NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
492582 | 2kng | 16831 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 SER 66 H1 SER 66 28.649 -12.197 -13.966 2 H2 SER 66 H2 SER 66 29.800 -13.015 -13.137 3 H3 SER 66 H3 SER 66 28.223 -13.434 -12.980 4 HA SER 66 HA SER 66 28.925 -12.257 -11.032 5 HB2 SER 66 HB2 SER 66 29.575 -9.960 -12.931 6 HB3 SER 66 HB3 SER 66 29.712 -9.947 -11.166 7 HG SER 66 HG SER 66 31.727 -10.410 -12.173 8 H GLY 67 H GLY 67 27.507 -10.845 -9.855 9 HA2 GLY 67 HA2 GLY 67 25.560 -9.676 -9.407 10 HA3 GLY 67 HA3 GLY 67 25.321 -9.400 -11.125 11 H SER 68 H SER 68 23.067 -9.728 -10.122 12 HA SER 68 HA SER 68 22.131 -12.349 -9.437 13 HB2 SER 68 HB2 SER 68 20.531 -9.966 -10.433 14 HB3 SER 68 HB3 SER 68 19.903 -11.361 -9.538 15 HG SER 68 HG SER 68 21.197 -10.714 -7.750 16 H GLY 69 H GLY 69 20.817 -13.808 -10.561 17 HA2 GLY 69 HA2 GLY 69 19.944 -13.543 -13.291 18 HA3 GLY 69 HA3 GLY 69 21.469 -14.436 -13.219 19 H ARG 70 H ARG 70 20.038 -16.104 -14.207 20 HA ARG 70 HA ARG 70 17.920 -17.343 -12.755 21 HB2 ARG 70 HB2 ARG 70 17.954 -19.047 -14.441 22 HB3 ARG 70 HB3 ARG 70 18.197 -17.472 -15.187 23 HG2 ARG 70 HG2 ARG 70 20.662 -17.950 -15.332 24 HG3 ARG 70 HG3 ARG 70 20.376 -19.555 -14.640 25 HD2 ARG 70 HD2 ARG 70 19.164 -18.500 -17.233 26 HD3 ARG 70 HD3 ARG 70 20.585 -19.532 -17.144 27 HE ARG 70 HE ARG 70 17.775 -20.311 -16.771 28 HH11 ARG 70 HH11 ARG 70 21.090 -21.415 -16.323 29 HH12 ARG 70 HH12 ARG 70 20.606 -23.083 -16.233 30 HH21 ARG 70 HH21 ARG 70 17.250 -22.453 -16.632 31 HH22 ARG 70 HH22 ARG 70 18.485 -23.651 -16.392 32 H GLY 71 H GLY 71 21.309 -17.752 -12.287 33 HA2 GLY 71 HA2 GLY 71 21.445 -20.337 -11.128 34 HA3 GLY 71 HA3 GLY 71 22.533 -18.983 -10.793 35 H ARG 72 H ARG 72 19.913 -17.508 -9.810 36 HA ARG 72 HA ARG 72 20.031 -18.128 -6.983 37 HB2 ARG 72 HB2 ARG 72 17.962 -16.654 -8.663 38 HB3 ARG 72 HB3 ARG 72 17.961 -16.700 -6.901 39 HG2 ARG 72 HG2 ARG 72 20.116 -15.582 -6.772 40 HG3 ARG 72 HG3 ARG 72 20.290 -15.578 -8.526 41 HD2 ARG 72 HD2 ARG 72 18.063 -14.174 -7.001 42 HD3 ARG 72 HD3 ARG 72 19.538 -13.396 -7.607 43 HE ARG 72 HE ARG 72 18.413 -14.682 -9.833 44 HH11 ARG 72 HH11 ARG 72 17.386 -12.098 -7.696 45 HH12 ARG 72 HH12 ARG 72 16.341 -11.387 -8.894 46 HH21 ARG 72 HH21 ARG 72 17.007 -13.763 -11.296 47 HH22 ARG 72 HH22 ARG 72 16.144 -12.309 -10.889 48 H GLY 73 H GLY 73 18.196 -19.574 -9.584 49 HA2 GLY 73 HA2 GLY 73 16.929 -21.479 -9.628 50 HA3 GLY 73 HA3 GLY 73 17.298 -21.744 -7.925 51 H ALA 74 H ALA 74 15.789 -18.696 -8.446 52 HA ALA 74 HA ALA 74 13.382 -19.532 -7.044 53 HB1 ALA 74 HB1 ALA 74 14.489 -17.372 -6.595 54 HB2 ALA 74 HB2 ALA 74 14.149 -16.845 -8.259 55 HB3 ALA 74 HB3 ALA 74 12.816 -17.149 -7.125 56 H ILE 75 H ILE 75 11.283 -19.500 -7.706 57 HA ILE 75 HA ILE 75 10.796 -19.816 -10.633 58 HB ILE 75 HB ILE 75 9.383 -21.013 -8.236 59 HG12 ILE 75 HG11 ILE 75 11.529 -22.085 -8.507 60 HG13 ILE 75 HG12 ILE 75 10.235 -23.172 -8.947 61 HG21 ILE 75 HG21 ILE 75 8.192 -22.467 -9.882 62 HG22 ILE 75 HG22 ILE 75 7.718 -20.778 -9.950 63 HG23 ILE 75 HG23 ILE 75 8.813 -21.438 -11.190 64 HD11 ILE 75 HD11 ILE 75 12.046 -21.698 -10.911 65 HD12 ILE 75 HD12 ILE 75 12.120 -23.407 -10.476 66 HD13 ILE 75 HD13 ILE 75 10.721 -22.799 -11.364 67 H ASP 76 H ASP 76 8.830 -19.018 -11.534 68 HA ASP 76 HA ASP 76 8.091 -16.374 -10.468 69 HB2 ASP 76 HB2 ASP 