ILE 36 HG12 ILE 36 49.489 0.241 -2.856 222 HG13 ILE 36 HG11 ILE 36 48.128 1.018 -3.648 223 HG21 ILE 36 HG21 ILE 36 49.399 3.169 -5.000 224 HG22 ILE 36 HG22 ILE 36 51.086 2.932 -4.539 225 HG23 ILE 36 HG23 ILE 36 50.169 4.280 -3.867 226 HD11 ILE 36 HD11 ILE 36 49.792 -0.324 -5.125 227 HD12 ILE 36 HD12 ILE 36 50.865 1.058 -4.907 228 HD13 ILE 36 HD13 ILE 36 49.295 1.274 -5.680 229 H ASP 37 HN ASP 37 49.123 2.828 -0.341 230 HA ASP 37 HA ASP 37 50.364 5.413 0.298 231 HB2 ASP 37 HB2 ASP 37 47.856 4.137 1.418 232 HB3 ASP 37 HB1 ASP 37 48.367 5.804 1.683 233 H GLN 38 HN GLN 38 51.031 2.440 1.145 234 HA GLN 38 HA GLN 38 51.966 1.388 3.026 235 HB2 GLN 38 HB2 GLN 38 53.008 4.181 2.945 236 HB3 GLN 38 HB1 GLN 38 53.384 3.199 4.362 237 HG2 GLN 38 HG2 GLN 38 54.310 1.440 2.930 238 HG3 GLN 38 HG1 GLN 38 53.878 2.363 1.490 239 HE21 GLN 38 HE21 GLN 38 55.396 3.432 4.583 240 HE22 GLN 38 HE22 GLN 38 56.770 4.103 3.848 241 H THR 39 HN THR 39 49.485 1.480 3.725 242 HA THR 39 HA THR 39 49.476 2.163 6.547 243 HB THR 39 HB THR 39 48.732 4.263 6.099 244 HG1 THR 39 HG1 THR 39 46.215 3.609 5.524 245 HG21 THR 39 HG21 THR 39 46.957 4.251 3.946 246 HG22 THR 39 HG22 THR 39 48.255 3.164 3.461 247 HG23 THR 39 HG23 THR 39 48.622 4.825 3.922 248 H THR 40 HN THR 40 46.876 1.986 7.134 249 HA THR 40 HA THR 40 46.075 -0.623 5.933 250 HB THR 40 HB THR 40 44.891 -1.017 8.135 251 HG1 THR 40 HG1 THR 40 45.147 0.396 9.718 252 HG21 THR 40 HG21 THR 40 47.715 -1.087 7.522 253 HG22 THR 40 HG22 THR 40 46.753 -2.235 8.454 254 HG23 THR 40 HG23 THR 40 47.470 -0.834 9.251 255 H THR 41 HN THR 41 43.534 -0.943 6.420 256 HA THR 41 HA THR 41 42.107 1.606 5.940 257 HB THR 41 HB THR 41 40.915 0.013 4.107 258 HG1 THR 41 HG1 THR 41 42.600 -1.560 4.565 259 HG21 THR 41 HG21 THR 41 43.387 1.695 3.684 260 HG22 THR 41 HG22 THR 41 41.730 2.298 3.746 261 HG23 THR 41 HG23 THR 41 42.235 1.236 2.430 262 H TRP 42 HN TRP 42 40.178 1.623 7.011 263 HA TRP 42 HA TRP 42 39.279 -0.838 8.343 264 HB2 TRP 42 HB2 TRP 42 38.122 1.965 8.311 265 HB3 TRP 42 HB1 TRP 42 37.503 0.637 9.288 266 HD1 TRP 42 HD1 TRP 42 39.345 3.536 9.833 267 HE1 TRP 42 HE1 TRP 42 41.076 3.321 11.732 268 HE3 TRP 42 HE3 TRP 42 39.652 -1.557 10.171 269 HZ2 TRP 42 HZ2 TRP 42 42.414 1.256 13.197 270 HZ3 TRP 42 HZ3 TRP 42 41.160 -2.614 11.825 271 HH2 TRP 42 HH2 TRP 42 42.543 -1.216 13.334 272 H GLN 43 HN GLN 43 38.644 1.008 5.515 273 HA GLN 43 HA GLN 43 36.101 -0.472 5.052 274 HB2 GLN 43 HB2 GLN 43 36.116 2.058 4.911 275 HB3 GLN 43 HB1 GLN 43 37.169 1.899 3.505 276 HG2 GLN 43 HG2 GLN 43 35.391 1.498 2.188 277 HG3 GLN 43 HG1 GLN 43 34.943 0.115 3.188 278 HE21 GLN 43 HE21 GLN 43 33.824 0.843 5.383 279 HE22 GLN 43 HE22 GLN 43 32.683 2.091 5.240 280 H ASP 44 HN ASP 44 35.800 -1.476 2.940 281 HA ASP 44 HA ASP 44 38.285 -2.640 1.925 282 HB2 ASP 44 HB2 ASP 44 35.435 -2.997 0.952 283 HB3 ASP 44 HB1 ASP 44 36.814 -4.008 0.524 284 HA PRO 45 HA PRO 45 38.731 0.460 -1.244 285 HB2 PRO 45 HB2 PRO 45 40.470 -0.953 -2.853 286 HB3 PRO 45 HB1 PRO 45 40.964 -0.073 -1.395 287 HG2 PRO 45 HG2 PRO 45 40.467 -2.977 -1.775 288 HG3 PRO 45 HG1 PRO 45 41.700 -2.159 -0.800 289 HD2 PRO 45 HD2 PRO 45 39.457 -3.265 0.287 290 HD3 PRO 45 HD1 PRO 45 40.260 -1.843 0.990 291 H ARG 46 HN ARG 46 37.552 -2.742 -1.699 292 HA ARG 46 HA ARG 46 36.962 -2.548 -4.527 293 HB2 ARG 46 HB2 ARG 46 36.505 -4.452 -2.341 294 HB3 ARG 46 HB1 ARG 46 35.157 -4.369 -3.475 295 HG2 ARG 46 HG2 ARG 46 36.417 -5.149 -5.250 296 HG3 ARG 46 HG1 ARG 46 37.923 -4.498 -4.602 297 HD2 ARG 46 HD2 ARG 46 36.422 -6.926 -3.581 298 HD3 ARG 46 HD1 ARG 46 37.976 -6.925 -4.416 299 HE ARG 46 HE ARG 46 38.597 -5.386 -2.303 300 HH11 ARG 46 HH11 ARG 46 39.084 -6.075 -0.206 301 HH12 ARG 46 HH12 ARG 46 38.406 -7.556 0.384 302 HH21 ARG 46 HH21 ARG 46 36.682 -8.243 -2.546 303 HH22 ARG 46 HH22 ARG 46 37.047 -8.783 -0.941 304 H LYS 47 HN LYS 47 36.058 -0.412 -2.594 305 HA LYS 47 HA LYS 47 33.300 -0.215 -3.651 306 HB2 LYS 47 HB2 LYS 47 34.098 -0.132 -0.746 307 HB3 LYS 47 HB1 LYS 47 32.660 0.719 -1.313 308 HG2 LYS 47 HG2 LYS 47 33.127 -2.186 -1.984 309 HG3 LYS 47 HG1 LYS 47 32.350 -1.707 -0.475 310 HD2 LYS 47 HD2 LYS 47 30.419 -1.141 -1.516 311 HD3 LYS 47 HD1 LYS 47 31.267 -0.329 -2.832 312 HE2 LYS 47 HE2 LYS 47 31.486 -2.288 -4.081 313 HE3 LYS 47 HE1 LYS 47 31.329 -3.327 -2.665 314 HZ1 LYS 47 HZ1 LYS 47 29.151 -1.685 -3.842 315 HZ2 LYS 47 HZ2 LYS 47 29.008 -2.720 -2.501 316 HZ3 LYS 47 HZ3 LYS 47 29.335 -3.360 -4.041 317 H ALA 48 HN ALA 48 32.630 1.950 -3.977 318 HA ALA 48 HA ALA 48 34.852 3.916 -3.899 319 HB1 ALA 48 HB1 ALA 48 32.116 4.105 -5.199 320 HB2 ALA 48 HB2 ALA 48 33.596 3.608 -6.019 321 HB3 ALA 48 HB3 ALA 48 33.441 5.252 -5.401 322 H MET 49 HN MET 49 34.588 4.044 -1.481 323 HA MET 49 HA MET 49 32.549 6.114 -0.831 324 HB2 MET 49 HB2 MET 49 32.887 3.429 0.425 325 HB3 MET 49 HB1 MET 49 32.545 4.786 1.498 326 HG2 MET 49 HG2 MET 49 30.912 4.319 -0.994 327 HG3 MET 49 HG1 MET 49 30.524 3.502 0.519 328 HE1 MET 49 HE1 MET 49 28.882 5.887 2.704 329 HE2 MET 49 HE2 MET 49 30.018 4.540 2.664 330 HE3 MET 49 HE3 MET 49 28.528 4.455 1.727 331 H GLY 50 HN GLY 50 33.122 6.888 1.582 332 HA2 GLY 50 HA2 GLY 50 35.778 6.705 2.555 333 HA3 GLY 50 HA1 GLY 50 35.718 8.077 1.446 334 H GLY 51 HN GLY 51 32.727 7.472 2.945 335 HA2 GLY 51 HA2 GLY 51 33.258 9.689 4.882 336 HA3 GLY 51 HA1 GLY 51 31.703 9.438 4.089 337 H GLY 52 HN GLY 52 30.969 6.959 4.446 338 HA2 GLY 52 HA2 GLY 52 29.970 5.587 6.080 339 HA3 GLY 52 HA1 GLY 52 31.618 5.467 6.697 340 H GLY 53 HN GLY 53 31.961 6.259 8.718 341 HA2 GLY 53 HA2 GLY 53 31.386 8.542 9.973 342 HA3 GLY 53 HA1 GLY 53 29.779 7.814 9.985 343 H ASN 54 HN ASN 54 31.971 8.374 12.122 344 HA ASN 54 HA ASN 54 32.683 7.336 14.101 345 HB2 ASN 54 HB2 ASN 54 30.236 5.767 13.328 346 HB3 ASN 54 HB1 ASN 54 31.205 5.260 14.712 347 HD21 ASN 54 HD21 ASN 54 29.592 5.892 16.297 348 HD22 ASN 54 HD22 ASN 54 29.218 7.521 16.592 349 H TYR 55 HN TYR 55 34.433 6.044 14.446 350 HA TYR 55 HA TYR 55 34.655 3.453 13.051 351 HB2 TYR 55 HB2 TYR 55 37.063 5.194 12.826 352 HB3 TYR 55 HB1 TYR 55 36.468 3.952 11.723 353 HD1 TYR 55 HD1 TYR 55 35.463 7.303 13.087 354 HD2 TYR 55 HD2 TYR 55 35.469 4.627 9.728 355 HE1 TYR 55 HE1 TYR 55 34.395 9.053 11.691 356 HE2 TYR 55 HE2 TYR 55 34.401 6.376 8.331 357 HH TYR 55 HH TYR 55 33.970 8.635 8.228 358 H GLN 56 HN GLN 56 36.387 2.128 13.978 359 HA GLN 56 HA GLN 56 36.637 2.462 16.817 360 HB2 GLN 56 HB2 GLN 56 38.658 0.755 15.508 361 HB3 GLN 56 HB1 GLN 56 37.497 0.350 16.774 362 HG2 GLN 56 HG2 GLN 56 35.756 0.639 14.783 363 HG3 GLN 56 HG1 GLN 56 37.171 0.261 13.800 364 HE21 GLN 56 HE21 GLN 56 37.272 -1.941 13.371 365 HE22 GLN 56 HE22 GLN 56 36.819 -3.170 14.451 366 H GLY 57 HN GLY 57 37.725 4.583 14.948 367 HA2 GLY 57 HA2 GLY 57 39.392 6.218 15.643 368 HA3 GLY 57 HA1 GLY 57 40.328 4.903 16.358 369 HA PRO 58 HA PRO 58 41.344 6.246 11.705 370 HB2 PRO 58 HB2 PRO 58 43.826 6.998 13.204 371 HB3 PRO 58 HB1 PRO 58 43.090 7.770 11.787 372 HG2 PRO 58 HG2 PRO 58 42.852 8.775 14.269 373 HG3 PRO 58 HG1 PRO 58 41.594 8.952 13.036 374 HD2 PRO 58 HD2 PRO 58 41.567 7.313 15.489 375 HD3 PRO 58 HD1 PRO 58 40.208 7.852 14.482 376 HA PRO 59 HA PRO 59 43.344 2.288 11.547 377 HB2 PRO 59 HB2 PRO 59 44.228 2.376 8.960 378 HB3 PRO 59 HB1 PRO 59 42.535 2.095 9.404 379 HG2 PRO 59 HG2 PRO 59 43.851 4.577 8.439 380 HG3 PRO 59 HG1 PRO 59 42.233 3.943 8.090 381 HD2 PRO 59 HD2 PRO 59 42.714 5.972 9.889 382 HD3 PRO 59 HD1 PRO 59 41.313 4.882 9.985 383 HA PRO 60 HA PRO 60 47.589 3.657 12.302 384 HB2 PRO 60 HB2 PRO 60 48.352 1.468 13.721 385 HB3 PRO 60 HB1 PRO 60 47.351 2.754 14.421 386 HG2 PRO 60 HG2 PRO 60 46.568 0.064 13.445 387 HG3 PRO 60 HG1 PRO 60 45.935 1.005 14.805 388 HD2 PRO 60 HD2 PRO 60 44.696 0.783 12.322 389 HD3 PRO 60 HD1 PRO 60 44.391 2.081 13.496 390 HA PRO 61 HA PRO 61 49.767 1.898 8.868 391 HB2 PRO 61 HB2 PRO 61 51.994 1.663 10.861 392 HB3 PRO 61 HB1 PRO 61 52.024 2.318 9.212 393 HG2 PRO 61 HG2 PRO 61 51.963 3.906 11.361 394 HG3 PRO 61 HG1 PRO 61 51.150 4.332 9.847 395 HD2 PRO 61 HD2 PRO 61 49.958 3.532 12.435 396 HD3 PRO 61 HD1 PRO 61 49.223 4.420 11.082 397 H TYR 62 HN TYR 62 49.728 -0.170 8.140 398 HA TYR 62 HA TYR 62 48.957 -2.432 9.473 399 HB2 TYR 62 HB2 TYR 62 50.712 -3.589 7.803 400 HB3 TYR 62 HB1 TYR 62 49.232 -2.832 7.215 401 HD1 TYR 62 HD1 TYR 62 52.615 -1.658 8.333 402 HD2 TYR 62 HD2 TYR 62 49.529 -1.495 5.354 403 HE1 TYR 62 HE1 TYR 62 53.956 -0.032 7.041 404 HE2 TYR 62 HE2 TYR 62 50.864 0.126 4.060 405 HH TYR 62 HH TYR 62 54.172 0.828 4.839 406 HA PRO 63 HA PRO 63 51.835 -4.008 12.403 407 HB2 PRO 63 HB2 PRO 63 52.699 -6.362 11.056 408 HB3 PRO 63 HB1 PRO 63 51.381 -6.230 12.233 409 HG2 PRO 63 HG2 PRO 63 51.276 -6.251 9.270 410 HG3 PRO 63 HG1 PRO 63 50.104 -6.864 10.450 411 HD2 PRO 63 HD2 PRO 63 49.616 -4.599 9.110 412 HD3 PRO 63 HD1 PRO 63 49.175 -4.742 10.828 413 H LYS 64 HN LYS 64 54.080 -3.963 12.842 414 HA LYS 64 HA LYS 64 55.786 -2.517 11.145 415 HB2 LYS 64 HB2 LYS 64 57.550 -3.086 12.620 416 HB3 LYS 64 HB1 LYS 64 56.105 -3.152 13.629 417 HG2 LYS 64 HG2 LYS 64 55.995 -5.646 13.034 418 HG3 LYS 64 HG1 LYS 64 57.639 -5.458 12.421 419 HD2 LYS 64 HD2 LYS 64 57.685 -6.220 14.757 420 HD3 LYS 64 HD1 LYS 64 58.353 -4.593 14.631 421 HE2 LYS 64 HE2 LYS 64 55.423 -4.790 15.106 422 HE3 LYS 64 HE1 LYS 64 56.472 -5.248 16.449 423 HZ1 LYS 64 HZ1 LYS 64 55.943 -2.656 15.352 424 HZ2 LYS 64 HZ2 LYS 64 57.607 -2.975 15.483 425 HZ3 LYS 64 HZ3 LYS 64 56.609 -3.079 16.854 426 H HIS 65 HN HIS 65 57.528 -3.185 9.751 427 HA HIS 65 HA HIS 65 57.003 -5.104 7.831 428 HB2 HIS 65 HB2 HIS 65 59.349 -5.046 7.241 429 HB3 HIS 65 HB1 HIS 65 58.895 -3.433 7.792 430 HD1 HIS 65 HD1 HIS 65 61.429 -5.921 8.290 431 HD2 HIS 65 HD2 HIS 65 59.497 -3.194 10.785 432 HE1 HIS 65 HE1 HIS 65 62.885 -5.677 10.349 433 HE2 HIS 65 HE2 HIS 65 61.719 -4.019 11.875 Start of MODEL 11 1 H1 SER 7 HT1 SER 7 30.430 -20.678 -11.830 2 H2 SER 7 HT2 SER 7 30.436 -22.312 -12.298 3 H3 SER 7 HT3 SER 7 31.400 -21.184 -13.126 4 HA SER 7 HA SER 7 32.668 -22.609 -11.568 5 HB2 SER 7 HB2 SER 7 32.950 -19.944 -12.144 6 HB3 SER 7 HB1 SER 7 32.900 -19.914 -10.383 7 HG SER 7 HG SER 7 34.479 -21.728 -10.588 8 H PHE 8 HN PHE 8 33.289 -21.368 -9.005 9 HA PHE 8 HA PHE 8 31.284 -22.756 -7.386 10 HB2 PHE 8 HB2 PHE 8 33.706 -21.116 -6.580 11 HB3 PHE 8 HB1 PHE 8 32.735 -22.103 -5.486 12 HD1 PHE 8 HD1 PHE 8 35.710 -22.108 -7.215 13 HD2 PHE 8 HD2 PHE 8 32.250 -24.584 -6.627 14 HE1 PHE 8 HE1 PHE 8 37.037 -24.109 -7.838 15 HE2 PHE 8 HE2 PHE 8 33.576 -26.585 -7.251 16 HZ PHE 8 HZ PHE 8 35.970 -26.348 -7.855 17 H GLU 9 HN GLU 9 31.434 -20.968 -5.104 18 HA GLU 9 HA GLU 9 29.312 -19.099 -5.906 19 HB2 GLU 9 HB2 GLU 9 30.418 -20.152 -3.355 20 HB3 GLU 9 HB1 GLU 9 29.741 -18.524 -3.296 21 HG2 GLU 9 HG2 GLU 9 28.176 -20.646 -4.708 22 HG3 GLU 9 HG1 GLU 9 28.196 -20.663 -2.943 23 H ILE 10 HN ILE 10 29.515 -16.852 -5.926 24 HA ILE 10 HA ILE 10 31.760 -15.552 -6.755 25 HB ILE 10 HB ILE 10 29.907 -14.385 -4.658 26 HG12 ILE 10 HG12 ILE 10 29.622 -14.545 -7.677 27 HG13 ILE 10 HG11 ILE 10 28.624 -15.398 -6.499 28 HG21 ILE 10 HG21 ILE 10 31.272 -12.972 -6.950 29 HG22 ILE 10 HG22 ILE 10 32.064 -13.166 -5.386 30 HG23 ILE 10 HG23 ILE 10 30.551 -12.267 -5.505 31 HD11 ILE 10 HD11 ILE 10 27.467 -13.377 -7.268 32 HD12 ILE 10 HD12 ILE 10 28.848 -12.388 -6.793 33 HD13 ILE 10 HD13 ILE 10 27.893 -13.217 -5.564 34 HA PRO 11 HA PRO 11 34.509 -16.745 -3.308 35 HB2 PRO 11 HB2 PRO 11 36.371 -15.213 -5.061 36 HB3 PRO 11 HB1 PRO 11 36.572 -16.816 -4.329 37 HG2 PRO 11 HG2 PRO 11 36.043 -16.508 -6.928 38 HG3 PRO 11 HG1 PRO 11 35.406 -17.871 -5.992 39 HD2 PRO 11 HD2 PRO 11 33.980 -15.453 -7.001 40 HD3 PRO 11 HD1 PRO 11 33.360 -17.094 -6.716 41 H ASP 12 HN ASP 12 34.647 -15.527 -1.474 42 HA ASP 12 HA ASP 12 34.229 -12.657 -1.566 43 HB2 ASP 12 HB2 ASP 12 33.853 -14.615 0.359 44 HB3 ASP 12 HB1 ASP 12 35.239 -13.712 0.970 45 H ASP 13 HN ASP 13 36.775 -14.385 -2.349 46 HA ASP 13 HA ASP 13 38.845 -12.791 -0.990 47 HB2 ASP 13 HB2 ASP 13 39.370 -15.129 -1.299 48 HB3 ASP 13 HB1 ASP 13 38.993 -15.035 -3.020 49 H VAL 14 HN VAL 14 36.947 -11.472 -2.783 50 HA VAL 14 HA VAL 14 37.831 -10.936 -5.367 51 HB VAL 14 HB VAL 14 36.886 -8.849 -3.379 52 HG11 VAL 14 HG11 VAL 14 36.540 -8.948 -6.386 53 HG12 VAL 14 HG12 VAL 14 37.858 -8.080 -5.600 54 HG13 VAL 14 HG13 VAL 14 36.187 -7.598 -5.307 55 HG21 VAL 14 HG21 VAL 14 35.554 -11.137 -3.974 56 HG22 VAL 14 HG22 VAL 14 35.022 -10.120 -5.312 57 HG23 VAL 14 HG23 VAL 14 34.740 -9.607 -3.648 58 HA PRO 15 HA PRO 15 42.126 -9.857 -4.403 59 HB2 PRO 15 HB2 PRO 15 41.923 -9.028 -7.266 60 HB3 PRO 15 HB1 PRO 15 43.156 -10.017 -6.461 61 HG2 PRO 15 HG2 PRO 15 41.277 -11.100 -8.019 62 HG3 PRO 15 HG1 PRO 15 41.901 -11.926 -6.581 63 HD2 PRO 15 HD2 PRO 15 39.258 -10.627 -6.998 64 HD3 PRO 15 HD1 PRO 15 39.705 -11.954 -5.904 65 H LEU 16 HN LEU 16 42.786 -7.944 -3.536 66 HA LEU 16 HA LEU 16 41.252 -5.511 -3.848 67 HB2 LEU 16 HB2 LEU 16 44.030 -5.944 -2.717 68 HB3 LEU 16 HB1 LEU 16 43.029 -4.525 -2.462 69 HG LEU 16 HG LEU 16 43.157 -6.724 -0.814 70 HD11 LEU 16 HD11 LEU 16 41.245 -4.452 -1.195 71 HD12 LEU 16 HD12 LEU 16 42.371 -4.759 0.127 72 HD13 LEU 16 HD13 LEU 16 40.871 -5.680 0.014 73 HD21 LEU 16 HD21 LEU 16 41.885 -8.190 -2.230 74 HD22 LEU 16 HD22 LEU 16 40.685 -6.939 -2.558 75 HD23 LEU 16 HD23 LEU 16 40.797 -7.653 -0.955 76 HA PRO 17 HA PRO 17 43.292 -3.447 -7.203 77 HB2 PRO 17 HB2 PRO 17 44.280 -1.232 -5.547 78 HB3 PRO 17 HB1 PRO 17 43.103 -1.212 -6.867 79 HG2 PRO 17 HG2 PRO 17 42.404 -0.864 -4.298 80 HG3 PRO 17 HG1 PRO 17 41.341 -1.630 -5.488 81 HD2 PRO 17 HD2 PRO 17 42.962 -2.891 -3.320 82 HD3 PRO 17 HD1 PRO 17 41.371 -3.365 -3.955 83 H ALA 18 HN ALA 18 45.561 -1.590 -6.746 84 HA ALA 18 HA ALA 18 47.652 -3.652 -6.889 85 HB1 ALA 18 HB1 ALA 18 47.870 -0.670 -7.304 86 HB2 ALA 18 HB2 ALA 18 47.381 -1.801 -8.566 87 HB3 ALA 18 HB3 ALA 18 48.994 -1.912 -7.859 88 H GLY 19 HN GLY 19 49.262 -3.914 -5.392 89 HA2 GLY 19 HA2 GLY 19 50.518 -3.621 -3.436 90 HA3 GLY 19 HA1 GLY 19 50.108 -1.909 -3.527 91 H TRP 20 HN TRP 20 47.517 -4.236 -3.411 92 HA TRP 20 HA TRP 20 46.898 -3.264 -0.668 93 HB2 TRP 20 HB2 TRP 20 45.176 -4.354 -2.874 94 HB3 TRP 20 HB1 TRP 20 44.583 -4.075 -1.233 95 HD1 TRP 20 HD1 TRP 20 45.610 -2.306 -4.382 96 HE1 TRP 20 HE1 TRP 20 45.134 0.201 -4.140 97 HE3 TRP 20 HE3 TRP 20 44.498 -2.176 0.555 98 HZ2 TRP 20 HZ2 TRP 20 44.371 2.057 -2.044 99 HZ3 TRP 20 HZ3 TRP 20 43.917 -0.068 1.674 100 HH2 TRP 20 HH2 TRP 20 43.844 2.065 0.388 101 H GLU 21 HN GLU 21 46.017 -4.754 0.898 102 HA GLU 21 HA GLU 21 46.047 -7.616 0.330 103 HB2 GLU 21 HB2 GLU 21 48.528 -6.605 0.854 104 HB3 GLU 21 HB1 GLU 21 47.984 -7.003 2.483 105 HG2 GLU 21 HG2 GLU 21 47.414 -9.293 1.715 106 HG3 GLU 21 HG1 GLU 21 48.022 -8.891 0.109 107 H MET 22 HN MET 22 44.361 -8.342 1.568 108 HA MET 22 HA MET 22 43.288 -6.772 3.723 109 HB2 MET 22 HB2 MET 22 41.574 -8.082 3.025 110 HB3 MET 22 HB1 MET 22 42.663 -9.317 2.392 111 HG2 MET 22 HG2 MET 22 42.979 -10.272 4.566 112 HG3 MET 22 HG1 MET 22 42.166 -8.914 5.344 113 HE1 MET 22 HE1 MET 22 41.835 -11.349 2.474 114 HE2 MET 22 HE2 MET 22 40.686 -10.138 1.910 115 HE3 MET 22 HE3 MET 22 40.113 -11.740 2.369 116 H ALA 23 HN ALA 23 43.680 -6.933 5.906 117 HA ALA 23 HA ALA 23 45.263 -9.213 6.923 118 HB1 ALA 23 HB1 ALA 23 47.043 -7.776 6.287 119 HB2 ALA 23 HB2 ALA 23 46.843 -7.519 8.019 120 HB3 ALA 23 HB3 ALA 23 46.194 -6.348 6.871 121 H LYS 24 HN LYS 24 45.577 -8.870 9.425 122 HA LYS 24 HA LYS 24 43.091 -7.576 10.452 123 HB2 LYS 24 HB2 LYS 24 43.646 -10.215 10.664 124 HB3 LYS 24 HB1 LYS 24 44.418 -9.616 12.134 125 HG2 LYS 24 HG2 LYS 24 42.405 -8.687 12.954 126 HG3 LYS 24 HG1 LYS 24 41.620 -8.786 11.378 127 HD2 LYS 24 HD2 LYS 24 42.508 -11.200 12.985 128 HD3 LYS 24 HD1 LYS 24 40.859 -10.579 12.958 129 HE2 LYS 24 HE2 LYS 24 40.513 -11.879 11.148 130 HE3 LYS 24 HE1 LYS 24 41.561 -10.773 10.263 131 HZ1 LYS 24 HZ1 LYS 24 43.260 -12.214 10.299 132 HZ2 LYS 24 HZ2 LYS 24 42.054 -13.380 10.572 133 HZ3 LYS 24 HZ3 LYS 24 42.934 -12.742 11.878 134 H THR 25 HN THR 25 43.189 -6.646 12.512 135 HA THR 25 HA THR 25 45.651 -5.162 13.000 136 HB THR 25 HB THR 25 43.202 -4.371 13.188 137 HG1 THR 25 HG1 THR 25 45.285 -3.472 14.191 138 HG21 THR 25 HG21 THR 25 42.577 -6.379 14.546 139 HG22 THR 25 HG22 THR 25 42.069 -4.840 15.240 140 HG23 THR 25 HG23 THR 25 43.476 -5.679 15.888 141 H SER 26 HN SER 26 46.608 -5.130 15.239 142 HA SER 26 HA SER 26 47.189 -7.792 16.159 143 HB2 SER 26 HB2 SER 26 47.567 -5.478 18.004 144 HB3 SER 26 HB1 SER 26 48.678 -6.785 17.605 145 HG SER 26 HG SER 26 47.912 -4.697 15.835 146 H SER 27 HN SER 27 44.336 -7.213 16.093 147 HA SER 27 HA SER 27 43.720 -7.886 18.915 148 HB2 SER 27 HB2 SER 27 42.351 -6.104 19.299 149 HB3 SER 27 HB1 SER 27 43.333 -5.332 18.057 150 HG SER 27 HG SER 27 41.677 -6.508 16.621 151 H GLY 28 HN GLY 28 42.962 -8.080 15.501 152 HA2 GLY 28 HA2 GLY 28 41.923 -10.274 14.859 153 HA3 GLY 28 HA1 GLY 28 40.813 -10.041 16.208 154 H GLN 29 HN GLN 29 41.423 -7.085 14.665 155 HA GLN 29 HA GLN 29 38.757 -7.220 13.396 156 HB2 GLN 29 HB2 GLN 29 40.611 -4.842 13.721 157 HB3 GLN 29 HB1 GLN 29 38.923 -4.792 13.213 158 HG2 GLN 29 HG2 GLN 29 38.542 -6.095 15.492 159 HG3 GLN 29 HG1 GLN 29 40.066 -5.324 15.929 160 HE21 GLN 29 HE21 GLN 29 36.862 -4.840 16.318 161 HE22 GLN 29 HE22 GLN 29 36.793 -3.145 16.263 162 H ARG 30 HN ARG 30 38.679 -7.791 11.287 163 HA ARG 30 HA ARG 30 41.038 -7.909 9.629 164 HB2 ARG 30 HB2 ARG 30 38.580 -9.089 9.533 165 HB3 ARG 30 HB1 ARG 30 38.419 -7.867 8.271 166 HG2 ARG 30 HG2 ARG 30 40.579 -8.673 7.289 167 HG3 ARG 30 HG1 ARG 30 40.585 -9.975 8.478 168 HD2 ARG 30 HD2 ARG 30 38.793 -9.572 6.118 169 HD3 ARG 30 HD1 ARG 30 39.532 -11.055 6.724 170 HE ARG 30 HE ARG 30 36.992 -9.890 7.643 171 HH11 ARG 30 HH11 ARG 30 35.832 -11.203 9.070 172 HH12 ARG 30 HH12 ARG 30 36.605 -12.582 9.779 173 HH21 ARG 30 HH21 ARG 30 39.632 -12.042 8.176 174 HH22 ARG 30 HH22 ARG 30 38.756 -13.057 9.272 175 H TYR 31 HN TYR 31 41.810 -6.457 8.174 176 HA TYR 31 HA TYR 31 40.116 -4.220 7.321 177 HB2 TYR 31 HB2 TYR 31 41.995 -2.566 7.837 178 HB3 TYR 31 HB1 TYR 31 41.026 -3.111 9.196 179 HD1 TYR 31 HD1 TYR 31 42.685 -2.621 10.868 180 HD2 TYR 31 HD2 TYR 31 43.610 -5.253 7.602 181 HE1 TYR 31 HE1 TYR 31 44.757 -3.331 12.024 182 HE2 TYR 31 HE2 TYR 31 45.672 -5.960 8.772 183 HH TYR 31 HH TYR 31 46.983 -5.676 10.519 184 H PHE 32 HN PHE 32 41.898 -2.733 5.908 185 HA PHE 32 HA PHE 32 43.152 -4.765 4.116 186 HB2 PHE 32 HB2 PHE 32 41.877 -2.151 3.277 187 HB3 PHE 32 HB1 PHE 32 42.505 -3.410 2.212 188 HD1 PHE 32 HD1 PHE 32 39.712 -2.341 4.288 189 HD2 PHE 32 HD2 PHE 32 41.403 -5.659 2.147 190 HE1 PHE 32 HE1 PHE 32 37.528 -3.512 4.379 191 HE2 PHE 32 HE2 PHE 32 39.218 -6.829 2.236 192 HZ PHE 32 HZ PHE 32 37.281 -5.755 3.352 193 H LEU 33 HN LEU 33 45.273 -4.495 3.744 194 HA LEU 33 HA LEU 33 46.595 -2.056 4.770 195 HB2 LEU 33 HB2 LEU 33 47.988 -4.343 3.388 196 HB3 LEU 33 HB1 LEU 33 48.613 -3.265 4.633 197 HG LEU 33 HG LEU 33 46.442 -5.342 5.039 198 HD11 LEU 33 HD11 LEU 33 48.414 -6.114 6.669 199 HD12 LEU 33 HD12 LEU 33 49.400 -5.299 5.455 200 HD13 LEU 33 HD13 LEU 33 48.353 -6.639 4.986 201 HD21 LEU 33 HD21 LEU 33 47.166 -2.997 6.524 202 HD22 LEU 33 HD22 LEU 33 47.602 -4.418 7.468 203 HD23 LEU 33 HD23 LEU 33 45.941 -4.201 6.913 204 H ASN 34 HN ASN 34 47.545 -0.507 3.461 205 HA ASN 34 HA ASN 34 47.210 -0.904 0.517 206 HB2 ASN 34 HB2 ASN 34 45.958 1.000 1.785 207 HB3 ASN 34 HB1 ASN 34 47.536 1.782 1.833 208 HD21 ASN 34 HD21 ASN 34 45.763 3.188 0.361 209 HD22 ASN 34 HD22 ASN 34 45.994 2.959 -1.305 210 H HIS 35 HN HIS 35 49.191 -1.538 -0.238 211 HA HIS 35 HA HIS 35 51.676 -0.652 0.986 212 HB2 HIS 35 HB2 HIS 35 51.347 -1.892 -1.758 213 HB3 HIS 35 HB1 HIS 35 52.770 -1.940 -0.717 214 HD1 HIS 35 HD1 HIS 35 52.017 -4.655 -1.389 215 HD2 HIS 35 HD2 HIS 35 49.986 -2.639 1.648 216 HE1 HIS 35 HE1 HIS 35 50.925 -6.435 0.048 217 HE2 HIS 35 HE2 HIS 35 49.687 -5.218 1.898 218 H ILE 36 HN ILE 36 49.465 0.644 -1.232 219 HA ILE 36 HA ILE 36 51.397 2.330 -2.662 220 HB ILE 36 HB ILE 36 48.443 2.847 -2.619 221 HG12 ILE 36 HG12 ILE 36 49.285 0.276 -2.914 222 HG13 ILE 36 HG11 ILE 36 47.861 0.930 -3.708 223 HG21 ILE 36 HG21 ILE 36 50.648 2.963 -4.691 224 HG22 ILE 36 HG22 ILE 36 49.779 4.321 -3.973 225 HG23 ILE 36 HG23 ILE 36 48.946 3.223 -5.074 226 HD11 ILE 36 HD11 ILE 36 49.020 1.283 -5.747 227 HD12 ILE 36 HD12 ILE 36 49.575 -0.298 -5.196 228 HD13 ILE 36 HD13 ILE 36 50.597 1.122 -4.971 229 H ASP 37 HN ASP 37 48.731 2.778 -0.365 230 HA ASP 37 HA ASP 37 49.672 5.495 0.243 231 HB2 ASP 37 HB2 ASP 37 47.302 3.862 1.153 232 HB3 ASP 37 HB1 ASP 37 47.706 5.406 1.906 233 H GLN 38 HN GLN 38 50.711 2.619 1.005 234 HA GLN 38 HA GLN 38 51.782 1.621 2.852 235 HB2 GLN 38 HB2 GLN 38 52.628 4.500 2.767 236 HB3 GLN 38 HB1 GLN 38 53.241 3.441 4.038 237 HG2 GLN 38 HG2 GLN 38 53.924 1.813 2.232 238 HG3 GLN 38 HG1 GLN 38 53.503 3.050 1.048 239 HE21 GLN 38 HE21 GLN 38 55.288 4.252 0.408 240 HE22 GLN 38 HE22 GLN 38 56.627 4.616 1.385 241 H THR 39 HN THR 39 49.166 1.933 3.557 242 HA THR 39 HA THR 39 49.395 2.388 6.431 243 HB THR 39 HB THR 39 48.745 4.552 6.138 244 HG1 THR 39 HG1 THR 39 46.423 4.636 6.281 245 HG21 THR 39 HG21 THR 39 48.231 3.723 3.489 246 HG22 THR 39 HG22 THR 39 48.277 5.377 4.098 247 HG23 THR 39 HG23 THR 39 46.754 4.491 4.065 248 H THR 40 HN THR 40 46.871 2.295 7.205 249 HA THR 40 HA THR 40 45.777 -0.149 5.886 250 HB THR 40 HB THR 40 44.838 -0.694 8.175 251 HG1 THR 40 HG1 THR 40 46.744 1.106 9.172 252 HG21 THR 40 HG21 THR 40 47.611 -0.678 8.882 253 HG22 THR 40 HG22 THR 40 47.468 -0.997 7.153 254 HG23 THR 40 HG23 THR 40 46.630 -2.029 8.315 255 H THR 41 HN THR 41 43.399 -0.337 6.003 256 HA THR 41 HA THR 41 41.969 2.187 6.589 257 HB THR 41 HB THR 41 41.938 2.588 4.368 258 HG1 THR 41 HG1 THR 41 40.164 0.387 4.458 259 HG21 THR 41 HG21 THR 41 43.569 1.116 3.588 260 HG22 THR 41 HG22 THR 41 42.138 0.570 2.712 261 HG23 THR 41 HG23 THR 41 42.681 -0.303 4.143 262 H TRP 42 HN TRP 42 39.813 1.905 7.148 263 HA TRP 42 HA TRP 42 39.085 -0.834 7.957 264 HB2 TRP 42 HB2 TRP 42 37.606 1.790 8.338 265 HB3 TRP 42 HB1 TRP 42 37.193 0.252 9.096 266 HD1 TRP 42 HD1 TRP 42 38.972 3.312 9.812 267 HE1 TRP 42 HE1 TRP 42 40.637 3.010 11.760 268 HE3 TRP 42 HE3 TRP 42 39.144 -1.784 10.033 269 HZ2 TRP 42 HZ2 TRP 42 41.875 0.879 13.219 270 HZ3 TRP 42 HZ3 TRP 42 40.571 -2.924 11.708 271 HH2 TRP 42 HH2 TRP 42 41.937 -1.600 13.298 272 H GLN 43 HN GLN 43 38.816 1.110 5.274 273 HA GLN 43 HA GLN 43 36.354 -0.333 4.385 274 HB2 GLN 43 HB2 GLN 43 36.037 2.141 4.681 275 HB3 GLN 43 HB1 GLN 43 37.273 2.398 3.449 276 HG2 GLN 43 HG2 GLN 43 35.903 1.741 1.740 277 HG3 GLN 43 HG1 GLN 43 35.095 0.518 2.723 278 HE21 GLN 43 HE21 GLN 43 33.781 1.669 4.675 279 HE22 GLN 43 HE22 GLN 43 32.820 2.981 4.185 280 H ASP 44 HN ASP 44 36.386 -1.129 2.223 281 HA ASP 44 HA ASP 44 39.043 -1.770 1.224 282 HB2 ASP 44 HB2 ASP 44 36.360 -2.221 -0.113 283 HB3 ASP 44 HB1 ASP 44 37.876 -3.044 -0.481 284 HA PRO 45 HA PRO 45 39.459 1.714 -1.474 285 HB2 PRO 45 HB2 PRO 45 41.163 0.609 -3.327 286 HB3 PRO 45 HB1 PRO 45 41.682 1.170 -1.727 287 HG2 PRO 45 HG2 PRO 45 41.126 -1.591 -2.676 288 HG3 PRO 45 HG1 PRO 45 42.374 -1.006 -1.563 289 HD2 PRO 45 HD2 PRO 45 40.093 -2.258 -0.714 290 HD3 PRO 45 HD1 PRO 45 40.958 -1.050 0.264 291 H ARG 46 HN ARG 46 38.294 -1.371 -2.545 292 HA ARG 46 HA ARG 46 37.649 -0.595 -5.258 293 HB2 ARG 46 HB2 ARG 46 37.116 -2.902 -3.476 294 HB3 ARG 46 HB1 ARG 46 35.903 -2.614 -4.722 295 HG2 ARG 46 HG2 ARG 46 37.337 -3.131 -6.432 296 HG3 ARG 46 HG1 ARG 46 38.736 -2.454 -5.599 297 HD2 ARG 46 HD2 ARG 46 37.415 -5.128 -5.077 298 HD3 ARG 46 HD1 ARG 46 39.045 -4.844 -5.687 299 HE ARG 46 HE ARG 46 39.162 -3.577 -3.290 300 HH11 ARG 46 HH11 ARG 46 39.556 -4.564 -1.294 301 HH12 ARG 46 HH12 ARG 46 39.124 -6.225 -1.066 302 HH21 ARG 46 HH21 ARG 46 37.877 -6.619 -4.277 303 HH22 ARG 46 HH22 ARG 46 38.174 -7.389 -2.755 304 H LYS 47 HN LYS 47 36.755 1.071 -2.900 305 HA LYS 47 HA LYS 47 33.840 1.116 -3.524 306 HB2 LYS 47 HB2 LYS 47 35.355 1.951 -1.042 307 HB3 LYS 47 HB1 LYS 47 33.672 2.395 -1.327 308 HG2 LYS 47 HG2 LYS 47 33.551 -0.265 -1.843 309 HG3 LYS 47 HG1 LYS 47 34.840 -0.242 -0.638 310 HD2 LYS 47 HD2 LYS 47 33.404 0.994 0.914 311 HD3 LYS 47 HD1 LYS 47 32.121 1.058 -0.296 312 HE2 LYS 47 HE2 LYS 47 31.487 -1.091 0.086 313 HE3 LYS 47 HE1 LYS 47 33.151 -1.653 0.241 314 HZ1 LYS 47 HZ1 LYS 47 31.855 -1.782 2.325 315 HZ2 LYS 47 HZ2 LYS 47 31.721 -0.089 2.317 316 HZ3 LYS 47 HZ3 LYS 47 33.246 -0.822 2.460 317 H ALA 48 HN ALA 48 32.879 3.219 -3.862 318 HA ALA 48 HA ALA 48 34.765 5.137 -5.064 319 HB1 ALA 48 HB1 ALA 48 32.629 6.348 -5.686 320 HB2 ALA 48 HB2 ALA 48 31.739 5.035 -4.916 321 HB3 ALA 48 HB3 ALA 48 32.752 4.707 -6.323 322 H MET 49 HN MET 49 35.765 5.746 -2.976 323 HA MET 49 HA MET 49 35.872 6.991 -0.964 324 HB2 MET 49 HB2 MET 49 34.227 8.853 -2.707 325 HB3 MET 49 HB1 MET 49 35.197 9.324 -1.310 326 HG2 MET 49 HG2 MET 49 36.695 7.754 -3.288 327 HG3 MET 49 HG1 MET 49 36.096 9.287 -3.919 328 HE1 MET 49 HE1 MET 49 36.804 11.494 -3.358 329 HE2 MET 49 HE2 MET 49 38.131 10.710 -4.213 330 HE3 MET 49 HE3 MET 49 38.474 11.759 -2.839 331 H GLY 50 HN GLY 50 34.623 5.838 0.543 332 HA2 GLY 50 HA2 GLY 50 31.695 6.233 0.568 333 HA3 GLY 50 HA1 GLY 50 32.602 5.158 1.633 334 H GLY 51 HN GLY 51 33.544 6.023 3.538 335 HA2 GLY 51 HA2 GLY 51 33.953 7.657 5.206 336 HA3 GLY 51 HA1 GLY 51 33.347 8.892 4.100 337 H GLY 52 HN GLY 52 32.431 6.527 6.525 338 HA2 GLY 52 HA2 GLY 52 29.670 7.680 6.505 339 HA3 GLY 52 HA1 GLY 52 30.035 6.036 7.030 340 H GLY 53 HN GLY 53 30.409 5.726 9.180 341 HA2 GLY 53 HA2 GLY 53 30.295 8.047 10.965 342 HA3 GLY 53 HA1 GLY 53 30.357 6.357 11.466 343 H ASN 54 HN ASN 54 32.127 6.208 12.780 344 HA ASN 54 HA ASN 54 34.677 7.418 11.786 345 HB2 ASN 54 HB2 ASN 54 33.785 8.284 13.983 346 HB3 ASN 54 HB1 ASN 54 33.994 6.661 14.640 347 HD21 ASN 54 HD21 ASN 54 36.192 8.231 12.300 348 HD22 ASN 54 HD22 ASN 54 37.528 8.285 13.346 349 H TYR 55 HN TYR 55 33.041 4.509 12.278 350 HA TYR 55 HA TYR 55 33.790 2.298 11.967 351 HB2 TYR 55 HB2 TYR 55 36.640 3.216 11.810 352 HB3 TYR 55 HB1 TYR 55 35.832 1.930 10.915 353 HD1 TYR 55 HD1 TYR 55 33.467 3.176 9.811 354 HD2 TYR 55 HD2 TYR 55 37.416 4.802 10.273 355 HE1 TYR 55 HE1 TYR 55 33.041 4.744 7.938 356 