76 8.699 -16.686 -12.821 70 HB3 ASP 76 HB3 ASP 76 7.345 -17.788 -13.054 71 H ARG 77 H ARG 77 6.382 -19.397 -11.291 72 HA ARG 77 HA ARG 77 3.947 -18.548 -9.775 73 HB2 ARG 77 HB2 ARG 77 4.355 -20.861 -11.715 74 HB3 ARG 77 HB3 ARG 77 2.844 -20.444 -10.888 75 HG2 ARG 77 HG2 ARG 77 2.877 -18.200 -11.993 76 HG3 ARG 77 HG3 ARG 77 4.326 -18.692 -12.895 77 HD2 ARG 77 HD2 ARG 77 3.069 -20.561 -13.906 78 HD3 ARG 77 HD3 ARG 77 1.612 -20.050 -13.021 79 HE ARG 77 HE ARG 77 2.626 -17.827 -14.494 80 HH11 ARG 77 HH21 ARG 77 0.992 -20.852 -15.178 81 HH12 ARG 77 HH22 ARG 77 0.309 -20.251 -16.665 82 HH21 ARG 77 HH11 ARG 77 1.710 -17.120 -16.381 83 HH22 ARG 77 HH12 ARG 77 0.704 -18.177 -17.321 84 H GLU 78 H GLU 78 6.130 -18.930 -8.267 85 HA GLU 78 HA GLU 78 6.754 -21.538 -7.394 86 HB2 GLU 78 HB2 GLU 78 8.063 -19.428 -7.249 87 HB3 GLU 78 HB3 GLU 78 7.077 -18.924 -5.879 88 HG2 GLU 78 HG2 GLU 78 7.928 -20.791 -4.543 89 HG3 GLU 78 HG3 GLU 78 8.731 -21.488 -5.955 90 H GLN 79 H GLN 79 3.936 -19.735 -6.514 91 HA GLN 79 HA GLN 79 3.316 -20.991 -3.998 92 HB2 GLN 79 HB2 GLN 79 1.492 -19.957 -6.209 93 HB3 GLN 79 HB3 GLN 79 0.948 -20.415 -4.602 94 HG2 GLN 79 HG2 GLN 79 2.911 -18.151 -5.203 95 HG3 GLN 79 HG3 GLN 79 1.194 -17.963 -4.899 96 HE21 GLN 79 HE22 GLN 79 2.864 -16.501 -3.316 97 HE22 GLN 79 HE21 GLN 79 2.908 -17.200 -1.702 98 H SER 80 H SER 80 3.564 -22.410 -7.156 99 HA SER 80 HA SER 80 1.781 -24.598 -7.027 100 HB2 SER 80 HB2 SER 80 3.473 -25.771 -8.393 101 HB3 SER 80 HB3 SER 80 3.203 -24.110 -8.964 102 HG SER 80 HG SER 80 5.450 -24.618 -8.836 103 H ALA 81 H ALA 81 5.048 -24.310 -5.508 104 HA ALA 81 HA ALA 81 5.066 -26.820 -4.283 105 HB1 ALA 81 HB1 ALA 81 6.857 -25.845 -2.874 106 HB2 ALA 81 HB2 ALA 81 7.040 -25.389 -4.580 107 HB3 ALA 81 HB3 ALA 81 6.391 -24.216 -3.409 108 H ALA 82 H ALA 82 3.651 -23.755 -3.101 109 HA ALA 82 HA ALA 82 2.957 -24.740 -0.470 110 HB1 ALA 82 HB1 ALA 82 3.239 -22.344 -0.978 111 HB2 ALA 82 HB2 ALA 82 1.852 -22.394 -2.083 112 HB3 ALA 82 HB3 ALA 82 1.616 -22.684 -0.351 113 H ILE 83 H ILE 83 1.177 -24.580 -3.597 114 HA ILE 83 HA ILE 83 -1.255 -25.748 -2.558 115 HB ILE 83 HB ILE 83 -0.187 -25.597 -5.405 116 HG12 ILE 83 HG12 ILE 83 -2.239 -23.934 -3.879 117 HG13 ILE 83 HG13 ILE 83 -0.622 -23.403 -4.268 118 HG21 ILE 83 HG21 ILE 83 -1.866 -27.437 -5.190 119 HG22 ILE 83 HG22 ILE 83 -3.000 -26.305 -4.420 120 HG23 ILE 83 HG23 ILE 83 -2.509 -26.096 -6.117 121 HD11 ILE 83 HD11 ILE 83 -1.186 -23.622 -6.722 122 HD12 ILE 83 HD12 ILE 83 -2.883 -23.879 -6.230 123 HD13 ILE 83 HD13 ILE 83 -2.069 -22.365 -5.832 124 H ARG 84 H ARG 84 1.655 -27.217 -4.070 125 HA ARG 84 HA ARG 84 0.819 -29.958 -3.931 126 HB2 ARG 84 HB2 ARG 84 2.833 -29.097 -5.157 127 HB3 ARG 84 HB3 ARG 84 3.604 -28.745 -3.619 128 HG2 ARG 84 HG2 ARG 84 3.468 -31.248 -3.079 129 HG3 ARG 84 HG3 ARG 84 2.857 -31.481 -4.721 130 HD2 ARG 84 HD2 ARG 84 5.228 -31.935 -4.696 131 HD3 ARG 84 HD3 ARG 84 4.960 -30.439 -5.608 132 HE ARG 84 HE ARG 84 5.514 -29.969 -2.777 133 HH11 ARG 84 H111 ARG 84 7.279 -30.782 -5.704 134 HH12 ARG 84 HH12 ARG 84 8.661 -29.838 -5.215 135 HH21 ARG 84 HH21 ARG 84 7.352 -28.863 -2.197 136 HH22 ARG 84 HH22 ARG 84 8.722 -28.852 -3.263 137 H GLU 85 H GLU 85 2.633 -28.031 -1.464 138 HA GLU 85 HA GLU 85 2.640 -30.029 0.472 139 HB2 GLU 85 HB2 GLU 85 3.985 -27.890 0.455 140 HB3 GLU 85 HB3 GLU 85 2.544 -27.052 