HE2 TYR 55 HE2 TYR 55 36.988 6.371 8.400 357 HH TYR 55 HH TYR 55 33.799 6.632 6.914 358 H GLN 56 HN GLN 56 36.362 1.292 12.930 359 HA GLN 56 HA GLN 56 35.724 1.312 15.806 360 HB2 GLN 56 HB2 GLN 56 38.095 -0.190 14.875 361 HB3 GLN 56 HB1 GLN 56 36.757 -0.722 15.895 362 HG2 GLN 56 HG2 GLN 56 36.672 -0.383 12.882 363 HG3 GLN 56 HG1 GLN 56 36.704 -1.916 13.752 364 HE21 GLN 56 HE21 GLN 56 34.584 -2.615 13.073 365 HE22 GLN 56 HE22 GLN 56 33.167 -1.827 13.573 366 H GLY 57 HN GLY 57 37.023 3.590 14.285 367 HA2 GLY 57 HA2 GLY 57 38.350 5.257 15.553 368 HA3 GLY 57 HA1 GLY 57 39.338 3.922 16.148 369 HA PRO 58 HA PRO 58 41.314 5.787 12.330 370 HB2 PRO 58 HB2 PRO 58 43.681 6.486 13.508 371 HB3 PRO 58 HB1 PRO 58 42.270 7.559 13.448 372 HG2 PRO 58 HG2 PRO 58 43.286 5.891 15.686 373 HG3 PRO 58 HG1 PRO 58 42.552 7.503 15.718 374 HD2 PRO 58 HD2 PRO 58 41.195 5.193 16.372 375 HD3 PRO 58 HD1 PRO 58 40.405 6.667 15.770 376 HA PRO 59 HA PRO 59 43.381 1.817 11.972 377 HB2 PRO 59 HB2 PRO 59 43.923 1.969 9.311 378 HB3 PRO 59 HB1 PRO 59 42.304 1.621 9.944 379 HG2 PRO 59 HG2 PRO 59 43.407 4.156 8.859 380 HG3 PRO 59 HG1 PRO 59 41.783 3.467 8.697 381 HD2 PRO 59 HD2 PRO 59 42.443 5.494 10.466 382 HD3 PRO 59 HD1 PRO 59 41.055 4.404 10.665 383 HA PRO 60 HA PRO 60 47.578 3.490 12.240 384 HB2 PRO 60 HB2 PRO 60 48.668 1.336 13.489 385 HB3 PRO 60 HB1 PRO 60 47.670 2.528 14.342 386 HG2 PRO 60 HG2 PRO 60 46.974 -0.195 13.398 387 HG3 PRO 60 HG1 PRO 60 46.439 0.674 14.845 388 HD2 PRO 60 HD2 PRO 60 44.939 0.394 12.513 389 HD3 PRO 60 HD1 PRO 60 44.669 1.635 13.754 390 HA PRO 61 HA PRO 61 49.533 1.999 8.562 391 HB2 PRO 61 HB2 PRO 61 51.936 1.767 10.344 392 HB3 PRO 61 HB1 PRO 61 51.800 2.484 8.725 393 HG2 PRO 61 HG2 PRO 61 51.865 3.996 10.914 394 HG3 PRO 61 HG1 PRO 61 50.872 4.423 9.509 395 HD2 PRO 61 HD2 PRO 61 50.006 3.446 12.176 396 HD3 PRO 61 HD1 PRO 61 49.094 4.371 10.963 397 H TYR 62 HN TYR 62 49.561 -0.009 7.702 398 HA TYR 62 HA TYR 62 48.965 -2.385 8.877 399 HB2 TYR 62 HB2 TYR 62 50.639 -3.399 7.103 400 HB3 TYR 62 HB1 TYR 62 49.200 -2.533 6.573 401 HD1 TYR 62 HD1 TYR 62 50.374 -2.104 4.406 402 HD2 TYR 62 HD2 TYR 62 51.849 -0.574 8.136 403 HE1 TYR 62 HE1 TYR 62 51.791 -0.491 3.189 404 HE2 TYR 62 HE2 TYR 62 53.261 1.040 6.923 405 HH TYR 62 HH TYR 62 54.190 0.815 3.978 406 HA PRO 63 HA PRO 63 51.985 -3.977 11.651 407 HB2 PRO 63 HB2 PRO 63 52.776 -6.320 10.268 408 HB3 PRO 63 HB1 PRO 63 51.469 -6.187 11.458 409 HG2 PRO 63 HG2 PRO 63 51.338 -6.160 8.494 410 HG3 PRO 63 HG1 PRO 63 50.184 -6.807 9.674 411 HD2 PRO 63 HD2 PRO 63 49.673 -4.512 8.390 412 HD3 PRO 63 HD1 PRO 63 49.241 -4.704 10.103 413 H LYS 64 HN LYS 64 54.356 -4.619 11.799 414 HA LYS 64 HA LYS 64 55.891 -3.092 9.775 415 HB2 LYS 64 HB2 LYS 64 57.785 -3.430 11.417 416 HB3 LYS 64 HB1 LYS 64 56.407 -2.543 12.068 417 HG2 LYS 64 HG2 LYS 64 55.985 -4.143 13.604 418 HG3 LYS 64 HG1 LYS 64 56.106 -5.427 12.400 419 HD2 LYS 64 HD2 LYS 64 58.423 -5.656 12.688 420 HD3 LYS 64 HD1 LYS 64 58.589 -4.052 13.400 421 HE2 LYS 64 HE2 LYS 64 57.188 -6.411 14.692 422 HE3 LYS 64 HE1 LYS 64 58.789 -5.810 15.123 423 HZ1 LYS 64 HZ1 LYS 64 57.210 -4.889 16.629 424 HZ2 LYS 64 HZ2 LYS 64 56.211 -4.360 15.361 425 HZ3 LYS 64 HZ3 LYS 64 57.729 -3.640 15.606 426 H HIS 65 HN HIS 65 57.061 -4.114 8.217 427 HA HIS 65 HA HIS 65 56.995 -6.993 7.975 428 HB2 HIS 65 HB2 HIS 65 58.617 -4.898 6.496 429 HB3 HIS 65 HB1 HIS 65 58.535 -6.600 6.039 430 HD1 HIS 65 HD1 HIS 65 56.751 -7.140 4.389 431 HD2 HIS 65 HD2 HIS 65 55.798 -3.739 6.610 432 HE1 HIS 65 HE1 HIS 65 54.555 -6.274 3.469 433 HE2 HIS 65 HE2 HIS 65 53.966 -4.204 4.813 Start of MODEL 12 1 H1 SER 7 HT1 SER 7 27.033 -21.692 0.031 2 H2 SER 7 HT2 SER 7 26.340 -20.189 -0.351 3 H3 SER 7 HT3 SER 7 25.434 -21.355 0.487 4 HA SER 7 HA SER 7 26.036 -20.281 2.330 5 HB2 SER 7 HB2 SER 7 27.512 -22.358 2.236 6 HB3 SER 7 HB1 SER 7 28.814 -21.303 1.692 7 HG SER 7 HG SER 7 28.821 -20.304 3.615 8 H PHE 8 HN PHE 8 28.785 -19.286 2.922 9 HA PHE 8 HA PHE 8 28.636 -16.787 1.284 10 HB2 PHE 8 HB2 PHE 8 30.165 -16.701 3.803 11 HB3 PHE 8 HB1 PHE 8 28.967 -15.570 3.175 12 HD1 PHE 8 HD1 PHE 8 26.491 -16.683 3.002 13 HD2 PHE 8 HD2 PHE 8 29.586 -17.835 5.747 14 HE1 PHE 8 HE1 PHE 8 24.784 -17.644 4.522 15 HE2 PHE 8 HE2 PHE 8 27.880 -18.796 7.269 16 HZ PHE 8 HZ PHE 8 25.478 -18.700 6.656 17 H GLU 9 HN GLU 9 30.365 -16.381 -0.009 18 HA GLU 9 HA GLU 9 33.041 -17.366 0.777 19 HB2 GLU 9 HB2 GLU 9 31.399 -18.643 -1.237 20 HB3 GLU 9 HB1 GLU 9 32.859 -17.977 -1.970 21 HG2 GLU 9 HG2 GLU 9 34.194 -19.094 -0.154 22 HG3 GLU 9 HG1 GLU 9 32.709 -19.880 0.385 23 H ILE 10 HN ILE 10 34.569 -15.869 0.219 24 HA ILE 10 HA ILE 10 33.685 -13.510 -1.307 25 HB ILE 10 HB ILE 10 36.467 -13.822 -0.243 26 HG12 ILE 10 HG12 ILE 10 33.995 -13.304 1.443 27 HG13 ILE 10 HG11 ILE 10 35.033 -14.726 1.545 28 HG21 ILE 10 HG21 ILE 10 34.704 -11.452 0.190 29 HG22 ILE 10 HG22 ILE 10 35.233 -11.778 -1.460 30 HG23 ILE 10 HG23 ILE 10 36.426 -11.517 -0.188 31 HD11 ILE 10 HD11 ILE 10 36.937 -13.313 2.190 32 HD12 ILE 10 HD12 ILE 10 35.588 -13.063 3.300 33 HD13 ILE 10 HD13 ILE 10 35.930 -11.872 2.045 34 HA PRO 11 HA PRO 11 35.223 -15.451 -5.085 35 HB2 PRO 11 HB2 PRO 11 35.120 -12.584 -5.920 36 HB3 PRO 11 HB1 PRO 11 34.477 -14.021 -6.738 37 HG2 PRO 11 HG2 PRO 11 32.896 -12.315 -5.420 38 HG3 PRO 11 HG1 PRO 11 32.572 -14.055 -5.476 39 HD2 PRO 11 HD2 PRO 11 33.557 -12.405 -3.209 40 HD3 PRO 11 HD1 PRO 11 32.664 -13.942 -3.185 41 H ASP 12 HN ASP 12 37.361 -15.888 -5.441 42 HA ASP 12 HA ASP 12 39.393 -14.034 -4.445 43 HB2 ASP 12 HB2 ASP 12 40.649 -16.136 -5.846 44 HB3 ASP 12 HB1 ASP 12 40.474 -15.984 -4.097 45 H ASP 13 HN ASP 13 37.632 -14.083 -7.093 46 HA ASP 13 HA ASP 13 39.812 -13.389 -8.977 47 HB2 ASP 13 HB2 ASP 13 36.847 -13.610 -9.552 48 HB3 ASP 13 HB1 ASP 13 38.159 -13.557 -10.729 49 H VAL 14 HN VAL 14 39.116 -11.626 -6.754 50 HA VAL 14 HA VAL 14 38.573 -9.202 -8.346 51 HB VAL 14 HB VAL 14 36.931 -10.050 -5.947 52 HG11 VAL 14 HG11 VAL 14 35.928 -7.635 -6.878 53 HG12 VAL 14 HG12 VAL 14 37.675 -7.394 -6.928 54 HG13 VAL 14 HG13 VAL 14 36.891 -7.851 -5.416 55 HG21 VAL 14 HG21 VAL 14 35.814 -10.911 -7.783 56 HG22 VAL 14 HG22 VAL 14 36.464 -9.693 -8.880 57 HG23 VAL 14 HG23 VAL 14 35.151 -9.277 -7.779 58 HA PRO 15 HA PRO 15 41.946 -9.067 -5.028 59 HB2 PRO 15 HB2 PRO 15 43.388 -7.800 -7.289 60 HB3 PRO 15 HB1 PRO 15 43.930 -9.068 -6.174 61 HG2 PRO 15 HG2 PRO 15 43.297 -9.581 -8.726 62 HG3 PRO 15 HG1 PRO 15 43.012 -10.746 -7.423 63 HD2 PRO 15 HD2 PRO 15 41.045 -9.022 -8.870 64 HD3 PRO 15 HD1 PRO 15 40.833 -10.647 -8.181 65 H LEU 16 HN LEU 16 42.942 -7.064 -4.150 66 HA LEU 16 HA LEU 16 41.135 -4.785 -4.393 67 HB2 LEU 16 HB2 LEU 16 43.702 -4.369 -3.023 68 HB3 LEU 16 HB1 LEU 16 42.075 -4.079 -2.437 69 HG LEU 16 HG LEU 16 43.724 -6.581 -2.328 70 HD11 LEU 16 HD11 LEU 16 42.072 -4.907 -0.453 71 HD12 LEU 16 HD12 LEU 16 43.750 -5.425 -0.296 72 HD13 LEU 16 HD13 LEU 16 42.444 -6.583 -0.053 73 HD21 LEU 16 HD21 LEU 16 41.177 -7.349 -1.502 74 HD22 LEU 16 HD22 LEU 16 41.944 -7.827 -3.014 75 HD23 LEU 16 HD23 LEU 16 40.860 -6.436 -2.976 76 HA PRO 17 HA PRO 17 43.460 -2.068 -7.020 77 HB2 PRO 17 HB2 PRO 17 44.598 -0.320 -4.964 78 HB3 PRO 17 HB1 PRO 17 43.400 0.047 -6.211 79 HG2 PRO 17 HG2 PRO 17 42.803 -0.127 -3.578 80 HG3 PRO 17 HG1 PRO 17 41.647 -0.467 -4.874 81 HD2 PRO 17 HD2 PRO 17 43.100 -2.371 -3.099 82 HD3 PRO 17 HD1 PRO 17 41.492 -2.522 -3.840 83 H ALA 18 HN ALA 18 45.888 -0.568 -6.295 84 HA ALA 18 HA ALA 18 47.751 -2.798 -6.743 85 HB1 ALA 18 HB1 ALA 18 49.344 -0.953 -7.269 86 HB2 ALA 18 HB2 ALA 18 48.074 0.203 -6.867 87 HB3 ALA 18 HB3 ALA 18 47.868 -0.894 -8.233 88 H GLY 19 HN GLY 19 49.251 -3.483 -5.301 89 HA2 GLY 19 HA2 GLY 19 50.526 -3.623 -3.345 90 HA3 GLY 19 HA1 GLY 19 50.364 -1.874 -3.213 91 H TRP 20 HN TRP 20 47.452 -3.806 -3.330 92 HA TRP 20 HA TRP 20 46.983 -3.038 -0.505 93 HB2 TRP 20 HB2 TRP 20 45.190 -3.750 -2.793 94 HB3 TRP 20 HB1 TRP 20 44.585 -3.620 -1.137 95 HD1 TRP 20 HD1 TRP 20 45.910 -1.593 -4.019 96 HE1 TRP 20 HE1 TRP 20 45.644 0.906 -3.503 97 HE3 TRP 20 HE3 TRP 20 44.524 -1.907 0.854 98 HZ2 TRP 20 HZ2 TRP 20 44.933 2.576 -1.247 99 HZ3 TRP 20 HZ3 TRP 20 44.076 0.111 2.176 100 HH2 TRP 20 HH2 TRP 20 44.271 2.368 1.142 101 H GLU 21 HN GLU 21 46.044 -4.547 0.990 102 HA GLU 21 HA GLU 21 45.815 -7.364 0.239 103 HB2 GLU 21 HB2 GLU 21 48.327 -6.925 0.484 104 HB3 GLU 21 HB1 GLU 21 48.009 -6.668 2.200 105 HG2 GLU 21 HG2 GLU 21 46.874 -9.133 0.964 106 HG3 GLU 21 HG1 GLU 21 48.618 -9.090 1.222 107 H MET 22 HN MET 22 44.169 -8.111 1.526 108 HA MET 22 HA MET 22 43.198 -6.583 3.748 109 HB2 MET 22 HB2 MET 22 41.455 -7.856 3.036 110 HB3 MET 22 HB1 MET 22 42.515 -9.120 2.411 111 HG2 MET 22 HG2 MET 22 42.836 -10.040 4.604 112 HG3 MET 22 HG1 MET 22 42.025 -8.667 5.357 113 HE1 MET 22 HE1 MET 22 40.663 -12.393 3.483 114 HE2 MET 22 HE2 MET 22 42.072 -11.418 3.077 115 HE3 MET 22 HE3 MET 22 40.576 -11.210 2.171 116 H ALA 23 HN ALA 23 43.640 -6.798 5.916 117 HA ALA 23 HA ALA 23 45.198 -9.123 6.858 118 HB1 ALA 23 HB1 ALA 23 46.202 -6.278 6.855 119 HB2 ALA 23 HB2 ALA 23 46.989 -7.699 6.173 120 HB3 ALA 23 HB3 ALA 23 46.867 -7.513 7.923 121 H LYS 24 HN LYS 24 45.571 -8.812 9.363 122 HA LYS 24 HA LYS 24 43.145 -7.454 10.441 123 HB2 LYS 24 HB2 LYS 24 43.613 -10.116 10.608 124 HB3 LYS 24 HB1 LYS 24 44.410 -9.561 12.082 125 HG2 LYS 24 HG2 LYS 24 42.443 -8.655 12.965 126 HG3 LYS 24 HG1 LYS 24 41.664 -8.555 11.389 127 HD2 LYS 24 HD2 LYS 24 42.425 -11.213 12.607 128 HD3 LYS 24 HD1 LYS 24 40.872 -10.451 12.945 129 HE2 LYS 24 HE2 LYS 24 40.049 -11.001 10.916 130 HE3 LYS 24 HE1 LYS 24 41.509 -10.452 10.094 131 HZ1 LYS 24 HZ1 LYS 24 40.803 -13.106 11.055 132 HZ2 LYS 24 HZ2 LYS 24 42.426 -12.643 11.252 133 HZ3 LYS 24 HZ3 LYS 24 41.723 -12.648 9.705 134 H THR 25 HN THR 25 43.299 -6.532 12.491 135 HA THR 25 HA THR 25 45.806 -5.136 12.974 136 HB THR 25 HB THR 25 43.385 -4.292 13.242 137 HG1 THR 25 HG1 THR 25 44.028 -3.012 15.023 138 HG21 THR 25 HG21 THR 25 42.152 -4.946 15.081 139 HG22 THR 25 HG22 THR 25 43.576 -5.443 15.992 140 HG23 THR 25 HG23 THR 25 42.976 -6.450 14.675 141 H SER 26 HN SER 26 46.770 -5.155 15.227 142 HA SER 26 HA SER 26 47.336 -7.850 16.069 143 HB2 SER 26 HB2 SER 26 48.138 -5.137 16.848 144 HB3 SER 26 HB1 SER 26 48.022 -6.238 18.218 145 HG SER 26 HG SER 26 49.884 -6.107 16.281 146 H SER 27 HN SER 27 44.470 -7.059 16.057 147 HA SER 27 HA SER 27 43.872 -7.852 18.862 148 HB2 SER 27 HB2 SER 27 43.558 -5.284 18.195 149 HB3 SER 27 HB1 SER 27 42.040 -5.896 17.548 150 HG SER 27 HG SER 27 42.965 -6.503 20.155 151 H GLY 28 HN GLY 28 43.083 -7.958 15.453 152 HA2 GLY 28 HA2 GLY 28 41.995 -10.115 14.772 153 HA3 GLY 28 HA1 GLY 28 40.901 -9.891 16.135 154 H GLN 29 HN GLN 29 41.510 -6.895 14.714 155 HA GLN 29 HA GLN 29 38.841 -6.945 13.461 156 HB2 GLN 29 HB2 GLN 29 40.712 -4.575 13.596 157 HB3 GLN 29 HB1 GLN 29 38.957 -4.568 13.430 158 HG2 GLN 29 HG2 GLN 29 38.622 -5.245 15.675 159 HG3 GLN 29 HG1 GLN 29 40.299 -5.762 15.857 160 HE21 GLN 29 HE21 GLN 29 38.384 -3.446 17.026 161 HE22 GLN 29 HE22 GLN 29 39.450 -2.125 17.076 162 H ARG 30 HN ARG 30 38.698 -7.489 11.345 163 HA ARG 30 HA ARG 30 41.013 -7.683 9.639 164 HB2 ARG 30 HB2 ARG 30 39.593 -8.640 8.099 165 HB3 ARG 30 HB1 ARG 30 38.603 -8.843 9.544 166 HG2 ARG 30 HG2 ARG 30 37.553 -6.596 9.012 167 HG3 ARG 30 HG1 ARG 30 38.390 -6.659 7.460 168 HD2 ARG 30 HD2 ARG 30 37.012 -8.280 6.633 169 HD3 ARG 30 HD1 ARG 30 36.882 -9.103 8.188 170 HE ARG 30 HE ARG 30 35.484 -6.620 8.354 171 HH11 ARG 30 HH11 ARG 30 33.230 -6.642 8.187 172 HH12 ARG 30 HH12 ARG 30 32.443 -8.002 7.458 173 HH21 ARG 30 HH21 ARG 30 35.395 -9.705 6.818 174 HH22 ARG 30 HH22 ARG 30 33.669 -9.736 6.684 175 H TYR 31 HN TYR 31 41.871 -6.217 8.256 176 HA TYR 31 HA TYR 31 40.263 -3.902 7.423 177 HB2 TYR 31 HB2 TYR 31 42.218 -2.345 7.952 178 HB3 TYR 31 HB1 TYR 31 41.251 -2.875 9.319 179 HD1 TYR 31 HD1 TYR 31 42.980 -2.465 10.950 180 HD2 TYR 31 HD2 TYR 31 43.692 -5.121 7.650 181 HE1 TYR 31 HE1 TYR 31 45.042 -3.284 12.049 182 HE2 TYR 31 HE2 TYR 31 45.745 -5.936 8.764 183 HH TYR 31 HH TYR 31 47.049 -5.812 10.532 184 H PHE 32 HN PHE 32 42.094 -2.500 5.961 185 HA PHE 32 HA PHE 32 43.321 -4.637 4.275 186 HB2 PHE 32 HB2 PHE 32 41.829 -2.164 3.373 187 HB3 PHE 32 HB1 PHE 32 42.749 -3.210 2.292 188 HD1 PHE 32 HD1 PHE 32 41.940 -5.404 1.684 189 HD2 PHE 32 HD2 PHE 32 39.833 -3.015 4.564 190 HE1 PHE 32 HE1 PHE 32 40.012 -6.960 1.566 191 HE2 PHE 32 HE2 PHE 32 37.905 -4.569 4.446 192 HZ PHE 32 HZ PHE 32 37.994 -6.542 2.945 193 H LEU 33 HN LEU 33 45.417 -4.394 3.857 194 HA LEU 33 HA LEU 33 46.801 -2.007 4.876 195 HB2 LEU 33 HB2 LEU 33 48.099 -4.307 3.428 196 HB3 LEU 33 HB1 LEU 33 48.789 -3.264 4.670 197 HG LEU 33 HG LEU 33 46.637 -5.364 5.038 198 HD11 LEU 33 HD11 LEU 33 48.527 -5.913 6.867 199 HD12 LEU 33 HD12 LEU 33 49.540 -5.129 5.655 200 HD13 LEU 33 HD13 LEU 33 48.594 -6.553 5.225 201 HD21 LEU 33 HD21 LEU 33 47.382 -2.998 6.662 202 HD22 LEU 33 HD22 LEU 33 47.239 -4.512 7.549 203 HD23 LEU 33 HD23 LEU 33 45.871 -3.903 6.619 204 H ASN 34 HN ASN 34 47.984 -0.557 3.635 205 HA ASN 34 HA ASN 34 47.563 -0.711 0.680 206 HB2 ASN 34 HB2 ASN 34 46.437 1.199 1.979 207 HB3 ASN 34 HB1 ASN 34 48.066 1.818 2.254 208 HD21 ASN 34 HD21 ASN 34 48.584 0.432 -0.593 209 HD22 ASN 34 HD22 ASN 34 48.106 1.660 -1.662 210 H HIS 35 HN HIS 35 49.483 -1.580 -0.023 211 HA HIS 35 HA HIS 35 52.026 -0.942 1.233 212 HB2 HIS 35 HB2 HIS 35 51.667 -2.144 -1.517 213 HB3 HIS 35 HB1 HIS 35 52.999 -2.384 -0.386 214 HD1 HIS 35 HD1 HIS 35 51.866 -4.957 -1.186 215 HD2 HIS 35 HD2 HIS 35 50.063 -2.720 1.842 216 HE1 HIS 35 HE1 HIS 35 50.473 -6.580 0.174 217 HE2 HIS 35 HE2 HIS 35 49.371 -5.228 2.016 218 H ILE 36 HN ILE 36 50.036 0.603 -1.051 219 HA ILE 36 HA ILE 36 52.158 1.970 -2.519 220 HB ILE 36 HB ILE 36 49.318 2.938 -2.277 221 HG12 ILE 36 HG12 ILE 36 49.735 0.329 -2.714 222 HG13 ILE 36 HG11 ILE 36 48.462 1.220 -3.533 223 HG21 ILE 36 HG21 ILE 36 51.486 2.981 -4.380 224 HG22 ILE 36 HG22 ILE 36 50.661 4.349 -3.632 225 HG23 ILE 36 HG23 ILE 36 49.803 3.323 -4.782 226 HD11 ILE 36 HD11 ILE 36 51.210 1.146 -4.741 227 HD12 ILE 36 HD12 ILE 36 49.650 1.342 -5.540 228 HD13 ILE 36 HD13 ILE 36 50.141 -0.241 -4.942 229 H ASP 37 HN ASP 37 49.820 2.795 -0.002 230 HA ASP 37 HA ASP 37 51.452 5.199 0.620 231 HB2 ASP 37 HB2 ASP 37 48.554 4.551 1.187 232 HB3 ASP 37 HB1 ASP 37 49.383 5.932 1.907 233 H GLN 38 HN GLN 38 51.608 2.239 1.476 234 HA GLN 38 HA GLN 38 51.985 1.024 3.473 235 HB2 GLN 38 HB2 GLN 38 53.634 2.139 4.936 236 HB3 GLN 38 HB1 GLN 38 54.058 2.339 3.236 237 HG2 GLN 38 HG2 GLN 38 53.190 4.589 3.215 238 HG3 GLN 38 HG1 GLN 38 52.500 4.392 4.827 239 HE21 GLN 38 HE21 GLN 38 53.805 6.111 5.762 240 HE22 GLN 38 HE22 GLN 38 55.480 5.935 5.985 241 H THR 39 HN THR 39 49.411 1.986 3.542 242 HA THR 39 HA THR 39 49.150 2.803 6.388 243 HB THR 39 HB THR 39 48.235 4.708 5.566 244 HG1 THR 39 HG1 THR 39 46.097 3.083 4.737 245 HG21 THR 39 HG21 THR 39 48.884 3.693 3.163 246 HG22 THR 39 HG22 THR 39 47.924 5.157 3.338 247 HG23 THR 39 HG23 THR 39 47.129 3.613 3.037 248 H THR 40 HN THR 40 46.506 2.494 6.737 249 HA THR 40 HA THR 40 45.967 -0.296 5.849 250 HB THR 40 HB THR 40 44.739 -0.411 8.174 251 HG1 THR 40 HG1 THR 40 45.351 1.924 8.415 252 HG21 THR 40 HG21 THR 40 46.418 -1.913 8.308 253 HG22 THR 40 HG22 THR 40 47.368 -0.636 9.065 254 HG23 THR 40 HG23 THR 40 47.486 -0.909 7.327 255 H THR 41 HN THR 41 43.449 -0.731 6.488 256 HA THR 41 HA THR 41 41.843 1.673 5.911 257 HB THR 41 HB THR 41 40.806 -0.068 4.094 258 HG1 THR 41 HG1 THR 41 43.621 -0.310 3.979 259 HG21 THR 41 HG21 THR 41 41.851 1.336 2.421 260 HG22 THR 41 HG22 THR 41 43.094 1.832 3.569 261 HG23 THR 41 HG23 THR 41 41.421 2.339 3.807 262 H TRP 42 HN TRP 42 39.942 1.551 7.023 263 HA TRP 42 HA TRP 42 39.250 -0.944 8.402 264 HB2 TRP 42 HB2 TRP 42 37.875 1.759 8.290 265 HB3 TRP 42 HB1 TRP 42 37.328 0.409 9.280 266 HD1 TRP 42 HD1 TRP 42 38.990 3.442 9.780 267 HE1 TRP 42 HE1 TRP 42 40.684 3.377 11.723 268 HE3 TRP 42 HE3 TRP 42 39.555 -1.615 10.285 269 HZ2 TRP 42 HZ2 TRP 42 42.089 1.433 13.286 270 HZ3 TRP 42 HZ3 TRP 42 41.073 -2.539 12.008 271 HH2 TRP 42 HH2 TRP 42 42.343 -1.025 13.505 272 H GLN 43 HN GLN 43 38.449 0.765 5.535 273 HA GLN 43 HA GLN 43 36.109 -1.021 5.078 274 HB2 GLN 43 HB2 GLN 43 35.730 1.477 5.048 275 HB3 GLN 43 HB1 GLN 43 36.780 1.550 3.633 276 HG2 GLN 43 HG2 GLN 43 34.966 1.100 2.372 277 HG3 GLN 43 HG1 GLN 43 34.970 -0.519 3.073 278 HE21 GLN 43 HE21 GLN 43 33.799 -0.653 5.304 279 HE22 GLN 43 HE22 GLN 43 32.393 0.283 5.483 280 H ASP 44 HN ASP 44 35.904 -1.914 2.882 281 HA ASP 44 HA ASP 44 38.510 -2.706 1.814 282 HB2 ASP 44 HB2 ASP 44 35.831 -3.339 0.578 283 HB3 ASP 44 HB1 ASP 44 37.317 -4.287 0.515 284 HA PRO 45 HA PRO 45 38.735 0.475 -1.255 285 HB2 PRO 45 HB2 PRO 45 40.160 -0.933 -3.174 286 HB3 PRO 45 HB1 PRO 45 40.886 -0.141 -1.762 287 HG2 PRO 45 HG2 PRO 45 40.219 -3.004 -2.191 288 HG3 PRO 45 HG1 PRO 45 41.590 -2.275 -1.337 289 HD2 PRO 45 HD2 PRO 45 39.464 -3.354 -0.026 290 HD3 PRO 45 HD1 PRO 45 40.386 -1.979 0.623 291 H ARG 46 HN ARG 46 37.464 -2.698 -1.945 292 HA ARG 46 HA ARG 46 36.452 -2.083 -4.588 293 HB2 ARG 46 HB2 ARG 46 36.103 -4.286 -2.596 294 HB3 ARG 46 HB1 ARG 46 34.888 -4.122 -3.865 295 HG2 ARG 46 HG2 ARG 46 36.588 -5.616 -4.696 296 HG3 ARG 46 HG1 ARG 46 36.783 -4.080 -5.543 297 HD2 ARG 46 HD2 ARG 46 38.293 -4.482 -2.993 298 HD3 ARG 46 HD1 ARG 46 38.870 -5.308 -4.440 299 HE ARG 46 HE ARG 46 38.862 -2.394 -3.999 300 HH11 ARG 46 HH11 ARG 46 39.986 -1.223 -5.573 301 HH12 ARG 46 HH12 ARG 46 40.480 -2.014 -7.032 302 HH21 ARG 46 HH21 ARG 46 39.141 -5.084 -6.137 303 HH22 ARG 46 HH22 ARG 46 40.002 -4.200 -7.351 304 H LYS 47 HN LYS 47 35.821 -0.307 -2.232 305 HA LYS 47 HA LYS 47 32.851 -0.358 -2.495 306 HB2 LYS 47 HB2 LYS 47 34.550 0.706 -0.219 307 HB3 LYS 47 HB1 LYS 47 32.792 0.825 -0.309 308 HG2 LYS 47 HG2 LYS 47 33.680 -1.901 -0.787 309 HG3 LYS 47 HG1 LYS 47 34.262 -1.304 0.769 310 HD2 LYS 47 HD2 LYS 47 32.066 -2.305 1.085 311 HD3 LYS 47 HD1 LYS 47 31.933 -0.560 1.299 312 HE2 LYS 47 HE2 LYS 47 30.824 -0.258 -0.727 313 HE3 LYS 47 HE1 LYS 47 31.488 -1.736 -1.425 314 HZ1 LYS 47 HZ1 LYS 47 29.016 -1.532 -0.446 315 HZ2 LYS 47 HZ2 LYS 47 29.837 -2.103 0.927 316 HZ3 LYS 47 HZ3 LYS 47 29.881 -2.989 -0.523 317 H ALA 48 HN ALA 48 31.948 1.983 -2.098 318 HA ALA 48 HA ALA 48 33.758 4.061 -3.195 319 HB1 ALA 48 HB1 ALA 48 32.637 3.008 -5.152 320 HB2 ALA 48 HB2 ALA 48 32.153 4.690 -4.938 321 HB3 ALA 48 HB3 ALA 48 31.071 3.390 -4.436 322 H MET 49 HN MET 49 33.433 4.737 -0.895 323 HA MET 49 HA MET 49 31.460 6.806 -0.690 324 HB2 MET 49 HB2 MET 49 29.944 4.857 -0.397 325 HB3 MET 49 HB1 MET 49 30.914 4.333 0.981 326 HG2 MET 49 HG2 MET 49 29.140 5.552 1.963 327 HG3 MET 49 HG1 MET 49 30.484 6.694 1.938 328 HE1 MET 49 HE1 MET 49 26.518 6.838 -0.228 329 HE2 MET 49 HE2 MET 49 26.918 6.250 1.384 330 HE3 MET 49 HE3 MET 49 27.434 5.337 -0.033 331 H GLY 50 HN GLY 50 32.399 4.641 1.961 332 HA2 GLY 50 HA2 GLY 50 33.826 5.005 3.788 333 HA3 GLY 50 HA1 GLY 50 34.761 6.065 2.733 334 H GLY 51 HN GLY 51 33.905 6.420 5.589 335 HA2 GLY 51 HA2 GLY 51 33.702 8.709 6.509 336 HA3 GLY 51 HA1 GLY 51 32.557 9.062 5.213 337 H GLY 52 HN GLY 52 32.200 9.211 8.177 338 HA2 GLY 52 HA2 GLY 52 29.894 8.974 9.089 339 HA3 GLY 52 HA1 GLY 52 29.850 7.368 8.357 340 H GLY 53 HN GLY 53 30.027 8.744 11.271 341 HA2 GLY 53 HA2 GLY 53 30.673 7.913 13.371 342 HA3 GLY 53 HA1 GLY 53 31.045 6.387 12.568 343 H ASN 54 HN ASN 54 32.961 6.311 13.987 344 HA ASN 54 HA ASN 54 35.256 7.649 12.695 345 HB2 ASN 54 HB2 ASN 54 36.061 8.748 14.607 346 HB3 ASN 54 HB1 ASN 54 34.325 9.048 14.696 347 HD21 ASN 54 HD21 ASN 54 36.919 8.022 16.555 348 HD22 ASN 54 HD22 ASN 54 36.073 7.132 17.727 349 H TYR 55 HN TYR 55 33.877 5.166 14.684 350 HA TYR 55 HA TYR 55 34.709 3.075 15.346 351 HB2 TYR 55 HB2 TYR 55 36.717 3.677 13.152 352 HB3 TYR 55 HB1 TYR 55 36.466 2.097 13.897 353 HD1 TYR 55 HD1 TYR 55 34.114 1.071 13.786 354 HD2 TYR 55 HD2 TYR 55 35.356 4.390 11.358 355 HE1 TYR 55 HE1 TYR 55 32.243 0.626 12.220 356 HE2 TYR 55 HE2 TYR 55 33.484 3.945 9.792 357 HH TYR 55 HH TYR 55 32.076 1.816 9.171 358 H GLN 56 HN GLN 56 37.356 2.143 15.533 359 HA GLN 56 HA GLN 56 38.219 3.400 17.952 360 HB2 GLN 56 HB2 GLN 56 40.420 2.012 16.820 361 HB3 GLN 56 HB1 GLN 56 39.319 1.437 18.074 362 HG2 GLN 56 HG2 GLN 56 37.811 0.519 16.426 363 HG3 GLN 56 HG1 GLN 56 38.721 1.259 15.109 364 HE21 GLN 56 HE21 GLN 56 39.241 -0.825 14.133 365 HE22 GLN 56 HE22 GLN 56 40.347 -1.890 14.856 366 H GLY 57 HN GLY 57 38.072 5.044 15.405 367 HA2 GLY 57 HA2 GLY 57 39.212 7.080 14.902 368 HA3 GLY 57 HA1 GLY 57 40.564 6.536 15.896 369 HA PRO 58 HA PRO 58 41.463 6.188 11.234 370 HB2 PRO 58 HB2 PRO 58 43.998 7.379 12.247 371 HB3 PRO 58 HB1 PRO 58 43.064 7.780 10.793 372 HG2 PRO 58 HG2 PRO 58 43.071 9.356 12.954 373 HG3 PRO 58 HG1 PRO 58 41.643 9.170 11.923 374 HD2 PRO 58 HD2 PRO 58 42.158 8.055 14.641 375 HD3 PRO 58 HD1 PRO 58 40.619 8.520 13.882 376 HA PRO 59 HA PRO 59 43.691 2.448 12.179 377 HB2 PRO 59 HB2 PRO 59 44.114 1.597 9.641 378 HB3 PRO 59 HB1 PRO 59 42.514 1.568 10.393 379 HG2 PRO 59 HG2 PRO 59 43.651 3.500 8.442 380 HG3 PRO 59 HG1 PRO 59 42.013 2.834 8.550 381 HD2 PRO 59 HD2 PRO 59 42.722 5.347 9.464 382 HD3 PRO 59 HD1 PRO 59 41.332 4.419 10.068 383 HA PRO 60 HA PRO 60 47.924 4.097 12.051 384 HB2 PRO 60 HB2 PRO 60 48.493 1.310 12.945 385 HB3 PRO 60 HB1 PRO 60 48.989 2.849 13.673 386 HG2 PRO 60 HG2 PRO 60 47.065 1.315 14.733 387 HG3 PRO 60 HG1 PRO 60 47.053 3.082 14.846 388 HD2 PRO 60 HD2 PRO 60 45.355 1.299 13.182 389 HD3 PRO 60 HD1 PRO 60 45.011 2.924 13.812 390 HA PRO 61 HA PRO 61 49.586 2.137 8.425 391 HB2 PRO 61 HB2 PRO 61 52.203 1.618 8.878 392 HB3 PRO 61 HB1 PRO 61 51.571 3.272 8.750 393 HG2 PRO 61 HG2 PRO 61 52.315 1.707 11.156 394 HG3 PRO 61 HG1 PRO 61 52.519 3.434 10.819 395 HD2 PRO 61 HD2 PRO 61 50.487 2.371 12.395 396 HD3 PRO 61 HD1 PRO 61 50.412 3.959 11.600 397 H TYR 62 HN TYR 62 49.570 0.158 7.472 398 HA TYR 62 HA TYR 62 48.834 -2.199 8.592 399 HB2 TYR 62 HB2 TYR 62 50.133 -3.341 6.748 400 HB3 TYR 62 HB1 TYR 62 49.111 -2.010 6.218 401 HD1 TYR 62 HD1 TYR 62 50.922 -2.502 4.261 402 HD2 TYR 62 HD2 TYR 62 51.734 -0.504 7.971 403 HE1 TYR 62 HE1 TYR 62 52.878 -1.390 3.249 404 HE2 TYR 62 HE2 TYR 62 53.680 0.603 6.966 405 HH TYR 62 HH TYR 62 54.278 0.542 3.571 406 HA PRO 63 HA PRO 63 51.818 -3.821 11.387 407 HB2 PRO 63 HB2 PRO 63 52.012 -6.449 10.435 408 HB3 PRO 63 HB1 PRO 63 50.797 -5.851 11.578 409 HG2 PRO 63 HG2 PRO 63 50.586 -6.298 8.650 410 HG3 PRO 63 HG1 PRO 63 49.372 -6.525 9.922 411 HD2 PRO 63 HD2 PRO 63 49.286 -4.400 8.263 412 HD3 PRO 63 HD1 PRO 63 48.798 -4.264 9.966 413 H LYS 64 HN LYS 64 54.016 -4.912 11.468 414 HA LYS 64 HA LYS 64 55.580 -4.114 9.068 415 HB2 LYS 64 HB2 LYS 64 56.812 -5.034 11.650 416 HB3 LYS 64 HB1 LYS 64 57.424 -3.864 10.481 417 HG2 LYS 64 HG2 LYS 64 55.158 -2.599 11.194 418 HG3 LYS 64 HG1 LYS 64 55.462 -3.488 12.688 419 HD2 LYS 64 HD2 LYS 64 56.668 -1.511 13.035 420 HD3 LYS 64 HD1 LYS 64 57.909 -2.603 12.417 421 HE2 LYS 64 HE2 LYS 64 56.828 -1.553 10.103 422 HE3 LYS 64 HE1 LYS 64 56.788 -0.176 11.205 423 HZ1 LYS 64 HZ1 LYS 64 58.962 0.054 10.971 424 HZ2 LYS 64 HZ2 LYS 64 58.988 -1.231 9.860 425 HZ3 LYS 64 HZ3 LYS 64 59.229 -1.531 11.514 426 H HIS 65 HN HIS 65 55.901 -5.751 7.637 427 HA HIS 65 HA HIS 65 55.451 -8.448 7.889 428 HB2 HIS 65 HB2 HIS 65 57.992 -7.991 6.509 429 HB3 HIS 65 HB1 HIS 65 56.460 -8.588 5.868 430 HD1 HIS 65 HD1 HIS 65 58.648 -5.843 5.443 431 HD2 HIS 65 HD2 HIS 65 54.503 -6.160 5.794 432 HE1 HIS 65 HE1 HIS 65 57.679 -3.709 4.477 433 HE2 HIS 65 HE2 HIS 65 55.159 -3.892 4.686 Start of MODEL 13 1 H1 SER 7 HT1 SER 7 22.987 -0.565 -4.578 2 H2 SER 7 HT2 SER 7 22.868 0.830 -3.614 3 H3 SER 7 HT3 SER 7 24.060 -0.335 -3.285 4 HA SER 7 HA SER 7 23.911 1.484 -5.622 5 HB2 SER 7 HB2 SER 7 24.939 2.020 -3.209 6 HB3 SER 7 HB1 SER 7 26.306 1.131 -3.874 7 HG SER 7 HG SER 7 24.995 3.228 -5.257 8 H PHE 8 HN PHE 8 23.801 -1.507 -5.661 9 HA PHE 8 HA PHE 8 24.808 -3.233 -6.890 10 HB2 PHE 8 HB2 PHE 8 25.578 -0.749 -8.179 11 HB3 PHE 8 HB1 PHE 8 26.857 -1.954 -8.329 12 HD1 PHE 8 HD1 PHE 8 23.425 -1.061 -9.239 13 HD2 PHE 8 HD2 PHE 8 26.419 -4.135 -9.410 14 HE1 PHE 8 HE1 PHE 8 22.116 -2.238 -10.986 15 HE2 PHE 8 HE2 PHE 8 25.111 -5.313 -11.158 16 HZ PHE 8 HZ PHE 8 22.959 -4.364 -11.945 17 H GLU 9 HN GLU 9 26.209 -4.678 -6.020 18 HA GLU 9 HA GLU 9 28.652 -3.602 -4.673 19 HB2 GLU 9 HB2 GLU 9 27.725 -6.372 -4.109 20 HB3 GLU 9 HB1 GLU 9 28.392 -5.164 -3.010 21 HG2 GLU 9 HG2 GLU 9 26.167 -3.881 -3.435 22 HG3 GLU 9 HG1 GLU 9 25.567 -5.434 -4.019 23 H ILE 10 HN ILE 10 30.524 -4.044 -5.721 24 HA ILE 10 HA ILE 10 30.631 -5.774 -8.020 25 HB ILE 10 HB ILE 10 32.947 -4.736 -6.360 26 HG12 ILE 10 HG12 ILE 10 31.218 -3.459 -8.477 27 HG13 ILE 10 HG11 ILE 10 31.743 -2.791 -6.930 28 HG21 ILE 10 HG21 ILE 10 34.230 -5.000 -8.398 29 HG22 ILE 10 HG22 ILE 10 32.783 -5.440 -9.304 30 HG23 ILE 10 HG23 ILE 10 33.415 -6.528 -8.067 31 HD11 ILE 10 HD11 ILE 10 33.364 -3.176 -9.446 32 HD12 ILE 10 HD12 ILE 10 34.138 -2.964 -7.876 33 HD13 ILE 10 HD13 ILE 10 33.102 -1.694 -8.529 34 HA PRO 11 HA PRO 11 30.889 -9.819 -6.234 35 HB2 PRO 11 HB2 PRO 11 33.124 -10.105 -8.208 36 HB3 PRO 11 HB1 PRO 11 31.748 -11.182 -7.900 37 HG2 PRO 11 HG2 PRO 11 31.832 -9.512 -10.002 38 HG3 PRO 11 HG1 PRO 11 30.323 -9.955 -9.188 39 HD2 PRO 11 HD2 PRO 11 31.735 -7.365 -9.192 40 HD3 PRO 11 HD1 PRO 11 30.049 -7.727 -8.764 41 H ASP 12 HN ASP 12 32.152 -10.824 -4.645 42 HA ASP 12 HA ASP 12 34.414 -9.299 -3.629 43 HB2 ASP 12 HB2 ASP 12 33.476 -11.997 -2.642 44 HB3 ASP 12 HB1 ASP 12 34.360 -10.767 -1.737 45 H ASP 13 HN ASP 13 34.183 -11.304 -6.086 46 HA ASP 13 HA ASP 13 36.633 -12.871 -5.582 47 HB2 ASP 13 HB2 ASP 13 34.657 -12.800 -7.871 48 HB3 ASP 13 HB1 ASP 13 36.147 -13.742 -7.931 49 H VAL 14 HN VAL 14 36.751 -9.948 -5.767 50 HA VAL 14 HA VAL 14 38.493 -9.721 -8.177 51 HB VAL 14 HB VAL 14 37.049 -7.412 -6.867 52 HG11 VAL 14 HG11 VAL 14 37.973 -6.150 -8.516 53 HG12 VAL 14 HG12 VAL 14 37.701 -7.392 -9.739 54 HG13 VAL 14 HG13 VAL 14 39.113 -7.485 -8.686 55 HG21 VAL 14 HG21 VAL 14 35.468 -7.630 -8.841 56 HG22 VAL 14 HG22 VAL 14 35.308 -8.899 -7.626 57 HG23 VAL 14 HG23 VAL 14 36.165 -9.223 -9.132 58 HA PRO 15 HA PRO 15 41.543 -9.478 -4.824 