1.064 141 HG2 GLU 85 HG2 GLU 85 2.504 -28.698 2.986 142 HG3 GLU 85 HG3 GLU 85 4.017 -29.380 2.388 143 H TRP 86 H TRP 86 0.202 -27.367 0.062 144 HA TRP 86 HA TRP 86 -1.523 -28.088 2.106 145 HB2 TRP 86 HB2 TRP 86 -1.778 -26.022 0.910 146 HB3 TRP 86 HB3 TRP 86 -2.053 -26.857 -0.612 147 HD1 TRP 86 HD1 TRP 86 -3.815 -25.907 2.623 148 HE1 TRP 86 HE1 TRP 86 -6.343 -26.327 2.403 149 HE3 TRP 86 HE3 TRP 86 -3.876 -28.158 -1.982 150 HZ2 TRP 86 HZ2 TRP 86 -8.120 -27.690 0.580 151 HZ3 TRP 86 HZ3 TRP 86 -6.015 -28.978 -2.949 152 HH2 TRP 86 HH2 TRP 86 -8.131 -28.783 -1.651 153 H ALA 87 H ALA 87 -1.522 -29.328 -1.278 154 HA ALA 87 HA ALA 87 -3.736 -31.084 -0.976 155 HB1 ALA 87 HB1 ALA 87 -1.315 -31.150 -2.836 156 HB2 ALA 87 HB2 ALA 87 -2.759 -32.172 -3.024 157 HB3 ALA 87 HB3 ALA 87 -2.894 -30.404 -3.147 158 H ARG 88 H ARG 88 -0.220 -31.711 -0.466 159 HA ARG 88 HA ARG 88 -0.480 -34.446 0.353 160 HB2 ARG 88 HB2 ARG 88 1.632 -33.356 -0.322 161 HB3 ARG 88 HB3 ARG 88 1.607 -32.360 1.136 162 HG2 ARG 88 HG2 ARG 88 1.765 -34.382 2.555 163 HG3 ARG 88 HG3 ARG 88 1.731 -35.418 1.119 164 HD2 ARG 88 HD2 ARG 88 3.861 -33.309 1.678 165 HD3 ARG 88 HD3 ARG 88 4.004 -35.012 2.139 166 HE ARG 88 HE ARG 88 3.406 -35.016 -0.606 167 HH11 ARG 88 HH11 ARG 88 6.080 -33.932 1.390 168 HH12 ARG 88 HH12 ARG 88 7.255 -34.197 0.133 169 HH21 ARG 88 HH21 ARG 88 4.965 -35.365 -2.162 170 HH22 ARG 88 HH22 ARG 88 6.626 -34.991 -1.828 171 H ARG 89 H ARG 89 -0.492 -31.467 2.350 172 HA ARG 89 HA ARG 89 -0.892 -32.704 4.908 173 HB2 ARG 89 HB2 ARG 89 -1.666 -29.970 3.797 174 HB3 ARG 89 HB3 ARG 89 -1.954 -30.425 5.475 175 HG2 ARG 89 HG2 ARG 89 0.430 -30.775 5.874 176 HG3 ARG 89 HG3 ARG 89 0.811 -30.428 4.181 177 HD2 ARG 89 HD2 ARG 89 -0.148 -28.152 4.432 178 HD3 ARG 89 HD3 ARG 89 -0.518 -28.471 6.123 179 HE ARG 89 HE ARG 89 2.088 -27.804 4.940 180 HH11 ARG 89 HH11 ARG 89 0.684 -29.213 7.861 181 HH12 ARG 89 HH12 ARG 89 2.123 -28.856 8.773 182 HH21 ARG 89 HH21 ARG 89 3.730 -27.384 6.075 183 HH22 ARG 89 HH22 ARG 89 3.862 -27.814 7.784 184 H ASN 90 H ASN 90 -3.253 -31.929 2.393 185 HA ASN 90 HA ASN 90 -5.499 -32.866 4.094 186 HB2 ASN 90 HB2 ASN 90 -5.351 -31.510 1.371 187 HB3 ASN 90 HB3 ASN 90 -6.842 -32.140 2.063 188 HD21 ASN 90 HD22 ASN 90 -4.349 -29.660 2.481 189 HD22 ASN 90 HD21 ASN 90 -5.304 -28.704 3.608 190 H GLY 91 H GLY 91 -3.250 -34.556 2.386 191 HA2 GLY 91 HA2 GLY 91 -3.165 -36.733 1.693 192 HA3 GLY 91 HA3 GLY 91 -4.802 -36.965 2.310 193 H HIS 92 H HIS 92 -4.276 -34.523 -0.148 194 HA HIS 92 HA HIS 92 -5.991 -36.013 -2.063 195 HB2 HIS 92 HB2 HIS 92 -4.912 -33.169 -2.160 196 HB3 HIS 92 HB3 HIS 92 -6.091 -33.865 -3.268 197 HD1 HIS 92 HD1 HIS 92 -7.778 -35.225 -0.621 198 HD2 HIS 92 HD2 HIS 92 -6.714 -31.242 -1.554 199 HE1 HIS 92 HE1 HIS 92 -9.477 -33.722 0.584 200 HE2 HIS 92 HE2 HIS 92 -8.838 -31.293 0.004 201 H ASN 93 H ASN 93 -5.431 -36.406 -4.225 202 HA ASN 93 HA ASN 93 -2.710 -37.272 -4.662 203 HB2 ASN 93 HB2 ASN 93 -4.745 -38.399 -5.563 204 HB3 ASN 93 HB3 ASN 93 -5.048 -37.007 -6.606 205 HD21 ASN 93 HD22 ASN 93 -4.983 -38.933 -8.196 206 HD22 ASN 93 HD21 ASN 93 -3.400 -39.288 -8.871 207 H VAL 94 H VAL 94 -1.014 -36.181 -5.466 208 HA VAL 94 HA VAL 94 -1.279 -34.054 -7.436 209 HB VAL 94 HB VAL 94 -1.578 -32.864 -5.251 210 HG11 VAL 94 HG11 VAL 94 1.334 -33.581 -4.714 211 HG12 VAL 94 HG12 VAL 94 0.333 -32.471 -3.773 