59 HB2 PRO 15 HB2 PRO 15 43.156 -8.635 -7.197 60 HB3 PRO 15 HB1 PRO 15 43.539 -9.825 -5.938 61 HG2 PRO 15 HG2 PRO 15 42.762 -10.565 -8.382 62 HG3 PRO 15 HG1 PRO 15 42.308 -11.479 -6.934 63 HD2 PRO 15 HD2 PRO 15 40.624 -9.728 -8.651 64 HD3 PRO 15 HD1 PRO 15 40.149 -11.104 -7.631 65 H LEU 16 HN LEU 16 42.810 -7.713 -3.886 66 HA LEU 16 HA LEU 16 41.556 -5.144 -4.076 67 HB2 LEU 16 HB2 LEU 16 44.304 -5.829 -2.999 68 HB3 LEU 16 HB1 LEU 16 43.375 -4.385 -2.630 69 HG LEU 16 HG LEU 16 43.409 -6.688 -1.136 70 HD11 LEU 16 HD11 LEU 16 42.702 -4.399 -0.470 71 HD12 LEU 16 HD12 LEU 16 41.593 -5.642 0.107 72 HD13 LEU 16 HD13 LEU 16 41.164 -4.661 -1.293 73 HD21 LEU 16 HD21 LEU 16 40.929 -6.696 -2.884 74 HD22 LEU 16 HD22 LEU 16 41.004 -7.502 -1.322 75 HD23 LEU 16 HD23 LEU 16 42.072 -8.017 -2.623 76 HA PRO 17 HA PRO 17 43.736 -3.053 -7.323 77 HB2 PRO 17 HB2 PRO 17 44.771 -0.962 -5.534 78 HB3 PRO 17 HB1 PRO 17 43.633 -0.828 -6.884 79 HG2 PRO 17 HG2 PRO 17 42.866 -0.570 -4.326 80 HG3 PRO 17 HG1 PRO 17 41.817 -1.254 -5.578 81 HD2 PRO 17 HD2 PRO 17 43.347 -2.659 -3.426 82 HD3 PRO 17 HD1 PRO 17 41.751 -3.044 -4.108 83 H ALA 18 HN ALA 18 46.066 -1.314 -6.723 84 HA ALA 18 HA ALA 18 48.076 -3.451 -6.913 85 HB1 ALA 18 HB1 ALA 18 49.304 -1.938 -8.100 86 HB2 ALA 18 HB2 ALA 18 48.830 -0.589 -7.066 87 HB3 ALA 18 HB3 ALA 18 47.724 -1.183 -8.304 88 H GLY 19 HN GLY 19 49.663 -3.824 -5.412 89 HA2 GLY 19 HA2 GLY 19 50.873 -3.678 -3.412 90 HA3 GLY 19 HA1 GLY 19 50.530 -1.950 -3.433 91 H TRP 20 HN TRP 20 47.854 -4.191 -3.462 92 HA TRP 20 HA TRP 20 47.219 -3.299 -0.696 93 HB2 TRP 20 HB2 TRP 20 45.501 -4.248 -2.969 94 HB3 TRP 20 HB1 TRP 20 44.889 -4.014 -1.328 95 HD1 TRP 20 HD1 TRP 20 46.013 -2.160 -4.390 96 HE1 TRP 20 HE1 TRP 20 45.634 0.352 -4.053 97 HE3 TRP 20 HE3 TRP 20 44.858 -2.177 0.540 98 HZ2 TRP 20 HZ2 TRP 20 44.921 2.154 -1.895 99 HZ3 TRP 20 HZ3 TRP 20 44.348 -0.091 1.734 100 HH2 TRP 20 HH2 TRP 20 44.369 2.090 0.531 101 H GLU 21 HN GLU 21 46.316 -4.791 0.821 102 HA GLU 21 HA GLU 21 46.213 -7.636 0.188 103 HB2 GLU 21 HB2 GLU 21 48.704 -7.122 0.471 104 HB3 GLU 21 HB1 GLU 21 48.341 -6.786 2.164 105 HG2 GLU 21 HG2 GLU 21 47.123 -9.139 2.027 106 HG3 GLU 21 HG1 GLU 21 48.241 -9.388 0.686 107 H MET 22 HN MET 22 44.481 -8.281 1.407 108 HA MET 22 HA MET 22 43.468 -6.717 3.573 109 HB2 MET 22 HB2 MET 22 41.743 -7.998 2.826 110 HB3 MET 22 HB1 MET 22 42.817 -9.287 2.279 111 HG2 MET 22 HG2 MET 22 43.040 -10.161 4.491 112 HG3 MET 22 HG1 MET 22 42.256 -8.745 5.194 113 HE1 MET 22 HE1 MET 22 40.801 -9.992 1.783 114 HE2 MET 22 HE2 MET 22 40.143 -11.557 2.250 115 HE3 MET 22 HE3 MET 22 41.874 -11.264 2.383 116 H ALA 23 HN ALA 23 43.801 -6.925 5.774 117 HA ALA 23 HA ALA 23 45.363 -9.215 6.791 118 HB1 ALA 23 HB1 ALA 23 46.992 -7.633 7.887 119 HB2 ALA 23 HB2 ALA 23 46.311 -6.346 6.892 120 HB3 ALA 23 HB3 ALA 23 47.131 -7.707 6.131 121 H LYS 24 HN LYS 24 45.633 -8.857 9.304 122 HA LYS 24 HA LYS 24 43.172 -7.480 10.261 123 HB2 LYS 24 HB2 LYS 24 43.262 -10.068 10.366 124 HB3 LYS 24 HB1 LYS 24 44.391 -9.819 11.700 125 HG2 LYS 24 HG2 LYS 24 42.701 -8.320 12.781 126 HG3 LYS 24 HG1 LYS 24 41.566 -8.746 11.502 127 HD2 LYS 24 HD2 LYS 24 42.920 -10.918 13.083 128 HD3 LYS 24 HD1 LYS 24 41.506 -10.098 13.744 129 HE2 LYS 24 HE2 LYS 24 41.557 -11.338 10.983 130 HE3 LYS 24 HE1 LYS 24 40.988 -12.193 12.416 131 HZ1 LYS 24 HZ1 LYS 24 39.203 -10.780 12.660 132 HZ2 LYS 24 HZ2 LYS 24 39.310 -10.905 10.970 133 HZ3 LYS 24 HZ3 LYS 24 39.915 -9.531 11.763 134 H THR 25 HN THR 25 43.280 -6.611 12.418 135 HA THR 25 HA THR 25 45.748 -5.206 12.938 136 HB THR 25 HB THR 25 43.460 -4.359 13.484 137 HG1 THR 25 HG1 THR 25 45.645 -4.114 14.838 138 HG21 THR 25 HG21 THR 25 42.166 -5.316 15.173 139 HG22 THR 25 HG22 THR 25 43.532 -6.202 15.846 140 HG23 THR 25 HG23 THR 25 42.816 -6.713 14.317 141 H SER 26 HN SER 26 46.519 -5.324 15.423 142 HA SER 26 HA SER 26 48.141 -7.333 15.999 143 HB2 SER 26 HB2 SER 26 46.077 -6.712 18.114 144 HB3 SER 26 HB1 SER 26 47.783 -7.091 18.335 145 HG SER 26 HG SER 26 46.667 -4.774 17.125 146 H SER 27 HN SER 27 44.621 -7.715 16.069 147 HA SER 27 HA SER 27 44.370 -10.263 15.164 148 HB2 SER 27 HB2 SER 27 45.495 -10.286 17.925 149 HB3 SER 27 HB1 SER 27 44.283 -11.500 17.527 150 HG SER 27 HG SER 27 46.322 -12.280 16.996 151 H GLY 28 HN GLY 28 42.342 -9.042 14.790 152 HA2 GLY 28 HA2 GLY 28 40.162 -9.938 16.274 153 HA3 GLY 28 HA1 GLY 28 40.614 -8.414 17.034 154 H GLN 29 HN GLN 29 41.393 -6.958 14.721 155 HA GLN 29 HA GLN 29 38.743 -6.733 13.384 156 HB2 GLN 29 HB2 GLN 29 40.865 -4.591 13.644 157 HB3 GLN 29 HB1 GLN 29 39.216 -4.385 13.058 158 HG2 GLN 29 HG2 GLN 29 40.155 -4.934 15.866 159 HG3 GLN 29 HG1 GLN 29 39.070 -3.668 15.292 160 HE21 GLN 29 HE21 GLN 29 36.863 -4.402 14.547 161 HE22 GLN 29 HE22 GLN 29 36.196 -5.811 15.217 162 H ARG 30 HN ARG 30 38.641 -7.031 11.215 163 HA ARG 30 HA ARG 30 41.127 -7.649 9.765 164 HB2 ARG 30 HB2 ARG 30 38.305 -8.290 9.492 165 HB3 ARG 30 HB1 ARG 30 38.974 -7.708 7.967 166 HG2 ARG 30 HG2 ARG 30 40.883 -9.330 8.282 167 HG3 ARG 30 HG1 ARG 30 40.006 -9.999 9.658 168 HD2 ARG 30 HD2 ARG 30 38.166 -9.818 7.494 169 HD3 ARG 30 HD1 ARG 30 39.636 -10.566 6.871 170 HE ARG 30 HE ARG 30 39.204 -11.923 9.228 171 HH11 ARG 30 HH11 ARG 30 37.915 -13.774 9.378 172 HH12 ARG 30 HH12 ARG 30 36.650 -14.026 8.223 173 HH21 ARG 30 HH21 ARG 30 37.296 -11.099 6.479 174 HH22 ARG 30 HH22 ARG 30 36.298 -12.512 6.582 175 H TYR 31 HN TYR 31 41.980 -6.334 8.121 176 HA TYR 31 HA TYR 31 40.405 -4.028 7.226 177 HB2 TYR 31 HB2 TYR 31 42.388 -2.472 7.731 178 HB3 TYR 31 HB1 TYR 31 41.350 -2.924 9.076 179 HD1 TYR 31 HD1 TYR 31 42.988 -2.548 10.809 180 HD2 TYR 31 HD2 TYR 31 43.831 -5.244 7.572 181 HE1 TYR 31 HE1 TYR 31 44.987 -3.377 12.011 182 HE2 TYR 31 HE2 TYR 31 45.819 -6.071 8.789 183 HH TYR 31 HH TYR 31 47.201 -4.482 11.349 184 H PHE 32 HN PHE 32 42.212 -2.637 5.785 185 HA PHE 32 HA PHE 32 43.410 -4.731 4.025 186 HB2 PHE 32 HB2 PHE 32 42.279 -2.049 3.189 187 HB3 PHE 32 HB1 PHE 32 42.886 -3.312 2.117 188 HD1 PHE 32 HD1 PHE 32 41.760 -5.644 2.278 189 HD2 PHE 32 HD2 PHE 32 40.020 -2.041 3.838 190 HE1 PHE 32 HE1 PHE 32 39.528 -6.724 2.282 191 HE2 PHE 32 HE2 PHE 32 37.788 -3.121 3.844 192 HZ PHE 32 HZ PHE 32 37.541 -5.462 3.066 193 H LEU 33 HN LEU 33 45.552 -4.564 3.663 194 HA LEU 33 HA LEU 33 46.983 -2.216 4.753 195 HB2 LEU 33 HB2 LEU 33 48.231 -4.600 3.381 196 HB3 LEU 33 HB1 LEU 33 48.963 -3.516 4.564 197 HG LEU 33 HG LEU 33 46.754 -5.529 5.064 198 HD11 LEU 33 HD11 LEU 33 48.776 -6.707 5.134 199 HD12 LEU 33 HD12 LEU 33 48.595 -6.203 6.815 200 HD13 LEU 33 HD13 LEU 33 49.676 -5.317 5.740 201 HD21 LEU 33 HD21 LEU 33 47.496 -4.582 7.516 202 HD22 LEU 33 HD22 LEU 33 46.097 -3.991 6.617 203 HD23 LEU 33 HD23 LEU 33 47.628 -3.122 6.539 204 H ASN 34 HN ASN 34 47.801 -0.610 3.490 205 HA ASN 34 HA ASN 34 47.613 -0.974 0.532 206 HB2 ASN 34 HB2 ASN 34 46.436 0.969 1.827 207 HB3 ASN 34 HB1 ASN 34 48.053 1.669 1.896 208 HD21 ASN 34 HD21 ASN 34 46.993 3.385 0.436 209 HD22 ASN 34 HD22 ASN 34 46.958 3.080 -1.234 210 H HIS 35 HN HIS 35 49.571 -1.644 -0.237 211 HA HIS 35 HA HIS 35 52.067 -0.934 1.091 212 HB2 HIS 35 HB2 HIS 35 51.467 -2.320 -1.538 213 HB3 HIS 35 HB1 HIS 35 53.099 -2.066 -0.924 214 HD1 HIS 35 HD1 HIS 35 53.436 -4.652 -0.624 215 HD2 HIS 35 HD2 HIS 35 50.333 -3.055 1.663 216 HE1 HIS 35 HE1 HIS 35 52.811 -6.425 1.077 217 HE2 HIS 35 HE2 HIS 35 50.924 -5.463 2.473 218 H ILE 36 HN ILE 36 49.990 0.582 -1.088 219 HA ILE 36 HA ILE 36 52.055 2.118 -2.499 220 HB ILE 36 HB ILE 36 49.152 2.870 -2.449 221 HG12 ILE 36 HG12 ILE 36 49.782 0.251 -2.775 222 HG13 ILE 36 HG11 ILE 36 48.430 1.027 -3.584 223 HG21 ILE 36 HG21 ILE 36 49.702 3.224 -4.910 224 HG22 ILE 36 HG22 ILE 36 51.380 2.867 -4.500 225 HG23 ILE 36 HG23 ILE 36 50.576 4.264 -3.785 226 HD11 ILE 36 HD11 ILE 36 50.081 -0.326 -5.049 227 HD12 ILE 36 HD12 ILE 36 51.187 1.027 -4.809 228 HD13 ILE 36 HD13 ILE 36 49.635 1.288 -5.604 229 H ASP 37 HN ASP 37 49.382 2.835 -0.272 230 HA ASP 37 HA ASP 37 50.610 5.419 0.389 231 HB2 ASP 37 HB2 ASP 37 48.049 4.898 0.172 232 HB3 ASP 37 HB1 ASP 37 48.222 4.293 1.821 233 H GLN 38 HN GLN 38 51.200 2.408 1.211 234 HA GLN 38 HA GLN 38 52.141 1.314 3.061 235 HB2 GLN 38 HB2 GLN 38 53.301 4.050 2.926 236 HB3 GLN 38 HB1 GLN 38 53.644 3.099 4.372 237 HG2 GLN 38 HG2 GLN 38 54.452 1.242 2.966 238 HG3 GLN 38 HG1 GLN 38 54.102 2.185 1.518 239 HE21 GLN 38 HE21 GLN 38 55.563 3.911 0.955 240 HE22 GLN 38 HE22 GLN 38 57.022 4.174 1.780 241 H THR 39 HN THR 39 49.757 1.377 3.889 242 HA THR 39 HA THR 39 49.817 1.979 6.686 243 HB THR 39 HB THR 39 49.333 4.185 6.336 244 HG1 THR 39 HG1 THR 39 47.484 4.178 7.275 245 HG21 THR 39 HG21 THR 39 48.572 3.265 3.715 246 HG22 THR 39 HG22 THR 39 49.064 4.882 4.216 247 HG23 THR 39 HG23 THR 39 47.374 4.400 4.334 248 H THR 40 HN THR 40 47.252 2.047 7.342 249 HA THR 40 HA THR 40 46.075 -0.323 5.955 250 HB THR 40 HB THR 40 45.021 -0.858 8.185 251 HG1 THR 40 HG1 THR 40 45.279 0.500 9.746 252 HG21 THR 40 HG21 THR 40 46.756 -2.271 8.287 253 HG22 THR 40 HG22 THR 40 47.690 -1.019 9.104 254 HG23 THR 40 HG23 THR 40 47.752 -1.158 7.348 255 H THR 41 HN THR 41 43.671 -0.385 6.032 256 HA THR 41 HA THR 41 42.373 2.221 6.557 257 HB THR 41 HB THR 41 42.497 2.639 4.341 258 HG1 THR 41 HG1 THR 41 40.546 2.294 3.686 259 HG21 THR 41 HG21 THR 41 43.100 -0.271 4.171 260 HG22 THR 41 HG22 THR 41 44.003 1.099 3.524 261 HG23 THR 41 HG23 THR 41 42.543 0.540 2.708 262 H TRP 42 HN TRP 42 40.169 2.078 6.972 263 HA TRP 42 HA TRP 42 39.211 -0.634 7.661 264 HB2 TRP 42 HB2 TRP 42 37.867 2.042 8.148 265 HB3 TRP 42 HB1 TRP 42 37.450 0.498 8.890 266 HD1 TRP 42 HD1 TRP 42 39.286 3.528 9.607 267 HE1 TRP 42 HE1 TRP 42 40.971 3.187 11.528 268 HE3 TRP 42 HE3 TRP 42 39.375 -1.572 9.791 269 HZ2 TRP 42 HZ2 TRP 42 42.193 1.022 12.956 270 HZ3 TRP 42 HZ3 TRP 42 40.806 -2.747 11.437 271 HH2 TRP 42 HH2 TRP 42 42.216 -1.458 13.016 272 H GLN 43 HN GLN 43 39.216 1.408 5.061 273 HA GLN 43 HA GLN 43 36.491 0.594 4.167 274 HB2 GLN 43 HB2 GLN 43 37.036 3.021 4.093 275 HB3 GLN 43 HB1 GLN 43 38.358 2.665 2.982 276 HG2 GLN 43 HG2 GLN 43 36.712 3.133 1.438 277 HG3 GLN 43 HG1 GLN 43 36.401 1.412 1.659 278 HE21 GLN 43 HE21 GLN 43 34.237 2.924 0.836 279 HE22 GLN 43 HE22 GLN 43 33.143 3.146 2.115 280 H ASP 44 HN ASP 44 36.235 -0.507 2.176 281 HA ASP 44 HA ASP 44 38.611 -2.012 1.312 282 HB2 ASP 44 HB2 ASP 44 35.832 -2.231 0.152 283 HB3 ASP 44 HB1 ASP 44 37.097 -3.460 0.196 284 HA PRO 45 HA PRO 45 39.416 0.626 -2.148 285 HB2 PRO 45 HB2 PRO 45 40.517 -1.265 -3.844 286 HB3 PRO 45 HB1 PRO 45 41.398 -0.459 -2.533 287 HG2 PRO 45 HG2 PRO 45 40.190 -3.170 -2.617 288 HG3 PRO 45 HG1 PRO 45 41.673 -2.614 -1.825 289 HD2 PRO 45 HD2 PRO 45 39.360 -3.093 -0.455 290 HD3 PRO 45 HD1 PRO 45 40.552 -1.879 0.062 291 H ARG 46 HN ARG 46 37.365 -2.126 -2.297 292 HA ARG 46 HA ARG 46 36.524 -1.682 -5.068 293 HB2 ARG 46 HB2 ARG 46 35.799 -3.599 -2.876 294 HB3 ARG 46 HB1 ARG 46 34.701 -3.401 -4.243 295 HG2 ARG 46 HG2 ARG 46 36.158 -5.181 -4.867 296 HG3 ARG 46 HG1 ARG 46 36.749 -3.769 -5.744 297 HD2 ARG 46 HD2 ARG 46 38.622 -4.978 -4.706 298 HD3 ARG 46 HD1 ARG 46 38.435 -3.385 -3.975 299 HE ARG 46 HE ARG 46 37.764 -4.435 -1.952 300 HH11 ARG 46 HH11 ARG 46 37.529 -6.276 -0.663 301 HH12 ARG 46 HH12 ARG 46 37.517 -7.841 -1.406 302 HH21 ARG 46 HH21 ARG 46 37.913 -6.609 -4.623 303 HH22 ARG 46 HH22 ARG 46 37.733 -8.029 -3.648 304 H LYS 47 HN LYS 47 36.210 0.422 -2.959 305 HA LYS 47 HA LYS 47 33.419 1.092 -3.605 306 HB2 LYS 47 HB2 LYS 47 34.201 1.330 -0.720 307 HB3 LYS 47 HB1 LYS 47 32.592 1.191 -1.431 308 HG2 LYS 47 HG2 LYS 47 33.059 -1.159 -2.029 309 HG3 LYS 47 HG1 LYS 47 34.661 -1.023 -1.304 310 HD2 LYS 47 HD2 LYS 47 33.809 -1.460 0.729 311 HD3 LYS 47 HD1 LYS 47 32.710 -0.088 0.583 312 HE2 LYS 47 HE2 LYS 47 31.128 -1.506 -0.693 313 HE3 LYS 47 HE1 LYS 47 32.217 -2.879 -0.496 314 HZ1 LYS 47 HZ1 LYS 47 30.245 -2.370 1.181 315 HZ2 LYS 47 HZ2 LYS 47 31.459 -1.444 1.923 316 HZ3 LYS 47 HZ3 LYS 47 31.690 -3.109 1.673 317 H ALA 48 HN ALA 48 32.946 3.381 -2.622 318 HA ALA 48 HA ALA 48 35.445 4.999 -2.499 319 HB1 ALA 48 HB1 ALA 48 34.805 5.247 -4.787 320 HB2 ALA 48 HB2 ALA 48 34.227 6.702 -3.975 321 HB3 ALA 48 HB3 ALA 48 33.100 5.404 -4.367 322 H MET 49 HN MET 49 34.579 4.761 -0.163 323 HA MET 49 HA MET 49 33.582 5.793 1.693 324 HB2 MET 49 HB2 MET 49 34.268 7.844 -0.136 325 HB3 MET 49 HB1 MET 49 32.648 8.223 0.449 326 HG2 MET 49 HG2 MET 49 33.577 7.729 2.803 327 HG3 MET 49 HG1 MET 49 35.172 7.835 2.058 328 HE1 MET 49 HE1 MET 49 33.521 9.775 4.395 329 HE2 MET 49 HE2 MET 49 32.128 9.417 3.377 330 HE3 MET 49 HE3 MET 49 32.628 11.090 3.619 331 H GLY 50 HN GLY 50 31.353 7.331 2.028 332 HA2 GLY 50 HA2 GLY 50 29.002 7.468 1.593 333 HA3 GLY 50 HA1 GLY 50 29.188 6.242 0.339 334 H GLY 51 HN GLY 51 27.719 6.661 3.185 335 HA2 GLY 51 HA2 GLY 51 26.778 5.140 4.706 336 HA3 GLY 51 HA1 GLY 51 27.345 3.845 3.651 337 H GLY 52 HN GLY 52 28.124 5.809 6.437 338 HA2 GLY 52 HA2 GLY 52 29.800 3.827 7.601 339 HA3 GLY 52 HA1 GLY 52 30.833 5.022 6.815 340 H GLY 53 HN GLY 53 29.948 4.314 9.760 341 HA2 GLY 53 HA2 GLY 53 28.931 6.941 10.633 342 HA3 GLY 53 HA1 GLY 53 29.239 5.551 11.676 343 H ASN 54 HN ASN 54 31.516 5.061 12.184 344 HA ASN 54 HA ASN 54 33.429 7.271 11.671 345 HB2 ASN 54 HB2 ASN 54 33.196 6.234 14.477 346 HB3 ASN 54 HB1 ASN 54 33.807 7.789 13.908 347 HD21 ASN 54 HD21 ASN 54 30.875 6.002 14.739 348 HD22 ASN 54 HD22 ASN 54 29.824 7.332 14.655 349 H TYR 55 HN TYR 55 32.888 4.160 11.321 350 HA TYR 55 HA TYR 55 34.236 2.244 11.186 351 HB2 TYR 55 HB2 TYR 55 36.681 3.966 11.393 352 HB3 TYR 55 HB1 TYR 55 36.363 2.601 10.323 353 HD1 TYR 55 HD1 TYR 55 37.270 5.654 9.813 354 HD2 TYR 55 HD2 TYR 55 33.631 3.425 9.334 355 HE1 TYR 55 HE1 TYR 55 36.546 7.219 8.031 356 HE2 TYR 55 HE2 TYR 55 32.906 4.989 7.551 357 HH TYR 55 HH TYR 55 35.061 7.392 6.230 358 H GLN 56 HN GLN 56 36.336 1.247 12.346 359 HA GLN 56 HA GLN 56 35.735 1.348 15.196 360 HB2 GLN 56 HB2 GLN 56 38.194 -0.055 14.477 361 HB3 GLN 56 HB1 GLN 56 36.728 -0.687 15.229 362 HG2 GLN 56 HG2 GLN 56 35.632 -0.721 12.992 363 HG3 GLN 56 HG1 GLN 56 37.149 -0.189 12.268 364 HE21 GLN 56 HE21 GLN 56 35.485 -2.939 13.703 365 HE22 GLN 56 HE22 GLN 56 36.701 -4.079 13.382 366 H GLY 57 HN GLY 57 36.965 3.676 13.698 367 HA2 GLY 57 HA2 GLY 57 38.202 5.434 14.873 368 HA3 GLY 57 HA1 GLY 57 39.147 4.175 15.671 369 HA PRO 58 HA PRO 58 41.126 6.118 11.674 370 HB2 PRO 58 HB2 PRO 58 43.236 6.554 13.745 371 HB3 PRO 58 HB1 PRO 58 42.754 7.594 12.391 372 HG2 PRO 58 HG2 PRO 58 42.040 8.120 14.917 373 HG3 PRO 58 HG1 PRO 58 40.998 8.502 13.536 374 HD2 PRO 58 HD2 PRO 58 40.685 6.378 15.586 375 HD3 PRO 58 HD1 PRO 58 39.453 7.167 14.578 376 HA PRO 59 HA PRO 59 43.163 2.151 11.419 377 HB2 PRO 59 HB2 PRO 59 44.099 2.385 8.877 378 HB3 PRO 59 HB1 PRO 59 42.388 2.093 9.247 379 HG2 PRO 59 HG2 PRO 59 43.755 4.619 8.474 380 HG3 PRO 59 HG1 PRO 59 42.154 4.013 8.019 381 HD2 PRO 59 HD2 PRO 59 42.578 5.926 9.968 382 HD3 PRO 59 HD1 PRO 59 41.151 4.869 9.904 383 HA PRO 60 HA PRO 60 47.347 3.622 12.335 384 HB2 PRO 60 HB2 PRO 60 48.122 1.442 13.746 385 HB3 PRO 60 HB1 PRO 60 47.040 2.671 14.428 386 HG2 PRO 60 HG2 PRO 60 46.408 -0.026 13.366 387 HG3 PRO 60 HG1 PRO 60 45.681 0.857 14.716 388 HD2 PRO 60 HD2 PRO 60 44.569 0.647 12.165 389 HD3 PRO 60 HD1 PRO 60 44.141 1.883 13.367 390 HA PRO 61 HA PRO 61 49.471 1.904 8.814 391 HB2 PRO 61 HB2 PRO 61 51.809 2.088 10.680 392 HB3 PRO 61 HB1 PRO 61 51.672 2.617 8.992 393 HG2 PRO 61 HG2 PRO 61 51.533 4.343 11.020 394 HG3 PRO 61 HG1 PRO 61 50.580 4.549 9.541 395 HD2 PRO 61 HD2 PRO 61 49.664 3.785 12.258 396 HD3 PRO 61 HD1 PRO 61 48.744 4.506 10.919 397 H TYR 62 HN TYR 62 49.663 -0.204 8.234 398 HA TYR 62 HA TYR 62 49.237 -2.436 9.745 399 HB2 TYR 62 HB2 TYR 62 51.008 -3.538 8.111 400 HB3 TYR 62 HB1 TYR 62 49.501 -2.883 7.473 401 HD1 TYR 62 HD1 TYR 62 49.725 -1.591 5.565 402 HD2 TYR 62 HD2 TYR 62 52.853 -1.545 8.505 403 HE1 TYR 62 HE1 TYR 62 51.000 0.010 4.185 404 HE2 TYR 62 HE2 TYR 62 54.129 0.060 7.128 405 HH TYR 62 HH TYR 62 54.246 0.675 4.668 406 HA PRO 63 HA PRO 63 52.352 -3.349 12.716 407 HB2 PRO 63 HB2 PRO 63 53.433 -5.727 11.577 408 HB3 PRO 63 HB1 PRO 63 52.158 -5.612 12.802 409 HG2 PRO 63 HG2 PRO 63 51.939 -5.988 9.874 410 HG3 PRO 63 HG1 PRO 63 50.881 -6.564 11.174 411 HD2 PRO 63 HD2 PRO 63 50.128 -4.531 9.590 412 HD3 PRO 63 HD1 PRO 63 49.737 -4.525 11.325 413 H LYS 64 HN LYS 64 54.700 -3.371 13.033 414 HA LYS 64 HA LYS 64 56.152 -2.323 10.649 415 HB2 LYS 64 HB2 LYS 64 56.417 -1.923 13.610 416 HB3 LYS 64 HB1 LYS 64 57.845 -1.723 12.592 417 HG2 LYS 64 HG2 LYS 64 56.733 -0.040 11.254 418 HG3 LYS 64 HG1 LYS 64 55.203 -0.328 12.084 419 HD2 LYS 64 HD2 LYS 64 57.260 0.222 14.026 420 HD3 LYS 64 HD1 LYS 64 57.233 1.505 12.816 421 HE2 LYS 64 HE2 LYS 64 55.668 1.897 14.751 422 HE3 LYS 64 HE1 LYS 64 54.872 1.886 13.177 423 HZ1 LYS 64 HZ1 LYS 64 54.811 -0.141 15.304 424 HZ2 LYS 64 HZ2 LYS 64 54.595 -0.625 13.690 425 HZ3 LYS 64 HZ3 LYS 64 53.532 0.499 14.392 426 H HIS 65 HN HIS 65 57.016 -4.120 9.636 427 HA HIS 65 HA HIS 65 58.005 -6.429 11.054 428 HB2 HIS 65 HB2 HIS 65 58.985 -7.060 8.858 429 HB3 HIS 65 HB1 HIS 65 57.293 -6.583 8.712 430 HD1 HIS 65 HD1 HIS 65 58.790 -3.488 9.257 431 HD2 HIS 65 HD2 HIS 65 58.840 -6.070 5.980 432 HE1 HIS 65 HE1 HIS 65 59.425 -2.083 7.245 433 HE2 HIS 65 HE2 HIS 65 59.458 -3.645 5.246 Start of MODEL 14 1 H1 SER 7 HT1 SER 7 23.109 -0.237 -5.405 2 H2 SER 7 HT2 SER 7 23.514 -0.342 -3.758 3 H3 SER 7 HT3 SER 7 21.978 0.215 -4.225 4 HA SER 7 HA SER 7 22.245 -2.204 -3.396 5 HB2 SER 7 HB2 SER 7 20.740 -1.340 -5.877 6 HB3 SER 7 HB1 SER 7 20.483 -2.895 -5.091 7 HG SER 7 HG SER 7 19.634 -0.409 -4.381 8 H PHE 8 HN PHE 8 21.562 -3.300 -6.401 9 HA PHE 8 HA PHE 8 22.685 -4.731 -7.882 10 HB2 PHE 8 HB2 PHE 8 25.169 -3.171 -7.127 11 HB3 PHE 8 HB1 PHE 8 24.865 -4.049 -8.627 12 HD1 PHE 8 HD1 PHE 8 22.417 -3.314 -9.686 13 HD2 PHE 8 HD2 PHE 8 25.039 -0.861 -7.330 14 HE1 PHE 8 HE1 PHE 8 21.399 -1.280 -10.673 15 HE2 PHE 8 HE2 PHE 8 24.021 1.174 -8.317 16 HZ PHE 8 HZ PHE 8 22.201 0.965 -9.989 17 H GLU 9 HN GLU 9 25.422 -5.653 -7.651 18 HA GLU 9 HA GLU 9 25.364 -7.039 -5.007 19 HB2 GLU 9 HB2 GLU 9 25.054 -8.204 -7.662 20 HB3 GLU 9 HB1 GLU 9 26.433 -8.891 -6.805 21 HG2 GLU 9 HG2 GLU 9 25.024 -9.420 -4.882 22 HG3 GLU 9 HG1 GLU 9 23.640 -8.644 -5.653 23 H ILE 10 HN ILE 10 27.338 -7.024 -4.017 24 HA ILE 10 HA ILE 10 29.650 -6.057 -5.613 25 HB ILE 10 HB ILE 10 29.675 -6.244 -2.621 26 HG12 ILE 10 HG12 ILE 10 28.047 -4.374 -4.318 27 HG13 ILE 10 HG11 ILE 10 27.635 -5.120 -2.773 28 HG21 ILE 10 HG21 ILE 10 31.301 -4.580 -2.785 29 HG22 ILE 10 HG22 ILE 10 30.675 -3.978 -4.320 30 HG23 ILE 10 HG23 ILE 10 31.585 -5.488 -4.269 31 HD11 ILE 10 HD11 ILE 10 29.599 -3.696 -1.824 32 HD12 ILE 10 HD12 ILE 10 28.072 -2.887 -2.178 33 HD13 ILE 10 HD13 ILE 10 29.421 -2.754 -3.304 34 HA PRO 11 HA PRO 11 30.846 -10.404 -5.022 35 HB2 PRO 11 HB2 PRO 11 32.502 -10.533 -7.177 36 HB3 PRO 11 HB1 PRO 11 30.737 -10.664 -7.312 37 HG2 PRO 11 HG2 PRO 11 32.516 -8.367 -7.910 38 HG3 PRO 11 HG1 PRO 11 31.027 -8.887 -8.714 39 HD2 PRO 11 HD2 PRO 11 31.196 -6.794 -6.885 40 HD3 PRO 11 HD1 PRO 11 29.701 -7.654 -7.309 41 H ASP 12 HN ASP 12 32.467 -11.005 -3.645 42 HA ASP 12 HA ASP 12 34.670 -9.189 -3.105 43 HB2 ASP 12 HB2 ASP 12 34.177 -11.995 -2.076 44 HB3 ASP 12 HB1 ASP 12 35.354 -10.855 -1.423 45 H ASP 13 HN ASP 13 34.168 -11.153 -5.554 46 HA ASP 13 HA ASP 13 36.763 -12.491 -5.708 47 HB2 ASP 13 HB2 ASP 13 35.083 -12.141 -8.146 48 HB3 ASP 13 HB1 ASP 13 35.925 -13.576 -7.561 49 H VAL 14 HN VAL 14 36.629 -9.545 -5.452 50 HA VAL 14 HA VAL 14 38.047 -8.826 -7.975 51 HB VAL 14 HB VAL 14 36.497 -7.006 -6.110 52 HG11 VAL 14 HG11 VAL 14 38.479 -5.968 -7.240 53 HG12 VAL 14 HG12 VAL 14 36.944 -5.272 -7.760 54 HG13 VAL 14 HG13 VAL 14 37.785 -6.426 -8.795 55 HG21 VAL 14 HG21 VAL 14 35.217 -8.647 -7.636 56 HG22 VAL 14 HG22 VAL 14 35.851 -7.697 -8.981 57 HG23 VAL 14 HG23 VAL 14 34.807 -6.936 -7.779 58 HA PRO 15 HA PRO 15 41.415 -8.977 -4.883 59 HB2 PRO 15 HB2 PRO 15 42.811 -8.030 -7.351 60 HB3 PRO 15 HB1 PRO 15 43.280 -9.302 -6.207 61 HG2 PRO 15 HG2 PRO 15 42.249 -9.877 -8.600 62 HG3 PRO 15 HG1 PRO 15 41.911 -10.864 -7.169 63 HD2 PRO 15 HD2 PRO 15 40.121 -8.974 -8.608 64 HD3 PRO 15 HD1 PRO 15 39.707 -10.399 -7.629 65 H LEU 16 HN LEU 16 42.376 -7.310 -3.695 66 HA LEU 16 HA LEU 16 41.347 -4.685 -3.813 67 HB2 LEU 16 HB2 LEU 16 44.044 -5.586 -2.767 68 HB3 LEU 16 HB1 LEU 16 43.238 -4.081 -2.361 69 HG LEU 16 HG LEU 16 43.085 -6.364 -0.899 70 HD11 LEU 16 HD11 LEU 16 41.326 -3.955 -1.190 71 HD12 LEU 16 HD12 LEU 16 42.416 -4.391 0.127 72 HD13 LEU 16 HD13 LEU 16 40.868 -5.219 -0.049 73 HD21 LEU 16 HD21 LEU 16 40.649 -6.283 -2.708 74 HD22 LEU 16 HD22 LEU 16 40.683 -7.126 -1.165 75 HD23 LEU 16 HD23 LEU 16 41.759 -7.633 -2.461 76 HA PRO 17 HA PRO 17 43.338 -2.381 -7.012 77 HB2 PRO 17 HB2 PRO 17 44.688 -0.538 -5.262 78 HB3 PRO 17 HB1 PRO 17 43.242 -0.267 -6.242 79 HG2 PRO 17 HG2 PRO 17 43.458 -0.776 -3.397 80 HG3 PRO 17 HG1 PRO 17 42.076 -0.202 -4.335 81 HD2 PRO 17 HD2 PRO 17 42.237 -2.706 -3.179 82 HD3 PRO 17 HD1 PRO 17 41.197 -2.308 -4.560 83 H ALA 18 HN ALA 18 45.831 -0.929 -6.492 84 HA ALA 18 HA ALA 18 47.635 -3.208 -6.932 85 HB1 ALA 18 HB1 ALA 18 47.501 -0.385 -7.663 86 HB2 ALA 18 HB2 ALA 18 48.294 -1.725 -8.492 87 HB3 ALA 18 HB3 ALA 18 49.117 -0.892 -7.173 88 H GLY 19 HN GLY 19 49.268 -3.800 -5.557 89 HA2 GLY 19 HA2 GLY 19 50.623 -3.856 -3.646 90 HA3 GLY 19 HA1 GLY 19 50.440 -2.106 -3.573 91 H TRP 20 HN TRP 20 47.558 -4.063 -3.509 92 HA TRP 20 HA TRP 20 47.189 -3.253 -0.674 93 HB2 TRP 20 HB2 TRP 20 45.273 -3.963 -2.870 94 HB3 TRP 20 HB1 TRP 20 44.777 -3.761 -1.184 95 HD1 TRP 20 HD1 TRP 20 45.977 -1.843 -4.206 96 HE1 TRP 20 HE1 TRP 20 45.766 0.672 -3.736 97 HE3 TRP 20 HE3 TRP 20 44.861 -2.036 0.731 98 HZ2 TRP 20 HZ2 TRP 20 45.201 2.402 -1.479 99 HZ3 TRP 20 HZ3 TRP 20 44.507 0.014 2.037 100 HH2 TRP 20 HH2 TRP 20 44.668 2.249 0.948 101 H GLU 21 HN GLU 21 46.226 -4.728 0.838 102 HA GLU 21 HA GLU 21 45.894 -7.535 0.104 103 HB2 GLU 21 HB2 GLU 21 48.501 -6.816 0.586 104 HB3 GLU 21 HB1 GLU 21 47.970 -7.334 2.186 105 HG2 GLU 21 HG2 GLU 21 47.151 -9.459 1.225 106 HG3 GLU 21 HG1 GLU 21 47.706 -8.946 -0.369 107 H MET 22 HN MET 22 44.200 -8.147 1.379 108 HA MET 22 HA MET 22 43.328 -6.639 3.634 109 HB2 MET 22 HB2 MET 22 42.275 -8.673 2.083 110 HB3 MET 22 HB1 MET 22 42.517 -9.454 3.647 111 HG2 MET 22 HG2 MET 22 41.384 -7.456 4.703 112 HG3 MET 22 HG1 MET 22 40.958 -6.931 3.075 113 HE1 MET 22 HE1 MET 22 37.695 -8.209 4.701 114 HE2 MET 22 HE2 MET 22 38.898 -6.923 4.730 115 HE3 MET 22 HE3 MET 22 39.011 -8.251 5.883 116 H ALA 23 HN ALA 23 43.789 -6.848 5.789 117 HA ALA 23 HA ALA 23 45.269 -9.218 6.745 118 HB1 ALA 23 HB1 ALA 23 47.007 -7.732 7.787 119 HB2 ALA 23 HB2 ALA 23 46.339 -6.390 6.860 120 HB3 ALA 23 HB3 ALA 23 47.070 -7.759 6.026 121 H LYS 24 HN LYS 24 45.620 -8.865 9.262 122 HA LYS 24 HA LYS 24 43.234 -7.395 10.266 123 HB2 LYS 24 HB2 LYS 24 43.275 -10.012 10.340 124 HB3 LYS 24 HB1 LYS 24 44.349 -9.763 11.720 125 HG2 LYS 24 HG2 LYS 24 42.708 -8.563 12.929 126 HG3 LYS 24 HG1 LYS 24 41.727 -8.295 11.492 127 HD2 LYS 24 HD2 LYS 24 40.698 -10.037 12.875 128 HD3 LYS 24 HD1 LYS 24 41.275 -10.736 11.362 129 HE2 LYS 24 HE2 LYS 24 43.389 -10.789 13.322 130 HE3 LYS 24 HE1 LYS 24 41.943 -11.547 13.987 131 HZ1 LYS 24 HZ1 LYS 24 42.844 -12.192 11.257 132 HZ2 LYS 24 HZ2 LYS 24 41.889 -13.116 12.317 133 HZ3 LYS 24 HZ3 LYS 24 43.557 -12.956 12.593 134 H THR 25 HN THR 25 43.408 -6.497 12.383 135 HA THR 25 HA THR 25 45.958 -5.246 12.901 136 HB THR 25 HB THR 25 43.704 -4.269 13.427 137 HG1 THR 25 HG1 THR 25 44.409 -3.734 15.700 138 HG21 THR 25 HG21 THR 25 42.351 -5.143 15.086 139 HG22 THR 25 HG22 THR 25 43.689 -5.969 15.884 140 HG23 THR 25 HG23 THR 25 43.026 -6.611 14.380 141 H SER 26 HN SER 26 46.703 -5.383 15.393 142 HA SER 26 HA SER 26 48.199 -7.469 16.012 143 HB2 SER 26 HB2 SER 26 47.528 -7.362 18.410 144 HB3 SER 26 HB1 SER 26 47.736 -5.763 17.703 145 HG SER 26 HG SER 26 45.436 -7.082 18.544 146 H SER 27 HN SER 27 44.656 -7.661 16.082 147 HA SER 27 HA SER 27 44.291 -10.198 15.160 148 HB2 SER 27 HB2 SER 27 45.387 -10.268 17.930 149 HB3 SER 27 HB1 SER 27 44.109 -11.414 17.535 150 HG SER 27 HG SER 27 45.868 -12.456 16.862 151 H GLY 28 HN GLY 28 42.330 -8.860 14.753 152 HA2 GLY 28 HA2 GLY 28 40.074 -9.654 16.151 153 HA3 GLY 28 HA1 GLY 28 40.600 -8.205 17.002 154 H GLN 29 HN GLN 29 41.535 -6.727 14.709 155 HA GLN 29 HA GLN 29 38.901 -6.215 13.421 156 HB2 GLN 29 HB2 GLN 29 41.185 -4.248 13.559 157 HB3 GLN 29 HB1 GLN 29 39.480 -3.921 13.255 158 HG2 GLN 29 HG2 GLN 29 38.879 -4.227 15.492 159 HG3 GLN 29 HG1 GLN 29 40.306 -5.201 15.847 160 HE21 GLN 29 HE21 GLN 29 39.011 -2.058 16.110 161 HE22 GLN 29 HE22 GLN 29 40.455 -1.232 16.450 162 H ARG 30 HN ARG 30 38.761 -6.733 11.309 163 HA ARG 30 HA ARG 30 41.171 -7.380 9.778 164 HB2 ARG 30 HB2 ARG 30 38.236 -7.665 9.419 165 HB3 ARG 30 HB1 ARG 30 39.180 -7.470 7.943 166 HG2 ARG 30 HG2 ARG 30 39.919 -9.590 8.074 167 HG3 ARG 30 HG1 ARG 30 40.511 -9.324 9.712 168 HD2 ARG 30 HD2 ARG 30 38.894 -11.041 9.942 169 HD3 ARG 30 HD1 ARG 30 38.058 -9.576 10.454 170 HE ARG 30 HE ARG 30 36.775 -9.639 8.420 171 HH11 ARG 30 HH11 ARG 30 35.909 -10.879 6.742 172 HH12 ARG 30 HH12 ARG 30 36.674 -12.369 6.301 173 HH21 ARG 30 HH21 ARG 30 39.175 -12.102 8.686 174 HH22 ARG 30 HH22 ARG 30 38.522 -13.061 7.401 175 H TYR 31 HN TYR 31 42.108 -6.083 8.215 176 HA TYR 31 HA TYR 31 40.643 -3.693 7.324 177 HB2 TYR 31 HB2 TYR 31 42.731 -2.271 7.795 178 HB3 TYR 31 HB1 TYR 31 41.697 -2.665 9.162 179 HD1 TYR 31 HD1 TYR 31 43.443 -2.359 10.820 180 HD2 TYR 31 HD2 TYR 31 43.938 -5.183 7.618 181 HE1 TYR 31 HE1 TYR 31 45.407 -3.333 11.972 182 HE2 TYR 31 HE2 TYR 31 45.894 -6.151 8.786 183 HH TYR 31 HH TYR 31 47.193 -4.703 11.724 184 H PHE 32 HN PHE 32 42.496 -2.411 5.846 185 HA PHE 32 HA PHE 32 43.519 -4.568 4.050 186 HB2 PHE 32 HB2 PHE 32 42.633 -1.788 3.240 187 HB3 PHE 32 HB1 PHE 32 43.052 -3.125 2.167 188 HD1 PHE 32 HD1 PHE 32 40.492 -1.692 4.348 189 HD2 PHE 32 HD2 PHE 32 41.593 -5.124 2.015 190 HE1 PHE 32 HE1 PHE 32 38.152 -2.506 4.442 191 HE2 PHE 32 HE2 PHE 32 39.254 -5.939 2.109 192 HZ PHE 32 HZ PHE 32 37.532 -4.630 3.322 193 H LEU 33 HN LEU 33 45.663 -4.569 3.703 194 