212 HG13 VAL 94 HG13 VAL 94 -0.072 -34.193 -3.814 213 HG21 VAL 94 HG21 VAL 94 -0.682 -31.748 -7.293 214 HG22 VAL 94 HG22 VAL 94 -0.174 -31.010 -5.771 215 HG23 VAL 94 HG23 VAL 94 0.967 -32.020 -6.677 216 H SER 95 H SER 95 0.650 -33.704 -8.623 217 HA SER 95 HA SER 95 2.587 -35.874 -8.526 218 HB2 SER 95 HB2 SER 95 1.807 -34.745 -10.634 219 HB3 SER 95 HB3 SER 95 2.759 -33.321 -10.157 220 HG SER 95 HG SER 95 3.950 -34.762 -11.518 221 H THR 96 H THR 96 4.912 -35.621 -8.287 222 HA THR 96 HA THR 96 5.650 -34.029 -5.958 223 HB THR 96 HB THR 96 7.921 -35.008 -6.369 224 HG1 THR 96 HG1 THR 96 8.044 -36.630 -7.975 225 HG21 THR 96 HG21 THR 96 6.239 -36.185 -4.955 226 HG22 THR 96 HG22 THR 96 5.659 -37.056 -6.390 227 HG23 THR 96 HG23 THR 96 7.316 -37.309 -5.803 228 H ARG 97 H ARG 97 6.154 -33.754 -9.437 229 HA ARG 97 HA ARG 97 7.394 -31.047 -9.134 230 HB2 ARG 97 HB2 ARG 97 8.417 -33.340 -10.879 231 HB3 ARG 97 HB3 ARG 97 8.993 -31.673 -10.969 232 HG2 ARG 97 HG2 ARG 97 9.768 -31.805 -8.602 233 HG3 ARG 97 HG3 ARG 97 9.273 -33.511 -8.552 234 HD2 ARG 97 HD2 ARG 97 10.806 -34.008 -10.434 235 HD3 ARG 97 HD3 ARG 97 11.329 -32.309 -10.451 236 HE ARG 97 HE ARG 97 11.685 -33.284 -7.813 237 HH11 ARG 97 HH11 ARG 97 13.111 -33.885 -10.960 238 HH12 ARG 97 HH12 ARG 97 14.637 -34.382 -10.278 239 HH21 ARG 97 HH21 ARG 97 13.656 -33.949 -7.009 240 HH22 ARG 97 HH22 ARG 97 14.928 -34.416 -8.097 241 H GLY 98 H GLY 98 7.404 -29.821 -11.172 242 HA2 GLY 98 HA2 GLY 98 6.463 -29.018 -13.139 243 HA3 GLY 98 HA3 GLY 98 5.730 -30.594 -13.404 244 H ARG 99 H ARG 99 3.799 -29.694 -14.126 245 HA ARG 99 HA ARG 99 2.341 -27.641 -12.689 246 HB2 ARG 99 HB2 ARG 99 1.531 -29.449 -15.012 247 HB3 ARG 99 HB3 ARG 99 0.556 -28.114 -14.397 248 HG2 ARG 99 HG2 ARG 99 2.415 -26.523 -14.874 249 HG3 ARG 99 HG3 ARG 99 3.353 -27.840 -15.591 250 HD2 ARG 99 HD2 ARG 99 0.624 -26.883 -16.552 251 HD3 ARG 99 HD3 ARG 99 2.154 -26.426 -17.277 252 HE ARG 99 HE ARG 99 0.739 -28.990 -17.531 253 HH11 ARG 99 HH21 ARG 99 3.826 -27.412 -18.110 254 HH12 ARG 99 HH22 ARG 99 4.323 -28.619 -19.264 255 HH21 ARG 99 HH11 ARG 99 1.446 -30.491 -19.002 256 HH22 ARG 99 HH12 ARG 99 2.997 -30.304 -19.767 257 H ILE 100 H ILE 100 0.254 -27.737 -11.868 258 HA ILE 100 HA ILE 100 -0.509 -30.267 -10.467 259 HB ILE 100 HB ILE 100 -0.788 -27.371 -9.635 260 HG12 ILE 100 HG11 ILE 100 0.718 -29.772 -8.491 261 HG13 ILE 100 HG12 ILE 100 1.428 -28.371 -9.285 262 HG21 ILE 100 HG21 ILE 100 -1.935 -28.096 -7.615 263 HG22 ILE 100 HG22 ILE 100 -2.875 -28.605 -8.994 264 HG23 ILE 100 HG23 ILE 100 -1.868 -29.792 -8.122 265 HD11 ILE 100 HD11 ILE 100 0.074 -28.434 -6.577 266 HD12 ILE 100 HD12 ILE 100 1.770 -28.102 -6.968 267 HD13 ILE 100 HD13 ILE 100 0.522 -26.924 -7.429 268 HA PRO 101 HA PRO 101 -4.195 -30.080 -12.987 269 HB2 PRO 101 HB2 PRO 101 -5.756 -31.299 -10.753 270 HB3 PRO 101 HB3 PRO 101 -5.528 -31.887 -12.421 271 HG2 PRO 101 HG2 PRO 101 -4.269 -33.051 -10.288 272 HG3 PRO 101 HG3 PRO 101 -3.455 -32.888 -11.881 273 HD2 PRO 101 HD2 PRO 101 -3.149 -31.161 -9.424 274 HD3 PRO 101 HD3 PRO 101 -1.897 -31.809 -10.525 275 H ALA 102 H ALA 102 -5.767 -28.550 -13.354 276 HA ALA 102 HA ALA 102 -6.045 -26.354 -11.661 277 HB1 ALA 102 HB1 ALA 102 -7.767 -25.612 -13.170 278 HB2 ALA 102 HB2 ALA 102 -6.423 -26.335 -14.081 279 HB3 ALA 102 HB3 ALA 102 -7.939 -27.254 -13.843 280 H ASP 103 H ASP 