HA LEU 33 HA LEU 33 47.300 -2.376 4.799 195 HB2 LEU 33 HB2 LEU 33 48.287 -4.799 3.280 196 HB3 LEU 33 HB1 LEU 33 49.177 -3.811 4.435 197 HG LEU 33 HG LEU 33 46.859 -5.667 5.027 198 HD11 LEU 33 HD11 LEU 33 49.819 -5.655 5.569 199 HD12 LEU 33 HD12 LEU 33 48.807 -6.970 4.970 200 HD13 LEU 33 HD13 LEU 33 48.729 -6.498 6.669 201 HD21 LEU 33 HD21 LEU 33 46.387 -4.086 6.611 202 HD22 LEU 33 HD22 LEU 33 47.992 -3.364 6.506 203 HD23 LEU 33 HD23 LEU 33 47.747 -4.829 7.453 204 H ASN 34 HN ASN 34 47.976 -0.693 3.567 205 HA ASN 34 HA ASN 34 47.731 -0.938 0.610 206 HB2 ASN 34 HB2 ASN 34 46.725 1.011 2.011 207 HB3 ASN 34 HB1 ASN 34 48.386 1.598 2.097 208 HD21 ASN 34 HD21 ASN 34 46.863 3.333 0.751 209 HD22 ASN 34 HD22 ASN 34 47.026 3.182 -0.933 210 H HIS 35 HN HIS 35 49.609 -1.688 -0.282 211 HA HIS 35 HA HIS 35 52.199 -1.196 0.970 212 HB2 HIS 35 HB2 HIS 35 51.439 -2.416 -1.701 213 HB3 HIS 35 HB1 HIS 35 53.088 -2.332 -1.088 214 HD1 HIS 35 HD1 HIS 35 53.213 -4.946 -0.919 215 HD2 HIS 35 HD2 HIS 35 50.256 -3.220 1.465 216 HE1 HIS 35 HE1 HIS 35 52.450 -6.745 0.695 217 HE2 HIS 35 HE2 HIS 35 50.651 -5.706 2.150 218 H ILE 36 HN ILE 36 50.139 0.507 -1.098 219 HA ILE 36 HA ILE 36 52.249 1.972 -2.519 220 HB ILE 36 HB ILE 36 49.403 2.901 -2.364 221 HG12 ILE 36 HG12 ILE 36 49.855 0.249 -2.781 222 HG13 ILE 36 HG11 ILE 36 48.522 1.134 -3.505 223 HG21 ILE 36 HG21 ILE 36 50.869 4.231 -3.712 224 HG22 ILE 36 HG22 ILE 36 49.909 3.269 -4.836 225 HG23 ILE 36 HG23 ILE 36 51.571 2.803 -4.475 226 HD11 ILE 36 HD11 ILE 36 51.222 0.982 -4.845 227 HD12 ILE 36 HD12 ILE 36 49.667 1.403 -5.563 228 HD13 ILE 36 HD13 ILE 36 49.998 -0.263 -5.092 229 H ASP 37 HN ASP 37 49.725 2.707 -0.132 230 HA ASP 37 HA ASP 37 51.112 5.208 0.560 231 HB2 ASP 37 HB2 ASP 37 48.487 3.998 1.437 232 HB3 ASP 37 HB1 ASP 37 49.149 5.454 2.182 233 H GLN 38 HN GLN 38 51.533 2.138 1.264 234 HA GLN 38 HA GLN 38 52.420 0.925 3.073 235 HB2 GLN 38 HB2 GLN 38 53.768 3.584 3.000 236 HB3 GLN 38 HB1 GLN 38 54.094 2.535 4.380 237 HG2 GLN 38 HG2 GLN 38 54.936 0.798 3.001 238 HG3 GLN 38 HG1 GLN 38 54.254 1.517 1.543 239 HE21 GLN 38 HE21 GLN 38 55.898 2.394 0.285 240 HE22 GLN 38 HE22 GLN 38 57.255 3.218 0.886 241 H THR 39 HN THR 39 50.126 1.040 4.007 242 HA THR 39 HA THR 39 50.265 1.627 6.790 243 HB THR 39 HB THR 39 49.930 3.867 6.471 244 HG1 THR 39 HG1 THR 39 47.981 4.177 7.246 245 HG21 THR 39 HG21 THR 39 49.584 4.651 4.395 246 HG22 THR 39 HG22 THR 39 47.893 4.177 4.530 247 HG23 THR 39 HG23 THR 39 49.073 3.049 3.865 248 H THR 40 HN THR 40 47.727 1.864 7.504 249 HA THR 40 HA THR 40 46.336 -0.377 6.101 250 HB THR 40 HB THR 40 45.305 -0.816 8.419 251 HG1 THR 40 HG1 THR 40 46.798 1.319 8.929 252 HG21 THR 40 HG21 THR 40 47.833 -1.642 9.129 253 HG22 THR 40 HG22 THR 40 47.971 -1.450 7.381 254 HG23 THR 40 HG23 THR 40 46.740 -2.518 8.058 255 H THR 41 HN THR 41 44.025 -0.179 5.966 256 HA THR 41 HA THR 41 42.836 2.352 6.925 257 HB THR 41 HB THR 41 43.109 3.212 4.865 258 HG1 THR 41 HG1 THR 41 41.350 2.856 3.634 259 HG21 THR 41 HG21 THR 41 43.527 1.784 2.839 260 HG22 THR 41 HG22 THR 41 43.406 0.371 3.888 261 HG23 THR 41 HG23 THR 41 44.696 1.549 4.139 262 H TRP 42 HN TRP 42 40.604 2.261 7.205 263 HA TRP 42 HA TRP 42 39.467 -0.456 7.322 264 HB2 TRP 42 HB2 TRP 42 38.025 2.119 7.986 265 HB3 TRP 42 HB1 TRP 42 37.685 0.500 8.586 266 HD1 TRP 42 HD1 TRP 42 39.436 3.600 9.481 267 HE1 TRP 42 HE1 TRP 42 40.938 3.239 11.543 268 HE3 TRP 42 HE3 TRP 42 39.424 -1.502 9.687 269 HZ2 TRP 42 HZ2 TRP 42 41.996 1.062 13.079 270 HZ3 TRP 42 HZ3 TRP 42 40.685 -2.693 11.456 271 HH2 TRP 42 HH2 TRP 42 41.972 -1.418 13.150 272 H GLN 43 HN GLN 43 39.782 1.986 5.082 273 HA GLN 43 HA GLN 43 37.119 1.827 3.889 274 HB2 GLN 43 HB2 GLN 43 38.585 3.842 3.688 275 HB3 GLN 43 HB1 GLN 43 39.687 2.895 2.686 276 HG2 GLN 43 HG2 GLN 43 37.363 2.387 1.402 277 HG3 GLN 43 HG1 GLN 43 37.005 3.995 2.032 278 HE21 GLN 43 HE21 GLN 43 38.047 5.786 1.045 279 HE22 GLN 43 HE22 GLN 43 39.172 5.636 -0.218 280 H ASP 44 HN ASP 44 36.545 0.683 2.014 281 HA ASP 44 HA ASP 44 38.516 -1.363 1.131 282 HB2 ASP 44 HB2 ASP 44 35.534 -1.703 0.900 283 HB3 ASP 44 HB1 ASP 44 36.785 -2.946 0.923 284 HA PRO 45 HA PRO 45 38.050 0.975 -2.687 285 HB2 PRO 45 HB2 PRO 45 39.461 -0.903 -4.220 286 HB3 PRO 45 HB1 PRO 45 40.159 0.502 -3.398 287 HG2 PRO 45 HG2 PRO 45 40.185 -2.338 -2.623 288 HG3 PRO 45 HG1 PRO 45 41.337 -1.047 -2.250 289 HD2 PRO 45 HD2 PRO 45 39.544 -2.069 -0.436 290 HD3 PRO 45 HD1 PRO 45 40.221 -0.428 -0.337 291 H ARG 46 HN ARG 46 36.776 -1.994 -1.819 292 HA ARG 46 HA ARG 46 35.577 -2.604 -4.435 293 HB2 ARG 46 HB2 ARG 46 35.924 -3.977 -1.856 294 HB3 ARG 46 HB1 ARG 46 34.349 -4.251 -2.601 295 HG2 ARG 46 HG2 ARG 46 35.275 -5.234 -4.513 296 HG3 ARG 46 HG1 ARG 46 36.846 -4.472 -4.262 297 HD2 ARG 46 HD2 ARG 46 35.647 -6.806 -2.765 298 HD3 ARG 46 HD1 ARG 46 37.168 -6.748 -3.657 299 HE ARG 46 HE ARG 46 37.402 -4.828 -1.622 300 HH11 ARG 46 HH11 ARG 46 38.391 -5.346 0.342 301 HH12 ARG 46 HH12 ARG 46 38.468 -7.000 0.847 302 HH21 ARG 46 HH21 ARG 46 36.824 -8.211 -1.955 303 HH22 ARG 46 HH22 ARG 46 37.581 -8.622 -0.452 304 H LYS 47 HN LYS 47 34.990 -0.114 -2.874 305 HA LYS 47 HA LYS 47 32.048 -0.308 -3.071 306 HB2 LYS 47 HB2 LYS 47 31.589 0.412 -0.893 307 HB3 LYS 47 HB1 LYS 47 32.947 -0.682 -0.633 308 HG2 LYS 47 HG2 LYS 47 34.409 1.459 -0.986 309 HG3 LYS 47 HG1 LYS 47 32.917 2.324 -0.614 310 HD2 LYS 47 HD2 LYS 47 32.824 0.613 1.412 311 HD3 LYS 47 HD1 LYS 47 34.566 0.549 1.143 312 HE2 LYS 47 HE2 LYS 47 34.338 3.182 1.085 313 HE3 LYS 47 HE1 LYS 47 32.867 2.863 2.004 314 HZ1 LYS 47 HZ1 LYS 47 34.501 3.074 3.617 315 HZ2 LYS 47 HZ2 LYS 47 35.660 2.223 2.711 316 HZ3 LYS 47 HZ3 LYS 47 34.364 1.394 3.433 317 H ALA 48 HN ALA 48 31.148 1.603 -3.825 318 HA ALA 48 HA ALA 48 33.079 3.808 -4.375 319 HB1 ALA 48 HB1 ALA 48 32.180 3.364 -6.443 320 HB2 ALA 48 HB2 ALA 48 30.937 4.474 -5.865 321 HB3 ALA 48 HB3 ALA 48 30.677 2.733 -5.769 322 H MET 49 HN MET 49 31.738 6.025 -4.532 323 HA MET 49 HA MET 49 30.799 7.716 -3.195 324 HB2 MET 49 HB2 MET 49 28.750 6.614 -4.028 325 HB3 MET 49 HB1 MET 49 28.799 5.494 -2.667 326 HG2 MET 49 HG2 MET 49 28.212 7.127 -1.124 327 HG3 MET 49 HG1 MET 49 28.857 8.439 -2.110 328 HE1 MET 49 HE1 MET 49 25.021 6.222 -2.061 329 HE2 MET 49 HE2 MET 49 26.657 5.596 -1.881 330 HE3 MET 49 HE3 MET 49 25.903 5.623 -3.473 331 H GLY 50 HN GLY 50 29.453 5.316 -1.041 332 HA2 GLY 50 HA2 GLY 50 30.060 4.690 1.150 333 HA3 GLY 50 HA1 GLY 50 31.662 5.365 0.849 334 H GLY 51 HN GLY 51 31.563 6.353 2.988 335 HA2 GLY 51 HA2 GLY 51 31.480 8.699 3.777 336 HA3 GLY 51 HA1 GLY 51 29.909 8.844 2.985 337 H GLY 52 HN GLY 52 28.066 8.056 4.048 338 HA2 GLY 52 HA2 GLY 52 28.055 8.014 6.874 339 HA3 GLY 52 HA1 GLY 52 26.766 7.347 5.870 340 H GLY 53 HN GLY 53 28.536 6.435 8.346 341 HA2 GLY 53 HA2 GLY 53 28.143 3.682 8.135 342 HA3 GLY 53 HA1 GLY 53 29.744 3.961 7.451 343 H ASN 54 HN ASN 54 31.127 3.260 9.037 344 HA ASN 54 HA ASN 54 31.370 4.823 11.464 345 HB2 ASN 54 HB2 ASN 54 29.648 3.531 12.415 346 HB3 ASN 54 HB1 ASN 54 30.161 2.066 11.579 347 HD21 ASN 54 HD21 ASN 54 32.448 1.259 12.266 348 HD22 ASN 54 HD22 ASN 54 32.853 1.419 13.906 349 H TYR 55 HN TYR 55 33.418 4.507 12.405 350 HA TYR 55 HA TYR 55 35.104 2.369 11.168 351 HB2 TYR 55 HB2 TYR 55 36.874 4.414 11.764 352 HB3 TYR 55 HB1 TYR 55 36.241 4.051 10.158 353 HD1 TYR 55 HD1 TYR 55 35.146 5.811 13.293 354 HD2 TYR 55 HD2 TYR 55 35.219 5.790 8.998 355 HE1 TYR 55 HE1 TYR 55 33.966 7.992 13.263 356 HE2 TYR 55 HE2 TYR 55 34.039 7.971 8.968 357 HH TYR 55 HH TYR 55 32.498 9.264 11.663 358 H GLN 56 HN GLN 56 36.441 1.288 12.606 359 HA GLN 56 HA GLN 56 35.882 1.550 15.423 360 HB2 GLN 56 HB2 GLN 56 38.356 0.132 14.841 361 HB3 GLN 56 HB1 GLN 56 36.854 -0.489 15.525 362 HG2 GLN 56 HG2 GLN 56 37.482 -0.088 12.587 363 HG3 GLN 56 HG1 GLN 56 37.252 -1.626 13.421 364 HE21 GLN 56 HE21 GLN 56 34.997 -1.891 14.480 365 HE22 GLN 56 HE22 GLN 56 33.671 -1.224 13.656 366 H GLY 57 HN GLY 57 37.132 3.830 13.870 367 HA2 GLY 57 HA2 GLY 57 38.332 5.623 15.061 368 HA3 GLY 57 HA1 GLY 57 39.312 4.376 15.836 369 HA PRO 58 HA PRO 58 41.545 6.060 12.071 370 HB2 PRO 58 HB2 PRO 58 43.880 6.631 13.413 371 HB3 PRO 58 HB1 PRO 58 42.561 7.793 13.183 372 HG2 PRO 58 HG2 PRO 58 43.261 6.173 15.570 373 HG3 PRO 58 HG1 PRO 58 42.628 7.823 15.468 374 HD2 PRO 58 HD2 PRO 58 41.072 5.656 16.112 375 HD3 PRO 58 HD1 PRO 58 40.434 7.116 15.324 376 HA PRO 59 HA PRO 59 43.431 2.006 11.824 377 HB2 PRO 59 HB2 PRO 59 44.211 2.154 9.225 378 HB3 PRO 59 HB1 PRO 59 42.522 1.906 9.707 379 HG2 PRO 59 HG2 PRO 59 43.881 4.381 8.779 380 HG3 PRO 59 HG1 PRO 59 42.243 3.797 8.444 381 HD2 PRO 59 HD2 PRO 59 42.833 5.753 10.308 382 HD3 PRO 59 HD1 PRO 59 41.381 4.729 10.361 383 HA PRO 60 HA PRO 60 47.687 3.418 12.441 384 HB2 PRO 60 HB2 PRO 60 48.509 1.262 13.863 385 HB3 PRO 60 HB1 PRO 60 47.487 2.527 14.573 386 HG2 PRO 60 HG2 PRO 60 46.755 -0.187 13.627 387 HG3 PRO 60 HG1 PRO 60 46.119 0.747 14.990 388 HD2 PRO 60 HD2 PRO 60 44.866 0.482 12.505 389 HD3 PRO 60 HD1 PRO 60 44.515 1.750 13.699 390 HA PRO 61 HA PRO 61 49.395 1.555 8.742 391 HB2 PRO 61 HB2 PRO 61 51.906 2.042 10.310 392 HB3 PRO 61 HB1 PRO 61 51.560 2.391 8.604 393 HG2 PRO 61 HG2 PRO 61 51.510 4.301 10.462 394 HG3 PRO 61 HG1 PRO 61 50.393 4.297 9.087 395 HD2 PRO 61 HD2 PRO 61 49.825 3.768 11.949 396 HD3 PRO 61 HD1 PRO 61 48.716 4.271 10.655 397 H TYR 62 HN TYR 62 49.711 -0.567 8.279 398 HA TYR 62 HA TYR 62 49.562 -2.713 9.940 399 HB2 TYR 62 HB2 TYR 62 51.221 -3.860 8.297 400 HB3 TYR 62 HB1 TYR 62 49.734 -3.188 7.634 401 HD1 TYR 62 HD1 TYR 62 49.919 -1.862 5.746 402 HD2 TYR 62 HD2 TYR 62 53.200 -2.043 8.508 403 HE1 TYR 62 HE1 TYR 62 51.238 -0.371 4.280 404 HE2 TYR 62 HE2 TYR 62 54.519 -0.548 7.046 405 HH TYR 62 HH TYR 62 54.585 0.100 4.672 406 HA PRO 63 HA PRO 63 52.867 -3.089 12.813 407 HB2 PRO 63 HB2 PRO 63 53.929 -5.586 11.967 408 HB3 PRO 63 HB1 PRO 63 52.708 -5.319 13.224 409 HG2 PRO 63 HG2 PRO 63 52.365 -6.105 10.390 410 HG3 PRO 63 HG1 PRO 63 51.384 -6.514 11.808 411 HD2 PRO 63 HD2 PRO 63 50.514 -4.731 9.994 412 HD3 PRO 63 HD1 PRO 63 50.189 -4.504 11.728 413 H LYS 64 HN LYS 64 55.095 -2.632 12.945 414 HA LYS 64 HA LYS 64 56.429 -2.135 10.342 415 HB2 LYS 64 HB2 LYS 64 57.361 -1.367 13.122 416 HB3 LYS 64 HB1 LYS 64 57.960 -0.736 11.587 417 HG2 LYS 64 HG2 LYS 64 55.494 -0.020 11.174 418 HG3 LYS 64 HG1 LYS 64 55.302 -0.240 12.914 419 HD2 LYS 64 HD2 LYS 64 57.472 1.477 11.682 420 HD3 LYS 64 HD1 LYS 64 55.918 2.114 12.222 421 HE2 LYS 64 HE2 LYS 64 57.883 0.604 13.970 422 HE3 LYS 64 HE1 LYS 64 57.661 2.353 13.970 423 HZ1 LYS 64 HZ1 LYS 64 56.386 1.326 15.734 424 HZ2 LYS 64 HZ2 LYS 64 55.581 0.332 14.616 425 HZ3 LYS 64 HZ3 LYS 64 55.342 2.014 14.587 426 H HIS 65 HN HIS 65 57.344 -4.056 9.658 427 HA HIS 65 HA HIS 65 58.562 -5.946 11.494 428 HB2 HIS 65 HB2 HIS 65 58.279 -5.687 8.532 429 HB3 HIS 65 HB1 HIS 65 59.564 -6.732 9.141 430 HD1 HIS 65 HD1 HIS 65 57.711 -7.417 11.780 431 HD2 HIS 65 HD2 HIS 65 56.780 -8.041 7.762 432 HE1 HIS 65 HE1 HIS 65 55.949 -9.238 11.726 433 HE2 HIS 65 HE2 HIS 65 55.377 -9.627 9.285 Start of MODEL 15 1 H1 SER 7 HT1 SER 7 27.740 -7.349 -19.296 2 H2 SER 7 HT2 SER 7 27.611 -5.782 -18.651 3 H3 SER 7 HT3 SER 7 27.560 -7.135 -17.624 4 HA SER 7 HA SER 7 29.931 -6.874 -19.292 5 HB2 SER 7 HB2 SER 7 30.902 -5.107 -18.087 6 HB3 SER 7 HB1 SER 7 29.249 -4.545 -18.322 7 HG SER 7 HG SER 7 28.892 -5.691 -16.208 8 H PHE 8 HN PHE 8 28.717 -9.111 -18.105 9 HA PHE 8 HA PHE 8 29.177 -10.868 -16.618 10 HB2 PHE 8 HB2 PHE 8 31.779 -9.478 -17.053 11 HB3 PHE 8 HB1 PHE 8 31.697 -10.637 -15.728 12 HD1 PHE 8 HD1 PHE 8 29.831 -10.709 -18.955 13 HD2 PHE 8 HD2 PHE 8 32.922 -12.489 -16.563 14 HE1 PHE 8 HE1 PHE 8 30.009 -12.578 -20.576 15 HE2 PHE 8 HE2 PHE 8 33.100 -14.358 -18.184 16 HZ PHE 8 HZ PHE 8 31.643 -14.402 -20.190 17 H GLU 9 HN GLU 9 28.033 -10.703 -14.738 18 HA GLU 9 HA GLU 9 27.957 -8.569 -12.938 19 HB2 GLU 9 HB2 GLU 9 27.713 -11.532 -12.329 20 HB3 GLU 9 HB1 GLU 9 27.223 -10.239 -11.233 21 HG2 GLU 9 HG2 GLU 9 25.206 -10.658 -12.298 22 HG3 GLU 9 HG1 GLU 9 25.864 -9.407 -13.353 23 H ILE 10 HN ILE 10 29.352 -7.779 -11.414 24 HA ILE 10 HA ILE 10 32.070 -8.490 -11.325 25 HB ILE 10 HB ILE 10 30.532 -7.361 -8.974 26 HG12 ILE 10 HG12 ILE 10 31.434 -6.069 -11.557 27 HG13 ILE 10 HG11 ILE 10 29.825 -6.043 -10.834 28 HG21 ILE 10 HG21 ILE 10 32.567 -6.615 -8.206 29 HG22 ILE 10 HG22 ILE 10 33.224 -6.416 -9.831 30 HG23 ILE 10 HG23 ILE 10 33.138 -8.021 -9.106 31 HD11 ILE 10 HD11 ILE 10 32.237 -4.437 -10.151 32 HD12 ILE 10 HD12 ILE 10 31.216 -4.948 -8.806 33 HD13 ILE 10 HD13 ILE 10 30.533 -3.980 -10.113 34 HA PRO 11 HA PRO 11 31.550 -12.352 -9.070 35 HB2 PRO 11 HB2 PRO 11 34.103 -13.233 -9.395 36 HB3 PRO 11 HB1 PRO 11 32.892 -13.308 -10.689 37 HG2 PRO 11 HG2 PRO 11 35.130 -11.400 -10.301 38 HG3 PRO 11 HG1 PRO 11 34.466 -12.077 -11.795 39 HD2 PRO 11 HD2 PRO 11 33.907 -9.528 -10.836 40 HD3 PRO 11 HD1 PRO 11 32.887 -10.421 -11.986 41 H ASP 12 HN ASP 12 31.988 -12.945 -6.934 42 HA ASP 12 HA ASP 12 33.094 -11.002 -5.171 43 HB2 ASP 12 HB2 ASP 12 31.855 -13.603 -4.940 44 HB3 ASP 12 HB1 ASP 12 33.244 -13.491 -3.859 45 H ASP 13 HN ASP 13 34.659 -12.691 -7.364 46 HA ASP 13 HA ASP 13 37.048 -13.316 -5.733 47 HB2 ASP 13 HB2 ASP 13 36.442 -13.796 -8.665 48 HB3 ASP 13 HB1 ASP 13 37.936 -14.279 -7.859 49 H VAL 14 HN VAL 14 36.203 -10.548 -6.148 50 HA VAL 14 HA VAL 14 38.200 -9.480 -8.040 51 HB VAL 14 HB VAL 14 35.965 -8.252 -6.430 52 HG11 VAL 14 HG11 VAL 14 37.470 -6.509 -6.196 53 HG12 VAL 14 HG12 VAL 14 36.831 -6.134 -7.797 54 HG13 VAL 14 HG13 VAL 14 38.379 -6.962 -7.637 55 HG21 VAL 14 HG21 VAL 14 35.380 -9.284 -8.577 56 HG22 VAL 14 HG22 VAL 14 36.646 -8.361 -9.387 57 HG23 VAL 14 HG23 VAL 14 35.248 -7.530 -8.704 58 HA PRO 15 HA PRO 15 40.890 -9.266 -4.412 59 HB2 PRO 15 HB2 PRO 15 43.168 -8.658 -5.810 60 HB3 PRO 15 HB1 PRO 15 42.540 -10.306 -5.621 61 HG2 PRO 15 HG2 PRO 15 42.355 -8.462 -7.937 62 HG3 PRO 15 HG1 PRO 15 42.534 -10.223 -7.901 63 HD2 PRO 15 HD2 PRO 15 40.152 -8.931 -8.408 64 HD3 PRO 15 HD1 PRO 15 40.266 -10.581 -7.758 65 H LEU 16 HN LEU 16 42.420 -7.523 -3.562 66 HA LEU 16 HA LEU 16 41.174 -4.946 -3.686 67 HB2 LEU 16 HB2 LEU 16 43.984 -5.644 -2.792 68 HB3 LEU 16 HB1 LEU 16 43.094 -4.189 -2.376 69 HG LEU 16 HG LEU 16 43.212 -6.478 -0.866 70 HD11 LEU 16 HD11 LEU 16 42.597 -4.553 0.248 71 HD12 LEU 16 HD12 LEU 16 41.036 -5.369 0.169 72 HD13 LEU 16 HD13 LEU 16 41.420 -4.090 -0.980 73 HD21 LEU 16 HD21 LEU 16 40.618 -6.478 -2.438 74 HD22 LEU 16 HD22 LEU 16 40.793 -7.271 -0.879 75 HD23 LEU 16 HD23 LEU 16 41.763 -7.806 -2.245 76 HA PRO 17 HA PRO 17 43.133 -2.885 -7.091 77 HB2 PRO 17 HB2 PRO 17 44.303 -0.793 -5.392 78 HB3 PRO 17 HB1 PRO 17 43.073 -0.659 -6.658 79 HG2 PRO 17 HG2 PRO 17 42.512 -0.388 -4.040 80 HG3 PRO 17 HG1 PRO 17 41.354 -1.024 -5.220 81 HD2 PRO 17 HD2 PRO 17 42.950 -2.486 -3.168 82 HD3 PRO 17 HD1 PRO 17 41.327 -2.842 -3.799 83 H ALA 18 HN ALA 18 45.506 -1.161 -6.666 84 HA ALA 18 HA ALA 18 47.490 -3.312 -6.960 85 HB1 ALA 18 HB1 ALA 18 48.888 -1.575 -7.898 86 HB2 ALA 18 HB2 ALA 18 47.783 -0.327 -7.318 87 HB3 ALA 18 HB3 ALA 18 47.271 -1.437 -8.590 88 H GLY 19 HN GLY 19 49.155 -3.687 -5.550 89 HA2 GLY 19 HA2 GLY 19 50.503 -3.512 -3.643 90 HA3 GLY 19 HA1 GLY 19 50.170 -1.782 -3.670 91 H TRP 20 HN TRP 20 47.491 -4.010 -3.487 92 HA TRP 20 HA TRP 20 47.031 -3.064 -0.706 93 HB2 TRP 20 HB2 TRP 20 45.180 -4.057 -2.848 94 HB3 TRP 20 HB1 TRP 20 44.668 -3.805 -1.176 95 HD1 TRP 20 HD1 TRP 20 45.640 -1.978 -4.316 96 HE1 TRP 20 HE1 TRP 20 45.253 0.536 -3.991 97 HE3 TRP 20 HE3 TRP 20 44.669 -1.948 0.657 98 HZ2 TRP 20 HZ2 TRP 20 44.604 2.355 -1.829 99 HZ3 TRP 20 HZ3 TRP 20 44.182 0.148 1.844 100 HH2 TRP 20 HH2 TRP 20 44.141 2.314 0.616 101 H GLU 21 HN GLU 21 46.164 -4.536 0.877 102 HA GLU 21 HA GLU 21 46.094 -7.397 0.312 103 HB2 GLU 21 HB2 GLU 21 48.588 -6.810 0.518 104 HB3 GLU 21 HB1 GLU 21 48.255 -6.480 2.219 105 HG2 GLU 21 HG2 GLU 21 47.729 -8.708 2.688 106 HG3 GLU 21 HG1 GLU 21 47.352 -9.077 1.005 107 H MET 22 HN MET 22 44.364 -7.975 1.564 108 HA MET 22 HA MET 22 43.475 -6.375 3.773 109 HB2 MET 22 HB2 MET 22 41.645 -7.525 3.101 110 HB3 MET 22 HB1 MET 22 42.615 -8.819 2.398 111 HG2 MET 22 HG2 MET 22 42.924 -9.856 4.544 112 HG3 MET 22 HG1 MET 22 42.199 -8.478 5.372 113 HE1 MET 22 HE1 MET 22 39.183 -10.213 6.232 114 HE2 MET 22 HE2 MET 22 39.526 -8.499 6.009 115 HE3 MET 22 HE3 MET 22 40.770 -9.561 6.663 116 H ALA 23 HN ALA 23 43.798 -6.661 5.982 117 HA ALA 23 HA ALA 23 45.312 -9.046 6.868 118 HB1 ALA 23 HB1 ALA 23 46.293 -6.229 6.925 119 HB2 ALA 23 HB2 ALA 23 47.201 -7.724 6.706 120 HB3 ALA 23 HB3 ALA 23 46.651 -7.251 8.314 121 H LYS 24 HN LYS 24 44.676 -9.671 8.924 122 HA LYS 24 HA LYS 24 42.697 -7.870 10.203 123 HB2 LYS 24 HB2 LYS 24 41.838 -10.109 9.611 124 HB3 LYS 24 HB1 LYS 24 43.092 -10.842 10.616 125 HG2 LYS 24 HG2 LYS 24 42.216 -9.543 12.568 126 HG3 LYS 24 HG1 LYS 24 40.899 -8.973 11.547 127 HD2 LYS 24 HD2 LYS 24 41.496 -11.893 12.106 128 HD3 LYS 24 HD1 LYS 24 40.244 -10.952 12.918 129 HE2 LYS 24 HE2 LYS 24 38.974 -11.865 11.220 130 HE3 LYS 24 HE1 LYS 24 39.541 -10.410 10.399 131 HZ1 LYS 24 HZ1 LYS 24 41.323 -12.691 10.265 132 HZ2 LYS 24 HZ2 LYS 24 40.881 -11.580 9.057 133 HZ3 LYS 24 HZ3 LYS 24 39.854 -12.879 9.440 134 H THR 25 HN THR 25 42.672 -7.731 12.474 135 HA THR 25 HA THR 25 45.215 -7.165 13.624 136 HB THR 25 HB THR 25 43.653 -7.241 15.758 137 HG1 THR 25 HG1 THR 25 41.896 -8.227 15.019 138 HG21 THR 25 HG21 THR 25 43.017 -4.981 15.288 139 HG22 THR 25 HG22 THR 25 43.053 -5.276 13.549 140 HG23 THR 25 HG23 THR 25 44.558 -5.241 14.469 141 H SER 26 HN SER 26 45.677 -8.231 15.936 142 HA SER 26 HA SER 26 46.780 -10.696 15.738 143 HB2 SER 26 HB2 SER 26 46.991 -9.774 17.876 144 HB3 SER 26 HB1 SER 26 45.265 -9.455 18.018 145 HG SER 26 HG SER 26 45.045 -11.819 17.999 146 H SER 27 HN SER 27 43.357 -10.032 15.730 147 HA SER 27 HA SER 27 42.385 -12.160 14.385 148 HB2 SER 27 HB2 SER 27 43.260 -13.050 17.100 149 HB3 SER 27 HB1 SER 27 41.779 -13.737 16.440 150 HG SER 27 HG SER 27 43.924 -13.587 14.700 151 H GLY 28 HN GLY 28 40.975 -10.159 14.365 152 HA2 GLY 28 HA2 GLY 28 38.487 -10.613 15.593 153 HA3 GLY 28 HA1 GLY 28 39.358 -9.512 16.660 154 H GLN 29 HN GLN 29 40.740 -7.971 14.735 155 HA GLN 29 HA GLN 29 38.428 -6.613 13.432 156 HB2 GLN 29 HB2 GLN 29 41.070 -5.516 14.423 157 HB3 GLN 29 HB1 GLN 29 39.916 -4.577 13.478 158 HG2 GLN 29 HG2 GLN 29 38.203 -5.382 15.307 159 HG3 GLN 29 HG1 GLN 29 39.655 -5.632 16.276 160 HE21 GLN 29 HE21 GLN 29 38.576 -3.772 17.580 161 HE22 GLN 29 HE22 GLN 29 38.945 -2.185 17.103 162 H ARG 30 HN ARG 30 38.364 -6.935 11.274 163 HA ARG 30 HA ARG 30 40.825 -7.683 9.835 164 HB2 ARG 30 HB2 ARG 30 39.455 -8.575 8.210 165 HB3 ARG 30 HB1 ARG 30 38.346 -8.652 9.578 166 HG2 ARG 30 HG2 ARG 30 37.517 -6.354 8.911 167 HG3 ARG 30 HG1 ARG 30 38.471 -6.514 7.437 168 HD2 ARG 30 HD2 ARG 30 36.907 -7.828 6.489 169 HD3 ARG 30 HD1 ARG 30 36.892 -8.903 7.888 170 HE ARG 30 HE ARG 30 34.883 -7.862 8.515 171 HH11 ARG 30 HH11 ARG 30 33.374 -6.179 8.529 172 HH12 ARG 30 HH12 ARG 30 33.740 -4.698 7.709 173 HH21 ARG 30 HH21 ARG 30 36.860 -5.758 6.630 174 HH22 ARG 30 HH22 ARG 30 35.713 -4.461 6.633 175 H TYR 31 HN TYR 31 41.896 -6.290 8.420 176 HA TYR 31 HA TYR 31 40.444 -3.834 7.626 177 HB2 TYR 31 HB2 TYR 31 42.539 -2.468 8.171 178 HB3 TYR 31 HB1 TYR 31 41.534 -2.957 9.529 179 HD1 TYR 31 HD1 TYR 31 42.206 -5.055 10.847 180 HD2 TYR 31 HD2 TYR 31 44.802 -3.101 8.040 181 HE1 TYR 31 HE1 TYR 31 44.168 -6.149 11.886 182 HE2 TYR 31 HE2 TYR 31 46.762 -4.208 9.082 183 HH TYR 31 HH TYR 31 46.523 -5.918 12.077 184 H PHE 32 HN PHE 32 42.220 -2.490 6.178 185 HA PHE 32 HA PHE 32 43.333 -4.548 4.321 186 HB2 PHE 32 HB2 PHE 32 42.108 -1.883 3.577 187 HB3 PHE 32 HB1 PHE 32 42.702 -3.110 2.456 188 HD1 PHE 32 HD1 PHE 32 39.974 -2.108 4.661 189 HD2 PHE 32 HD2 PHE 32 41.562 -5.323 2.298 190 HE1 PHE 32 HE1 PHE 32 37.781 -3.262 4.759 191 HE2 PHE 32 HE2 PHE 32 39.369 -6.477 2.392 192 HZ PHE 32 HZ PHE 32 37.478 -5.446 3.623 193 H LEU 33 HN LEU 33 45.422 -4.317 3.744 194 HA LEU 33 HA LEU 33 46.904 -1.987 4.824 195 HB2 LEU 33 HB2 LEU 33 48.146 -4.296 3.338 196 HB3 LEU 33 HB1 LEU 33 48.852 -3.286 4.599 197 HG LEU 33 HG LEU 33 46.537 -5.188 5.053 198 HD11 LEU 33 HD11 LEU 33 48.701 -6.130 6.482 199 HD12 LEU 33 HD12 LEU 33 49.445 -5.606 4.972 200 HD13 LEU 33 HD13 LEU 33 48.140 -6.791 4.947 201 HD21 LEU 33 HD21 LEU 33 46.360 -4.130 7.023 202 HD22 LEU 33 HD22 LEU 33 47.647 -3.030 6.548 203 HD23 LEU 33 HD23 LEU 33 48.038 -4.528 7.388 204 H ASN 34 HN ASN 34 47.882 -0.456 3.518 205 HA ASN 34 HA ASN 34 47.427 -0.764 0.577 206 HB2 ASN 34 HB2 ASN 34 46.278 1.146 1.929 207 HB3 ASN 34 HB1 ASN 34 47.883 1.877 1.940 208 HD21 ASN 34 HD21 ASN 34 46.314 3.467 0.565 209 HD22 ASN 34 HD22 ASN 34 46.392 3.230 -1.114 210 H HIS 35 HN HIS 35 49.335 -1.314 -0.375 211 HA HIS 35 HA HIS 35 51.898 -0.603 0.826 212 HB2 HIS 35 HB2 HIS 35 51.480 -1.638 -1.983 213 HB3 HIS 35 HB1 HIS 35 52.888 -1.847 -0.946 214 HD1 HIS 35 HD1 HIS 35 51.834 -4.428 -1.924 215 HD2 HIS 35 HD2 HIS 35 50.209 -2.588 1.449 216 HE1 HIS 35 HE1 HIS 35 50.671 -6.251 -0.602 217 HE2 HIS 35 HE2 HIS 35 49.679 -5.143 1.452 218 H ILE 36 HN ILE 36 49.641 0.907 -1.191 219 HA ILE 36 HA ILE 36 51.568 2.613 -2.605 220 HB ILE 36 HB ILE 36 48.644 3.240 -2.414 221 HG12 ILE 36 HG12 ILE 36 49.367 0.649 -2.881 222 HG13 ILE 36 HG11 ILE 36 47.930 1.401 -3.553 223 HG21 ILE 36 HG21 ILE 36 50.772 3.366 -4.565 224 HG22 ILE 36 HG22 ILE 36 49.985 4.719 -3.754 225 HG23 ILE 36 HG23 ILE 36 49.070 3.709 -4.872 226 HD11 ILE 36 HD11 ILE 36 49.457 0.203 -5.221 227 HD12 ILE 36 HD12 ILE 36 50.607 1.512 -4.951 228 HD13 ILE 36 HD13 ILE 36 49.016 1.861 -5.626 229 H ASP 37 HN ASP 37 48.982 3.041 -0.210 230 HA ASP 37 HA ASP 37 50.039 5.675 0.526 231 HB2 ASP 37 HB2 ASP 37 47.701 4.029 1.498 232 HB3 ASP 37 HB1 ASP 37 48.178 5.529 2.295 233 H GLN 38 HN GLN 38 50.998 2.707 1.059 234 HA GLN 38 HA GLN 38 52.163 1.568 2.757 235 HB2 GLN 38 HB2 GLN 38 53.136 4.392 2.685 236 HB3 GLN 38 HB1 GLN 38 53.736 3.332 3.964 237 HG2 GLN 38 HG2 GLN 38 54.316 1.643 2.195 238 HG3 GLN 38 HG1 GLN 38 53.880 2.842 0.978 239 HE21 GLN 38 HE21 GLN 38 55.124 4.546 3.580 240 HE22 GLN 38 HE22 GLN 38 56.740 4.666 3.077 241 H THR 39 HN THR 39 49.649 1.865 3.686 242 HA THR 39 HA THR 39 50.074 2.107 6.547 243 HB THR 39 HB THR 39 49.585 4.333 6.466 244 HG1 THR 39 HG1 THR 39 46.930 3.503 6.199 245 HG21 THR 39 HG21 THR 39 48.814 3.770 3.816 246 HG22 THR 39 HG22 THR 39 49.009 5.360 4.551 247 HG23 THR 39 HG23 THR 39 47.434 4.568 4.567 248 H THR 40 HN THR 40 47.608 2.124 7.486 249 HA THR 40 HA THR 40 46.279 -0.144 6.071 250 HB THR 40 HB THR 40 45.377 -0.738 8.358 251 HG1 THR 40 HG1 THR 40 47.411 0.891 9.391 252 HG21 THR 40 HG21 THR 40 48.141 -0.946 9.016 253 HG22 THR 40 HG22 THR 40 47.985 -1.113 7.269 254 HG23 THR 40 HG23 THR 40 47.084 -2.185 8.345 255 H THR 41 HN THR 41 43.887 -0.190 6.328 256 HA THR 41 HA THR 41 42.669 2.419 7.014 257 HB THR 41 HB THR 41 42.594 2.861 4.797 258 HG1 THR 41 HG1 THR 41 40.761 1.426 3.860 259 HG21 THR 41 HG21 THR 41 42.559 0.885 3.098 260 HG22 THR 41 HG22 THR 41 43.040 -0.089 4.487 261 HG23 THR 41 HG23 THR 41 44.060 1.247 3.950 262 H TRP 42 HN TRP 42 40.501 2.282 7.620 263 HA TRP 42 HA TRP 42 39.609 -0.429 8.389 264 HB2 TRP 42 HB2 TRP 42 38.347 2.271 8.964 265 HB3 TRP 42 HB1 TRP 42 37.897 0.733 9.699 266 HD1 TRP 42 HD1 TRP 42 39.884 3.666 10.394 267 HE1 TRP 42 HE1 TRP 42 41.656 3.209 12.213 268 HE3 TRP 42 HE3 TRP 42 39.795 -1.439 10.444 269 HZ2 TRP 42 HZ2 TRP 42 42.873 0.968 13.515 270 HZ3 TRP 42 HZ3 TRP 42 41.268 -2.708 11.980 271 HH2 TRP 42 HH2 TRP 42 42.807 -1.513 13.512 272 H GLN 43 HN GLN 43 39.390 1.648 5.815 273 HA GLN 43 HA GLN 43 36.648 0.747 5.077 274 HB2 GLN 43 HB2 GLN 43 38.026 3.232 4.807 275 HB3 GLN 43 HB1 GLN 43 37.729 2.601 3.187 276 HG2 GLN 43 HG2 GLN 43 35.779 3.853 3.742 277 HG3 GLN 43 HG1 GLN 43 35.328 2.161 3.959 278 HE21 GLN 43 HE21 GLN 43 35.222 1.336 6.211 279 HE22 GLN 43 HE22 GLN 43 35.035 2.415 7.507 280 H ASP 44 HN ASP 44 36.328 -0.215 2.981 281 HA ASP 44 HA ASP 44 38.737 -1.611 1.995 282 HB2 ASP 44 HB2 ASP 44 35.957 -2.056 0.937 283 HB3 ASP 44 HB1 ASP 44 37.290 -3.204 1.063 284 HA PRO 45 HA PRO 45 39.071 1.203 -1.426 285 HB2 PRO 45 HB2 PRO 45 40.455 -0.472 -3.139 286 HB3 PRO 45 HB1 PRO 45 41.204 0.450 -1.822 287 HG2 PRO 45 HG2 PRO 45 40.422 -2.414 -1.922 288 HG3 PRO 45 HG1 PRO 45 41.823 -1.650 -1.153 289 HD2 PRO 45 HD2 PRO 45 39.645 -2.479 0.259 290 HD3 PRO 45 HD1 PRO 45 40.637 -1.090 0.758 291 H ARG 46 HN ARG 46 37.303 -1.664 -1.407 292 HA ARG 46 HA ARG 46 36.416 -1.422 -4.215 293 HB2 ARG 46 HB2 ARG 46 36.259 -3.494 -2.092 294 HB3 ARG 46 HB1 ARG 46 34.894 -3.418 -3.206 295 HG2 ARG 46 HG2 ARG 46 36.146 -4.099 -5.001 296 HG3 ARG 46 HG1 ARG 46 37.596 -3.269 -4.434 297 HD2 ARG 46 HD2 ARG 46 36.482 -5.903 -3.435 298 HD3 ARG 46 HD1 ARG 46 38.018 -5.636 -4.261 299 HE ARG 46 HE ARG 46 38.165 -4.039 -1.986 300 HH11 ARG 46 HH11 ARG 46 39.053 -4.795 -0.050 301 HH12 ARG 46 HH12 ARG 46 39.081 -6.498 0.267 302 HH21 ARG 46 HH21 ARG 46 37.558 -7.351 -2.729 303 HH22 ARG 46 HH22 ARG 46 38.236 -7.945 -1.250 304 H LYS 47 HN LYS 47 35.813 0.576 -2.075 305 HA LYS 47 HA LYS 47 32.912 0.270 -1.667 306 HB2 LYS 47 HB2 LYS 47 33.133 2.446 -0.453 307 HB3 LYS 47 HB1 LYS 47 34.206 1.196 0.177 308 HG2 LYS 47 HG2 LYS 47 36.014 2.122 -1.335 309 HG3 LYS 47 HG1 LYS 47 34.935 3.475 -1.677 310 HD2 LYS 47 HD2 LYS 47 35.021 4.272 0.527 311 HD3 LYS 47 HD1 LYS 47 35.548 2.715 1.169 312 HE2 LYS 47 HE2 LYS 47 37.751 2.997 0.384 313 HE3 LYS 47 HE1 LYS 47 37.276 4.245 -0.768 314 HZ1 LYS 47 HZ1 LYS 47 37.462 5.822 0.772 315 HZ2 LYS 47 HZ2 LYS 47 38.299 4.679 1.709 316 HZ3 LYS 47 HZ3 LYS 47 36.632 4.918 1.944 317 H ALA 48 HN ALA 48 31.354 1.517 -2.722 318 HA ALA 48 HA ALA 48 32.373 3.277 -4.918 319 HB1 ALA 48 HB1 ALA 48 30.913 2.332 -6.405 320 HB2 ALA 48 HB2 ALA 48 29.666 2.091 -5.181 321 HB3 ALA 48 HB3 ALA 48 31.012 0.957 -5.303 322 H MET 49 HN MET 49 31.873 5.370 -4.503 323 HA MET 49 HA MET 49 30.722 7.250 -3.696 324 HB2 MET 49 HB2 MET 49 28.969 6.734 -5.212 325 HB3 MET 49 HB1 MET 49 28.473 5.320 -4.281 326 HG2 MET 49 HG2 MET 49 26.975 7.345 -4.006 327 HG3 MET 49 HG1 MET 49 27.621 6.695 -2.498 328 HE1 MET 49 HE1 MET 49 28.191 9.180 -5.381 329 HE2 MET 49 HE2 MET 49 28.363 10.693 -4.495 330 HE3 MET 49 HE3 MET 49 26.871 9.764 -4.359 331 H GLY 50 HN GLY 50 31.462 7.417 -1.576 332 HA2 GLY 50 HA2 GLY 50 30.506 5.649 0.530 333 HA3 GLY 50 HA1 GLY 50 31.497 7.091 0.761 334 H GLY 51 HN GLY 51 30.082 7.639 2.579 335 HA2 GLY 51 HA2 GLY 51 28.372 9.678 2.413 336 HA3 GLY 51 HA1 GLY 51 27.300 8.383 1.877 337 H GLY 52 HN GLY 52 29.698 8.828 4.507 338 HA2 GLY 52 HA2 GLY 52 28.927 8.926 6.852 339 HA3 GLY 52 HA1 GLY 52 27.597 7.859 6.399 340 H GLY 53 HN GLY 53 28.395 6.479 8.197 341 HA2 GLY 53 HA2 GLY 53 29.307 4.293 8.559 342 HA3 GLY 53 HA1 GLY 53 30.373 4.535 7.175 343 H ASN 54 HN ASN 54 30.464 4.189 10.419 344 HA ASN 54 HA ASN 54 32.671 6.155 10.812 345 HB2 ASN 54 HB2 ASN 54 31.069 6.331 12.568 346 HB3 ASN 54 HB1 ASN 54 30.951 4.578 12.736 347 HD21 ASN 54 HD21 ASN 54 33.627 7.017 12.776 348 HD22 ASN 54 HD22 ASN 54 34.386 6.367 14.148 349 H TYR 55 HN TYR 55 34.471 5.196 12.319 350 HA TYR 55 HA TYR 55 35.094 2.418 11.399 351 HB2 TYR 55 HB2 TYR 55 37.416 4.103 12.007 352 HB3 TYR 55 HB1 TYR 55 37.110 3.078 10.604 353 HD1 TYR 55 HD1 TYR 55 34.876 4.052 9.235 354 HD2 TYR 55 HD2 TYR 55 37.771 6.330 11.445 355 HE1 TYR 55 HE1 TYR 55 34.326 6.060 7.887 356 HE2 TYR 55 HE2 TYR 55 37.221 8.337 10.097 357 HH TYR 55 HH TYR 55 35.282 9.176 8.758 358 H GLN 56 HN GLN 56 37.255 1.819 12.883 359 HA GLN 56 HA GLN 56 36.201 1.991 15.653 360 HB2 GLN 56 HB2 GLN 56 38.524 0.246 15.118 361 HB3 GLN 56 HB1 GLN 56 37.034 -0.106 15.993 362 HG2 GLN 56 HG2 GLN 56 35.976 0.067 13.557 363 HG3 GLN 56 HG1 GLN 56 37.619 -0.354 13.072 364 HE21 GLN 56 HE21 GLN 56 37.518 -1.741 16.003 365 HE22 GLN 56 HE22 GLN 56 36.877 -3.264 15.617 366 H GLY 57 HN GLY 57 37.841 4.037 14.134 367 HA2 GLY 57 HA2 GLY 57 39.143 5.662 15.540 368 HA3 GLY 57 HA1 GLY 57 40.043 4.271 16.148 369 HA PRO 58 HA PRO 58 42.312 6.041 12.481 370 HB2 PRO 58 HB2 PRO 58 44.703 6.403 13.748 371 HB3 PRO 58 HB1 PRO 58 43.416 7.625 13.738 372 HG2 PRO 58 HG2 PRO 58 44.199 5.716 15.876 373 HG3 PRO 58 HG1 PRO 58 43.631 7.389 16.003 374 HD2 PRO 58 HD2 PRO 58 42.034 5.181 16.466 375 HD3 PRO 58 HD1 PRO 58 41.414 6.774 15.982 376 HA PRO 59 HA PRO 59 43.945 1.906 11.892 377 HB2 PRO 59 HB2 PRO 59 44.659 2.197 9.282 378 HB3 PRO 59 HB1 PRO 59 42.975 1.995 9.802 379 HG2 PRO 59 HG2 PRO 59 44.424 4.460 8.994 380 HG3 PRO 59 HG1 PRO 59 42.746 3.981 8.687 381 HD2 PRO 59 HD2 PRO 59 43.508 5.774 10.654 382 HD3 PRO 59 HD1 PRO 59 42.004 4.828 10.691 383 HA PRO 60 HA PRO 60 48.276 3.051 12.524 384 HB2 PRO 60 HB2 PRO 60 49.051 0.673 13.599 385 HB3 PRO 60 HB1 PRO 60 48.150 1.892 14.521 386 HG2 PRO 60 HG2 PRO 60 47.198 -0.628 13.282 387 HG3 PRO 60 HG1 PRO 60 46.692 0.156 14.786 388 HD2 PRO 60 HD2 PRO 60 45.286 0.278 12.387 389 HD3 PRO 60 HD1 PRO 60 45.110 1.435 13.725 390 HA PRO 61 HA PRO 61 50.049 1.717 8.671 391 HB2 PRO 61 HB2 PRO 61 52.485 1.438 10.403 392 HB3 PRO 61 HB1 PRO 61 52.321 2.196 8.805 393 HG2 PRO 61 HG2 PRO 61 52.420 3.650 11.033 394 HG3 PRO 61 HG1 PRO 61 51.409 4.114 9.655 395 HD2 PRO 61 HD2 PRO 61 50.579 3.079 12.308 396 HD3 PRO 61 HD1 PRO 61 49.647 4.021 11.124 397 H TYR 62 HN TYR 62 50.075 -0.268 7.744 398 HA TYR 62 HA TYR 62 49.493 -2.675 8.866 399 HB2 TYR 62 HB2 TYR 62 51.173 -3.628 7.042 400 HB3 TYR 62 HB1 TYR 62 49.692 -2.808 6.564 401 HD1 TYR 62 HD1 TYR 62 50.700 -2.221 4.387 402 HD2 TYR 62 HD2 TYR 62 52.391 -0.863 8.091 403 HE1 TYR 62 HE1 TYR 62 52.030 -0.536 3.165 404 HE2 TYR 62 HE2 TYR 62 53.716 0.822 6.873 405 HH TYR 62 HH TYR 62 54.557 0.801 4.044 406 HA PRO 63 HA PRO 63 52.545 -4.370 11.541 407 HB2 PRO 63 HB2 PRO 63 53.367 -6.623 10.020 408 HB3 PRO 63 HB1 PRO 63 52.086 -6.580 11.243 409 HG2 PRO 63 HG2 PRO 63 51.887 -6.411 8.290 410 HG3 PRO 63 HG1 PRO 63 50.766 -7.124 9.463 411 HD2 PRO 63 HD2 PRO 63 50.202 -4.781 8.292 412 HD3 PRO 63 HD1 PRO 63 49.809 -5.053 10.005 413 H LYS 64 HN LYS 64 54.925 -4.977 11.653 414 HA LYS 64 HA LYS 64 56.425 -3.418 9.606 415 HB2 LYS 64 HB2 LYS 64 58.297 -3.670 11.378 416 HB3 LYS 64 HB1 LYS 64 56.945 -2.606 11.768 417 HG2 LYS 64 HG2 LYS 64 55.959 -4.189 13.214 418 HG3 LYS 64 HG1 LYS 64 56.899 -5.521 12.540 419 HD2 LYS 64 HD2 LYS 64 57.637 -4.600 14.836 420 HD3 LYS 64 HD1 LYS 64 58.889 -4.810 13.610 421 HE2 LYS 64 HE2 LYS 64 58.983 -2.497 13.140 422 HE3 LYS 64 HE1 LYS 64 57.427 -2.188 13.911 423 HZ1 LYS 64 HZ1 LYS 64 58.410 -2.745 16.044 424 HZ2 LYS 64 HZ2 LYS 64 59.263 -1.475 15.307 425 HZ3 LYS 64 HZ3 LYS 64 59.906 -3.046 15.304 426 H HIS 65 HN HIS 65 56.824 -4.896 7.955 427 HA HIS 65 HA HIS 65 57.300 -7.641 8.148 428 HB2 HIS 65 HB2 HIS 65 59.068 -6.216 6.245 429 HB3 HIS 65 HB1 HIS 65 57.909 -7.511 5.950 430 HD1 HIS 65 HD1 HIS 65 58.168 -3.769 6.227 431 HD2 HIS 65 HD2 HIS 65 55.268 -6.636 5.348 432 HE1 HIS 65 HE1 HIS 65 56.168 -2.510 5.310 433 HE2 HIS 65 HE2 HIS 65 54.399 -4.246 4.772 Start of MODEL 16 1 H1 SER 7 HT1 SER 7 23.174 -16.045 -8.449 2 H2 SER 7 HT2 SER 7 21.785 -15.720 -9.373 3 H3 SER 7 HT3 SER 7 23.240 -14.905 -9.704 4 HA SER 7 HA SER 7 22.728 -17.807 -10.067 5 HB2 SER 7 HB2 SER 7 21.961 -15.778 -11.707 6 HB3 SER 7 HB1 SER 7 23.598 -16.055 -12.294 7 HG SER 7 HG SER 7 22.034 -17.389 -13.331 8 H PHE 8 HN PHE 8 24.988 -15.393 -9.295 9 HA PHE 8 HA PHE 8 27.207 -17.281 -9.947 10 HB2 PHE 8 HB2 PHE 8 27.583 -14.300 -10.150 11 HB3 PHE 8 HB1 PHE 8 28.554 -15.587 -10.864 12 HD1 PHE 8 HD1 PHE 8 25.567 -13.507 -11.215 13 HD2 PHE 8 HD2 PHE 8 27.713 -16.863 -12.820 14 HE1 PHE 8 HE1 PHE 8 24.215 -13.379 -13.290 15 HE2 PHE 8 HE2 PHE 8 26.362 -16.735 -14.895 16 HZ PHE 8 HZ PHE 8 24.613 -14.992 -15.130 17 H GLU 9 HN GLU 9 29.286 -16.387 -8.713 18 HA GLU 9 HA GLU 9 28.421 -15.437 -6.013 19 HB2 GLU 9 HB2 GLU 9 30.151 -16.975 -5.053 20 HB3 GLU 9 HB1 GLU 9 28.833 -17.832 -5.854 21 HG2 GLU 9 HG2 GLU 9 30.149 -18.401 -7.703 22 HG3 GLU 9 HG1 GLU 9 31.302 -17.099 -7.405 23 H ILE 10 HN ILE 10 29.989 -14.148 -4.905 24 HA ILE 10 HA ILE 10 31.400 -12.231 -6.234 25 HB ILE 10 HB ILE 10 32.420 -13.647 -3.752 26 HG12 ILE 10 HG12 ILE 10 30.417 -11.416 -4.184 27 HG13 ILE 10 HG11 ILE 10 30.163 -12.948 -3.346 28 HG21 ILE 10 HG21 ILE 10 33.586 -11.576 -3.286 29 HG22 ILE 10 HG22 ILE 10 32.854 -10.797 -4.689 30 HG23 ILE 10 HG23 ILE 10 34.028 -12.094 -4.913 31 HD11 ILE 10 HD11 ILE 10 32.299 -11.900 -1.969 32 HD12 ILE 10 HD12 ILE 10 30.615 -11.767 -1.461 33 HD13 ILE 10 HD13 ILE 10 31.372 -10.452 -2.361 34 HA PRO 11 HA PRO 11 34.063 -14.960 -8.745 35 HB2 PRO 11 HB2 PRO 11 34.965 -12.240 -9.587 36 HB3 PRO 11 HB1 PRO 11 34.521 -13.640 -10.582 37 HG2 PRO 11 HG2 PRO 11 32.891 -11.546 -10.289 38 HG3 PRO 11 HG1 PRO 11 32.279 -13.202 -10.442 39 HD2 PRO 11 HD2 PRO 11 32.392 -11.457 -8.032 40 HD3 PRO 11 HD1 PRO 11 31.264 -12.773 -8.421 41 H ASP 12 HN ASP 12 35.966 -15.767 -7.967 42 HA ASP 12 HA ASP 12 37.485 -14.356 -5.963 43 HB2 ASP 12 HB2 ASP 12 37.725 -16.970 -7.381 44 HB3 ASP 12 HB1 ASP 12 39.172 -16.326 -6.605 45 H ASP 13 HN ASP 13 37.243 -13.754 -9.076 46 HA ASP 13 HA ASP 13 40.112 -13.194 -9.556 47 HB2 ASP 13 HB2 ASP 13 38.625 -14.304 -11.317 48 HB3 ASP 13 HB1 ASP 13 37.831 -12.738 -11.486 49 H VAL 14 HN VAL 14 38.612 -11.656 -7.589 50 HA VAL 14 HA VAL 14 38.892 -8.980 -8.857 51 HB VAL 14 HB VAL 14 36.645 -9.919 -7.057 52 HG11 VAL 14 HG11 VAL 14 36.810 -7.800 -6.220 53 HG12 VAL 14 HG12 VAL 14 36.013 -7.360 -7.731 54 HG13 VAL 14 HG13 VAL 14 37.766 -7.229 -7.588 55 HG21 VAL 14 HG21 VAL 14 36.524 -8.583 -9.771 56 HG22 VAL 14 HG22 VAL 14 35.223 -9.410 -8.915 57 HG23 VAL 14 HG23 VAL 14 36.570 -10.335 -9.580 58 HA PRO 15 HA PRO 15 41.198 -9.517 -4.804 59 HB2 PRO 15 HB2 PRO 15 43.678 -8.911 -5.799 60 HB3 PRO 15 HB1 PRO 15 43.022 -10.558 -5.738 61 HG2 PRO 15 HG2 PRO 15 43.201 -8.676 -8.030 62 HG3 PRO 15 HG1 PRO 15 43.415 -10.434 -7.989 63 HD2 PRO 15 HD2 PRO 15 41.118 -9.215 -8.876 64 HD3 PRO 15 HD1 PRO 15 41.154 -10.847 -8.177 65 H LEU 16 HN LEU 16 42.569 -7.769 -3.708 66 HA LEU 16 HA LEU 16 41.361 -5.206 -3.965 67 HB2 LEU 16 HB2 LEU 16 44.090 -5.878 -2.835 68 HB3 LEU 16 HB1 LEU 16 43.162 -4.424 -2.503 69 HG LEU 16 HG LEU 16 43.166 -6.685 -0.964 70 HD11 LEU 16 HD11 LEU 16 42.425 -4.668 -0.033 71 HD12 LEU 16 HD12 LEU 16 40.953 -5.640 -0.069 72 HD13 LEU 16 HD13 LEU 16 41.228 -4.410 -1.303 73 HD21 LEU 16 HD21 LEU 16 41.892 -8.066 -2.462 74 HD22 LEU 16 HD22 LEU 16 40.732 -6.773 -2.773 75 HD23 LEU 16 HD23 LEU 16 40.786 -7.547 -1.196 76 HA PRO 17 HA PRO 17 43.420 -3.116 -7.280 77 HB2 PRO 17 HB2 PRO 17 44.436 -1.044 -5.445 78 HB3 PRO 17 HB1 PRO 17 43.375 -0.886 -6.850 79 HG2 PRO 17 HG2 PRO 17 42.522 -0.669 -4.291 80 HG3 PRO 17 HG1 PRO 17 41.498 -1.195 -5.634 81 HD2 PRO 17 HD2 PRO 17 42.617 -2.783 -3.409 82 HD3 PRO 17 HD1 PRO 17 41.210 -3.120 -4.436 83 H ALA 18 HN ALA 18 45.750 -1.385 -6.704 84 HA ALA 18 HA ALA 18 47.759 -3.525 -6.858 85 HB1 ALA 18 HB1 ALA 18 48.862 -2.089 -8.196 86 HB2 ALA 18 HB2 ALA 18 48.667 -0.754 -7.058 87 HB3 ALA 18 HB3 ALA 18 47.369 -1.151 -8.184 88 H GLY 19 HN GLY 19 49.375 -3.852 -5.372 89 HA2 GLY 19 HA2 GLY 19 50.602 -3.660 -3.388 90 HA3 GLY 19 HA1 GLY 19 50.240 -1.938 -3.437 91 H TRP 20 HN TRP 20 47.586 -4.202 -3.389 92 HA TRP 20 HA TRP 20 46.987 -3.271 -0.627 93 HB2 TRP 20 HB2 TRP 20 45.240 -4.261 -2.858 94 HB3 TRP 20 HB1 TRP 20 44.651 -3.997 -1.213 95 HD1 TRP 20 HD1 TRP 20 45.699 -2.205 -4.333 96 HE1 TRP 20 HE1 TRP 20 45.323 0.315 -4.040 97 HE3 TRP 20 HE3 TRP 20 44.664 -2.120 0.623 98 HZ2 TRP 20 HZ2 TRP 20 44.654 2.159 -1.904 99 HZ3 TRP 20 HZ3 TRP 20 44.173 -0.012 1.784 100 HH2 TRP 20 HH2 TRP 20 44.159 2.143 0.536 101 H GLU 21 HN GLU 21 46.119 -4.745 0.927 102 HA GLU 21 HA GLU 21 45.990 -7.598 0.328 103 HB2 GLU 21 HB2 GLU 21 48.475 -7.171 0.529 104 HB3 GLU 21 HB1 GLU 21 48.193 -6.684 2.201 105 HG2 GLU 21 HG2 GLU 21 47.902 -8.823 2.901 106 HG3 GLU 21 HG1 GLU 21 46.945 -9.252 1.482 107 H MET 22 HN MET 22 44.298 -8.244 1.604 108 HA MET 22 HA MET 22 43.344 -6.635 3.778 109 HB2 MET 22 HB2 MET 22 41.567 -7.874 3.111 110 HB3 MET 22 HB1 MET 22 42.593 -9.160 2.475 111 HG2 MET 22 HG2 MET 22 42.901 -10.107 4.653 112 HG3 MET 22 HG1 MET 22 42.154 -8.712 5.428 113 HE1 MET 22 HE1 MET 22 41.687 -11.158 2.587 114 HE2 MET 22 HE2 MET 22 40.579 -9.908 2.025 115 HE3 MET 22 HE3 MET 22 39.950 -11.481 2.509 116 H ALA 23 HN ALA 23 43.748 -6.807 5.959 117 HA ALA 23 HA ALA 23 45.222 -9.150 6.986 118 HB1 ALA 23 HB1 ALA 23 46.873 -7.473 8.073 119 HB2 ALA 23 HB2 ALA 23 46.332 -6.363 6.814 120 HB3 ALA 23 HB3 ALA 23 47.107 -7.882 6.374 121 H LYS 24 HN LYS 24 45.287 -9.130 9.389 122 HA LYS 24 HA LYS 24 43.015 -7.541 10.458 123 HB2 LYS 24 HB2 LYS 24 43.412 -10.202 10.683 124 HB3 LYS 24 HB1 LYS 24 44.242 -9.644 12.138 125 HG2 LYS 24 HG2 LYS 24 42.303 -8.605 12.991 126 HG3 LYS 24 HG1 LYS 24 41.489 -8.639 11.428 127 HD2 LYS 24 HD2 LYS 24 42.233 -11.107 13.032 128 HD3 LYS 24 HD1 LYS 24 40.622 -10.393 12.980 129 HE2 LYS 24 HE2 LYS 24 42.066 -11.952 10.903 130 HE3 LYS 24 HE1 LYS 24 40.342 -11.894 11.272 131 HZ1 LYS 24 HZ1 LYS 24 40.530 -10.806 9.245 132 HZ2 LYS 24 HZ2 LYS 24 41.954 -9.993 9.689 133 HZ3 LYS 24 HZ3 LYS 24 40.464 -9.532 10.362 134 H THR 25 HN THR 25 43.176 -6.588 12.490 135 HA THR 25 HA THR 25 45.715 -5.240 12.962 136 HB THR 25 HB THR 25 43.306 -4.322 13.171 137 HG1 THR 25 HG1 THR 25 45.465 -3.561 14.184 138 HG21 THR 25 HG21 THR 25 42.077 -4.830 15.083 139 HG22 THR 25 HG22 THR 25 43.484 -5.463 15.937 140 HG23 THR 25 HG23 THR 25 42.760 -6.389 14.623 141 H SER 26 HN SER 26 46.661 -5.237 15.217 142 HA SER 26 HA SER 26 47.110 -7.926 16.145 143 HB2 SER 26 HB2 SER 26 48.775 -6.951 17.334 144 HB3 SER 26 HB1 SER 26 48.318 -5.445 16.542 145 HG SER 26 HG SER 26 47.594 -6.443 19.077 146 H SER 27 HN SER 27 44.282 -7.121 16.077 147 HA SER 27 HA SER 27 43.634 -7.781 18.899 148 HB2 SER 27 HB2 SER 27 41.910 -5.758 17.537 149 HB3 SER 27 HB1 SER 27 42.247 -5.971 19.253 150 HG SER 27 HG SER 27 43.302 -4.133 18.393 151 H GLY 28 HN GLY 28 42.906 -7.993 15.497 152 HA2 GLY 28 HA2 GLY 28 41.693 -10.097 14.878 153 HA3 GLY 28 HA1 GLY 28 40.590 -9.752 16.209 154 H GLN 29 HN GLN 29 41.383 -6.849 14.728 155 HA GLN 29 HA GLN 29 38.756 -6.797 13.390 156 HB2 GLN 29 HB2 GLN 29 40.727 -4.512 13.499 157 HB3 GLN 29 HB1 GLN 29 38.975 -4.437 13.335 158 HG2 GLN 29 HG2 GLN 29 40.191 -5.684 15.787 159 HG3 GLN 29 HG1 GLN 29 40.048 -3.930 15.668 160 HE21 GLN 29 HE21 GLN 29 38.444 -4.230 17.527 161 HE22 GLN 29 HE22 GLN 29 36.841 -4.632 17.140 162 H ARG 30 HN ARG 30 38.654 -7.387 11.282 163 HA ARG 30 HA ARG 30 41.028 -7.686 9.656 164 HB2 ARG 30 HB2 ARG 30 39.645 -8.693 8.121 165 HB3 ARG 30 HB1 ARG 30 38.598 -8.818 9.535 166 HG2 ARG 30 HG2 ARG 30 37.588 -6.598 8.874 167 HG3 ARG 30 HG1 ARG 30 38.505 -6.702 7.370 168 HD2 ARG 30 HD2 ARG 30 36.706 -7.825 6.565 169 HD3 ARG 30 HD1 ARG 30 37.324 -9.187 7.499 170 HE ARG 30 HE ARG 30 35.770 -7.694 9.291 171 HH11 ARG 30 HH11 ARG 30 33.599 -8.209 9.650 172 HH12 ARG 30 HH12 ARG 30 32.719 -9.086 8.443 173 HH21 ARG 30 HH21 ARG 30 35.408 -9.306 6.264 174 HH22 ARG 30 HH22 ARG 30 33.743 -9.707 6.526 175 H TYR 31 HN TYR 31 41.949 -6.244 8.277 176 HA TYR 31 HA TYR 31 40.350 -3.953 7.359 177 HB2 TYR 31 HB2 TYR 31 42.279 -2.372 7.866 178 HB3 TYR 31 HB1 TYR 31 41.311 -2.883 9.238 179 HD1 TYR 31 HD1 TYR 31 42.845 -2.663 11.008 180 HD2 TYR 31 HD2 TYR 31 43.973 -4.878 7.504 181 HE1 TYR 31 HE1 TYR 31 44.913 -3.412 12.144 182 HE2 TYR 31 HE2 TYR 31 46.031 -5.629 8.655 183 HH TYR 31 HH TYR 31 47.457 -4.375 10.881 184 H PHE 32 HN PHE 32 42.199 -2.566 5.929 185 HA PHE 32 HA PHE 32 43.376 -4.680 4.185 186 HB2 PHE 32 HB2 PHE 32 42.191 -2.064 3.239 187 HB3 PHE 32 HB1 PHE 32 42.704 -3.430 2.244 188 HD1 PHE 32 HD1 PHE 32 41.432 -5.551 2.256 189 HD2 PHE 32 HD2 PHE 32 40.097 -2.111 4.456 190 HE1 PHE 32 HE1 PHE 32 39.193 -6.586 2.516 191 HE2 PHE 32 HE2 PHE 32 37.858 -3.145 4.714 192 HZ PHE 32 HZ PHE 32 37.406 -5.383 3.743 193 H LEU 33 HN LEU 33 45.483 -4.482 3.795 194 HA LEU 33 HA LEU 33 46.912 -2.094 4.771 195 HB2 LEU 33 HB2 LEU 33 48.185 -4.429 3.356 196 HB3 LEU 33 HB1 LEU 33 48.871 -3.389 4.605 197 HG LEU 33 HG LEU 33 46.572 -5.313 5.041 198 HD11 LEU 33 HD11 LEU 33 48.578 -6.279 6.560 199 HD12 LEU 33 HD12 LEU 33 49.531 -5.584 5.248 200 HD13 LEU 33 HD13 LEU 33 48.311 -6.810 4.900 201 HD21 LEU 33 HD21 LEU 33 47.962 -4.549 7.419 202 HD22 LEU 33 HD22 LEU 33 46.286 -4.212 6.982 203 HD23 LEU 33 HD23 LEU 33 47.560 -3.084 6.527 204 H ASN 34 HN ASN 34 47.723 -0.513 3.464 205 HA ASN 34 HA ASN 34 47.428 -0.909 0.518 206 HB2 ASN 34 HB2 ASN 34 46.263 1.039 1.818 207 HB3 ASN 34 HB1 ASN 34 47.873 1.758 1.833 208 HD21 ASN 34 HD21 ASN 34 47.916 -0.054 -0.909 209 HD22 ASN 34 HD22 ASN 34 47.352 1.087 -2.032 210 H HIS 35 HN HIS 35 49.393 -1.646 -0.211 211 HA HIS 35 HA HIS 35 51.907 -0.844 1.008 212 HB2 HIS 35 HB2 HIS 35 51.465 -2.090 -1.723 213 HB3 HIS 35 HB1 HIS 35 52.961 -2.089 -0.794 214 HD1 HIS 35 HD1 HIS 35 52.510 -4.817 -1.165 215 HD2 HIS 35 HD2 HIS 35 50.095 -2.820 1.588 216 HE1 HIS 35 HE1 HIS 35 51.496 -6.599 0.325 217 HE2 HIS 35 HE2 HIS 35 50.024 -5.394 2.004 218 H ILE 36 HN ILE 36 49.735 0.574 -1.151 219 HA ILE 36 HA ILE 36 51.709 2.195 -2.595 220 HB ILE 36 HB ILE 36 48.778 2.819 -2.506 221 HG12 ILE 36 HG12 ILE 36 49.523 0.225 -2.838 222 HG13 ILE 36 HG11 ILE 36 48.112 0.937 -3.602 223 HG21 ILE 36 HG21 ILE 36 50.979 2.908 -4.580 224 HG22 ILE 36 HG22 ILE 36 50.102 4.266 -3.876 225 HG23 ILE 36 HG23 ILE 36 49.282 3.167 -4.984 226 HD11 ILE 36 HD11 ILE 36 49.745 -0.334 -5.135 227 HD12 ILE 36 HD12 ILE 36 50.834 1.034 -4.905 228 HD13 ILE 36 HD13 ILE 36 49.256 1.280 -5.654 229 H ASP 37 HN ASP 37 49.036 2.790 -0.335 230 HA ASP 37 HA ASP 37 50.116 5.441 0.304 231 HB2 ASP 37 HB2 ASP 37 47.622 4.935 0.158 232 HB3 ASP 37 HB1 ASP 37 47.811 4.034 1.663 233 H GLN 38 HN GLN 38 51.023 2.518 1.057 234 HA GLN 38 HA GLN 38 52.047 1.465 2.894 235 HB2 GLN 38 HB2 GLN 38 53.071 4.257 2.705 236 HB3 GLN 38 HB1 GLN 38 53.540 3.304 4.115 237 HG2 GLN 38 HG2 GLN 38 54.374 1.516 2.668 238 HG3 GLN 38 HG1 GLN 38 53.843 2.402 1.238 239 HE21 GLN 38 HE21 GLN 38 56.489 1.886 1.159 240 HE22 GLN 38 HE22 GLN 38 57.420 3.239 1.588 241 H THR 39 HN THR 39 49.593 1.603 3.738 242 HA THR 39 HA THR 39 49.782 2.136 6.562 243 HB THR 39 HB THR 39 49.264 4.340 6.269 244 HG1 THR 39 HG1 THR 39 46.638 3.931 5.941 245 HG21 THR 39 HG21 THR 39 48.674 3.566 3.636 246 HG22 THR 39 HG22 THR 39 48.752 5.213 4.260 247 HG23 THR 39 HG23 THR 39 47.215 4.349 4.237 248 H THR 40 HN THR 40 47.244 2.176 7.319 249 HA THR 40 HA THR 40 46.033 -0.189 5.955 250 HB THR 40 HB THR 40 45.055 -0.729 8.228 251 HG1 THR 40 HG1 THR 40 46.994 1.141 9.100 252 HG21 THR 40 HG21 THR 40 46.769 -2.169 8.264 253 HG22 THR 40 HG22 THR 40 47.776 -0.923 9.002 254 HG23 THR 40 HG23 THR 40 47.722 -1.087 7.246 255 H THR 41 HN THR 41 43.648 -0.263 6.072 256 HA THR 41 HA THR 41 42.337 2.311 6.705 257 HB THR 41 HB THR 41 42.371 2.780 4.496 258 HG1 THR 41 HG1 THR 41 40.511 2.140 3.572 259 HG21 THR 41 HG21 THR 41 43.886 1.277 3.611 260 HG22 THR 41 HG22 THR 41 42.413 0.731 2.811 261 HG23 THR 41 HG23 THR 41 43.010 -0.121 4.235 262 H TRP 42 HN TRP 42 40.159 2.117 7.217 263 HA TRP 42 HA TRP 42 39.285 -0.605 7.934 264 HB2 TRP 42 HB2 TRP 42 37.897 2.067 8.332 265 HB3 TRP 42 HB1 TRP 42 37.411 0.531 9.048 266 HD1 TRP 42 HD1 TRP 42 39.208 3.517 9.921 267 HE1 TRP 42 HE1 TRP 42 40.824 3.128 11.894 268 HE3 TRP 42 HE3 TRP 42 39.343 -1.586 9.947 269 HZ2 TRP 42 HZ2 TRP 42 42.017 0.933 13.296 270 HZ3 TRP 42 HZ3 TRP 42 40.724 -2.799 11.609 271 HH2 TRP 42 HH2 TRP 42 42.061 -1.548 13.280 272 H GLN 43 HN GLN 43 39.144 1.475 5.321 273 HA GLN 43 HA GLN 43 36.572 0.315 4.362 274 HB2 GLN 43 HB2 GLN 43 37.462 2.956 4.405 275 HB3 GLN 43 HB1 GLN 43 37.698 2.452 2.731 276 HG2 GLN 43 HG2 GLN 43 35.484 3.154 2.672 277 HG3 GLN 43 HG1 GLN 43 35.284 1.436 3.015 278 HE21 GLN 43 HE21 GLN 43 33.204 3.071 3.827 279 HE22 GLN 43 HE22 GLN 43 33.222 3.263 5.514 280 H ASP 44 HN ASP 44 36.548 -0.776 2.367 281 HA ASP 44 HA ASP 44 39.237 -1.368 1.240 282 HB2 ASP 44 HB2 ASP 44 37.336 -3.127 2.182 283 HB3 ASP 44 HB1 ASP 44 37.006 -3.116 0.450 284 HA PRO 45 HA PRO 45 37.900 0.874 -2.360 285 HB2 PRO 45 HB2 PRO 45 39.623 -0.385 -4.163 286 HB3 PRO 45 HB1 PRO 45 40.030 1.026 -3.171 287 HG2 PRO 45 HG2 PRO 45 40.722 -1.821 -2.782 288 HG3 PRO 45 HG1 PRO 45 41.620 -0.363 -2.335 289 HD2 PRO 45 HD2 PRO 45 40.258 -1.896 -0.525 290 HD3 PRO 45 HD1 PRO 45 40.535 -0.155 -0.308 291 H ARG 46 HN ARG 46 37.316 -2.292 -1.679 292 HA ARG 46 HA ARG 46 36.079 -2.885 -4.308 293 HB2 ARG 46 HB2 ARG 46 36.653 -4.672 -1.927 294 HB3 ARG 46 HB1 ARG 46 35.873 -5.210 -3.415 295 HG2 ARG 46 HG2 ARG 46 38.680 -4.102 -3.130 296 HG3 ARG 46 HG1 ARG 46 38.232 -5.752 -3.560 297 HD2 ARG 46 HD2 ARG 46 38.624 -4.876 -5.669 298 HD3 ARG 46 HD1 ARG 46 36.903 -4.529 -5.503 299 HE ARG 46 HE ARG 46 38.199 -2.292 -4.445 300 HH11 ARG 46 HH11 ARG 46 38.650 -0.481 -5.722 301 HH12 ARG 46 HH12 ARG 46 38.780 -0.660 -7.440 302 HH21 ARG 46 HH21 ARG 46 38.151 -4.071 -7.399 303 HH22 ARG 46 HH22 ARG 46 38.497 -2.692 -8.389 304 H LYS 47 HN LYS 47 35.080 -1.051 -2.141 305 HA LYS 47 HA LYS 47 32.309 -2.009 -2.187 306 HB2 LYS 47 HB2 LYS 47 32.282 -2.862 -0.102 307 HB3 LYS 47 HB1 LYS 47 33.975 -2.426 0.125 308 HG2 LYS 47 HG2 LYS 47 33.316 -0.150 0.788 309 HG3 LYS 47 HG1 LYS 47 31.619 -0.560 0.534 310 HD2 LYS 47 HD2 LYS 47 31.759 -0.971 2.800 311 HD3 LYS 47 HD1 LYS 47 32.242 -2.557 2.196 312 HE2 LYS 47 HE2 LYS 47 34.652 -1.606 2.223 313 HE3 LYS 47 HE1 LYS 47 33.991 -0.342 3.259 314 HZ1 LYS 47 HZ1 LYS 47 32.983 -2.601 4.343 315 HZ2 LYS 47 HZ2 LYS 47 34.362 -1.781 4.902 316 HZ3 LYS 47 HZ3 LYS 47 34.525 -3.105 3.850 317 H ALA 48 HN ALA 48 30.808 -0.292 -1.689 318 HA ALA 48 HA ALA 48 31.505 2.274 -2.569 319 HB1 ALA 48 HB1 ALA 48 29.177 1.078 -1.744 320 HB2 ALA 48 HB2 ALA 48 29.333 2.791 -2.132 321 HB3 ALA 48 HB3 ALA 48 29.444 2.254 -0.457 322 H MET 49 HN MET 49 31.361 4.318 -1.100 323 HA MET 49 HA MET 49 33.372 3.963 1.040 324 HB2 MET 49 HB2 MET 49 33.550 5.782 -0.720 325 HB3 MET 49 HB1 MET 49 32.151 6.546 0.036 326 HG2 MET 49 HG2 MET 49 33.312 6.998 2.025 327 HG3 MET 49 HG1 MET 49 34.542 5.778 1.694 328 HE1 MET 49 HE1 MET 49 36.526 8.568 2.110 329 HE2 MET 49 HE2 MET 49 34.961 8.206 2.834 330 HE3 MET 49 HE3 MET 49 35.176 9.695 1.920 331 H GLY 50 HN GLY 50 32.982 4.548 3.211 332 HA2 GLY 50 HA2 GLY 50 30.105 4.620 3.949 333 HA3 GLY 50 HA1 GLY 50 31.434 4.233 5.043 334 H GLY 51 HN GLY 51 32.242 5.864 6.301 335 HA2 GLY 51 HA2 GLY 51 32.869 8.161 6.741 336 HA3 GLY 51 HA1 GLY 51 31.735 8.678 5.493 337 H GLY 52 HN GLY 52 32.017 9.372 8.453 338 HA2 GLY 52 HA2 GLY 52 30.043 10.291 9.636 339 HA3 GLY 52 HA1 GLY 52 29.158 8.843 9.152 340 H GLY 53 HN GLY 53 28.918 7.396 10.773 341 HA2 GLY 53 HA2 GLY 53 29.932 7.531 13.336 342 HA3 GLY 53 HA1 GLY 53 29.534 5.992 12.572 343 H ASN 54 HN ASN 54 32.038 7.781 13.922 344 HA ASN 54 HA ASN 54 34.298 7.118 12.368 345 HB2 ASN 54 HB2 ASN 54 33.797 7.768 15.220 346 HB3 ASN 54 HB1 ASN 54 35.304 6.916 14.884 347 HD21 ASN 54 HD21 ASN 54 35.904 9.349 15.712 348 HD22 ASN 54 HD22 ASN 54 36.215 10.441 14.450 349 H TYR 55 HN TYR 55 35.059 5.152 11.773 350 HA TYR 55 HA TYR 55 33.977 2.680 12.572 351 HB2 TYR 55 HB2 TYR 55 36.832 3.166 11.670 352 HB3 TYR 55 HB1 TYR 55 35.934 1.654 11.548 353 HD1 TYR 55 HD1 TYR 55 33.556 1.900 10.332 354 HD2 TYR 55 HD2 TYR 55 36.905 4.532 9.785 355 HE1 TYR 55 HE1 TYR 55 32.630 2.622 8.148 356 HE2 TYR 55 HE2 TYR 55 35.979 5.255 7.601 357 HH TYR 55 HH TYR 55 34.456 4.721 5.984 358 H GLN 56 HN GLN 56 36.309 1.158 13.334 359 HA GLN 56 HA GLN 56 36.138 1.404 16.182 360 HB2 GLN 56 HB2 GLN 56 38.540 0.029 15.491 361 HB3 GLN 56 HB1 GLN 56 37.007 -0.668 16.017 362 HG2 GLN 56 HG2 GLN 56 37.648 0.116 13.159 363 HG3 GLN 56 HG1 GLN 56 37.733 -1.528 13.790 364 HE21 GLN 56 HE21 GLN 56 35.640 -2.470 14.623 365 HE22 GLN 56 HE22 GLN 56 34.174 -1.916 13.974 366 H GLY 57 HN GLY 57 37.153 3.741 14.540 367 HA2 GLY 57 HA2 GLY 57 38.448 5.543 15.592 368 HA3 GLY 57 HA1 GLY 57 39.515 4.313 16.271 369 HA PRO 58 HA PRO 58 41.349 5.973 12.296 370 HB2 PRO 58 HB2 PRO 58 43.755 6.715 13.383 371 HB3 PRO 58 HB1 PRO 58 42.350 7.793 13.286 372 HG2 PRO 58 HG2 PRO 58 43.398 6.253 15.599 373 HG3 PRO 58 HG1 PRO 58 42.667 7.865 15.550 374 HD2 PRO 58 HD2 PRO 58 41.317 5.609 16.368 375 HD3 PRO 58 HD1 PRO 58 40.519 7.039 15.678 376 HA PRO 59 HA PRO 59 43.397 2.001 12.000 377 HB2 PRO 59 HB2 PRO 59 44.038 2.149 9.353 378 HB3 PRO 59 HB1 PRO 59 42.399 1.801 9.934 379 HG2 PRO 59 HG2 PRO 59 43.539 4.338 8.889 380 HG3 PRO 59 HG1 PRO 59 41.922 3.649 8.670 381 HD2 PRO 59 HD2 PRO 59 42.501 5.677 10.454 382 HD3 PRO 59 HD1 PRO 59 41.128 4.563 10.626 383 HA PRO 60 HA PRO 60 47.601 3.614 12.402 384 HB2 PRO 60 HB2 PRO 60 48.611 1.472 13.732 385 HB3 PRO 60 HB1 PRO 60 47.589 2.687 14.522 386 HG2 PRO 60 HG2 PRO 60 46.906 -0.045 13.590 387 HG3 PRO 60 HG1 PRO 60 46.318 0.852 15.000 388 HD2 PRO 60 HD2 PRO 60 44.920 0.553 12.604 389 HD3 PRO 60 HD1 PRO 60 44.604 1.809 13.820 390 HA PRO 61 HA PRO 61 49.513 1.985 8.736 391 HB2 PRO 61 HB2 PRO 61 51.970 2.092 10.453 392 HB3 PRO 61 HB1 PRO 61 51.727 2.680 8.796 393 HG2 PRO 61 HG2 PRO 61 51.732 4.334 10.890 394 HG3 PRO 61 HG1 PRO 61 50.694 4.600 9.480 395 HD2 PRO 61 HD2 PRO 61 49.935 3.757 12.218 396 HD3 PRO 61 HD1 PRO 61 48.941 4.517 10.956 397 H TYR 62 HN TYR 62 49.667 -0.105 8.070 398 HA TYR 62 HA TYR 62 49.303 -2.389 9.500 399 HB2 TYR 62 HB2 TYR 62 51.008 -3.444 7.781 400 HB3 TYR 62 HB1 TYR 62 49.500 -2.741 7.203 401 HD1 TYR 62 HD1 TYR 62 49.689 -1.369 5.356 402 HD2 TYR 62 HD2 TYR 62 52.913 -1.519 8.186 403 HE1 TYR 62 HE1 TYR 62 50.957 0.250 3.997 404 HE2 TYR 62 HE2 TYR 62 54.186 0.108 6.828 405 HH TYR 62 HH TYR 62 54.300 1.083 4.765 406 HA PRO 63 HA PRO 63 52.476 -3.405 12.363 407 HB2 PRO 63 HB2 PRO 63 53.482 -5.773 11.141 408 HB3 PRO 63 HB1 PRO 63 52.240 -5.664 12.400 409 HG2 PRO 63 HG2 PRO 63 51.941 -5.963 9.470 410 HG3 PRO 63 HG1 PRO 63 50.906 -6.555 10.781 411 HD2 PRO 63 HD2 PRO 63 50.147 -4.470 9.271 412 HD3 PRO 63 HD1 PRO 63 49.805 -4.501 11.017 413 H LYS 64 HN LYS 64 54.668 -2.949 12.642 414 HA LYS 64 HA LYS 64 56.147 -1.549 10.762 415 HB2 LYS 64 HB2 LYS 64 56.966 -3.268 13.088 416 HB3 LYS 64 HB1 LYS 64 58.202 -2.553 12.053 417 HG2 LYS 64 HG2 LYS 64 57.694 -0.396 12.699 418 HG3 LYS 64 HG1 LYS 64 56.000 -0.776 13.008 419 HD2 LYS 64 HD2 LYS 64 57.914 -2.193 14.754 420 HD3 LYS 64 HD1 LYS 64 57.878 -0.442 14.969 421 HE2 LYS 64 HE2 LYS 64 56.186 -1.988 16.296 422 HE3 LYS 64 HE1 LYS 64 55.661 -0.431 15.656 423 HZ1 LYS 64 HZ1 LYS 64 55.418 -2.372 13.644 424 HZ2 LYS 64 HZ2 LYS 64 54.191 -1.468 14.395 425 HZ3 LYS 64 HZ3 LYS 64 54.667 -2.964 15.044 426 H HIS 65 HN HIS 65 56.575 -2.215 8.706 427 HA HIS 65 HA HIS 65 57.253 -3.591 6.928 428 HB2 HIS 65 HB2 HIS 65 58.947 -4.679 9.193 429 HB3 HIS 65 HB1 HIS 65 59.153 -5.157 7.507 430 HD1 HIS 65 HD1 HIS 65 61.055 -3.289 9.499 431 HD2 HIS 65 HD2 HIS 65 58.839 -2.114 6.167 432 HE1 HIS 65 HE1 HIS 65 62.105 -1.140 8.661 433 HE2 HIS 65 HE2 HIS 65 60.763 -0.417 6.633 Start of MODEL 17 1 H1 SER 7 HT1 SER 7 21.064 -14.088 -3.759 2 H2 SER 7 HT2 SER 7 20.228 -14.292 -5.223 3 H3 SER 7 HT3 SER 7 19.994 -12.888 -4.296 4 HA SER 7 HA SER 7 21.653 -13.044 -6.389 5 HB2 SER 7 HB2 SER 7 22.852 -11.112 -4.897 6 HB3 SER 7 HB1 SER 7 21.319 -10.883 -5.735 7 HG SER 7 HG SER 7 21.390 -10.367 -3.409 8 H PHE 8 HN PHE 8 24.181 -12.187 -5.877 9 HA PHE 8 HA PHE 8 25.417 -14.379 -4.262 10 HB2 PHE 8 HB2 PHE 8 25.487 -14.222 -7.030 11 HB3 PHE 8 HB1 PHE 8 27.015 -13.483 -6.551 12 HD1 PHE 8 HD1 PHE 8 28.549 -14.744 -4.970 13 HD2 PHE 8 HD2 PHE 8 25.148 -16.568 -6.856 14 HE1 PHE 8 HE1 PHE 8 29.484 -16.989 -4.483 15 HE2 PHE 8 HE2 PHE 8 26.082 -18.813 -6.370 16 HZ PHE 8 HZ PHE 8 28.249 -19.024 -5.183 17 H GLU 9 HN GLU 9 27.282 -13.777 -3.111 18 HA GLU 9 HA GLU 9 27.716 -10.848 -2.913 19 HB2 GLU 9 HB2 GLU 9 28.077 -13.179 -1.119 20 HB3 GLU 9 HB1 GLU 9 29.305 -11.919 -0.983 21 HG2 GLU 9 HG2 GLU 9 27.557 -11.336 0.555 22 HG3 GLU 9 HG1 GLU 9 27.404 -10.242 -0.820 23 H ILE 10 HN ILE 10 29.479 -9.928 -3.842 24 HA ILE 10 HA ILE 10 31.231 -11.030 -5.616 25 HB ILE 10 HB ILE 10 32.246 -9.110 -3.513 26 HG12 ILE 10 HG12 ILE 10 30.203 -8.732 -5.687 27 HG13 ILE 10 HG11 ILE 10 30.218 -8.077 -4.049 28 HG21 ILE 10 HG21 ILE 10 33.765 -10.024 -5.332 29 HG22 ILE 10 HG22 ILE 10 33.608 -8.268 -5.307 30 HG23 ILE 10 HG23 ILE 10 32.723 -9.214 -6.502 31 HD11 ILE 10 HD11 