103 -8.058 -29.286 -11.757 281 HA ASP 103 HA ASP 103 -10.134 -28.460 -10.116 282 HB2 ASP 103 HB2 ASP 103 -8.790 -31.177 -10.362 283 HB3 ASP 103 HB3 ASP 103 -10.313 -30.897 -9.520 284 H VAL 104 H VAL 104 -6.834 -29.482 -9.202 285 HA VAL 104 HA VAL 104 -7.403 -29.508 -6.365 286 HB VAL 104 HB VAL 104 -4.728 -29.625 -7.719 287 HG11 VAL 104 HG11 VAL 104 -4.533 -29.102 -5.324 288 HG12 VAL 104 HG12 VAL 104 -5.571 -30.492 -4.930 289 HG13 VAL 104 HG13 VAL 104 -3.964 -30.739 -5.650 290 HG21 VAL 104 HG21 VAL 104 -6.092 -31.547 -8.496 291 HG22 VAL 104 HG22 VAL 104 -4.828 -32.088 -7.396 292 HG23 VAL 104 HG23 VAL 104 -6.499 -31.936 -6.812 293 H ILE 105 H ILE 105 -5.895 -27.280 -8.715 294 HA ILE 105 HA ILE 105 -5.147 -25.235 -6.819 295 HB ILE 105 HB ILE 105 -5.888 -25.203 -9.766 296 HG12 ILE 105 HG11 ILE 105 -3.150 -24.561 -8.623 297 HG13 ILE 105 HG12 ILE 105 -3.650 -26.245 -8.603 298 HG21 ILE 105 HG21 ILE 105 -6.387 -22.964 -8.981 299 HG22 ILE 105 HG22 ILE 105 -4.869 -22.890 -8.053 300 HG23 ILE 105 HG23 ILE 105 -4.843 -22.917 -9.833 301 HD11 ILE 105 HD11 ILE 105 -3.631 -24.537 -11.115 302 HD12 ILE 105 HD12 ILE 105 -2.360 -25.678 -10.626 303 HD13 ILE 105 HD13 ILE 105 -3.988 -26.280 -10.972 304 H ASP 106 H ASP 106 -8.224 -25.735 -8.658 305 HA ASP 106 HA ASP 106 -9.687 -23.709 -7.436 306 HB2 ASP 106 HB2 ASP 106 -10.402 -24.926 -9.439 307 HB3 ASP 106 HB3 ASP 106 -10.633 -26.393 -8.488 308 H ALA 107 H ALA 107 -9.343 -27.167 -6.383 309 HA ALA 107 HA ALA 107 -10.863 -27.068 -4.097 310 HB1 ALA 107 HB1 ALA 107 -8.264 -28.622 -4.530 311 HB2 ALA 107 HB2 ALA 107 -9.563 -29.022 -3.391 312 HB3 ALA 107 HB3 ALA 107 -9.864 -29.105 -5.127 313 H TYR 108 H TYR 108 -7.400 -26.187 -4.416 314 HA TYR 108 HA TYR 108 -6.943 -25.390 -1.711 315 HB2 TYR 108 HB2 TYR 108 -5.094 -25.811 -3.125 316 HB3 TYR 108 HB3 TYR 108 -5.664 -24.724 -4.372 317 HD1 TYR 108 HD2 TYR 108 -4.382 -24.777 -0.853 318 HD2 TYR 108 HD1 TYR 108 -4.974 -22.468 -4.448 319 HE1 TYR 108 HE2 TYR 108 -2.975 -22.951 0.093 320 HE2 TYR 108 HE1 TYR 108 -3.584 -20.630 -3.488 321 HH TYR 108 HH TYR 108 -2.328 -19.911 -1.694 322 H HIS 109 H HIS 109 -7.932 -23.391 -4.578 323 HA HIS 109 HA HIS 109 -8.241 -20.950 -3.119 324 HB2 HIS 109 HB2 HIS 109 -9.717 -21.919 -5.601 325 HB3 HIS 109 HB3 HIS 109 -9.756 -20.277 -4.978 326 HD1 HIS 109 HD1 HIS 109 -8.626 -20.943 -7.888 327 HD2 HIS 109 HD2 HIS 109 -6.434 -20.253 -4.347 328 HE1 HIS 109 HE1 HIS 109 -6.297 -20.114 -8.622 329 HE2 HIS 109 HE2 HIS 109 -4.974 -19.682 -6.454 330 H ALA 110 H ALA 110 -10.653 -23.586 -3.592 331 HA ALA 110 HA ALA 110 -12.767 -22.257 -2.253 332 HB1 ALA 110 HB1 ALA 110 -13.056 -24.291 -3.617 333 HB2 ALA 110 HB2 ALA 110 -12.155 -25.244 -2.417 334 HB3 ALA 110 HB3 ALA 110 -13.717 -24.517 -1.985 335 H ALA 111 H ALA 111 -10.152 -24.367 -0.879 336 HA ALA 111 HA ALA 111 -11.033 -24.226 1.759 337 HB1 ALA 111 HB1 ALA 111 -8.216 -24.603 0.675 338 HB2 ALA 111 HB2 ALA 111 -8.769 -25.022 2.310 339 HB3 ALA 111 HB3 ALA 111 -9.450 -25.870 0.908 340 H THR 112 H THR 112 -8.770 -22.042 -0.006 341 HA THR 112 HA THR 112 -8.254 -20.417 2.364 342 HB THR 112 HB THR 112 -7.073 -18.890 0.862 343 HG1 THR 112 HG1 THR 112 -6.932 -19.342 -1.305 344 HG21 THR 112 HG21 THR 112 -5.291 -20.399 0.177 345 HG22 THR 112 HG22 THR 112 -5.910 -20.891 1.759 346 HG23 THR 112 HG23 THR 112 -6.366 -21.802 0.304 347 H LEU 113 H LEU 113 -10.704 -20.153 -0.198 348 HA LEU 113 HA LEU 113 -11.441 -17.462 0.696 349 HB2 LEU 113 HB2 LEU 113 -11.225 -17.996 -1.676 350 HB3 LEU 113 HB3 LEU 113 -12.425 -19.285 -1.519 351 HG LEU 113 HG LEU 113 -14.164 -17.677 -0.982 352 HD11 LEU 113 HD11 LEU 113 -12.904 -15.827 0.042 353 HD12 LEU 113 HD12 LEU 113 -12.024 -15.550 -1.477 354 HD13 LEU 113 HD13 LEU 113 -13.770 -15.232 -1.370 355 HD21 LEU 113 HD21 LEU 113 -13.751 -18.327 -3.330 356 HD22 LEU 113 HD22 LEU 113 -14.343 -16.661 -3.228 357 HD23 LEU 113 HD23 LEU 113 -12.618 -16.969 -3.518 358 H GLU 114 H GLU 114 -12.996 -20.700 0.629 359 HA GLU 114 HA GLU 114 -15.448 -19.527 1.696 360 HB2 GLU 114 HB2 GLU 114 -14.882 -22.425 1.091 361 HB3 GLU 114 HB3 GLU 114 -16.444 -21.706 1.473 362 HG2 GLU 114 HG2 GLU 114 -14.746 -21.073 -0.974 363 HG3 GLU 114 HG3 GLU 114 -16.173 -22.100 -0.930 364 H HIS 115 H HIS 115 -12.785 -21.174 3.250 365 HA HIS 115 HA HIS 115 -14.187 -22.271 5.458 366 HB2 HIS 115 HB2 HIS 115 -11.866 -22.804 4.703 367 HB3 HIS 115 HB3 HIS 115 -11.302 -21.282 5.382 368 HD1 HIS 115 HD1 HIS 115 -12.583 -24.755 6.441 369 HD2 HIS 115 HD2 HIS 115 -10.907 -21.223 8.042 370 HE1 HIS 115 HE1 HIS 115 -11.895 -25.308 8.862 371 HE2 HIS 115 HE2 HIS 115 -10.884 -23.144 9.834 372 H HIS 116 H HIS 116 -13.479 -18.948 4.889 373 HA HIS 116 HA HIS 116 -14.605 -18.191 7.568 374 HB2 HIS 116 HB2 HIS 116 -13.386 -16.042 7.309 375 HB3 HIS 116 HB3 HIS 116 -12.345 -17.442 7.434 376 HD1 HIS 116 HD1 HIS 116 -13.471 -14.860 4.794 377 HD2 HIS 116 HD2 HIS 116 -10.761 -18.044 5.388 378 HE1 HIS 116 HE1 HIS 116 -11.879 -14.851 2.762 379 HE2 HIS 116 HE2 HIS 116 -10.248 -16.837 3.120 380 H HIS 117 H HIS 117 -16.094 -18.973 5.148 381 HA HIS 117 HA HIS 117 -17.890 -16.590 4.932 382 HB2 HIS 117 HB2 HIS 117 -16.344 -16.486 3.010 383 HB3 HIS 117 HB3 HIS 117 -16.741 -18.153 2.580 384 HD1 HIS 117 HD1 HIS 117 -18.317 -18.216 0.576 385 HD2 HIS 117 HD2 HIS 117 -18.913 -14.902 3.144 386 HE1 HIS 117 HE1 HIS 117 -20.268 -16.840 -0.431 387 HE2 HIS 117 HE2 HIS 117 -20.614 -14.823 1.141 388 H HIS 118 H HIS 118 -17.566 -20.072 4.056 389 HA HIS 118 HA HIS 118 -20.502 -20.441 4.550 390 HB2 HIS 118 HB2 HIS 118 -19.630 -20.364 2.119 391 HB3 HIS 118 HB3 HIS 118 -18.899 -21.926 2.442 392 HD1 HIS 118 HD1 HIS 118 -20.846 -23.874 3.230 393 HD2 HIS 118 HD2 HIS 118 -22.114 -20.302 1.375 394 HE1 HIS 118 HE1 HIS 118 -23.234 -24.322 2.340 395 HE2 HIS 118 HE2 HIS 118 -23.996 -22.131 1.217 396 H HIS 119 H HIS 119 -18.530 -20.756 6.543 397 HA HIS 119 HA HIS 119 -18.859 -23.597 7.328 398 HB2 HIS 119 HB2 HIS 119 -16.745 -23.617 6.091 399 HB3 HIS 119 HB3 HIS 119 -16.172 -22.203 6.965 400 HD1 HIS 119 HD1 HIS 119 -16.869 -25.965 7.600 401 HD2 HIS 119 HD2 HIS 119 -14.984 -22.580 9.300 402 HE1 HIS 119 HE1 HIS 119 -15.597 -26.804 9.679 403 HE2 HIS 119 HE2 HIS 119 -14.459 -24.733 10.715 404 H HIS 120 H HIS 120 -18.562 -23.961 9.571 405 HA HIS 120 HA HIS 120 -18.034 -21.713 11.390 406 HB2 HIS 120 HB2 HIS 120 -20.081 -22.172 12.726 407 HB3 HIS 120 HB3 HIS 120 -20.385 -21.436 11.162 408 HD1 HIS 120 HD1 HIS 120 -19.955 -25.232 11.694 409 HD2 HIS 120 HD2 HIS 120 -22.847 -22.300 10.774 410 HE1 HIS 120 HE1 HIS 120 -22.128 -26.517 11.055 411 HE2 HIS 120 HE2 HIS 120 -23.877 -24.706 10.480 Start of MODEL 2 1 H1 SER 66 H1 SER 66 20.503 -16.206 -29.083 2 H2 SER 66 H2 SER 66 19.414 -16.772 -28.004 