ILE 10 30.846 -6.182 -5.207 32 HD12 ILE 10 HD12 ILE 10 31.625 -7.100 -6.497 33 HD13 ILE 10 HD13 ILE 10 32.439 -6.893 -4.945 34 HA PRO 11 HA PRO 11 32.896 -14.342 -2.952 35 HB2 PRO 11 HB2 PRO 11 34.389 -14.772 -5.502 36 HB3 PRO 11 HB1 PRO 11 33.519 -15.942 -4.492 37 HG2 PRO 11 HG2 PRO 11 32.509 -15.047 -6.795 38 HG3 PRO 11 HG1 PRO 11 31.483 -15.421 -5.401 39 HD2 PRO 11 HD2 PRO 11 32.249 -12.765 -6.511 40 HD3 PRO 11 HD1 PRO 11 30.787 -13.238 -5.617 41 H ASP 12 HN ASP 12 34.981 -14.673 -2.000 42 HA ASP 12 HA ASP 12 36.638 -12.383 -1.777 43 HB2 ASP 12 HB2 ASP 12 37.970 -13.643 -0.327 44 HB3 ASP 12 HB1 ASP 12 36.434 -14.507 -0.239 45 H ASP 13 HN ASP 13 36.227 -14.144 -4.391 46 HA ASP 13 HA ASP 13 39.001 -14.427 -5.277 47 HB2 ASP 13 HB2 ASP 13 36.476 -15.444 -6.109 48 HB3 ASP 13 HB1 ASP 13 37.143 -14.536 -7.465 49 H VAL 14 HN VAL 14 37.949 -11.767 -4.504 50 HA VAL 14 HA VAL 14 38.312 -10.357 -7.106 51 HB VAL 14 HB VAL 14 36.109 -10.007 -5.907 52 HG11 VAL 14 HG11 VAL 14 36.015 -9.176 -3.781 53 HG12 VAL 14 HG12 VAL 14 37.443 -8.165 -4.004 54 HG13 VAL 14 HG13 VAL 14 37.626 -9.884 -3.656 55 HG21 VAL 14 HG21 VAL 14 36.748 -7.325 -5.801 56 HG22 VAL 14 HG22 VAL 14 36.322 -8.202 -7.270 57 HG23 VAL 14 HG23 VAL 14 38.017 -7.970 -6.843 58 HA PRO 15 HA PRO 15 42.267 -9.742 -4.807 59 HB2 PRO 15 HB2 PRO 15 42.919 -8.697 -7.522 60 HB3 PRO 15 HB1 PRO 15 43.832 -9.818 -6.493 61 HG2 PRO 15 HG2 PRO 15 42.466 -10.652 -8.633 62 HG3 PRO 15 HG1 PRO 15 42.623 -11.637 -7.169 63 HD2 PRO 15 HD2 PRO 15 40.253 -10.141 -8.181 64 HD3 PRO 15 HD1 PRO 15 40.322 -11.614 -7.189 65 H LEU 16 HN LEU 16 42.835 -7.872 -3.749 66 HA LEU 16 HA LEU 16 41.334 -5.467 -3.994 67 HB2 LEU 16 HB2 LEU 16 44.140 -5.854 -2.913 68 HB3 LEU 16 HB1 LEU 16 43.095 -4.482 -2.581 69 HG LEU 16 HG LEU 16 43.314 -6.717 -1.017 70 HD11 LEU 16 HD11 LEU 16 40.830 -5.001 -1.247 71 HD12 LEU 16 HD12 LEU 16 42.337 -4.449 -0.513 72 HD13 LEU 16 HD13 LEU 16 41.449 -5.796 0.200 73 HD21 LEU 16 HD21 LEU 16 41.020 -7.789 -1.208 74 HD22 LEU 16 HD22 LEU 16 42.146 -8.216 -2.491 75 HD23 LEU 16 HD23 LEU 16 40.871 -7.034 -2.791 76 HA PRO 17 HA PRO 17 43.217 -3.144 -7.267 77 HB2 PRO 17 HB2 PRO 17 44.153 -0.996 -5.484 78 HB3 PRO 17 HB1 PRO 17 42.983 -0.931 -6.809 79 HG2 PRO 17 HG2 PRO 17 42.253 -0.755 -4.232 80 HG3 PRO 17 HG1 PRO 17 41.227 -1.492 -5.474 81 HD2 PRO 17 HD2 PRO 17 42.868 -2.812 -3.355 82 HD3 PRO 17 HD1 PRO 17 41.308 -3.312 -4.044 83 H ALA 18 HN ALA 18 45.450 -1.256 -6.766 84 HA ALA 18 HA ALA 18 47.580 -3.265 -7.023 85 HB1 ALA 18 HB1 ALA 18 48.808 -0.904 -7.436 86 HB2 ALA 18 HB2 ALA 18 47.143 -0.440 -7.785 87 HB3 ALA 18 HB3 ALA 18 47.902 -1.749 -8.691 88 H GLY 19 HN GLY 19 49.200 -3.573 -5.561 89 HA2 GLY 19 HA2 GLY 19 50.492 -3.334 -3.623 90 HA3 GLY 19 HA1 GLY 19 50.063 -1.626 -3.643 91 H TRP 20 HN TRP 20 47.505 -3.998 -3.550 92 HA TRP 20 HA TRP 20 46.927 -3.105 -0.773 93 HB2 TRP 20 HB2 TRP 20 45.184 -4.175 -2.972 94 HB3 TRP 20 HB1 TRP 20 44.615 -3.958 -1.312 95 HD1 TRP 20 HD1 TRP 20 45.523 -2.083 -4.427 96 HE1 TRP 20 HE1 TRP 20 45.028 0.412 -4.104 97 HE3 TRP 20 HE3 TRP 20 44.567 -2.088 0.548 98 HZ2 TRP 20 HZ2 TRP 20 44.312 2.204 -1.942 99 HZ3 TRP 20 HZ3 TRP 20 43.999 -0.012 1.736 100 HH2 TRP 20 HH2 TRP 20 43.862 2.148 0.505 101 H GLU 21 HN GLU 21 46.104 -4.631 0.778 102 HA GLU 21 HA GLU 21 46.195 -7.488 0.185 103 HB2 GLU 21 HB2 GLU 21 48.657 -6.586 0.578 104 HB3 GLU 21 HB1 GLU 21 48.176 -6.644 2.274 105 HG2 GLU 21 HG2 GLU 21 47.254 -9.061 1.368 106 HG3 GLU 21 HG1 GLU 21 48.712 -8.855 0.395 107 H MET 22 HN MET 22 44.402 -8.103 1.342 108 HA MET 22 HA MET 22 43.383 -6.602 3.546 109 HB2 MET 22 HB2 MET 22 41.666 -7.863 2.741 110 HB3 MET 22 HB1 MET 22 42.743 -9.150 2.192 111 HG2 MET 22 HG2 MET 22 42.934 -10.047 4.399 112 HG3 MET 22 HG1 MET 22 42.140 -8.641 5.105 113 HE1 MET 22 HE1 MET 22 40.103 -7.840 4.696 114 HE2 MET 22 HE2 MET 22 39.329 -9.000 5.772 115 HE3 MET 22 HE3 MET 22 38.634 -8.682 4.184 116 H ALA 23 HN ALA 23 43.693 -6.882 5.747 117 HA ALA 23 HA ALA 23 45.248 -9.198 6.702 118 HB1 ALA 23 HB1 ALA 23 46.898 -7.661 7.829 119 HB2 ALA 23 HB2 ALA 23 46.227 -6.339 6.873 120 HB3 ALA 23 HB3 ALA 23 47.027 -7.688 6.071 121 H LYS 24 HN LYS 24 45.515 -8.909 9.227 122 HA LYS 24 HA LYS 24 43.089 -7.500 10.225 123 HB2 LYS 24 HB2 LYS 24 43.008 -10.071 10.193 124 HB3 LYS 24 HB1 LYS 24 44.193 -9.993 11.501 125 HG2 LYS 24 HG2 LYS 24 42.619 -8.415 12.700 126 HG3 LYS 24 HG1 LYS 24 41.414 -8.797 11.472 127 HD2 LYS 24 HD2 LYS 24 42.791 -10.863 13.212 128 HD3 LYS 24 HD1 LYS 24 41.184 -10.207 13.526 129 HE2 LYS 24 HE2 LYS 24 40.354 -11.807 12.178 130 HE3 LYS 24 HE1 LYS 24 41.139 -10.987 10.828 131 HZ1 LYS 24 HZ1 LYS 24 42.821 -12.696 12.478 132 HZ2 LYS 24 HZ2 LYS 24 42.833 -12.455 10.796 133 HZ3 LYS 24 HZ3 LYS 24 41.679 -13.483 11.502 134 H THR 25 HN THR 25 43.215 -6.711 12.397 135 HA THR 25 HA THR 25 45.737 -5.474 13.033 136 HB THR 25 HB THR 25 43.482 -4.559 13.617 137 HG1 THR 25 HG1 THR 25 44.563 -3.541 15.084 138 HG21 THR 25 HG21 THR 25 42.808 -6.982 14.352 139 HG22 THR 25 HG22 THR 25 42.096 -5.581 15.152 140 HG23 THR 25 HG23 THR 25 43.420 -6.457 15.919 141 H SER 26 HN SER 26 46.475 -5.775 15.514 142 HA SER 26 HA SER 26 48.011 -7.867 15.994 143 HB2 SER 26 HB2 SER 26 47.862 -6.781 17.994 144 HB3 SER 26 HB1 SER 26 46.142 -6.455 17.795 145 HG SER 26 HG SER 26 45.834 -8.068 19.093 146 H SER 27 HN SER 27 44.475 -8.147 16.007 147 HA SER 27 HA SER 27 44.158 -10.605 14.897 148 HB2 SER 27 HB2 SER 27 45.259 -10.884 17.653 149 HB3 SER 27 HB1 SER 27 44.018 -12.026 17.149 150 HG SER 27 HG SER 27 46.602 -11.984 16.515 151 H GLY 28 HN GLY 28 42.190 -9.231 14.634 152 HA2 GLY 28 HA2 GLY 28 39.960 -10.200 16.013 153 HA3 GLY 28 HA1 GLY 28 40.455 -8.762 16.902 154 H GLN 29 HN GLN 29 41.327 -7.181 14.672 155 HA GLN 29 HA GLN 29 38.681 -6.714 13.391 156 HB2 GLN 29 HB2 GLN 29 40.899 -4.682 13.641 157 HB3 GLN 29 HB1 GLN 29 39.195 -4.394 13.294 158 HG2 GLN 29 HG2 GLN 29 38.534 -4.868 15.505 159 HG3 GLN 29 HG1 GLN 29 40.042 -5.705 15.873 160 HE21 GLN 29 HE21 GLN 29 40.727 -4.339 17.618 161 HE22 GLN 29 HE22 GLN 29 41.111 -2.699 17.403 162 H ARG 30 HN ARG 30 38.580 -7.174 11.258 163 HA ARG 30 HA ARG 30 41.024 -7.685 9.732 164 HB2 ARG 30 HB2 ARG 30 39.627 -8.555 8.072 165 HB3 ARG 30 HB1 ARG 30 38.660 -8.838 9.520 166 HG2 ARG 30 HG2 ARG 30 37.573 -6.579 9.094 167 HG3 ARG 30 HG1 ARG 30 38.375 -6.584 7.523 168 HD2 ARG 30 HD2 ARG 30 36.500 -7.666 6.821 169 HD3 ARG 30 HD1 ARG 30 37.257 -9.081 7.553 170 HE ARG 30 HE ARG 30 35.908 -7.965 9.669 171 HH11 ARG 30 HH11 ARG 30 33.745 -8.405 10.156 172 HH12 ARG 30 HH12 ARG 30 32.671 -8.904 8.891 173 HH21 ARG 30 HH21 ARG 30 35.097 -8.772 6.416 174 HH22 ARG 30 HH22 ARG 30 33.437 -9.112 6.775 175 H TYR 31 HN TYR 31 41.880 -6.326 8.127 176 HA TYR 31 HA TYR 31 40.355 -3.939 7.377 177 HB2 TYR 31 HB2 TYR 31 42.420 -2.475 7.877 178 HB3 TYR 31 HB1 TYR 31 41.376 -2.910 9.221 179 HD1 TYR 31 HD1 TYR 31 43.787 -5.247 7.607 180 HD2 TYR 31 HD2 TYR 31 42.997 -2.700 10.975 181 HE1 TYR 31 HE1 TYR 31 45.751 -6.179 8.787 182 HE2 TYR 31 HE2 TYR 31 44.964 -3.643 12.141 183 HH TYR 31 HH TYR 31 46.844 -4.879 11.870 184 H PHE 32 HN PHE 32 42.165 -2.561 5.929 185 HA PHE 32 HA PHE 32 43.290 -4.651 4.118 186 HB2 PHE 32 HB2 PHE 32 42.064 -2.003 3.303 187 HB3 PHE 32 HB1 PHE 32 42.652 -3.267 2.219 188 HD1 PHE 32 HD1 PHE 32 41.580 -5.586 2.361 189 HD2 PHE 32 HD2 PHE 32 39.865 -2.095 4.185 190 HE1 PHE 32 HE1 PHE 32 39.393 -6.745 2.521 191 HE2 PHE 32 HE2 PHE 32 37.677 -3.253 4.343 192 HZ PHE 32 HZ PHE 32 37.442 -5.578 3.509 193 H LEU 33 HN LEU 33 45.397 -4.460 3.663 194 HA LEU 33 HA LEU 33 46.844 -2.097 4.697 195 HB2 LEU 33 HB2 LEU 33 48.060 -4.503 3.338 196 HB3 LEU 33 HB1 LEU 33 48.814 -3.411 4.499 197 HG LEU 33 HG LEU 33 46.611 -5.418 5.050 198 HD11 LEU 33 HD11 LEU 33 48.444 -6.071 6.799 199 HD12 LEU 33 HD12 LEU 33 49.529 -5.170 5.741 200 HD13 LEU 33 HD13 LEU 33 48.654 -6.570 5.121 201 HD21 LEU 33 HD21 LEU 33 45.943 -3.907 6.609 202 HD22 LEU 33 HD22 LEU 33 47.422 -2.966 6.458 203 HD23 LEU 33 HD23 LEU 33 47.395 -4.400 7.479 204 H ASN 34 HN ASN 34 47.564 -0.482 3.391 205 HA ASN 34 HA ASN 34 47.341 -0.903 0.445 206 HB2 ASN 34 HB2 ASN 34 46.176 1.048 1.813 207 HB3 ASN 34 HB1 ASN 34 47.768 1.796 1.667 208 HD21 ASN 34 HD21 ASN 34 46.068 3.262 0.295 209 HD22 ASN 34 HD22 ASN 34 46.047 2.912 -1.367 210 H HIS 35 HN HIS 35 49.276 -1.419 -0.449 211 HA HIS 35 HA HIS 35 51.795 -0.693 0.834 212 HB2 HIS 35 HB2 HIS 35 51.125 -2.023 -1.805 213 HB3 HIS 35 HB1 HIS 35 52.779 -1.704 -1.283 214 HD1 HIS 35 HD1 HIS 35 53.037 -4.386 -1.244 215 HD2 HIS 35 HD2 HIS 35 50.446 -2.783 1.605 216 HE1 HIS 35 HE1 HIS 35 52.661 -6.200 0.486 217 HE2 HIS 35 HE2 HIS 35 51.086 -5.235 2.223 218 H ILE 36 HN ILE 36 49.597 0.813 -1.234 219 HA ILE 36 HA ILE 36 51.562 2.480 -2.643 220 HB ILE 36 HB ILE 36 48.641 3.136 -2.506 221 HG12 ILE 36 HG12 ILE 36 49.347 0.534 -2.922 222 HG13 ILE 36 HG11 ILE 36 47.929 1.289 -3.633 223 HG21 ILE 36 HG21 ILE 36 50.004 4.587 -3.847 224 HG22 ILE 36 HG22 ILE 36 49.115 3.557 -4.969 225 HG23 ILE 36 HG23 ILE 36 50.811 3.221 -4.617 226 HD11 ILE 36 HD11 ILE 36 49.036 1.683 -5.697 227 HD12 ILE 36 HD12 ILE 36 49.502 0.044 -5.241 228 HD13 ILE 36 HD13 ILE 36 50.624 1.381 -4.991 229 H ASP 37 HN ASP 37 48.911 3.015 -0.337 230 HA ASP 37 HA ASP 37 50.014 5.631 0.382 231 HB2 ASP 37 HB2 ASP 37 47.692 4.120 1.610 232 HB3 ASP 37 HB1 ASP 37 48.079 5.819 1.880 233 H GLN 38 HN GLN 38 50.839 2.631 1.046 234 HA GLN 38 HA GLN 38 51.940 1.530 2.804 235 HB2 GLN 38 HB2 GLN 38 52.958 4.328 2.699 236 HB3 GLN 38 HB1 GLN 38 53.456 3.324 4.062 237 HG2 GLN 38 HG2 GLN 38 54.320 1.623 2.571 238 HG3 GLN 38 HG1 GLN 38 53.677 2.471 1.165 239 HE21 GLN 38 HE21 GLN 38 54.869 4.284 0.346 240 HE22 GLN 38 HE22 GLN 38 56.378 4.749 0.970 241 H THR 39 HN THR 39 49.488 1.660 3.691 242 HA THR 39 HA THR 39 49.735 2.083 6.530 243 HB THR 39 HB THR 39 49.221 4.298 6.321 244 HG1 THR 39 HG1 THR 39 47.556 3.405 7.501 245 HG21 THR 39 HG21 THR 39 48.765 5.175 4.305 246 HG22 THR 39 HG22 THR 39 47.142 4.494 4.383 247 HG23 THR 39 HG23 THR 39 48.458 3.556 3.682 248 H THR 40 HN THR 40 47.212 2.108 7.334 249 HA THR 40 HA THR 40 45.987 -0.234 5.944 250 HB THR 40 HB THR 40 45.033 -0.834 8.180 251 HG1 THR 40 HG1 THR 40 46.355 1.531 8.796 252 HG21 THR 40 HG21 THR 40 47.752 -0.824 9.032 253 HG22 THR 40 HG22 THR 40 47.731 -1.045 7.284 254 HG23 THR 40 HG23 THR 40 46.835 -2.153 8.326 255 H THR 41 HN THR 41 43.588 -0.325 6.142 256 HA THR 41 HA THR 41 42.293 2.275 6.702 257 HB THR 41 HB THR 41 42.312 2.670 4.476 258 HG1 THR 41 HG1 THR 41 40.376 2.199 3.752 259 HG21 THR 41 HG21 THR 41 42.916 -0.239 4.314 260 HG22 THR 41 HG22 THR 41 43.764 1.124 3.581 261 HG23 THR 41 HG23 THR 41 42.258 0.537 2.874 262 H TRP 42 HN TRP 42 40.114 2.114 7.222 263 HA TRP 42 HA TRP 42 39.225 -0.590 8.012 264 HB2 TRP 42 HB2 TRP 42 37.879 2.094 8.457 265 HB3 TRP 42 HB1 TRP 42 37.457 0.568 9.232 266 HD1 TRP 42 HD1 TRP 42 39.281 3.586 9.925 267 HE1 TRP 42 HE1 TRP 42 41.020 3.252 11.801 268 HE3 TRP 42 HE3 TRP 42 39.457 -1.513 10.050 269 HZ2 TRP 42 HZ2 TRP 42 42.315 1.095 13.171 270 HZ3 TRP 42 HZ3 TRP 42 40.945 -2.682 11.649 271 HH2 TRP 42 HH2 TRP 42 42.377 -1.387 13.206 272 H GLN 43 HN GLN 43 39.070 1.437 5.378 273 HA GLN 43 HA GLN 43 36.362 0.493 4.576 274 HB2 GLN 43 HB2 GLN 43 36.914 2.952 4.446 275 HB3 GLN 43 HB1 GLN 43 38.103 2.556 3.205 276 HG2 GLN 43 HG2 GLN 43 36.272 2.999 1.863 277 HG3 GLN 43 HG1 GLN 43 36.036 1.272 2.131 278 HE21 GLN 43 HE21 GLN 43 34.280 4.036 2.058 279 HE22 GLN 43 HE22 GLN 43 33.110 3.686 3.237 280 H ASP 44 HN ASP 44 36.091 -0.594 2.556 281 HA ASP 44 HA ASP 44 38.498 -2.068 1.694 282 HB2 ASP 44 HB2 ASP 44 35.729 -2.452 0.574 283 HB3 ASP 44 HB1 ASP 44 37.027 -3.636 0.736 284 HA PRO 45 HA PRO 45 39.036 0.362 -1.953 285 HB2 PRO 45 HB2 PRO 45 40.095 -1.547 -3.626 286 HB3 PRO 45 HB1 PRO 45 41.016 -0.744 -2.342 287 HG2 PRO 45 HG2 PRO 45 39.783 -3.444 -2.384 288 HG3 PRO 45 HG1 PRO 45 41.295 -2.900 -1.640 289 HD2 PRO 45 HD2 PRO 45 38.987 -3.342 -0.216 290 HD3 PRO 45 HD1 PRO 45 40.245 -2.194 0.291 291 H ARG 46 HN ARG 46 37.051 -2.457 -1.902 292 HA ARG 46 HA ARG 46 36.059 -2.166 -4.634 293 HB2 ARG 46 HB2 ARG 46 35.353 -3.891 -2.273 294 HB3 ARG 46 HB1 ARG 46 34.258 -3.794 -3.653 295 HG2 ARG 46 HG2 ARG 46 35.853 -5.683 -3.877 296 HG3 ARG 46 HG1 ARG 46 36.065 -4.493 -5.162 297 HD2 ARG 46 HD2 ARG 46 37.664 -4.128 -2.669 298 HD3 ARG 46 HD1 ARG 46 38.145 -5.427 -3.760 299 HE ARG 46 HE ARG 46 38.198 -2.531 -4.389 300 HH11 ARG 46 HH11 ARG 46 39.423 -2.039 -6.223 301 HH12 ARG 46 HH12 ARG 46 40.001 -3.323 -7.233 302 HH21 ARG 46 HH21 ARG 46 38.586 -5.833 -5.306 303 HH22 ARG 46 HH22 ARG 46 39.527 -5.469 -6.714 304 H LYS 47 HN LYS 47 35.876 0.066 -2.626 305 HA LYS 47 HA LYS 47 32.951 0.543 -2.920 306 HB2 LYS 47 HB2 LYS 47 34.740 1.074 -0.551 307 HB3 LYS 47 HB1 LYS 47 33.233 1.961 -0.779 308 HG2 LYS 47 HG2 LYS 47 33.263 -1.045 -0.930 309 HG3 LYS 47 HG1 LYS 47 33.184 -0.232 0.633 310 HD2 LYS 47 HD2 LYS 47 31.063 0.558 0.271 311 HD3 LYS 47 HD1 LYS 47 31.320 0.756 -1.462 312 HE2 LYS 47 HE2 LYS 47 29.775 -1.050 -1.249 313 HE3 LYS 47 HE1 LYS 47 31.330 -1.799 -1.607 314 HZ1 LYS 47 HZ1 LYS 47 29.988 -1.569 1.024 315 HZ2 LYS 47 HZ2 LYS 47 31.621 -2.008 0.859 316 HZ3 LYS 47 HZ3 LYS 47 30.405 -2.985 0.188 317 H ALA 48 HN ALA 48 32.399 2.584 -3.688 318 HA ALA 48 HA ALA 48 34.558 4.157 -4.874 319 HB1 ALA 48 HB1 ALA 48 31.897 3.746 -5.492 320 HB2 ALA 48 HB2 ALA 48 32.922 4.993 -6.204 321 HB3 ALA 48 HB3 ALA 48 31.888 5.381 -4.828 322 H MET 49 HN MET 49 35.544 5.872 -3.925 323 HA MET 49 HA MET 49 36.053 7.482 -2.292 324 HB2 MET 49 HB2 MET 49 33.506 8.034 -3.381 325 HB3 MET 49 HB1 MET 49 33.348 8.269 -1.640 326 HG2 MET 49 HG2 MET 49 34.077 10.361 -2.647 327 HG3 MET 49 HG1 MET 49 35.404 9.696 -1.695 328 HE1 MET 49 HE1 MET 49 35.349 11.884 -4.017 329 HE2 MET 49 HE2 MET 49 34.227 10.999 -5.048 330 HE3 MET 49 HE3 MET 49 35.857 11.342 -5.622 331 H GLY 50 HN GLY 50 35.431 8.177 0.056 332 HA2 GLY 50 HA2 GLY 50 34.031 6.117 1.612 333 HA3 GLY 50 HA1 GLY 50 35.773 6.185 1.883 334 H GLY 51 HN GLY 51 33.207 7.029 3.468 335 HA2 GLY 51 HA2 GLY 51 33.836 9.881 3.943 336 HA3 GLY 51 HA1 GLY 51 32.482 8.993 4.645 337 H GLY 52 HN GLY 52 32.735 8.131 6.677 338 HA2 GLY 52 HA2 GLY 52 34.317 6.995 8.279 339 HA3 GLY 52 HA1 GLY 52 35.486 8.244 7.849 340 H GLY 53 HN GLY 53 32.614 7.539 9.708 341 HA2 GLY 53 HA2 GLY 53 32.877 10.235 10.982 342 HA3 GLY 53 HA1 GLY 53 31.312 9.455 10.748 343 H ASN 54 HN ASN 54 34.175 9.562 12.715 344 HA ASN 54 HA ASN 54 34.635 8.607 14.808 345 HB2 ASN 54 HB2 ASN 54 32.258 9.520 15.171 346 HB3 ASN 54 HB1 ASN 54 31.708 7.863 14.920 347 HD21 ASN 54 HD21 ASN 54 31.892 6.421 16.678 348 HD22 ASN 54 HD22 ASN 54 32.671 6.799 18.138 349 H TYR 55 HN TYR 55 35.874 6.862 13.945 350 HA TYR 55 HA TYR 55 34.379 4.295 13.610 351 HB2 TYR 55 HB2 TYR 55 36.621 5.515 12.182 352 HB3 TYR 55 HB1 TYR 55 36.979 3.871 12.710 353 HD1 TYR 55 HD1 TYR 55 34.444 5.932 10.905 354 HD2 TYR 55 HD2 TYR 55 36.036 2.005 11.606 355 HE1 TYR 55 HE1 TYR 55 33.034 5.034 9.073 356 HE2 TYR 55 HE2 TYR 55 34.625 1.106 9.775 357 HH TYR 55 HH TYR 55 32.122 2.993 8.289 358 H GLN 56 HN GLN 56 36.295 2.447 14.062 359 HA GLN 56 HA GLN 56 36.580 2.476 16.921 360 HB2 GLN 56 HB2 GLN 56 38.387 0.681 15.430 361 HB3 GLN 56 HB1 GLN 56 37.193 0.294 16.669 362 HG2 GLN 56 HG2 GLN 56 36.703 0.785 13.723 363 HG3 GLN 56 HG1 GLN 56 36.395 -0.693 14.636 364 HE21 GLN 56 HE21 GLN 56 34.529 1.282 13.123 365 HE22 GLN 56 HE22 GLN 56 33.307 1.614 14.253 366 H GLY 57 HN GLY 57 37.895 4.622 15.236 367 HA2 GLY 57 HA2 GLY 57 39.741 5.982 16.062 368 HA3 GLY 57 HA1 GLY 57 40.529 4.506 16.620 369 HA PRO 58 HA PRO 58 41.477 6.136 12.009 370 HB2 PRO 58 HB2 PRO 58 44.005 6.795 13.475 371 HB3 PRO 58 HB1 PRO 58 43.251 7.627 12.102 372 HG2 PRO 58 HG2 PRO 58 43.079 8.545 14.622 373 HG3 PRO 58 HG1 PRO 58 41.798 8.783 13.423 374 HD2 PRO 58 HD2 PRO 58 41.796 7.064 15.820 375 HD3 PRO 58 HD1 PRO 58 40.425 7.648 14.852 376 HA PRO 59 HA PRO 59 43.423 2.166 11.614 377 HB2 PRO 59 HB2 PRO 59 44.269 2.375 9.020 378 HB3 PRO 59 HB1 PRO 59 42.578 2.097 9.476 379 HG2 PRO 59 HG2 PRO 59 43.921 4.607 8.624 380 HG3 PRO 59 HG1 PRO 59 42.290 4.016 8.263 381 HD2 PRO 59 HD2 PRO 59 42.819 5.939 10.158 382 HD3 PRO 59 HD1 PRO 59 41.407 4.862 10.219 383 HA PRO 60 HA PRO 60 47.694 3.431 12.382 384 HB2 PRO 60 HB2 PRO 60 48.455 1.140 13.636 385 HB3 PRO 60 HB1 PRO 60 47.485 2.391 14.437 386 HG2 PRO 60 HG2 PRO 60 46.647 -0.219 13.306 387 HG3 PRO 60 HG1 PRO 60 46.048 0.642 14.732 388 HD2 PRO 60 HD2 PRO 60 44.771 0.591 12.256 389 HD3 PRO 60 HD1 PRO 60 44.496 1.813 13.515 390 HA PRO 61 HA PRO 61 49.625 1.884 8.684 391 HB2 PRO 61 HB2 PRO 61 52.025 1.860 10.483 392 HB3 PRO 61 HB1 PRO 61 51.860 2.497 8.834 393 HG2 PRO 61 HG2 PRO 61 51.840 4.099 10.967 394 HG3 PRO 61 HG1 PRO 61 50.854 4.428 9.533 395 HD2 PRO 61 HD2 PRO 61 49.988 3.538 12.225 396 HD3 PRO 61 HD1 PRO 61 49.053 4.357 10.954 397 H TYR 62 HN TYR 62 49.717 -0.179 7.948 398 HA TYR 62 HA TYR 62 49.259 -2.502 9.308 399 HB2 TYR 62 HB2 TYR 62 50.941 -3.536 7.533 400 HB3 TYR 62 HB1 TYR 62 49.427 -2.804 7.007 401 HD1 TYR 62 HD1 TYR 62 52.853 -1.623 7.983 402 HD2 TYR 62 HD2 TYR 62 49.602 -1.388 5.192 403 HE1 TYR 62 HE1 TYR 62 54.115 0.043 6.662 404 HE2 TYR 62 HE2 TYR 62 50.858 0.272 3.868 405 HH TYR 62 HH TYR 62 54.140 1.303 4.844 406 HA PRO 63 HA PRO 63 52.445 -3.739 12.077 407 HB2 PRO 63 HB2 PRO 63 53.377 -6.077 10.750 408 HB3 PRO 63 HB1 PRO 63 52.138 -5.991 12.015 409 HG2 PRO 63 HG2 PRO 63 51.828 -6.142 9.073 410 HG3 PRO 63 HG1 PRO 63 50.786 -6.779 10.357 411 HD2 PRO 63 HD2 PRO 63 50.062 -4.607 8.960 412 HD3 PRO 63 HD1 PRO 63 49.730 -4.716 10.704 413 H LYS 64 HN LYS 64 54.842 -4.073 12.238 414 HA LYS 64 HA LYS 64 56.214 -2.736 9.957 415 HB2 LYS 64 HB2 LYS 64 57.180 -3.186 12.799 416 HB3 LYS 64 HB1 LYS 64 57.984 -2.212 11.567 417 HG2 LYS 64 HG2 LYS 64 56.027 -0.714 11.466 418 HG3 LYS 64 HG1 LYS 64 55.220 -1.685 12.697 419 HD2 LYS 64 HD2 LYS 64 56.411 -0.745 14.376 420 HD3 LYS 64 HD1 LYS 64 57.923 -0.857 13.476 421 HE2 LYS 64 HE2 LYS 64 57.144 1.508 13.964 422 HE3 LYS 64 HE1 LYS 64 57.450 1.162 12.262 423 HZ1 LYS 64 HZ1 LYS 64 55.158 0.927 11.844 424 HZ2 LYS 64 HZ2 LYS 64 55.313 2.345 12.769 425 HZ3 LYS 64 HZ3 LYS 64 54.768 0.909 13.495 426 H HIS 65 HN HIS 65 56.952 -4.280 8.552 427 HA HIS 65 HA HIS 65 58.665 -6.434 9.701 428 HB2 HIS 65 HB2 HIS 65 56.131 -6.855 8.533 429 HB3 HIS 65 HB1 HIS 65 57.306 -7.347 7.314 430 HD1 HIS 65 HD1 HIS 65 58.054 -9.706 7.559 431 HD2 HIS 65 HD2 HIS 65 56.960 -8.068 11.236 432 HE1 HIS 65 HE1 HIS 65 58.338 -11.548 9.277 433 HE2 HIS 65 HE2 HIS 65 57.674 -10.561 11.519 Start of MODEL 18 1 H1 SER 7 HT1 SER 7 21.308 -6.336 -3.485 2 H2 SER 7 HT2 SER 7 22.729 -6.981 -2.816 3 H3 SER 7 HT3 SER 7 21.721 -7.954 -3.776 4 HA SER 7 HA SER 7 22.221 -5.984 -5.491 5 HB2 SER 7 HB2 SER 7 24.629 -5.465 -5.314 6 HB3 SER 7 HB1 SER 7 23.754 -4.882 -3.902 7 HG SER 7 HG SER 7 24.903 -7.457 -3.949 8 H PHE 8 HN PHE 8 25.214 -7.260 -5.560 9 HA PHE 8 HA PHE 8 24.264 -9.779 -6.868 10 HB2 PHE 8 HB2 PHE 8 26.839 -8.435 -7.632 11 HB3 PHE 8 HB1 PHE 8 25.802 -9.483 -8.599 12 HD1 PHE 8 HD1 PHE 8 26.040 -6.098 -7.060 13 HD2 PHE 8 HD2 PHE 8 24.050 -8.591 -9.936 14 HE1 PHE 8 HE1 PHE 8 24.894 -4.107 -7.993 15 HE2 PHE 8 HE2 PHE 8 22.903 -6.600 -10.869 16 HZ PHE 8 HZ PHE 8 23.325 -4.357 -9.898 17 H GLU 9 HN GLU 9 26.974 -10.730 -7.282 18 HA GLU 9 HA GLU 9 27.747 -11.276 -4.441 19 HB2 GLU 9 HB2 GLU 9 28.152 -13.165 -6.771 20 HB3 GLU 9 HB1 GLU 9 28.293 -13.525 -5.049 21 HG2 GLU 9 HG2 GLU 9 25.713 -12.624 -6.354 22 HG3 GLU 9 HG1 GLU 9 26.138 -14.319 -6.111 23 H ILE 10 HN ILE 10 29.660 -10.286 -4.029 24 HA ILE 10 HA ILE 10 31.433 -9.266 -6.001 25 HB ILE 10 HB ILE 10 32.439 -10.125 -3.305 26 HG12 ILE 10 HG12 ILE 10 30.281 -8.120 -3.914 27 HG13 ILE 10 HG11 ILE 10 30.392 -9.260 -2.572 28 HG21 ILE 10 HG21 ILE 10 33.796 -8.206 -3.490 29 HG22 ILE 10 HG22 ILE 10 32.733 -7.460 -4.683 30 HG23 ILE 10 HG23 ILE 10 33.746 -8.830 -5.139 31 HD11 ILE 10 HD11 ILE 10 30.916 -7.230 -1.532 32 HD12 ILE 10 HD12 ILE 10 31.802 -6.629 -2.935 33 HD13 ILE 10 HD13 ILE 10 32.513 -7.876 -1.910 34 HA PRO 11 HA PRO 11 32.951 -13.214 -7.573 35 HB2 PRO 11 HB2 PRO 11 35.105 -11.355 -8.493 36 HB3 PRO 11 HB1 PRO 11 34.214 -12.588 -9.406 37 HG2 PRO 11 HG2 PRO 11 33.676 -9.982 -9.654 38 HG3 PRO 11 HG1 PRO 11 32.416 -11.222 -9.763 39 HD2 PRO 11 HD2 PRO 11 32.940 -9.270 -7.586 40 HD3 PRO 11 HD1 PRO 11 31.426 -10.091 -8.028 41 H ASP 12 HN ASP 12 34.235 -14.663 -6.496 42 HA ASP 12 HA ASP 12 35.899 -13.804 -4.308 43 HB2 ASP 12 HB2 ASP 12 35.135 -16.393 -5.535 44 HB3 ASP 12 HB1 ASP 12 36.673 -16.374 -4.670 45 H ASP 13 HN ASP 13 36.402 -13.482 -7.432 46 HA ASP 13 HA ASP 13 39.334 -13.977 -7.245 47 HB2 ASP 13 HB2 ASP 13 38.992 -13.655 -9.888 48 HB3 ASP 13 HB1 ASP 13 38.789 -15.222 -9.105 49 H VAL 14 HN VAL 14 37.990 -11.621 -6.205 50 HA VAL 14 HA VAL 14 38.895 -9.542 -8.133 51 HB VAL 14 HB VAL 14 36.522 -9.409 -7.391 52 HG11 VAL 14 HG11 VAL 14 37.407 -10.268 -4.993 53 HG12 VAL 14 HG12 VAL 14 35.904 -9.366 -5.182 54 HG13 VAL 14 HG13 VAL 14 37.373 -8.534 -4.678 55 HG21 VAL 14 HG21 VAL 14 36.577 -7.110 -7.284 56 HG22 VAL 14 HG22 VAL 14 38.262 -7.382 -7.727 57 HG23 VAL 14 HG23 VAL 14 37.828 -7.094 -6.042 58 HA PRO 15 HA PRO 15 42.116 -9.453 -4.886 59 HB2 PRO 15 HB2 PRO 15 44.135 -8.653 -6.538 60 HB3 PRO 15 HB1 PRO 15 43.639 -10.346 -6.359 61 HG2 PRO 15 HG2 PRO 15 43.036 -8.416 -8.530 62 HG3 PRO 15 HG1 PRO 15 43.334 -10.160 -8.614 63 HD2 PRO 15 HD2 PRO 15 40.822 -9.005 -8.723 64 HD3 PRO 15 HD1 PRO 15 41.131 -10.682 -8.224 65 H LEU 16 HN LEU 16 43.088 -7.655 -3.814 66 HA LEU 16 HA LEU 16 41.820 -5.119 -4.101 67 HB2 LEU 16 HB2 LEU 16 44.510 -5.768 -2.863 68 HB3 LEU 16 HB1 LEU 16 43.565 -4.319 -2.564 69 HG LEU 16 HG LEU 16 43.505 -6.566 -1.025 70 HD11 LEU 16 HD11 LEU 16 42.631 -4.664 -0.059 71 HD12 LEU 16 HD12 LEU 16 41.135 -5.540 -0.385 72 HD13 LEU 16 HD13 LEU 16 41.663 -4.260 -1.476 73 HD21 LEU 16 HD21 LEU 16 42.351 -7.975 -2.600 74 HD22 LEU 16 HD22 LEU 16 41.171 -6.713 -2.959 75 HD23 LEU 16 HD23 LEU 16 41.174 -7.495 -1.384 76 HA PRO 17 HA PRO 17 44.123 -2.941 -7.204 77 HB2 PRO 17 HB2 PRO 17 45.081 -0.886 -5.330 78 HB3 PRO 17 HB1 PRO 17 44.015 -0.722 -6.732 79 HG2 PRO 17 HG2 PRO 17 43.128 -0.513 -4.204 80 HG3 PRO 17 HG1 PRO 17 42.133 -1.143 -5.527 81 HD2 PRO 17 HD2 PRO 17 43.496 -2.624 -3.323 82 HD3 PRO 17 HD1 PRO 17 41.960 -2.984 -4.140 83 H ALA 18 HN ALA 18 46.448 -1.240 -6.499 84 HA ALA 18 HA ALA 18 48.427 -3.413 -6.602 85 HB1 ALA 18 HB1 ALA 18 49.952 -1.371 -7.040 86 HB2 ALA 18 HB2 ALA 18 48.444 -0.463 -7.160 87 HB3 ALA 18 HB3 ALA 18 48.760 -1.799 -8.267 88 H GLY 19 HN GLY 19 49.937 -3.818 -5.035 89 HA2 GLY 19 HA2 GLY 19 51.060 -3.699 -2.985 90 HA3 GLY 19 HA1 GLY 19 50.767 -1.963 -3.027 91 H TRP 20 HN TRP 20 48.032 -4.127 -3.153 92 HA TRP 20 HA TRP 20 47.313 -3.197 -0.420 93 HB2 TRP 20 HB2 TRP 20 45.669 -4.135 -2.753 94 HB3 TRP 20 HB1 TRP 20 44.991 -3.878 -1.140 95 HD1 TRP 20 HD1 TRP 20 46.276 -2.071 -4.164 96 HE1 TRP 20 HE1 TRP 20 45.946 0.452 -3.859 97 HE3 TRP 20 HE3 TRP 20 44.936 -2.022 0.720 98 HZ2 TRP 20 HZ2 TRP 20 45.198 2.287 -1.740 99 HZ3 TRP 20 HZ3 TRP 20 44.433 0.086 1.880 100 HH2 TRP 20 HH2 TRP 20 44.555 2.256 0.663 101 H GLU 21 HN GLU 21 46.306 -4.681 1.078 102 HA GLU 21 HA GLU 21 46.232 -7.526 0.426 103 HB2 GLU 21 HB2 GLU 21 48.712 -6.936 0.844 104 HB3 GLU 21 HB1 GLU 21 48.243 -6.735 2.533 105 HG2 GLU 21 HG2 GLU 21 47.426 -9.022 2.631 106 HG3 GLU 21 HG1 GLU 21 47.719 -9.239 0.906 107 H MET 22 HN MET 22 44.441 -8.175 1.544 108 HA MET 22 HA MET 22 43.325 -6.688 3.713 109 HB2 MET 22 HB2 MET 22 42.495 -8.793 2.094 110 HB3 MET 22 HB1 MET 22 42.601 -9.517 3.701 111 HG2 MET 22 HG2 MET 22 41.304 -7.537 4.574 112 HG3 MET 22 HG1 MET 22 41.039 -7.060 2.898 113 HE1 MET 22 HE1 MET 22 37.799 -8.423 4.537 114 HE2 MET 22 HE2 MET 22 39.127 -7.350 4.967 115 HE3 MET 22 HE3 MET 22 39.025 -8.949 5.697 116 H ALA 23 HN ALA 23 43.663 -6.864 5.897 117 HA ALA 23 HA ALA 23 45.148 -9.195 6.947 118 HB1 ALA 23 HB1 ALA 23 46.966 -7.736 6.386 119 HB2 ALA 23 HB2 ALA 23 46.731 -7.587 8.127 120 HB3 ALA 23 HB3 ALA 23 46.122 -6.337 7.042 121 H LYS 24 HN LYS 24 45.334 -8.875 9.476 122 HA LYS 24 HA LYS 24 42.808 -7.561 10.364 123 HB2 LYS 24 HB2 LYS 24 43.342 -10.206 10.617 124 HB3 LYS 24 HB1 LYS 24 44.006 -9.596 12.134 125 HG2 LYS 24 HG2 LYS 24 41.939 -8.623 12.776 126 HG3 LYS 24 HG1 LYS 24 41.267 -8.793 11.155 127 HD2 LYS 24 HD2 LYS 24 40.518 -10.525 12.925 128 HD3 LYS 24 HD1 LYS 24 41.041 -11.141 11.360 129 HE2 LYS 24 HE2 LYS 24 43.022 -10.821 13.604 130 HE3 LYS 24 HE1 LYS 24 41.997 -12.254 13.514 131 HZ1 LYS 24 HZ1 LYS 24 42.805 -12.287 11.065 132 HZ2 LYS 24 HZ2 LYS 24 43.810 -12.895 12.293 133 HZ3 LYS 24 HZ3 LYS 24 44.085 -11.345 11.657 134 H THR 25 HN THR 25 42.799 -6.590 12.397 135 HA THR 25 HA THR 25 45.224 -5.113 13.012 136 HB THR 25 HB THR 25 42.764 -4.359 13.143 137 HG1 THR 25 HG1 THR 25 44.566 -4.008 15.307 138 HG21 THR 25 HG21 THR 25 42.433 -6.544 14.621 139 HG22 THR 25 HG22 THR 25 41.434 -5.109 14.840 140 HG23 THR 25 HG23 THR 25 42.793 -5.410 15.921 141 H SER 26 HN SER 26 46.181 -5.138 15.226 142 HA SER 26 HA SER 26 46.700 -7.813 16.148 143 HB2 SER 26 HB2 SER 26 47.911 -5.381 16.524 144 HB3 SER 26 HB1 SER 26 47.134 -5.623 18.086 145 HG SER 26 HG SER 26 48.600 -7.058 18.500 146 H SER 27 HN SER 27 43.847 -7.085 16.068 147 HA SER 27 HA SER 27 43.206 -7.768 18.887 148 HB2 SER 27 HB2 SER 27 42.903 -5.214 18.107 149 HB3 SER 27 HB1 SER 27 41.369 -5.860 17.531 150 HG SER 27 HG SER 27 40.769 -5.716 19.534 151 H GLY 28 HN GLY 28 42.538 -8.080 15.485 152 HA2 GLY 28 HA2 GLY 28 41.401 -10.246 14.917 153 HA3 GLY 28 HA1 GLY 28 40.257 -9.881 16.206 154 H GLN 29 HN GLN 29 40.987 -7.003 14.652 155 HA GLN 29 HA GLN 29 38.419 -7.135 13.197 156 HB2 GLN 29 HB2 GLN 29 39.327 -5.155 14.717 157 HB3 GLN 29 HB1 GLN 29 40.121 -4.675 13.214 158 HG2 GLN 29 HG2 GLN 29 37.160 -5.279 13.445 159 HG3 GLN 29 HG1 GLN 29 37.844 -3.654 13.521 160 HE21 GLN 29 HE21 GLN 29 38.974 -2.855 11.544 161 HE22 GLN 29 HE22 GLN 29 38.599 -3.523 10.029 162 H ARG 30 HN ARG 30 38.293 -7.092 10.980 163 HA ARG 30 HA ARG 30 40.791 -7.586 9.517 164 HB2 ARG 30 HB2 ARG 30 39.475 -8.485 7.839 165 HB3 ARG 30 HB1 ARG 30 38.415 -8.732 9.227 166 HG2 ARG 30 HG2 ARG 30 37.432 -6.424 8.686 167 HG3 ARG 30 HG1 ARG 30 38.273 -6.553 7.140 168 HD2 ARG 30 HD2 ARG 30 36.025 -7.385 6.823 169 HD3 ARG 30 HD1 ARG 30 37.120 -8.766 6.786 170 HE ARG 30 HE ARG 30 36.258 -9.464 8.914 171 HH11 ARG 30 HH11 ARG 30 34.572 -9.425 10.417 172 HH12 ARG 30 HH12 ARG 30 33.468 -8.090 10.426 173 HH21 ARG 30 HH21 ARG 30 35.019 -6.447 7.795 174 HH22 ARG 30 HH22 ARG 30 33.722 -6.404 8.941 175 H TYR 31 HN TYR 31 41.754 -6.174 8.121 176 HA TYR 31 HA TYR 31 40.259 -3.821 7.205 177 HB2 TYR 31 HB2 TYR 31 42.210 -2.302 7.839 178 HB3 TYR 31 HB1 TYR 31 41.153 -2.805 9.148 179 HD1 TYR 31 HD1 TYR 31 42.886 -2.313 10.807 180 HD2 TYR 31 HD2 TYR 31 43.543 -5.219 7.714 181 HE1 TYR 31 HE1 TYR 31 44.860 -3.171 12.029 182 HE2 TYR 31 HE2 TYR 31 45.509 -6.074 8.950 183 HH TYR 31 HH TYR 31 46.119 -5.828 11.859 184 H PHE 32 HN PHE 32 42.201 -2.466 5.868 185 HA PHE 32 HA PHE 32 43.426 -4.616 4.191 186 HB2 PHE 32 HB2 PHE 32 42.375 -1.962 3.188 187 HB3 PHE 32 HB1 PHE 32 42.913 -3.335 2.219 188 HD1 PHE 32 HD1 PHE 32 40.354 -2.255 4.706 189 HD2 PHE 32 HD2 PHE 32 41.449 -5.132 1.712 190 HE1 PHE 32 HE1 PHE 32 38.082 -3.243 4.824 191 HE2 PHE 32 HE2 PHE 32 39.175 -6.116 1.826 192 HZ PHE 32 HZ PHE 32 37.492 -5.171 3.381 193 H LEU 33 HN LEU 33 45.566 -4.485 3.939 194 HA LEU 33 HA LEU 33 47.009 -2.159 5.023 195 HB2 LEU 33 HB2 LEU 33 48.249 -4.514 3.598 196 HB3 LEU 33 HB1 LEU 33 48.961 -3.496 4.848 197 HG LEU 33 HG LEU 33 46.687 -5.470 5.207 198 HD11 LEU 33 HD11 LEU 33 49.608 -5.429 5.873 199 HD12 LEU 33 HD12 LEU 33 48.614 -6.761 5.284 200 HD13 LEU 33 HD13 LEU 33 48.502 -6.256 6.969 201 HD21 LEU 33 HD21 LEU 33 46.065 -3.955 6.804 202 HD22 LEU 33 HD22 LEU 33 47.654 -3.199 6.847 203 HD23 LEU 33 HD23 LEU 33 47.377 -4.705 7.714 204 H ASN 34 HN ASN 34 48.126 -0.637 3.775 205 HA ASN 34 HA ASN 34 47.814 -0.935 0.814 206 HB2 ASN 34 HB2 ASN 34 46.597 0.984 2.083 207 HB3 ASN 34 HB1 ASN 34 48.201 1.703 2.210 208 HD21 ASN 34 HD21 ASN 34 48.397 -0.032 -0.578 209 HD22 ASN 34 HD22 ASN 34 47.895 1.143 -1.696 210 H HIS 35 HN HIS 35 49.779 -1.678 0.134 211 HA HIS 35 HA HIS 35 52.261 -0.892 1.443 212 HB2 HIS 35 HB2 HIS 35 51.981 -2.227 -1.259 213 HB3 HIS 35 HB1 HIS 35 53.348 -2.311 -0.148 214 HD1 HIS 35 HD1 HIS 35 52.508 -5.006 -0.720 215 HD2 HIS 35 HD2 HIS 35 50.382 -2.751 2.076 216 HE1 HIS 35 HE1 HIS 35 51.238 -6.660 0.722 217 HE2 HIS 35 HE2 HIS 35 49.943 -5.299 2.426 218 H ILE 36 HN ILE 36 50.252 0.461 -0.954 219 HA ILE 36 HA ILE 36 52.366 1.903 -2.374 220 HB ILE 36 HB ILE 36 49.462 2.678 -2.390 221 HG12 ILE 36 HG12 ILE 36 50.066 0.072 -2.614 222 HG13 ILE 36 HG11 ILE 36 48.790 0.824 -3.553 223 HG21 ILE 36 HG21 ILE 36 50.885 4.059 -3.735 224 HG22 ILE 36 HG22 ILE 36 50.059 2.974 -4.853 225 HG23 ILE 36 HG23 ILE 36 51.732 2.659 -4.393 226 HD11 ILE 36 HD11 ILE 36 50.614 -0.614 -4.781 227 HD12 ILE 36 HD12 ILE 36 51.603 0.835 -4.606 228 HD13 ILE 36 HD13 ILE 36 50.083 0.907 -5.500 229 H ASP 37 HN ASP 37 49.699 2.778 -0.204 230 HA ASP 37 HA ASP 37 51.031 5.350 0.349 231 HB2 ASP 37 HB2 ASP 37 48.337 4.274 1.216 232 HB3 ASP 37 HB1 ASP 37 48.945 5.878 1.625 233 H GLN 38 HN GLN 38 51.459 2.399 1.381 234 HA GLN 38 HA GLN 38 52.160 1.389 3.389 235 HB2 GLN 38 HB2 GLN 38 53.352 4.137 3.309 236 HB3 GLN 38 HB1 GLN 38 53.584 3.151 4.753 237 HG2 GLN 38 HG2 GLN 38 54.358 1.284 3.200 238 HG3 GLN 38 HG1 GLN 38 54.393 2.491 1.915 239 HE21 GLN 38 HE21 GLN 38 56.755 2.367 1.752 240 HE22 GLN 38 HE22 GLN 38 57.753 3.031 2.954 241 H THR 39 HN THR 39 49.542 1.943 3.683 242 HA THR 39 HA THR 39 49.382 2.704 6.515 243 HB THR 39 HB THR 39 48.698 4.776 5.909 244 HG1 THR 39 HG1 THR 39 46.438 3.187 5.351 245 HG21 THR 39 HG21 THR 39 48.929 5.227 3.715 246 HG22 THR 39 HG22 THR 39 47.254 4.712 3.528 247 HG23 THR 39 HG23 THR 39 48.562 3.561 3.274 248 H THR 40 HN THR 40 46.756 2.617 6.923 249 HA THR 40 HA THR 40 45.816 0.097 5.640 250 HB THR 40 HB THR 40 44.837 -0.470 7.948 251 HG1 THR 40 HG1 THR 40 45.801 0.558 9.670 252 HG21 THR 40 HG21 THR 40 46.561 -1.897 8.071 253 HG22 THR 40 HG22 THR 40 47.669 -0.594 8.494 254 HG23 THR 40 HG23 THR 40 47.352 -0.965 6.801 255 H THR 41 HN THR 41 43.433 -0.099 5.685 256 HA THR 41 HA THR 41 42.008 2.404 6.376 257 HB THR 41 HB THR 41 41.922 2.867 4.179 258 HG1 THR 41 HG1 THR 41 40.250 1.658 3.095 259 HG21 THR 41 HG21 THR 41 42.181 0.862 2.478 260 HG22 THR 41 HG22 THR 41 42.828 0.035 3.896 261 HG23 THR 41 HG23 THR 41 43.590 1.515 3.314 262 H TRP 42 HN TRP 42 39.916 2.116 7.048 263 HA TRP 42 HA TRP 42 39.156 -0.609 7.824 264 HB2 TRP 42 HB2 TRP 42 37.605 1.986 8.106 265 HB3 TRP 42 HB1 TRP 42 37.254 0.466 8.925 266 HD1 TRP 42 HD1 TRP 42 38.833 3.628 9.566 267 HE1 TRP 42 HE1 TRP 42 40.506 3.491 11.527 268 HE3 TRP 42 HE3 TRP 42 39.360 -1.438 9.910 269 HZ2 TRP 42 HZ2 TRP 42 41.879 1.486 13.042 270 HZ3 TRP 42 HZ3 TRP 42 40.852 -2.435 11.620 271 HH2 TRP 42 HH2 TRP 42 42.113 -0.980 13.182 272 H GLN 43 HN GLN 43 38.873 1.308 5.098 273 HA GLN 43 HA GLN 43 36.301 0.044 4.286 274 HB2 GLN 43 HB2 GLN 43 36.608 2.575 4.144 275 HB3 GLN 43 HB1 GLN 43 37.760 2.266 2.845 276 HG2 GLN 43 HG2 GLN 43 36.129 1.707 1.361 277 HG3 GLN 43 HG1 GLN 43 35.192 0.834 2.575 278 HE21 GLN 43 HE21 GLN 43 33.239 1.985 1.718 279 HE22 GLN 43 HE22 GLN 43 32.943 3.590 2.186 280 H ASP 44 HN ASP 44 36.218 -0.702 1.969 281 HA ASP 44 HA ASP 44 38.820 -1.943 1.225 282 HB2 ASP 44 HB2 ASP 44 36.249 -2.930 0.081 283 HB3 ASP 44 HB1 ASP 44 37.688 -3.835 0.551 284 HA PRO 45 HA PRO 45 38.841 0.532 -2.438 285 HB2 PRO 45 HB2 PRO 45 40.153 -1.250 -4.116 286 HB3 PRO 45 HB1 PRO 45 40.956 -0.180 -2.953 287 HG2 PRO 45 HG2 PRO 45 40.316 -3.070 -2.737 288 HG3 PRO 45 HG1 PRO 45 41.713 -2.169 -2.125 289 HD2 PRO 45 HD2 PRO 45 39.666 -2.975 -0.513 290 HD3 PRO 45 HD1 PRO 45 40.612 -1.501 -0.200 291 H ARG 46 HN ARG 46 37.159 -2.370 -2.112 292 HA ARG 46 HA ARG 46 36.050 -2.266 -4.857 293 HB2 ARG 46 HB2 ARG 46 35.808 -4.297 -2.626 294 HB3 ARG 46 HB1 ARG 46 34.900 -4.407 -4.134 295 HG2 ARG 46 HG2 ARG 46 36.772 -4.907 -5.388 296 HG3 ARG 46 HG1 ARG 46 37.852 -4.001 -4.327 297 HD2 ARG 46 HD2 ARG 46 36.604 -6.705 -3.769 298 HD3 ARG 46 HD1 ARG 46 38.314 -6.361 -4.030 299 HE ARG 46 HE ARG 46 37.846 -4.810 -1.876 300 HH11 ARG 46 HH11 ARG 46 37.753 -5.485 0.280 301 HH12 ARG 46 HH12 ARG 46 37.263 -7.106 0.645 302 HH21 ARG 46 HH21 ARG 46 36.801 -7.996 -2.674 303 HH22 ARG 46 HH22 ARG 46 36.724 -8.528 -1.027 304 H LYS 47 HN LYS 47 35.495 -0.305 -2.669 305 HA LYS 47 HA LYS 47 32.538 -0.496 -2.812 306 HB2 LYS 47 HB2 LYS 47 34.141 0.056 -0.299 307 HB3 LYS 47 HB1 LYS 47 32.397 0.275 -0.435 308 HG2 LYS 47 HG2 LYS 47 32.399 -2.199 -1.272 309 HG3 LYS 47 HG1 LYS 47 33.986 -2.277 -0.506 310 HD2 LYS 47 HD2 LYS 47 32.954 -1.425 1.608 311 HD3 LYS 47 HD1 LYS 47 31.374 -1.515 0.829 312 HE2 LYS 47 HE2 LYS 47 31.608 -3.915 0.517 313 HE3 LYS 47 HE1 LYS 47 33.259 -3.870 1.137 314 HZ1 LYS 47 HZ1 LYS 47 31.882 -4.562 2.905 315 HZ2 LYS 47 HZ2 LYS 47 30.750 -3.328 2.620 316 HZ3 LYS 47 HZ3 LYS 47 32.288 -2.949 3.236 317 H ALA 48 HN ALA 48 31.785 1.377 -3.661 318 HA ALA 48 HA ALA 48 33.453 3.835 -3.302 319 HB1 ALA 48 HB1 ALA 48 32.660 2.645 -5.665 320 HB2 ALA 48 HB2 ALA 48 33.143 4.332 -5.492 321 HB3 ALA 48 HB3 ALA 48 31.436 3.893 -5.436 322 H MET 49 HN MET 49 31.476 2.916 -1.386 323 HA MET 49 HA MET 49 29.474 5.122 -1.677 324 HB2 MET 49 HB2 MET 49 28.847 2.740 0.013 325 HB3 MET 49 HB1 MET 49 27.764 3.762 -0.932 326 HG2 MET 49 HG2 MET 49 27.787 1.824 -2.223 327 HG3 MET 49 HG1 MET 49 29.080 2.754 -2.981 328 HE1 MET 49 HE1 MET 49 30.160 -0.916 -3.182 329 HE2 MET 49 HE2 MET 49 28.945 0.232 -3.739 330 HE3 MET 49 HE3 MET 49 28.564 -0.874 -2.421 331 H GLY 50 HN GLY 50 28.833 6.119 0.368 332 HA2 GLY 50 HA2 GLY 50 30.923 5.788 2.484 333 HA3 GLY 50 HA1 GLY 50 30.150 7.329 2.112 334 H GLY 51 HN GLY 51 30.206 5.283 4.518 335 HA2 GLY 51 HA2 GLY 51 27.244 5.249 4.933 336 HA3 GLY 51 HA1 GLY 51 28.361 4.121 5.704 337 H GLY 52 HN GLY 52 30.307 6.387 6.160 338 HA2 GLY 52 HA2 GLY 52 30.830 7.625 8.105 339 HA3 GLY 52 HA1 GLY 52 29.385 8.522 7.639 340 H GLY 53 HN GLY 53 30.408 5.614 9.435 341 HA2 GLY 53 HA2 GLY 53 28.107 6.111 11.277 342 HA3 GLY 53 HA1 GLY 53 28.503 4.477 10.744 343 H ASN 54 HN ASN 54 30.783 7.053 11.628 344 HA ASN 54 HA ASN 54 32.480 7.072 13.249 345 HB2 ASN 54 HB2 ASN 54 30.341 6.985 14.680 346 HB3 ASN 54 HB1 ASN 54 30.684 5.266 14.876 347 HD21 ASN 54 HD21 ASN 54 32.324 4.671 16.361 348 HD22 ASN 54 HD22 ASN 54 33.269 5.791 17.217 349 H TYR 55 HN TYR 55 34.348 5.925 13.149 350 HA TYR 55 HA TYR 55 34.137 2.954 12.865 351 HB2 TYR 55 HB2 TYR 55 36.655 4.255 12.033 352 HB3 TYR 55 HB1 TYR 55 35.711 3.005 11.221 353 HD1 TYR 55 HD1 TYR 55 36.850 6.224 10.815 354 HD2 TYR 55 HD2 TYR 55 33.189 3.987 10.595 355 HE1 TYR 55 HE1 TYR 55 35.897 7.932 9.290 356 HE2 TYR 55 HE2 TYR 55 32.236 5.695 9.070 357 HH TYR 55 HH TYR 55 34.158 8.525 8.053 358 H GLN 56 HN GLN 56 36.500 2.019 13.490 359 HA GLN 56 HA GLN 56 36.762 2.507 16.325 360 HB2 GLN 56 HB2 GLN 56 37.228 0.303 15.168 361 HB3 GLN 56 HB1 GLN 56 38.709 1.026 14.538 362 HG2 GLN 56 HG2 GLN 56 39.692 0.341 16.454 363 HG3 GLN 56 HG1 GLN 56 38.801 1.642 17.244 364 HE21 GLN 56 HE21 GLN 56 39.353 -0.627 18.771 365 HE22 GLN 56 HE22 GLN 56 37.932 -1.522 19.015 366 H GLY 57 HN GLY 57 37.349 4.695 14.310 367 HA2 GLY 57 HA2 GLY 57 38.705 6.642 14.681 368 HA3 GLY 57 HA1 GLY 57 39.798 5.660 15.661 369 HA PRO 58 HA PRO 58 41.684 6.195 11.446 370 HB2 PRO 58 HB2 PRO 58 44.083 7.174 12.304 371 HB3 PRO 58 HB1 PRO 58 42.673 8.204 11.993 372 HG2 PRO 58 HG2 PRO 58 43.771 7.226 14.573 373 HG3 PRO 58 HG1 PRO 58 43.029 8.784 14.177 374 HD2 PRO 58 HD2 PRO 58 41.717 6.732 15.494 375 HD3 PRO 58 HD1 PRO 58 40.899 8.012 14.571 376 HA PRO 59 HA PRO 59 43.721 2.265 12.178 377 HB2 PRO 59 HB2 PRO 59 44.149 1.633 9.576 378 HB3 PRO 59 HB1 PRO 59 42.547 1.545 10.323 379 HG2 PRO 59 HG2 PRO 59 43.693 3.628 8.540 380 HG3 PRO 59 HG1 PRO 59 42.050 2.968 8.599 381 HD2 PRO 59 HD2 PRO 59 42.786 5.389 9.718 382 HD3 PRO 59 HD1 PRO 59 41.385 4.431 10.241 383 HA PRO 60 HA PRO 60 47.963 3.898 12.142 384 HB2 PRO 60 HB2 PRO 60 48.579 1.127 13.007 385 HB3 PRO 60 HB1 PRO 60 48.974 2.666 13.792 386 HG2 PRO 60 HG2 PRO 60 47.079 0.998 14.721 387 HG3 PRO 60 HG1 PRO 60 47.005 2.756 14.919 388 HD2 PRO 60 HD2 PRO 60 45.428 1.003 13.104 389 HD3 PRO 60 HD1 PRO 60 44.997 2.569 13.825 390 HA PRO 61 HA PRO 61 49.706 1.984 8.533 391 HB2 PRO 61 HB2 PRO 61 52.316 1.494 9.033 392 HB3 PRO 61 HB1 PRO 61 51.664 3.140 8.922 393 HG2 PRO 61 HG2 PRO 61 52.384 1.544 11.315 394 HG3 PRO 61 HG1 PRO 61 52.562 3.280 11.017 395 HD2 PRO 61 HD2 PRO 61 50.514 2.139 12.522 396 HD3 PRO 61 HD1 PRO 61 50.438 3.751 11.776 397 H TYR 62 HN TYR 62 49.516 0.021 7.615 398 HA TYR 62 HA TYR 62 48.916 -2.378 8.726 399 HB2 TYR 62 HB2 TYR 62 49.995 -3.455 6.760 400 HB3 TYR 62 HB1 TYR 62 49.120 -1.992 6.294 401 HD1 TYR 62 HD1 TYR 62 50.476 0.236 6.391 402 HD2 TYR 62 HD2 TYR 62 52.240 -3.666 6.128 403 HE1 TYR 62 HE1 TYR 62 52.565 1.247 5.554 404 HE2 TYR 62 HE2 TYR 62 54.331 -2.658 5.279 405 HH TYR 62 HH TYR 62 55.463 -0.720 4.998 406 HA PRO 63 HA PRO 63 52.296 -3.768 11.214 407 HB2 PRO 63 HB2 PRO 63 52.145 -6.489 10.781 408 HB3 PRO 63 HB1 PRO 63 51.063 -5.590 11.861 409 HG2 PRO 63 HG2 PRO 63 50.601 -6.546 9.085 410 HG3 PRO 63 HG1 PRO 63 49.485 -6.479 10.459 411 HD2 PRO 63 HD2 PRO 63 49.428 -4.654 8.435 412 HD3 PRO 63 HD1 PRO 63 48.964 -4.250 10.102 413 H LYS 64 HN LYS 64 54.474 -4.597 11.075 414 HA LYS 64 HA LYS 64 55.971 -4.067 8.825 415 HB2 LYS 64 HB2 LYS 64 56.498 -6.415 10.671 416 HB3 LYS 64 HB1 LYS 64 57.692 -5.549 9.702 417 HG2 LYS 64 HG2 LYS 64 56.134 -3.739 11.377 418 HG3 LYS 64 HG1 LYS 64 56.977 -4.958 12.332 419 HD2 LYS 64 HD2 LYS 64 58.278 -3.223 10.212 420 HD3 LYS 64 HD1 LYS 64 58.375 -2.934 11.949 421 HE2 LYS 64 HE2 LYS 64 60.187 -4.277 11.960 422 HE3 LYS 64 HE1 LYS 64 59.083 -5.620 11.665 423 HZ1 LYS 64 HZ1 LYS 64 59.657 -5.736 9.511 424 HZ2 LYS 64 HZ2 LYS 64 61.075 -4.959 10.031 425 HZ3 LYS 64 HZ3 LYS 64 59.815 -4.056 9.335 426 H HIS 65 HN HIS 65 56.167 -4.951 6.815 427 HA HIS 65 HA HIS 65 55.470 -6.323 5.006 428 HB2 HIS 65 HB2 HIS 65 56.779 -8.188 6.999 429 HB3 HIS 65 HB1 HIS 65 56.329 -8.698 5.371 430 HD1 HIS 65 HD1 HIS 65 58.807 -6.634 7.247 431 HD2 HIS 65 HD2 HIS 65 57.834 -7.419 3.267 432 HE1 HIS 65 HE1 HIS 65 60.725 -5.743 5.849 433 HE2 HIS 65 HE2 HIS 65 60.143 -6.215 3.426 Start of MODEL 19 1 H1 SER 7 HT1 SER 7 30.185 -12.170 -18.646 2 H2 SER 7 HT2 SER 7 31.875 -12.322 -18.739 3 H3 SER 7 HT3 SER 7 31.048 -11.317 -19.831 4 HA SER 7 HA SER 7 32.275 -10.278 -17.816 5 HB2 SER 7 HB2 SER 7 29.434 -9.374 -18.170 6 HB3 SER 7 HB1 SER 7 30.901 -8.407 -18.052 7 HG SER 7 HG SER 7 31.235 -9.931 -20.137 8 H PHE 8 HN PHE 8 31.649 -12.630 -16.535 9 HA PHE 8 HA PHE 8 30.765 -11.735 -13.969 10 HB2 PHE 8 HB2 PHE 8 28.684 -12.671 -15.814 11 HB3 PHE 8 HB1 PHE 8 28.705 -13.555 -14.288 12 HD1 PHE 8 HD1 PHE 8 28.997 -12.043 -12.126 13 HD2 PHE 8 HD2 PHE 8 27.531 -10.645 -15.913 14 HE1 PHE 8 HE1 PHE 8 27.911 -10.121 -10.996 15 HE2 PHE 8 HE2 PHE 8 26.446 -8.723 -14.784 16 HZ PHE 8 HZ PHE 8 26.636 -8.461 -12.325 17 H GLU 9 HN GLU 9 32.879 -12.953 -13.869 18 HA GLU 9 HA GLU 9 32.363 -15.698 -12.995 19 HB2 GLU 9 HB2 GLU 9 33.488 -15.124 -15.619 20 HB3 GLU 9 HB1 GLU 9 34.590 -16.081 -14.630 21 HG2 GLU 9 HG2 GLU 9 32.661 -17.627 -14.120 22 HG3 GLU 9 HG1 GLU 9 31.711 -16.738 -15.312 23 H ILE 10 HN ILE 10 33.450 -13.028 -12.121 24 HA ILE 10 HA ILE 10 36.263 -13.544 -11.508 25 HB ILE 10 HB ILE 10 34.634 -11.440 -10.120 26 HG12 ILE 10 HG12 ILE 10 35.410 -11.525 -13.042 27 HG13 ILE 10 HG11 ILE 10 33.833 -11.151 -12.343 28 HG21 ILE 10 HG21 ILE 10 37.152 -11.914 -9.795 29 HG22 ILE 10 HG22 ILE 10 36.680 -10.246 -10.115 30 HG23 ILE 10 HG23 ILE 10 37.356 -11.234 -11.408 31 HD11 ILE 10 HD11 ILE 10 36.318 -9.447 -12.398 32 HD12 ILE 10 HD12 ILE 10 35.058 -9.166 -11.197 33 HD13 ILE 10 HD13 ILE 10 34.684 -9.030 -12.915 34 HA PRO 11 HA PRO 11 35.197 -16.295 -8.097 35 HB2 PRO 11 HB2 PRO 11 37.973 -15.478 -7.337 36 HB3 PRO 11 HB1 PRO 11 37.257 -17.099 -7.418 37 HG2 PRO 11 HG2 PRO 11 38.915 -16.192 -9.306 38 HG3 PRO 11 HG1 PRO 11 37.560 -17.271 -9.678 39 HD2 PRO 11 HD2 PRO 11 37.868 -14.379 -10.276 40 HD3 PRO 11 HD1 PRO 11 36.872 -15.602 -11.094 41 H ASP 12 HN ASP 12 34.780 -16.018 -5.832 42 HA ASP 12 HA ASP 12 34.144 -13.368 -5.005 43 HB2 ASP 12 HB2 ASP 12 34.026 -16.057 -3.834 44 HB3 ASP 12 HB1 ASP 12 34.310 -14.786 -2.644 45 H ASP 13 HN ASP 13 37.052 -14.564 -5.471 46 HA ASP 13 HA ASP 13 38.320 -13.279 -3.115 47 HB2 ASP 13 HB2 ASP 13 39.603 -14.961 -5.287 48 HB3 ASP 13 HB1 ASP 13 40.362 -14.430 -3.787 49 H VAL 14 HN VAL 14 37.082 -11.661 -5.160 50 HA VAL 14 HA VAL 14 38.706 -10.670 -7.191 51 HB VAL 14 HB VAL 14 37.084 -8.962 -5.282 52 HG11 VAL 14 HG11 VAL 14 38.380 -7.559 -6.714 53 HG12 VAL 14 HG12 VAL 14 36.779 -7.632 -7.447 54 HG13 VAL 14 HG13 VAL 14 38.096 -8.599 -8.109 55 HG21 VAL 14 HG21 VAL 14 35.157 -9.546 -6.459 56 HG22 VAL 14 HG22 VAL 14 36.027 -11.080 -6.459 57 HG23 VAL 14 HG23 VAL 14 36.060 -10.047 -7.888 58 HA PRO 15 HA PRO 15 42.338 -9.723 -4.625 59 HB2 PRO 15 HB2 PRO 15 43.291 -8.739 -7.265 60 HB3 PRO 15 HB1 PRO 15 44.061 -9.869 -6.137 61 HG2 PRO 15 HG2 PRO 15 42.923 -10.689 -8.414 62 HG3 PRO 15 HG1 PRO 15 42.907 -11.671 -6.939 63 HD2 PRO 15 HD2 PRO 15 40.685 -10.121 -8.191 64 HD3 PRO 15 HD1 PRO 15 40.623 -11.616 -7.231 65 H LEU 16 HN LEU 16 42.892 -7.809 -3.619 66 HA LEU 16 HA LEU 16 41.388 -5.425 -4.011 67 HB2 LEU 16 HB2 LEU 16 44.137 -5.781 -2.784 68 HB3 LEU 16 HB1 LEU 16 43.094 -4.385 -2.559 69 HG LEU 16 HG LEU 16 43.206 -6.565 -0.905 70 HD11 LEU 16 HD11 LEU 16 41.261 -5.587 0.167 71 HD12 LEU 16 HD12 LEU 16 40.797 -4.779 -1.330 72 HD13 LEU 16 HD13 LEU 16 42.263 -4.289 -0.482 73 HD21 LEU 16 HD21 LEU 16 40.848 -6.910 -2.784 74 HD22 LEU 16 HD22 LEU 16 40.906 -7.610 -1.171 75 HD23 LEU 16 HD23 LEU 16 42.087 -8.099 -2.380 76 HA PRO 17 HA PRO 17 43.311 -3.171 -7.303 77 HB2 PRO 17 HB2 PRO 17 44.204 -1.014 -5.501 78 HB3 PRO 17 HB1 PRO 17 43.123 -0.944 -6.897 79 HG2 PRO 17 HG2 PRO 17 42.252 -0.741 -4.360 80 HG3 PRO 17 HG1 PRO 17 41.277 -1.425 -5.671 81 HD2 PRO 17 HD2 PRO 17 42.640 -2.807 -3.423 82 HD3 PRO 17 HD1 PRO 17 41.192 -3.291 -4.330 83 H ALA 18 HN ALA 18 45.540 -1.290 -6.782 84 HA ALA 18 HA ALA 18 47.666 -3.311 -6.958 85 HB1 ALA 18 HB1 ALA 18 48.366 -0.468 -7.187 86 HB2 ALA 18 HB2 ALA 18 47.131 -1.011 -8.323 87 HB3 ALA 18 HB3 ALA 18 48.705 -1.806 -8.285 88 H GLY 19 HN GLY 19 49.268 -3.589 -5.467 89 HA2 GLY 19 HA2 GLY 19 50.524 -3.324 -3.508 90 HA3 GLY 19 HA1 GLY 19 50.092 -1.617 -3.559 91 H TRP 20 HN TRP 20 47.524 -3.974 -3.484 92 HA TRP 20 HA TRP 20 46.922 -3.071 -0.713 93 HB2 TRP 20 HB2 TRP 20 45.185 -4.125 -2.924 94 HB3 TRP 20 HB1 TRP 20 44.607 -3.870 -1.272 95 HD1 TRP 20 HD1 TRP 20 45.524 -2.078 -4.421 96 HE1 TRP 20 HE1 TRP 20 45.084 0.433 -4.142 97 HE3 TRP 20 HE3 TRP 20 44.648 -1.969 0.563 98 HZ2 TRP 20 HZ2 TRP 20 44.438 2.282 -2.001 99 HZ3 TRP 20 HZ3 TRP 20 44.141 0.136 1.721 100 HH2 TRP 20 HH2 TRP 20 44.027 2.278 0.454 101 H GLU 21 HN GLU 21 46.097 -4.583 0.836 102 HA GLU 21 HA GLU 21 46.101 -7.436 0.222 103 HB2 GLU 21 HB2 GLU 21 48.552 -6.951 0.424 104 HB3 GLU 21 HB1 GLU 21 48.266 -6.385 2.070 105 HG2 GLU 21 HG2 GLU 21 48.300 -8.497 2.842 106 HG3 GLU 21 HG1 GLU 21 47.016 -8.955 1.721 107 H MET 22 HN MET 22 44.349 -8.063 1.428 108 HA MET 22 HA MET 22 43.375 -6.549 3.643 109 HB2 MET 22 HB2 MET 22 41.643 -7.812 2.865 110 HB3 MET 22 HB1 MET 22 42.709 -9.109 2.320 111 HG2 MET 22 HG2 MET 22 42.928 -9.978 4.534 112 HG3 MET 22 HG1 MET 22 42.149 -8.559 5.234 113 HE1 MET 22 HE1 MET 22 38.546 -8.806 4.695 114 HE2 MET 22 HE2 MET 22 39.969 -7.771 4.778 115 HE3 MET 22 HE3 MET 22 39.622 -8.885 6.097 116 H ALA 23 HN ALA 23 43.714 -6.827 5.842 117 HA ALA 23 HA ALA 23 45.305 -9.133 6.766 118 HB1 ALA 23 HB1 ALA 23 47.069 -7.619 6.152 119 HB2 ALA 23 HB2 ALA 23 46.923 -7.553 7.907 120 HB3 ALA 23 HB3 ALA 23 46.245 -6.262 6.915 121 H LYS 24 HN LYS 24 45.586 -8.850 9.293 122 HA LYS 24 HA LYS 24 43.116 -7.520 10.295 123 HB2 LYS 24 HB2 LYS 24 43.209 -10.113 10.267 124 HB3 LYS 24 HB1 LYS 24 44.318 -9.927 11.630 125 HG2 LYS 24 HG2 LYS 24 42.688 -8.809 12.943 126 HG3 LYS 24 HG1 LYS 24 41.648 -8.524 11.550 127 HD2 LYS 24 HD2 LYS 24 40.621 -10.336 12.687 128 HD3 LYS 24 HD1 LYS 24 41.497 -11.087 11.352 129 HE2 LYS 24 HE2 LYS 24 43.456 -11.205 13.130 130 HE3 LYS 24 HE1 LYS 24 42.125 -11.107 14.283 131 HZ1 LYS 24 HZ1 LYS 24 41.734 -13.241 13.933 132 HZ2 LYS 24 HZ2 LYS 24 42.980 -13.320 12.782 133 HZ3 LYS 24 HZ3 LYS 24 41.400 -12.926 12.301 134 H THR 25 HN THR 25 43.210 -6.704 12.453 135 HA THR 25 HA THR 25 45.709 -5.397 13.091 136 HB THR 25 HB THR 25 43.427 -4.485 13.588 137 HG1 THR 25 HG1 THR 25 45.470 -4.777 15.452 138 HG21 THR 25 HG21 THR 25 43.327 -6.271 15.974 139 HG22 THR 25 HG22 THR 25 42.782 -6.900 14.419 140 HG23 THR 25 HG23 THR 25 42.012 -5.473 15.113 141 H SER 26 HN SER 26 46.384 -5.617 15.601 142 HA SER 26 HA SER 26 47.910 -7.701 16.173 143 HB2 SER 26 HB2 SER 26 46.159 -7.599 18.461 144 HB3 SER 26 HB1 SER 26 47.784 -6.941 18.289 145 HG SER 26 HG SER 26 45.338 -5.708 18.120 146 H SER 27 HN SER 27 44.379 -7.954 16.099 147 HA SER 27 HA SER 27 44.057 -10.448 15.090 148 HB2 SER 27 HB2 SER 27 45.103 -10.635 17.878 149 HB3 SER 27 HB1 SER 27 43.860 -11.784 17.392 150 HG SER 27 HG SER 27 45.508 -11.705 15.394 151 H GLY 28 HN GLY 28 42.083 -9.151 14.711 152 HA2 GLY 28 HA2 GLY 28 39.826 -10.014 16.082 153 HA3 GLY 28 HA1 GLY 28 40.319 -8.560 16.944 154 H GLN 29 HN GLN 29 41.252 -7.046 14.684 155 HA GLN 29 HA GLN 29 38.628 -6.579 13.357 156 HB2 GLN 29 HB2 GLN 29 40.871 -4.570 13.560 157 HB3 GLN 29 HB1 GLN 29 39.169 -4.272 13.211 158 HG2 GLN 29 HG2 GLN 29 39.945 -5.558 15.815 159 HG3 GLN 29 HG1 GLN 29 40.081 -3.809 15.628 160 HE21 GLN 29 HE21 GLN 29 37.601 -5.186 13.675 161 HE22 GLN 29 HE22 GLN 29 36.285 -4.775 14.665 162 H ARG 30 HN ARG 30 38.567 -7.222 11.271 163 HA ARG 30 HA ARG 30 41.028 -7.709 9.768 164 HB2 ARG 30 HB2 ARG 30 38.190 -8.335 9.498 165 HB3 ARG 30 HB1 ARG 30 38.891 -7.791 7.974 166 HG2 ARG 30 HG2 ARG 30 40.577 -9.488 8.033 167 HG3 ARG 30 HG1 ARG 30 40.199 -9.896 9.707 168 HD2 ARG 30 HD2 ARG 30 37.772 -10.304 8.623 169 HD3 ARG 30 HD1 ARG 30 38.765 -10.639 7.205 170 HE ARG 30 HE ARG 30 39.620 -12.570 8.304 171 HH11 ARG 30 HH11 ARG 30 39.518 -14.093 9.970 172 HH12 ARG 30 HH12 ARG 30 38.668 -13.705 11.430 173 HH21 ARG 30 HH21 ARG 30 37.759 -10.531 10.370 174 HH22 ARG 30 HH22 ARG 30 37.672 -11.689 11.655 175 H TYR 31 HN TYR 31 41.954 -6.283 8.300 176 HA TYR 31 HA TYR 31 40.310 -4.006 7.397 177 HB2 TYR 31 HB2 TYR 31 42.330 -2.472 7.876 178 HB3 TYR 31 HB1 TYR 31 41.294 -2.915 9.224 179 HD1 TYR 31 HD1 TYR 31 42.885 -2.664 10.995 180 HD2 TYR 31 HD2 TYR 31 43.785 -5.185 7.635 181 HE1 TYR 31 HE1 TYR 31 44.875 -3.542 12.177 182 HE2 TYR 31 HE2 TYR 31 45.764 -6.060 8.832 183 HH TYR 31 HH TYR 31 47.045 -5.901 10.619 184 H PHE 32 HN PHE 32 42.080 -2.583 5.956 185 HA PHE 32 HA PHE 32 43.245 -4.623 4.113 186 HB2 PHE 32 HB2 PHE 32 42.080 -1.932 3.360 187 HB3 PHE 32 HB1 PHE 32 42.647 -3.183 2.253 188 HD1 PHE 32 HD1 PHE 32 41.581 -5.620 2.834 189 HD2 PHE 32 HD2 PHE 32 39.780 -1.812 3.673 190 HE1 PHE 32 HE1 PHE 32 39.347 -6.693 2.898 191 HE2 PHE 32 HE2 PHE 32 37.545 -2.885 3.737 192 HZ PHE 32 HZ PHE 32 37.328 -5.324 3.350 193 H LEU 33 HN LEU 33 45.378 -4.420 3.705 194 HA LEU 33 HA LEU 33 46.789 -2.051 4.784 195 HB2 LEU 33 HB2 LEU 33 48.069 -4.397 3.378 196 HB3 LEU 33 HB1 LEU 33 48.783 -3.317 4.572 197 HG LEU 33 HG LEU 33 46.594 -5.352 5.087 198 HD11 LEU 33 HD11 LEU 33 48.582 -6.577 5.027 199 HD12 LEU 33 HD12 LEU 33 48.519 -6.102 6.725 200 HD13 LEU 33 HD13 LEU 33 49.550 -5.220 5.599 201 HD21 LEU 33 HD21 LEU 33 47.366 -2.953 6.505 202 HD22 LEU 33 HD22 LEU 33 47.671 -4.375 7.498 203 HD23 LEU 33 HD23 LEU 33 46.055 -4.072 6.860 204 H ASN 34 HN ASN 34 47.719 -0.484 3.491 205 HA ASN 34 HA ASN 34 47.361 -0.846 0.544 206 HB2 ASN 34 HB2 ASN 34 46.189 1.077 1.875 207 HB3 ASN 34 HB1 ASN 34 47.788 1.820 1.864 208 HD21 ASN 34 HD21 ASN 34 46.119 3.332 0.459 209 HD22 ASN 34 HD22 ASN 34 46.229 3.073 -1.215 210 H HIS 35 HN HIS 35 49.296 -1.472 -0.299 211 HA HIS 35 HA HIS 35 51.835 -0.704 0.901 212 HB2 HIS 35 HB2 HIS 35 51.447 -1.834 -1.879 213 HB3 HIS 35 HB1 HIS 35 52.848 -2.005 -0.820 214 HD1 HIS 35 HD1 HIS 35 51.832 -4.626 -1.697 215 HD2 HIS 35 HD2 HIS 35 50.117 -2.655 1.557 216 HE1 HIS 35 HE1 HIS 35 50.649 -6.400 -0.326 217 HE2 HIS 35 HE2 HIS 35 49.602 -5.212 1.656 218 H ILE 36 HN ILE 36 49.620 0.703 -1.261 219 HA ILE 36 HA ILE 36 51.573 2.373 -2.675 220 HB ILE 36 HB ILE 36 48.638 2.986 -2.553 221 HG12 ILE 36 HG12 ILE 36 49.394 0.400 -2.948 222 HG13 ILE 36 HG11 ILE 36 47.973 1.123 -3.684 223 HG21 ILE 36 HG21 ILE 36 49.131 3.383 -5.029 224 HG22 ILE 36 HG22 ILE 36 50.830 3.129 -4.635 225 HG23 ILE 36 HG23 ILE 36 49.946 4.467 -3.901 226 HD11 ILE 36 HD11 ILE 36 49.097 1.519 -5.738 227 HD12 ILE 36 HD12 ILE 36 49.597 -0.103 -5.260 228 HD13 ILE 36 HD13 ILE 36 50.682 1.264 -5.008 229 H ASP 37 HN ASP 37 48.969 2.844 -0.314 230 HA ASP 37 HA ASP 37 50.007 5.510 0.349 231 HB2 ASP 37 HB2 ASP 37 47.607 3.917 1.239 232 HB3 ASP 37 HB1 ASP 37 48.085 5.390 2.086 233 H GLN 38 HN GLN 38 50.943 2.563 1.010 234 HA GLN 38 HA GLN 38 52.039 1.479 2.792 235 HB2 GLN 38 HB2 GLN 38 53.006 4.314 2.704 236 HB3 GLN 38 HB1 GLN 38 53.592 3.245 3.980 237 HG2 GLN 38 HG2 GLN 38 54.172 1.567 2.178 238 HG3 GLN 38 HG1 GLN 38 53.804 2.820 0.992 239 HE21 GLN 38 HE21 GLN 38 56.213 2.542 0.447 240 HE22 GLN 38 HE22 GLN 38 57.337 3.422 1.366 241 H THR 39 HN THR 39 49.459 1.887 3.592 242 HA THR 39 HA THR 39 49.805 2.250 6.466 243 HB THR 39 HB THR 39 49.246 4.448 6.263 244 HG1 THR 39 HG1 THR 39 46.614 3.958 5.893 245 HG21 THR 39 HG21 THR 39 48.626 3.728 3.604 246 HG22 THR 39 HG22 THR 39 48.772 5.356 4.264 247 HG23 THR 39 HG23 THR 39 47.204 4.551 4.245 248 H THR 40 HN THR 40 47.311 2.249 7.327 249 HA THR 40 HA THR 40 46.081 -0.129 6.010 250 HB THR 40 HB THR 40 45.123 -0.570 8.340 251 HG1 THR 40 HG1 THR 40 46.322 1.766 8.744 252 HG21 THR 40 HG21 THR 40 47.746 -1.043 7.265 253 HG22 THR 40 HG22 THR 40 46.775 -2.082 8.312 254 HG23 THR 40 HG23 THR 40 47.848 -0.874 9.017 255 H THR 41 HN THR 41 43.729 -0.187 6.014 256 HA THR 41 HA THR 41 42.395 2.379 6.670 257 HB THR 41 HB THR 41 42.373 2.804 4.452 258 HG1 THR 41 HG1 THR 41 40.422 0.819 4.826 259 HG21 THR 41 HG21 THR 41 43.886 1.315 3.551 260 HG22 THR 41 HG22 THR 41 42.403 0.708 2.815 261 HG23 THR 41 HG23 THR 41 43.067 -0.085 4.242 262 H TRP 42 HN TRP 42 40.239 2.182 7.248 263 HA TRP 42 HA TRP 42 39.403 -0.529 8.042 264 HB2 TRP 42 HB2 TRP 42 38.018 2.146 8.418 265 HB3 TRP 42 HB1 TRP 42 37.546 0.625 9.173 266 HD1 TRP 42 HD1 TRP 42 39.407 3.622 9.913 267 HE1 TRP 42 HE1 TRP 42 41.050 3.268 11.873 268 HE3 TRP 42 HE3 TRP 42 39.445 -1.478 10.109 269 HZ2 TRP 42 HZ2 TRP 42 42.220 1.096 13.331 270 HZ3 TRP 42 HZ3 TRP 42 40.830 -2.664 11.788 271 HH2 TRP 42 HH2 TRP 42 42.219 -1.385 13.395 272 H GLN 43 HN GLN 43 39.194 1.448 5.364 273 HA GLN 43 HA GLN 43 36.644 0.153 4.495 274 HB2 GLN 43 HB2 GLN 43 36.139 2.427 4.420 275 HB3 GLN 43 HB1 GLN 43 37.789 2.879 3.986 276 HG2 GLN 43 HG2 GLN 43 37.506 2.027 1.742 277 HG3 GLN 43 HG1 GLN 43 35.936 1.335 2.152 278 HE21 GLN 43 HE21 GLN 43 37.051 4.546 3.230 279 HE22 GLN 43 HE22 GLN 43 35.898 5.425 2.346 280 H ASP 44 HN ASP 44 36.579 -0.637 2.310 281 HA ASP 44 HA ASP 44 39.258 -1.356 1.274 282 HB2 ASP 44 HB2 ASP 44 36.979 -2.854 1.610 283 HB3 ASP 44 HB1 ASP 44 36.879 -2.425 -0.097 284 HA PRO 45 HA PRO 45 39.034 1.624 -1.987 285 HB2 PRO 45 HB2 PRO 45 40.282 0.100 -3.974 286 HB3 PRO 45 HB1 PRO 45 41.113 1.106 -2.775 287 HG2 PRO 45 HG2 PRO 45 40.688 -1.824 -2.815 288 HG3 PRO 45 HG1 PRO 45 42.045 -0.883 -2.176 289 HD2 PRO 45 HD2 PRO 45 40.170 -2.018 -0.564 290 HD3 PRO 45 HD1 PRO 45 40.999 -0.503 -0.141 291 H ARG 46 HN ARG 46 37.780 -1.600 -2.308 292 HA ARG 46 HA ARG 46 36.368 -1.018 -4.817 293 HB2 ARG 46 HB2 ARG 46 36.549 -3.393 -2.973 294 HB3 ARG 46 HB1 ARG 46 35.291 -3.319 -4.207 295 HG2 ARG 46 HG2 ARG 46 36.907 -4.299 -5.501 296 HG3 ARG 46 HG1 ARG 46 37.443 -2.631 -5.705 297 HD2 ARG 46 HD2 ARG 46 39.278 -4.229 -5.035 298 HD3 ARG 46 HD1 ARG 46 39.070 -2.866 -3.934 299 HE ARG 46 HE ARG 46 38.423 -4.398 -2.264 300 HH11 ARG 46 HH11 ARG 46 37.928 -6.470 -1.507 301 HH12 ARG 46 HH12 ARG 46 37.657 -7.750 -2.642 302 HH21 ARG 46 HH21 ARG 46 38.182 -5.752 -5.426 303 HH22 ARG 46 HH22 ARG 46 37.801 -7.344 -4.860 304 H LYS 47 HN LYS 47 35.879 0.530 -2.308 305 HA LYS 47 HA LYS 47 32.939 0.390 -2.416 306 HB2 LYS 47 HB2 LYS 47 34.547 -0.085 0.101 307 HB3 LYS 47 HB1 LYS 47 32.865 0.448 0.141 308 HG2 LYS 47 HG2 LYS 47 32.495 -1.575 -1.509 309 HG3 LYS 47 HG1 LYS 47 34.002 -2.164 -0.804 310 HD2 LYS 47 HD2 LYS 47 32.470 -3.081 0.677 311 HD3 LYS 47 HD1 LYS 47 32.794 -1.539 1.473 312 HE2 LYS 47 HE2 LYS 47 30.814 -0.553 0.402 313 HE3 LYS 47 HE1 LYS 47 30.497 -2.072 -0.434 314 HZ1 LYS 47 HZ1 LYS 47 30.824 -2.528 2.336 315 HZ2 LYS 47 HZ2 LYS 47 29.479 -2.856 1.351 316 HZ3 LYS 47 HZ3 LYS 47 29.643 -1.336 2.092 317 H ALA 48 HN ALA 48 32.141 2.447 -2.395 318 HA ALA 48 HA ALA 48 34.025 4.630 -1.647 319 HB1 ALA 48 HB1 ALA 48 31.958 4.294 -3.691 320 HB2 ALA 48 HB2 ALA 48 33.295 5.443 -3.629 321 HB3 ALA 48 HB3 ALA 48 31.782 5.805 -2.797 322 H MET 49 HN MET 49 32.129 6.652 -1.184 323 HA MET 49 HA MET 49 31.541 6.320 1.562 324 HB2 MET 49 HB2 MET 49 30.461 8.393 1.443 325 HB3 MET 49 HB1 MET 49 31.545 8.466 0.052 326 HG2 MET 49 HG2 MET 49 29.566 7.442 -1.276 327 HG3 MET 49 HG1 MET 49 28.576 7.941 0.095 328 HE1 MET 49 HE1 MET 49 27.832 9.274 -2.768 329 HE2 MET 49 HE2 MET 49 27.420 10.773 -1.938 330 HE3 MET 49 HE3 MET 49 27.135 9.227 -1.142 331 H GLY 50 HN GLY 50 28.870 6.950 1.969 332 HA2 GLY 50 HA2 GLY 50 26.676 6.067 1.910 333 HA3 GLY 50 HA1 GLY 50 27.155 5.064 0.540 334 H GLY 51 HN GLY 51 26.454 3.061 1.281 335 HA2 GLY 51 HA2 GLY 51 26.437 1.110 2.585 336 HA3 GLY 51 HA1 GLY 51 28.105 1.534 2.977 337 H GLY 52 HN GLY 52 28.331 1.472 5.160 338 HA2 GLY 52 HA2 GLY 52 26.218 2.816 6.797 339 HA3 GLY 52 HA1 GLY 52 26.990 1.320 7.329 340 H GLY 53 HN GLY 53 29.652 1.881 6.608 341 HA2 GLY 53 HA2 GLY 53 31.513 3.252 7.170 342 HA3 GLY 53 HA1 GLY 53 30.395 4.458 7.812 343 H ASN 54 HN ASN 54 31.254 4.728 9.868 344 HA ASN 54 HA ASN 54 31.449 4.204 12.158 345 HB2 ASN 54 HB2 ASN 54 29.458 2.572 11.417 346 HB3 ASN 54 HB1 ASN 54 30.692 1.350 11.721 347 HD21 ASN 54 HD21 ASN 54 31.919 1.750 13.937 348 HD22 ASN 54 HD22 ASN 54 30.937 2.198 15.246 349 H TYR 55 HN TYR 55 33.508 4.002 12.880 350 HA TYR 55 HA TYR 55 35.044 1.571 12.096 351 HB2 TYR 55 HB2 TYR 55 37.031 3.415 12.179 352 HB3 TYR 55 HB1 TYR 55 36.202 2.958 10.690 353 HD1 TYR 55 HD1 TYR 55 34.398 4.374 9.763 354 HD2 TYR 55 HD2 TYR 55 36.633 5.554 13.236 355 HE1 TYR 55 HE1 TYR 55 33.559 6.694 9.513 356 HE2 TYR 55 HE2 TYR 55 35.794 7.875 12.987 357 HH TYR 55 HH TYR 55 33.753 8.804 10.227 358 H GLN 56 HN GLN 56 37.305 1.860 13.485 359 HA GLN 56 HA GLN 56 36.366 2.298 16.284 360 HB2 GLN 56 HB2 GLN 56 38.844 0.748 15.877 361 HB3 GLN 56 HB1 GLN 56 37.462 0.402 16.917 362 HG2 GLN 56 HG2 GLN 56 36.208 -0.076 14.675 363 HG3 GLN 56 HG1 GLN 56 37.829 -0.232 13.999 364 HE21 GLN 56 HE21 GLN 56 35.441 -2.147 15.131 365 HE22 GLN 56 HE22 GLN 56 36.349 -3.387 15.850 366 H GLY 57 HN GLY 57 37.629 4.174 14.267 367 HA2 GLY 57 HA2 GLY 57 38.824 6.176 15.157 368 HA3 GLY 57 HA1 GLY 57 39.885 5.061 16.020 369 HA PRO 58 HA PRO 58 41.918 6.071 11.985 370 HB2 PRO 58 HB2 PRO 58 44.333 6.780 13.023 371 HB3 PRO 58 HB1 PRO 58 42.979 7.917 12.874 372 HG2 PRO 58 HG2 PRO 58 43.987 6.475 15.266 373 HG3 PRO 58 HG1 PRO 58 43.320 8.109 15.128 374 HD2 PRO 58 HD2 PRO 58 41.901 5.914 16.062 375 HD3 PRO 58 HD1 PRO 58 41.157 7.381 15.390 376 HA PRO 59 HA PRO 59 43.734 1.976 12.123 377 HB2 PRO 59 HB2 PRO 59 44.319 1.781 9.473 378 HB3 PRO 59 HB1 PRO 59 42.671 1.618 10.108 379 HG2 PRO 59 HG2 PRO 59 43.963 3.934 8.768 380 HG3 PRO 59 HG1 PRO 59 42.300 3.338 8.645 381 HD2 PRO 59 HD2 PRO 59 43.056 5.507 10.188 382 HD3 PRO 59 HD1 PRO 59 41.601 4.529 10.481 383 HA PRO 60 HA PRO 60 48.028 3.323 12.360 384 HB2 PRO 60 HB2 PRO 60 48.989 1.051 13.528 385 HB3 PRO 60 HB1 PRO 60 48.104 2.299 14.426 386 HG2 PRO 60 HG2 PRO 60 47.174 -0.335 13.427 387 HG3 PRO 60 HG1 PRO 60 46.744 0.529 14.911 388 HD2 PRO 60 HD2 PRO 60 45.152 0.436 12.645 389 HD3 PRO 60 HD1 PRO 60 45.056 1.703 13.887 390 HA PRO 61 HA PRO 61 49.811 1.849 8.583 391 HB2 PRO 61 HB2 PRO 61 52.258 1.562 10.296 392 HB3 PRO 61 HB1 PRO 61 52.090 2.295 8.688 393 HG2 PRO 61 HG2 PRO 61 52.237 3.783 10.893 394 HG3 PRO 61 HG1 PRO 61 51.225 4.245 9.515 395 HD2 PRO 61 HD2 PRO 61 50.395 3.271 12.190 396 HD3 PRO 61 HD1 PRO 61 49.473 4.210 10.996 397 H TYR 62 HN TYR 62 49.835 -0.159 7.692 398 HA TYR 62 HA TYR 62 49.201 -2.530 8.857 399 HB2 TYR 62 HB2 TYR 62 50.873 -3.560 7.084 400 HB3 TYR 62 HB1 TYR 62 49.437 -2.691 6.556 401 HD1 TYR 62 HD1 TYR 62 52.121 -0.763 8.109 402 HD2 TYR 62 HD2 TYR 62 50.581 -2.249 4.388 403 HE1 TYR 62 HE1 TYR 62 53.540 0.841 6.886 404 HE2 TYR 62 HE2 TYR 62 52.003 -0.645 3.162 405 HH TYR 62 HH TYR 62 54.257 1.510 4.888 406 HA PRO 63 HA PRO 63 52.156 -4.189 11.653 407 HB2 PRO 63 HB2 PRO 63 52.965 -6.500 10.207 408 HB3 PRO 63 HB1 PRO 63 51.673 -6.400 11.416 409 HG2 PRO 63 HG2 PRO 63 51.505 -6.320 8.458 410 HG3 PRO 63 HG1 PRO 63 50.356 -6.968 9.643 411 HD2 PRO 63 HD2 PRO 63 49.858 -4.653 8.387 412 HD3 PRO 63 HD1 PRO 63 49.440 -4.859 10.103 413 H LYS 64 HN LYS 64 54.346 -3.864 12.026 414 HA LYS 64 HA LYS 64 56.010 -2.502 10.274 415 HB2 LYS 64 HB2 LYS 64 57.920 -3.340 11.617 416 HB3 LYS 64 HB1 LYS 64 56.575 -2.839 12.643 417 HG2 LYS 64 HG2 LYS 64 56.883 -5.703 11.738 418 HG3 LYS 64 HG1 LYS 64 57.689 -5.102 13.187 419 HD2 LYS 64 HD2 LYS 64 55.271 -4.177 13.754 420 HD3 LYS 64 HD1 LYS 64 54.763 -5.462 12.658 421 HE2 LYS 64 HE2 LYS 64 54.893 -6.159 15.082 422 HE3 LYS 64 HE1 LYS 64 55.874 -7.138 13.992 423 HZ1 LYS 64 HZ1 LYS 64 57.000 -6.379 16.082 424 HZ2 LYS 64 HZ2 LYS 64 56.947 -4.799 15.460 425 HZ3 LYS 64 HZ3 LYS 64 57.819 -6.007 14.643 426 H HIS 65 HN HIS 65 57.535 -3.092 8.692 427 HA HIS 65 HA HIS 65 58.164 -5.861 8.104 428 HB2 HIS 65 HB2 HIS 65 56.867 -6.257 6.205 429 HB3 HIS 65 HB1 HIS 65 55.728 -5.376 7.224 430 HD1 HIS 65 HD1 HIS 65 56.693 -2.502 6.833 431 HD2 HIS 65 HD2 HIS 65 56.315 -5.216 3.687 432 HE1 HIS 65 HE1 HIS 65 56.461 -1.123 4.719 433 HE2 HIS 65 HE2 HIS 65 56.231 -2.765 2.799 Start of MODEL 20 1 H1 SER 7 HT1 SER 7 21.222 -12.032 -6.329 2 H2 SER 7 HT2 SER 7 22.741 -12.711 -6.673 3 H3 SER 7 HT3 SER 7 22.636 -11.240 -5.829 4 HA SER 7 HA SER 7 21.285 -12.605 -4.119 5 HB2 SER 7 HB2 SER 7 22.591 -14.640 -5.882 6 HB3 SER 7 HB1 SER 7 22.525 -14.957 -4.151 7 HG SER 7 HG SER 7 20.183 -13.993 -5.203 8 H PHE 8 HN PHE 8 22.951 -13.958 -2.501 9 HA PHE 8 HA PHE 8 25.186 -12.043 -2.137 10 HB2 PHE 8 HB2 PHE 8 23.421 -13.416 -0.378 11 HB3 PHE 8 HB1 PHE 8 25.044 -14.027 -0.062 12 HD1 PHE 8 HD1 PHE 8 23.296 -10.770 -0.724 13 HD2 PHE 8 HD2 PHE 8 26.400 -12.833 1.409 14 HE1 PHE 8 HE1 PHE 8 23.847 -8.681 0.494 15 HE2 PHE 8 HE2 PHE 8 26.952 -10.745 2.627 16 HZ PHE 8 HZ PHE 8 25.675 -8.668 2.170 17 H GLU 9 HN GLU 9 26.572 -12.900 -3.817 18 HA GLU 9 HA GLU 9 28.139 -15.217 -2.898 19 HB2 GLU 9 HB2 GLU 9 26.191 -15.401 -5.024 20 HB3 GLU 9 HB1 GLU 9 27.813 -15.690 -5.656 21 HG2 GLU 9 HG2 GLU 9 26.989 -17.821 -4.924 22 HG3 GLU 9 HG1 GLU 9 28.154 -17.295 -3.709 23 H ILE 10 HN ILE 10 28.348 -12.269 -3.478 24 HA ILE 10 HA ILE 10 29.801 -11.514 -5.682 25 HB ILE 10 HB ILE 10 30.601 -10.863 -2.829 26 HG12 ILE 10 HG12 ILE 10 28.463 -9.798 -4.675 27 HG13 ILE 10 HG11 ILE 10 28.313 -10.291 -2.987 28 HG21 ILE 10 HG21 ILE 10 32.003 -10.262 -5.050 29 HG22 ILE 10 HG22 ILE 10 31.892 -9.163 -3.676 30 HG23 ILE 10 HG23 ILE 10 30.849 -8.930 -5.079 31 HD11 ILE 10 HD11 ILE 10 29.498 -7.771 -4.120 32 HD12 ILE 10 HD12 ILE 10 30.028 -8.360 -2.544 33 HD13 ILE 10 HD13 ILE 10 28.331 -7.959 -2.810 34 HA PRO 11 HA PRO 11 32.893 -14.830 -5.776 35 HB2 PRO 11 HB2 PRO 11 33.958 -12.938 -7.829 36 HB3 PRO 11 HB1 PRO 11 33.710 -14.691 -7.932 37 HG2 PRO 11 HG2 PRO 11 32.053 -12.963 -9.113 38 HG3 PRO 11 HG1 PRO 11 31.481 -14.485 -8.411 39 HD2 PRO 11 HD2 PRO 11 31.123 -11.708 -7.410 40 HD3 PRO 11 HD1 PRO 11 30.109 -13.143 -7.147 41 H ASP 12 HN ASP 12 34.693 -14.945 -4.496 42 HA ASP 12 HA ASP 12 35.842 -12.505 -3.409 43 HB2 ASP 12 HB2 ASP 12 37.008 -13.886 -1.902 44 HB3 ASP 12 HB1 ASP 12 35.533 -14.802 -2.214 45 H ASP 13 HN ASP 13 36.190 -13.870 -6.257 46 HA ASP 13 HA ASP 13 39.092 -13.874 -6.539 47 HB2 ASP 13 HB2 ASP 13 38.733 -14.546 -8.749 48 HB3 ASP 13 HB1 ASP 13 37.280 -15.157 -7.957 49 H VAL 14 HN VAL 14 37.698 -11.439 -5.561 50 HA VAL 14 HA VAL 14 38.290 -9.519 -7.742 51 HB VAL 14 HB VAL 14 37.006 -9.037 -5.040 52 HG11 VAL 14 HG11 VAL 14 36.727 -6.839 -5.669 53 HG12 VAL 14 HG12 VAL 14 36.653 -7.232 -7.387 54 HG13 VAL 14 HG13 VAL 14 38.210 -7.178 -6.560 55 HG21 VAL 14 HG21 VAL 14 34.913 -9.252 -6.067 56 HG22 VAL 14 HG22 VAL 14 35.832 -10.536 -6.852 57 HG23 VAL 14 HG23 VAL 14 35.572 -9.003 -7.684 58 HA PRO 15 HA PRO 15 42.155 -9.094 -5.407 59 HB2 PRO 15 HB2 PRO 15 43.556 -7.887 -7.418 60 HB3 PRO 15 HB1 PRO 15 43.318 -9.641 -7.311 61 HG2 PRO 15 HG2 PRO 15 41.946 -7.646 -9.024 62 HG3 PRO 15 HG1 PRO 15 42.395 -9.323 -9.373 63 HD2 PRO 15 HD2 PRO 15 39.837 -8.505 -8.704 64 HD3 PRO 15 HD1 PRO 15 40.446 -10.161 -8.491 65 H LEU 16 HN LEU 16 42.901 -7.355 -4.197 66 HA LEU 16 HA LEU 16 41.420 -4.895 -4.169 67 HB2 LEU 16 HB2 LEU 16 44.190 -5.435 -3.060 68 HB3 LEU 16 HB1 LEU 16 43.105 -4.143 -2.569 69 HG LEU 16 HG LEU 16 43.350 -6.575 -1.334 70 HD11 LEU 16 HD11 LEU 16 41.330 -5.892 -0.102 71 HD12 LEU 16 HD12 LEU 16 40.932 -4.749 -1.385 72 HD13 LEU 16 HD13 LEU 16 42.383 -4.510 -0.411 73 HD21 LEU 16 HD21 LEU 16 42.213 -7.876 -3.004 74 HD22 LEU 16 HD22 LEU 16 40.937 -6.668 -3.174 75 HD23 LEU 16 HD23 LEU 16 41.055 -7.623 -1.703 76 HA PRO 17 HA PRO 17 43.247 -2.228 -7.197 77 HB2 PRO 17 HB2 PRO 17 44.349 -0.336 -5.328 78 HB3 PRO 17 HB1 PRO 17 42.917 -0.168 -6.347 79 HG2 PRO 17 HG2 PRO 17 43.093 -0.806 -3.516 80 HG3 PRO 17 HG1 PRO 17 41.699 -0.289 -4.471 81 HD2 PRO 17 HD2 PRO 17 41.986 -2.826 -3.453 82 HD3 PRO 17 HD1 PRO 17 41.020 -2.447 -4.892 83 H ALA 18 HN ALA 18 45.601 -0.590 -6.579 84 HA ALA 18 HA ALA 18 47.577 -2.726 -7.007 85 HB1 ALA 18 HB1 ALA 18 47.418 0.206 -7.497 86 HB2 ALA 18 HB2 ALA 18 47.909 -1.091 -8.587 87 HB3 ALA 18 HB3 ALA 18 49.016 -0.521 -7.336 88 H GLY 19 HN GLY 19 49.115 -3.309 -5.563 89 HA2 GLY 19 HA2 GLY 19 50.453 -3.310 -3.640 90 HA3 GLY 19 HA1 GLY 19 50.192 -1.570 -3.548 91 H TRP 20 HN TRP 20 47.409 -3.675 -3.573 92 HA TRP 20 HA TRP 20 46.938 -2.904 -0.742 93 HB2 TRP 20 HB2 TRP 20 45.095 -3.668 -2.979 94 HB3 TRP 20 HB1 TRP 20 44.555 -3.496 -1.304 95 HD1 TRP 20 HD1 TRP 20 45.659 -1.535 -4.308 96 HE1 TRP 20 HE1 TRP 20 45.389 0.973 -3.832 97 HE3 TRP 20 HE3 TRP 20 44.678 -1.757 0.655 98 HZ2 TRP 20 HZ2 TRP 20 44.837 2.687 -1.562 99 HZ3 TRP 20 HZ3 TRP 20 44.303 0.284 1.970 100 HH2 TRP 20 HH2 TRP 20 44.373 2.522 0.877 101 H GLU 21 HN GLU 21 46.056 -4.416 0.759 102 HA GLU 21 HA GLU 21 45.841 -7.234 0.015 103 HB2 GLU 21 HB2 GLU 21 48.352 -6.769 0.263 104 HB3 GLU 21 HB1 GLU 21 48.026 -6.527 1.979 105 HG2 GLU 21 HG2 GLU 21 46.746 -8.853 1.680 106 HG3 GLU 21 HG1 GLU 21 47.903 -9.034 0.360 107 H MET 22 HN MET 22 44.083 -7.825 1.218 108 HA MET 22 HA MET 22 43.170 -6.364 3.487 109 HB2 MET 22 HB2 MET 22 42.145 -8.364 1.866 110 HB3 MET 22 HB1 MET 22 42.329 -9.163 3.431 111 HG2 MET 22 HG2 MET 22 41.178 -7.180 4.477 112 HG3 MET 22 HG1 MET 22 40.827 -6.606 2.847 113 HE1 MET 22 HE1 MET 22 39.410 -10.343 4.989 114 HE2 MET 22 HE2 MET 22 40.924 -9.457 5.147 115 HE3 MET 22 HE3 MET 22 40.726 -10.625 3.842 116 H ALA 23 HN ALA 23 43.564 -6.641 5.657 117 HA ALA 23 HA ALA 23 45.030 -9.037 6.566 118 HB1 ALA 23 HB1 ALA 23 46.715 -7.539 7.721 119 HB2 ALA 23 HB2 ALA 23 46.091 -6.212 6.742 120 HB3 ALA 23 HB3 ALA 23 46.859 -7.595 5.965 121 H LYS 24 HN LYS 24 45.327 -8.785 9.095 122 HA LYS 24 HA LYS 24 42.906 -7.377 10.109 123 HB2 LYS 24 HB2 LYS 24 42.963 -9.973 10.139 124 HB3 LYS 24 HB1 LYS 24 44.085 -9.768 11.489 125 HG2 LYS 24 HG2 LYS 24 42.408 -8.269 12.588 126 HG3 LYS 24 HG1 LYS 24 41.275 -8.654 11.291 127 HD2 LYS 24 HD2 LYS 24 42.593 -10.872 12.841 128 HD3 LYS 24 HD1 LYS 24 41.179 -10.050 13.504 129 HE2 LYS 24 HE2 LYS 24 39.792 -10.739 11.730 130 HE3 LYS 24 HE1 LYS 24 41.162 -11.105 10.681 131 HZ1 LYS 24 HZ1 LYS 24 41.530 -12.681 12.887 132 HZ2 LYS 24 HZ2 LYS 24 40.954 -13.189 11.371 133 HZ3 LYS 24 HZ3 LYS 24 39.860 -12.765 12.600 134 H THR 25 HN THR 25 43.036 -6.553 12.267 135 HA THR 25 HA THR 25 45.543 -5.234 12.828 136 HB THR 25 HB THR 25 43.261 -4.332 13.348 137 HG1 THR 25 HG1 THR 25 44.312 -4.397 15.848 138 HG21 THR 25 HG21 THR 25 41.844 -5.373 14.762 139 HG22 THR 25 HG22 THR 25 43.139 -5.892 15.840 140 HG23 THR 25 HG23 THR 25 42.804 -6.797 14.364 141 H SER 26 HN SER 26 46.280 -5.409 15.321 142 HA SER 26 HA SER 26 47.837 -7.450 15.911 143 HB2 SER 26 HB2 SER 26 47.456 -7.202 18.222 144 HB3 SER 26 HB1 SER 26 46.889 -5.672 17.560 145 HG SER 26 HG SER 26 45.320 -7.953 18.209 146 H SER 27 HN SER 27 44.303 -7.799 15.957 147 HA SER 27 HA SER 27 44.039 -10.311 14.938 148 HB2 SER 27 HB2 SER 27 45.149 -10.444 17.703 149 HB3 SER 27 HB1 SER 27 43.919 -11.625 17.263 150 HG SER 27 HG SER 27 46.049 -11.103 15.508 151 H GLY 28 HN GLY 28 42.054 -8.978 14.611 152 HA2 GLY 28 HA2 GLY 28 39.827 -9.919 16.002 153 HA3 GLY 28 HA1 GLY 28 40.301 -8.453 16.857 154 H GLN 29 HN GLN 29 41.182 -6.930 14.583 155 HA GLN 29 HA GLN 29 38.541 -6.521 13.273 156 HB2 GLN 29 HB2 GLN 29 39.793 -4.702 14.751 157 HB3 GLN 29 HB1 GLN 29 40.636 -4.401 13.230 158 HG2 GLN 29 HG2 GLN 29 38.755 -2.955 13.169 159 HG3 GLN 29 HG1 GLN 29 38.301 -4.323 12.153 160 HE21 GLN 29 HE21 GLN 29 38.236 -5.698 15.106 161 HE22 GLN 29 HE22 GLN 29 36.636 -5.374 15.569 162 H ARG 30 HN ARG 30 38.416 -6.594 11.086 163 HA ARG 30 HA ARG 30 40.855 -7.349 9.605 164 HB2 ARG 30 HB2 ARG 30 37.963 -7.742 9.275 165 HB3 ARG 30 HB1 ARG 30 38.789 -7.315 7.776 166 HG2 ARG 30 HG2 ARG 30 40.416 -9.133 8.149 167 HG3 ARG 30 HG1 ARG 30 39.589 -9.564 9.646 168 HD2 ARG 30 HD2 ARG 30 38.448 -9.681 6.842 169 HD3 ARG 30 HD1 ARG 30 38.799 -11.047 7.901 170 HE ARG 30 HE ARG 30 36.408 -9.437 7.983 171 HH11 ARG 30 HH11 ARG 30 34.967 -9.831 9.679 172 HH12 ARG 30 HH12 ARG 30 35.513 -10.694 11.078 173 HH21 ARG 30 HH21 ARG 30 38.743 -11.108 9.889 174 HH22 ARG 30 HH22 ARG 30 37.650 -11.419 11.196 175 H TYR 31 HN TYR 31 41.804 -5.992 8.065 176 HA TYR 31 HA TYR 31 40.316 -3.600 7.234 177 HB2 TYR 31 HB2 TYR 31 42.386 -2.164 7.755 178 HB3 TYR 31 HB1 TYR 31 41.341 -2.598 9.100 179 HD1 TYR 31 HD1 TYR 31 43.046 -2.324 10.796 180 HD2 TYR 31 HD2 TYR 31 43.647 -5.037 7.520 181 HE1 TYR 31 HE1 TYR 31 45.011 -3.293 11.950 182 HE2 TYR 31 HE2 TYR 31 45.602 -6.001 8.688 183 HH TYR 31 HH TYR 31 47.250 -5.291 10.397 184 H PHE 32 HN PHE 32 42.175 -2.260 5.814 185 HA PHE 32 HA PHE 32 43.243 -4.352 3.973 186 HB2 PHE 32 HB2 PHE 32 42.251 -1.594 3.215 187 HB3 PHE 32 HB1 PHE 32 42.719 -2.892 2.116 188 HD1 PHE 32 HD1 PHE 32 41.055 -4.278 1.265 189 HD2 PHE 32 HD2 PHE 32 40.393 -2.270 5.000 190 HE1 PHE 32 HE1 PHE 32 38.754 -5.197 1.347 191 HE2 PHE 32 HE2 PHE 32 38.090 -3.186 5.084 192 HZ PHE 32 HZ PHE 32 37.270 -4.650 3.256 193 H LEU 33 HN LEU 33 45.393 -4.275 3.629 194 HA LEU 33 HA LEU 33 46.925 -2.009 4.745 195 HB2 LEU 33 HB2 LEU 33 48.079 -4.375 3.269 196 HB3 LEU 33 HB1 LEU 33 48.843 -3.378 4.503 197 HG LEU 33 HG LEU 33 46.545 -5.309 4.926 198 HD11 LEU 33 HD11 LEU 33 49.494 -5.336 5.486 199 HD12 LEU 33 HD12 LEU 33 48.464 -6.631 4.876 200 HD13 LEU 33 HD13 LEU 33 48.404 -6.186 6.582 201 HD21 LEU 33 HD21 LEU 33 46.025 -3.969 6.672 202 HD22 LEU 33 HD22 LEU 33 47.488 -3.011 6.459 203 HD23 LEU 33 HD23 LEU 33 47.543 -4.501 7.396 204 H ASN 34 HN ASN 34 47.872 -0.426 3.509 205 HA ASN 34 HA ASN 34 47.531 -0.681 0.552 206 HB2 ASN 34 HB2 ASN 34 46.509 1.277 1.959 207 HB3 ASN 34 HB1 ASN 34 48.159 1.900 1.954 208 HD21 ASN 34 HD21 ASN 34 47.939 0.153 -0.852 209 HD22 ASN 34 HD22 ASN 34 47.446 1.381 -1.917 210 H HIS 35 HN HIS 35 49.425 -1.475 -0.269 211 HA HIS 35 HA HIS 35 52.008 -0.914 0.936 212 HB2 HIS 35 HB2 HIS 35 51.293 -2.064 -1.782 213 HB3 HIS 35 HB1 HIS 35 52.916 -2.036 -1.094 214 HD1 HIS 35 HD1 HIS 35 52.442 -4.776 -1.419 215 HD2 HIS 35 HD2 HIS 35 50.491 -2.824 1.710 216 HE1 HIS 35 HE1 HIS 35 51.706 -6.578 0.205 217 HE2 HIS 35 HE2 HIS 35 50.518 -5.401 2.112 218 H ILE 36 HN ILE 36 49.904 0.722 -1.174 219 HA ILE 36 HA ILE 36 51.968 2.300 -2.531 220 HB ILE 36 HB ILE 36 49.079 3.100 -2.371 221 HG12 ILE 36 HG12 ILE 36 49.658 0.494 -2.868 222 HG13 ILE 36 HG11 ILE 36 48.298 1.338 -3.591 223 HG21 ILE 36 HG21 ILE 36 51.264 3.188 -4.463 224 HG22 ILE 36 HG22 ILE 36 50.485 4.551 -3.657 225 HG23 ILE 36 HG23 ILE 36 49.584 3.582 -4.823 226 HD11 ILE 36 HD11 ILE 36 49.457 1.711 -5.621 227 HD12 ILE 36 HD12 ILE 36 49.882 0.056 -5.183 228 HD13 ILE 36 HD13 ILE 36 51.023 1.367 -4.886 229 H ASP 37 HN ASP 37 49.400 2.882 -0.154 230 HA ASP 37 HA ASP 37 50.628 5.441 0.599 231 HB2 ASP 37 HB2 ASP 37 48.105 4.002 1.358 232 HB3 ASP 37 HB1 ASP 37 48.705 5.302 2.389 233 H GLN 38 HN GLN 38 51.357 2.412 1.149 234 HA GLN 38 HA GLN 38 52.386 1.192 2.885 235 HB2 GLN 38 HB2 GLN 38 53.567 3.937 2.826 236 HB3 GLN 38 HB1 GLN 38 54.058 2.844 4.119 237 HG2 GLN 38 HG2 GLN 38 54.502 1.103 2.322 238 HG3 GLN 38 HG1 GLN 38 54.282 2.391 1.137 239 HE21 GLN 38 HE21 GLN 38 55.751 3.008 4.303 240 HE22 GLN 38 HE22 GLN 38 57.316 3.304 3.716 241 H THR 39 HN THR 39 49.870 1.707 3.745 242 HA THR 39 HA THR 39 50.254 1.950 6.618 243 HB THR 39 HB THR 39 49.896 4.198 6.502 244 HG1 THR 39 HG1 THR 39 48.178 3.847 7.665 245 HG21 THR 39 HG21 THR 39 47.829 4.540 4.529 246 HG22 THR 39 HG22 THR 39 49.177 3.647 3.833 247 HG23 THR 39 HG23 THR 39 49.448 5.231 4.555 248 H THR 40 HN THR 40 47.773 2.135 7.500 249 HA THR 40 HA THR 40 46.334 -0.070 6.094 250 HB THR 40 HB THR 40 45.345 -0.535 8.395 251 HG1 THR 40 HG1 THR 40 47.528 1.047 9.249 252 HG21 THR 40 HG21 THR 40 47.944 -1.142 7.324 253 HG22 THR 40 HG22 THR 40 46.882 -2.160 8.298 254 HG23 THR 40 HG23 THR 40 48.026 -1.074 9.083 255 H THR 41 HN THR 41 44.006 0.087 6.067 256 HA THR 41 HA THR 41 42.826 2.644 6.948 257 HB THR 41 HB THR 41 43.020 3.427 4.850 258 HG1 THR 41 HG1 THR 41 41.241 1.586 3.829 259 HG21 THR 41 HG21 THR 41 43.206 0.592 3.822 260 HG22 THR 41 HG22 THR 41 44.588 1.603 4.251 261 HG23 THR 41 HG23 THR 41 43.547 2.056 2.901 262 H TRP 42 HN TRP 42 40.616 2.529 7.325 263 HA TRP 42 HA TRP 42 39.537 -0.184 7.645 264 HB2 TRP 42 HB2 TRP 42 38.208 2.496 8.168 265 HB3 TRP 42 HB1 TRP 42 37.647 0.923 8.732 266 HD1 TRP 42 HD1 TRP 42 39.606 3.791 9.833 267 HE1 TRP 42 HE1 TRP 42 41.027 3.214 11.905 268 HE3 TRP 42 HE3 TRP 42 39.243 -1.303 9.756 269 HZ2 TRP 42 HZ2 TRP 42 41.895 0.894 13.340 270 HZ3 TRP 42 HZ3 TRP 42 40.375 -2.669 11.485 271 HH2 TRP 42 HH2 TRP 42 41.700 -1.579 13.275 272 H GLN 43 HN GLN 43 39.795 1.984 5.164 273 HA GLN 43 HA GLN 43 37.134 1.768 4.008 274 HB2 GLN 43 HB2 GLN 43 38.552 3.646 3.396 275 HB3 GLN 43 HB1 GLN 43 39.800 2.552 2.799 276 HG2 GLN 43 HG2 GLN 43 38.214 1.693 1.096 277 HG3 GLN 43 HG1 GLN 43 37.000 2.837 1.670 278 HE21 GLN 43 HE21 GLN 43 40.483 2.966 0.692 279 HE22 GLN 43 HE22 GLN 43 40.320 4.390 -0.218 280 H ASP 44 HN ASP 44 36.537 0.464 2.185 281 HA ASP 44 HA ASP 44 38.343 -1.847 1.680 282 HB2 ASP 44 HB2 ASP 44 35.325 -1.989 1.732 283 HB3 ASP 44 HB1 ASP 44 36.463 -3.335 1.670 284 HA PRO 45 HA PRO 45 37.871 0.259 -2.372 285 HB2 PRO 45 HB2 PRO 45 39.285 -2.044 -3.434 286 HB3 PRO 45 HB1 PRO 45 39.829 -0.363 -3.331 287 HG2 PRO 45 HG2 PRO 45 40.507 -2.609 -1.645 288 HG3 PRO 45 HG1 PRO 45 41.227 -0.996 -1.705 289 HD2 PRO 45 HD2 PRO 45 39.706 -1.957 0.397 290 HD3 PRO 45 HD1 PRO 45 39.954 -0.233 0.047 291 H ARG 46 HN ARG 46 36.758 -2.698 -1.131 292 HA ARG 46 HA ARG 46 35.472 -3.621 -3.591 293 HB2 ARG 46 HB2 ARG 46 35.566 -4.546 -0.736 294 HB3 ARG 46 HB1 ARG 46 34.307 -5.165 -1.805 295 HG2 ARG 46 HG2 ARG 46 36.169 -6.689 -1.941 296 HG3 ARG 46 HG1 ARG 46 36.132 -5.774 -3.448 297 HD2 ARG 46 HD2 ARG 46 37.759 -4.722 -1.160 298 HD3 ARG 46 HD1 ARG 46 38.401 -6.057 -2.118 299 HE ARG 46 HE ARG 46 38.024 -3.295 -3.043 300 HH11 ARG 46 HH11 ARG 46 38.842 -2.880 -5.108 301 HH12 ARG 46 HH12 ARG 46 39.305 -4.204 -6.124 302 HH21 ARG 46 HH21 ARG 46 38.460 -6.631 -3.796 303 HH22 ARG 46 HH22 ARG 46 39.088 -6.329 -5.381 304 H LYS 47 HN LYS 47 34.888 -0.940 -2.377 305 HA LYS 47 HA LYS 47 31.939 -1.198 -2.456 306 HB2 LYS 47 HB2 LYS 47 33.399 0.398 -0.332 307 HB3 LYS 47 HB1 LYS 47 31.652 0.229 -0.499 308 HG2 LYS 47 HG2 LYS 47 31.983 -2.278 -0.242 309 HG3 LYS 47 HG1 LYS 47 33.651 -1.929 0.213 310 HD2 LYS 47 HD2 LYS 47 32.867 -0.513 2.065 311 HD3 LYS 47 HD1 LYS 47 31.193 -0.829 1.606 312 HE2 LYS 47 HE2 LYS 47 31.231 -2.983 2.412 313 HE3 LYS 47 HE1 LYS 47 32.944 -3.198 2.052 314 HZ1 LYS 47 HZ1 LYS 47 33.573 -2.105 3.967 315 HZ2 LYS 47 HZ2 LYS 47 32.198 -2.955 4.488 316 HZ3 LYS 47 HZ3 LYS 47 32.093 -1.296 4.135 317 H ALA 48 HN ALA 48 30.924 1.036 -2.725 318 HA ALA 48 HA ALA 48 32.309 2.449 -4.839 319 HB1 ALA 48 HB1 ALA 48 30.252 4.115 -4.033 320 HB2 ALA 48 HB2 ALA 48 29.667 2.519 -3.564 321 HB3 ALA 48 HB3 ALA 48 30.114 2.838 -5.240 322 H MET 49 HN MET 49 32.054 5.092 -4.468 323 HA MET 49 HA MET 49 34.199 5.751 -2.682 324 HB2 MET 49 HB2 MET 49 33.633 7.102 -4.683 325 HB3 MET 49 HB1 MET 49 32.119 7.584 -3.916 326 HG2 MET 49 HG2 MET 49 33.320 9.343 -3.126 327 HG3 MET 49 HG1 MET 49 33.946 8.180 -1.956 328 HE1 MET 49 HE1 MET 49 35.410 10.909 -4.384 329 HE2 MET 49 HE2 MET 49 36.681 10.658 -3.191 330 HE3 MET 49 HE3 MET 49 34.997 10.716 -2.675 331 H GLY 50 HN GLY 50 30.977 7.260 -2.476 332 HA2 GLY 50 HA2 GLY 50 29.741 7.892 -0.581 333 HA3 GLY 50 HA1 GLY 50 30.195 6.309 0.053 334 H GLY 51 HN GLY 51 30.220 7.587 2.143 335 HA2 GLY 51 HA2 GLY 51 32.769 7.935 3.177 336 HA3 GLY 51 HA1 GLY 51 32.346 9.528 2.549 337 H GLY 52 HN GLY 52 32.733 8.873 5.343 338 HA2 GLY 52 HA2 GLY 52 30.463 10.178 6.474 339 HA3 GLY 52 HA1 GLY 52 30.309 8.444 6.756 340 H GLY 53 HN GLY 53 31.785 11.320 7.844 341 HA2 GLY 53 HA2 GLY 53 34.176 10.494 9.036 342 HA3 GLY 53 HA1 GLY 53 33.106 11.701 9.753 343 H ASN 54 HN ASN 54 34.177 10.449 11.705 344 HA ASN 54 HA ASN 54 33.678 9.164 13.610 345 HB2 ASN 54 HB2 ASN 54 31.169 9.585 12.332 346 HB3 ASN 54 HB1 ASN 54 31.232 7.889 12.813 347 HD21 ASN 54 HD21 ASN 54 32.171 7.607 15.189 348 HD22 ASN 54 HD22 ASN 54 31.585 8.709 16.339 349 H TYR 55 HN TYR 55 35.433 7.744 12.995 350 HA TYR 55 HA TYR 55 34.590 5.253 11.584 351 HB2 TYR 55 HB2 TYR 55 37.385 6.255 12.208 352 HB3 TYR 55 HB1 TYR 55 36.977 4.847 11.227 353 HD1 TYR 55 HD1 TYR 55 37.874 8.220 11.065 354 HD2 TYR 55 HD2 TYR 55 35.151 5.401 9.306 355 HE1 TYR 55 HE1 TYR 55 37.662 9.672 9.066 356 HE2 TYR 55 HE2 TYR 55 34.939 6.853 7.307 357 HH TYR 55 HH TYR 55 36.994 9.120 6.456 358 H GLN 56 HN GLN 56 36.845 3.750 12.692 359 HA GLN 56 HA GLN 56 35.766 3.333 15.443 360 HB2 GLN 56 HB2 GLN 56 36.802 1.003 15.148 361 HB3 GLN 56 HB1 GLN 56 35.379 1.354 14.166 362 HG2 GLN 56 HG2 GLN 56 37.716 2.253 12.759 363 HG3 GLN 56 HG1 GLN 56 37.963 0.581 13.265 364 HE21 GLN 56 HE21 GLN 56 35.807 2.701 11.377 365 HE22 GLN 56 HE22 GLN 56 35.068 1.447 10.503 366 H GLY 57 HN GLY 57 37.980 5.119 14.401 367 HA2 GLY 57 HA2 GLY 57 39.788 5.871 15.879 368 HA3 GLY 57 HA1 GLY 57 40.045 4.190 16.344 369 HA PRO 58 HA PRO 58 42.220 5.878 12.142 370 HB2 PRO 58 HB2 PRO 58 44.368 6.526 14.126 371 HB3 PRO 58 HB1 PRO 58 43.966 7.332 12.597 372 HG2 PRO 58 HG2 PRO 58 43.260 8.342 14.978 373 HG3 PRO 58 HG1 PRO 58 42.271 8.548 13.523 374 HD2 PRO 58 HD2 PRO 58 41.738 6.893 15.914 375 HD3 PRO 58 HD1 PRO 58 40.607 7.495 14.683 376 HA PRO 59 HA PRO 59 44.031 1.794 12.625 377 HB2 PRO 59 HB2 PRO 59 44.543 1.351 9.993 378 HB3 PRO 59 HB1 PRO 59 42.911 1.256 10.681 379 HG2 PRO 59 HG2 PRO 59 44.163 3.408 9.070 380 HG3 PRO 59 HG1 PRO 59 42.487 2.836 9.090 381 HD2 PRO 59 HD2 PRO 59 43.394 5.133 10.378 382 HD3 PRO 59 HD1 PRO 59 41.894 4.268 10.774 383 HA PRO 60 HA PRO 60 48.347 3.052 12.605 384 HB2 PRO 60 HB2 PRO 60 49.348 0.764 13.706 385 HB3 PRO 60 HB1 PRO 60 48.516 2.009 14.657 386 HG2 PRO 60 HG2 PRO 60 47.518 -0.609 13.677 387 HG3 PRO 60 HG1 PRO 60 47.170 0.241 15.192 388 HD2 PRO 60 HD2 PRO 60 45.462 0.186 13.012 389 HD3 PRO 60 HD1 PRO 60 45.447 1.445 14.266 390 HA PRO 61 HA PRO 61 49.968 1.584 8.754 391 HB2 PRO 61 HB2 PRO 61 52.479 1.224 10.352 392 HB3 PRO 61 HB1 PRO 61 52.253 1.998 8.771 393 HG2 PRO 61 HG2 PRO 61 52.530 3.423 11.009 394 HG3 PRO 61 HG1 PRO 61 51.482 3.947 9.681 395 HD2 PRO 61 HD2 PRO 61 50.723 2.936 12.361 396 HD3 PRO 61 HD1 PRO 61 49.781 3.919 11.219 397 H TYR 62 HN TYR 62 50.010 -0.417 7.817 398 HA TYR 62 HA TYR 62 49.330 -2.788 8.960 399 HB2 TYR 62 HB2 TYR 62 50.975 -3.845 7.188 400 HB3 TYR 62 HB1 TYR 62 49.575 -2.922 6.654 401 HD1 TYR 62 HD1 TYR 62 50.781 -2.534 4.501 402 HD2 TYR 62 HD2 TYR 62 52.282 -1.072 8.248 403 HE1 TYR 62 HE1 TYR 62 52.269 -0.972 3.298 404 HE2 TYR 62 HE2 TYR 62 53.766 0.489 7.049 405 HH TYR 62 HH TYR 62 54.430 1.245 5.075 406 HA PRO 63 HA PRO 63 52.276 -4.465 11.758 407 HB2 PRO 63 HB2 PRO 63 52.929 -6.882 10.460 408 HB3 PRO 63 HB1 PRO 63 51.593 -6.633 11.599 409 HG2 PRO 63 HG2 PRO 63 51.569 -6.643 8.626 410 HG3 PRO 63 HG1 PRO 63 50.353 -7.239 9.770 411 HD2 PRO 63 HD2 PRO 63 49.967 -4.934 8.471 412 HD3 PRO 63 HD1 PRO 63 49.495 -5.093 10.180 413 H LYS 64 HN LYS 64 54.498 -4.306 12.079 414 HA LYS 64 HA LYS 64 56.145 -3.351 9.906 415 HB2 LYS 64 HB2 LYS 64 56.304 -3.445 12.737 416 HB3 LYS 64 HB1 LYS 64 57.717 -4.307 12.128 417 HG2 LYS 64 HG2 LYS 64 57.813 -2.216 10.467 418 HG3 LYS 64 HG1 LYS 64 56.958 -1.438 11.800 419 HD2 LYS 64 HD2 LYS 64 59.028 -1.101 12.669 420 HD3 LYS 64 HD1 LYS 64 58.945 -2.804 13.123 421 HE2 LYS 64 HE2 LYS 64 59.921 -3.357 10.853 422 HE3 LYS 64 HE1 LYS 64 60.200 -1.629 10.629 423 HZ1 LYS 64 HZ1 LYS 64 62.127 -2.876 11.543 424 HZ2 LYS 64 HZ2 LYS 64 61.219 -3.176 12.946 425 HZ3 LYS 64 HZ3 LYS 64 61.619 -1.582 12.515 426 H HIS 65 HN HIS 65 56.744 -4.748 8.305 427 HA HIS 65 HA HIS 65 56.786 -7.514 8.299 428 HB2 HIS 65 HB2 HIS 65 58.972 -5.879 6.989 429 HB3 HIS 65 HB1 HIS 65 58.298 -7.414 6.443 430 HD1 HIS 65 HD1 HIS 65 55.345 -6.001 7.394 431 HD2 HIS 65 HD2 HIS 65 57.976 -4.959 4.330 432 HE1 HIS 65 HE1 HIS 65 53.996 -4.668 5.712 433 HE2 HIS 65 HE2 HIS 65 55.589 -4.028 3.844
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