3 H3 SER 66 H3 SER 66 19.042 -15.486 -28.957 4 HA SER 66 HA SER 66 21.149 -15.513 -26.897 5 HB2 SER 66 HB2 SER 66 21.193 -13.025 -27.262 6 HB3 SER 66 HB3 SER 66 21.818 -13.994 -28.604 7 HG SER 66 HG SER 66 20.399 -12.365 -29.360 8 H GLY 67 H GLY 67 18.326 -13.353 -27.503 9 HA2 GLY 67 HA2 GLY 67 16.448 -12.912 -26.205 10 HA3 GLY 67 HA3 GLY 67 16.834 -14.284 -25.171 11 H SER 68 H SER 68 15.962 -12.611 -23.620 12 HA SER 68 HA SER 68 18.179 -11.212 -22.251 13 HB2 SER 68 HB2 SER 68 16.837 -9.160 -21.986 14 HB3 SER 68 HB3 SER 68 17.255 -9.485 -23.676 15 HG SER 68 HG SER 68 15.053 -8.868 -23.438 16 H GLY 69 H GLY 69 17.666 -10.561 -20.056 17 HA2 GLY 69 HA2 GLY 69 16.204 -12.593 -18.587 18 HA3 GLY 69 HA3 GLY 69 17.070 -11.211 -17.920 19 H ARG 70 H ARG 70 14.795 -11.979 -16.725 20 HA ARG 70 HA ARG 70 12.413 -10.673 -17.727 21 HB2 ARG 70 HB2 ARG 70 12.388 -12.753 -16.407 22 HB3 ARG 70 HB3 ARG 70 13.074 -11.916 -15.015 23 HG2 ARG 70 HG2 ARG 70 10.667 -12.341 -14.753 24 HG3 ARG 70 HG3 ARG 70 11.031 -10.625 -14.711 25 HD2 ARG 70 HD2 ARG 70 10.329 -10.519 -17.180 26 HD3 ARG 70 HD3 ARG 70 9.821 -12.194 -17.018 27 HE ARG 70 HE ARG 70 7.964 -11.522 -15.801 28 HH11 ARG 70 HH11 ARG 70 10.098 -8.707 -16.026 29 HH12 ARG 70 HH12 ARG 70 8.824 -7.626 -15.527 30 HH21 ARG 70 HH22 ARG 70 6.443 -10.072 -15.115 31 HH22 ARG 70 HH21 ARG 70 6.829 -8.384 -14.974 32 H GLY 71 H GLY 71 15.023 -9.430 -15.869 33 HA2 GLY 71 HA2 GLY 71 15.516 -7.252 -15.322 34 HA3 GLY 71 HA3 GLY 71 13.949 -6.758 -15.959 35 H ARG 72 H ARG 72 12.456 -8.496 -14.067 36 HA ARG 72 HA ARG 72 13.012 -7.356 -11.350 37 HB2 ARG 72 HB2 ARG 72 10.315 -7.572 -12.772 38 HB3 ARG 72 HB3 ARG 72 10.505 -7.168 -11.076 39 HG2 ARG 72 HG2 ARG 72 11.549 -5.438 -13.363 40 HG3 ARG 72 HG3 ARG 72 9.999 -5.252 -12.565 41 HD2 ARG 72 HD2 ARG 72 11.349 -3.653 -11.547 42 HD3 ARG 72 HD3 ARG 72 11.235 -4.964 -10.364 43 HE ARG 72 HE ARG 72 13.563 -5.237 -12.089 44 HH11 ARG 72 HH21 ARG 72 12.528 -3.390 -9.295 45 HH12 ARG 72 HH22 ARG 72 14.157 -3.190 -8.712 46 HH21 ARG 72 HH11 ARG 72 15.573 -4.975 -11.317 47 HH22 ARG 72 HH12 ARG 72 15.861 -4.062 -9.859 48 H GLY 73 H GLY 73 11.913 -8.569 -9.622 49 HA2 GLY 73 HA2 GLY 73 12.431 -11.397 -9.785 50 HA3 GLY 73 HA3 GLY 73 11.648 -10.553 -8.450 51 H ALA 74 H ALA 74 11.067 -13.144 -9.930 52 HA ALA 74 HA ALA 74 8.136 -12.853 -10.122 53 HB1 ALA 74 HB1 ALA 74 8.947 -12.423 -12.429 54 HB2 ALA 74 HB2 ALA 74 9.856 -13.948 -12.402 55 HB3 ALA 74 HB3 ALA 74 8.084 -13.970 -12.339 56 H ILE 75 H ILE 75 7.029 -14.939 -10.146 57 HA ILE 75 HA ILE 75 8.200 -16.879 -8.339 58 HB ILE 75 HB ILE 75 5.633 -16.880 -9.958 59 HG12 ILE 75 HG11 ILE 75 6.178 -16.526 -6.969 60 HG13 ILE 75 HG12 ILE 75 5.858 -15.212 -8.094 61 HG21 ILE 75 HG21 ILE 75 6.507 -18.930 -7.864 62 HG22 ILE 75 HG22 ILE 75 4.904 -18.835 -8.626 63 HG23 ILE 75 HG23 ILE 75 6.287 -19.248 -9.598 64 HD11 ILE 75 HD11 ILE 75 3.837 -15.632 -6.916 65 HD12 ILE 75 HD12 ILE 75 3.599 -16.223 -8.579 66 HD13 ILE 75 HD13 ILE 75 3.902 -17.366 -7.240 67 H ASP 76 H ASP 76 9.140 -18.768 -8.686 68 HA ASP 76 HA ASP 76 9.425 -19.814 -11.488 69 HB2 ASP 76 HB2 ASP 76 11.563 -19.065 -10.490 70 HB3 ASP 76 HB3 ASP 76 11.300 -20.154 -9.126 71 H ARG 77 H ARG 77 8.864 -20.671 -8.074 72 HA ARG 77 HA ARG 77 7.203 -23.018 -8.900 73 HB2 ARG 77 HB2 ARG 77 9.579 -23.197 -6.978 74 HB3 ARG 77 HB3 ARG 77 8.373 -24.462 -7.178 75 HG2 ARG 77 HG2 ARG 77 10.310 -23.543 -9.333 76 HG3 ARG 77 HG3 ARG 77 10.467 -24.973 -8.323 77 HD2 ARG 77 HD2 ARG 77 8.370 -25.898 -9.249 78 HD3 ARG 77 HD3 ARG 77 8.196 -24.499 -10.304 79 HE ARG 77 HE ARG 77 10.055 -26.750 -10.591 80 HH11 ARG 77 HH21 ARG 77 9.466 -23.466 -11.671 81 HH12 ARG 77 HH22 ARG 77 10.480 -23.654 -13.078 82 HH21 ARG 77 HH11 ARG 77 11.308 -26.931 -12.417 83 HH22 ARG 77 HH12 ARG 77 11.445 -25.591 -13.516 84 H GLU 78 H GLU 78 7.892 -20.537 -6.620 85 HA GLU 78 HA GLU 78 7.082 -21.384 -4.205 86 HB2 GLU 78 HB2 GLU 78 6.429 -18.654 -5.392 87 HB3 GLU 78 HB3 GLU 78 6.463 -19.071 -3.682 88 HG2 GLU 78 HG2 GLU 78 8.544 -18.228 -3.806 89 HG3 GLU 78 HG3 GLU 78 8.949 -19.875 -4.254 90 H GLN 79 H GLN 79 4.532 -19.913 -6.377 91 HA GLN 79 HA GLN 79 2.477 -20.553 -4.471 92 HB2 GLN 79 HB2 GLN 79 0.898 -19.800 -6.049 93 HB3 GLN 79 HB3 GLN 79 2.308 -18.747 -6.136 94 HG2 GLN 79 HG2 GLN 79 3.022 -20.058 -8.215 95 HG3 GLN 79 HG3 GLN 79 1.486 -20.915 -8.126 96 HE21 GLN 79 HE22 GLN 79 1.837 -19.713 -10.466 97 HE22 GLN 79 HE21 GLN 79 0.916 -18.216 -10.557 98 H SER 80 H SER 80 3.662 -22.311 -7.316 99 HA SER 80 HA SER 80 1.728 -24.424 -7.315 100 HB2 SER 80 HB2 SER 80 4.614 -24.322 -8.285 101 HB3 SER 80 HB3 SER 80 3.452 -25.625 -8.651 102 HG SER 80 HG SER 80 3.508 -24.008 -10.311 103 H ALA 81 H ALA 81 4.967 -24.169 -5.727 104 HA ALA 81 HA ALA 81 4.887 -26.652 -4.420 105 HB1 ALA 81 HB1 ALA 81 6.260 -24.053 -3.605 106 HB2 ALA 81 HB2 ALA 81 6.652 -25.680 -2.999 107 HB3 ALA 81 HB3 ALA 81 6.911 -25.285 -4.708 108 H ALA 82 H ALA 82 3.683 -23.428 -3.268 109 HA ALA 82 HA ALA 82 2.801 -24.314 -0.723 110 HB1 ALA 82 HB1 ALA 82 2.994 -21.947 -1.398 111 HB2 ALA 82 HB2 ALA 82 1.615 -22.140 -2.509 112 HB3 ALA 82 HB3 ALA 82 1.384 -22.310 -0.757 113 H ILE 83 H ILE 83 1.024 -24.339 -3.850 114 HA ILE 83 HA ILE 83 -1.378 -25.531 -2.788 115 HB ILE 83 HB ILE 83 -0.267 -25.404 -5.618 116 HG12 ILE 83 HG11 ILE 83 -2.511 -23.875 -4.231 117 HG13 ILE 83 HG12 ILE 83 -0.899 -23.237 -4.450 118 HG21 ILE 83 HG21 ILE 83 -2.550 -26.032 -6.380 119 HG22 ILE 83 HG22 ILE 83 -1.830 -27.336 -5.458 120 HG23 ILE 83 HG23 ILE 83 -3.049 -26.295 -4.696 121 HD11 ILE 83 HD11 ILE 83 -2.948 -23.814 -6.605 122 HD12 ILE 83 HD12 ILE 83 -2.235 -22.267 -6.140 123 HD13 ILE 83 HD13 ILE 83 -1.227 -23.476 -6.961 124 H ARG 84 H ARG 84 1.542 -27.026 -4.302 125 HA ARG 84 HA ARG 84 0.703 -29.740 -4.118 126 HB2 ARG 84 HB2 ARG 84 2.793 -28.853 -5.297 127 HB3 ARG 84 HB3 ARG 84 3.545 -28.673 -3.717 128 HG2 ARG 84 HG2 ARG 84 3.007 -31.242 -3.416 129 HG3 ARG 84 HG3 ARG 84 2.695 -31.209 -5.147 130 HD2 ARG 84 HD2 ARG 84 4.921 -31.926 -4.940 131 HD3 ARG 84 HD3 ARG 84 5.053 -30.227 -5.419 132 HE ARG 84 HE ARG 84 5.094 -30.522 -2.512 133 HH11 ARG 84 HH11 ARG 84 7.272 -31.094 -5.240 134 HH12 ARG 84 HH12 ARG 84 8.666 -30.729 -4.264 135 HH21 ARG 84 HH21 ARG 84 6.854 -30.323 -1.360 136 HH22 ARG 84 HH22 ARG 84 8.455 -30.325 -2.090 137 H GLU 85 H GLU 85 2.538 -27.815 -1.712 138 HA GLU 85 HA GLU 85 2.711 -29.882 0.140 139 HB2 GLU 85 HB2 GLU 85 3.021 -26.892 0.396 140 HB3 GLU 85 HB3 GLU 85 3.293 -27.966 1.766 141 HG2 GLU 85 HG2 GLU 85 4.651 -28.217 -0.935 142 HG3 GLU 85 HG3 GLU 85 5.399 -27.483 0.495 143 H TRP 86 H TRP 86 0.219 -27.342 -0.125 144 HA TRP 86 HA TRP 86 -1.311 -28.108 2.110 145 HB2 TRP 86 HB2 TRP 86 -1.661 -25.992 1.015 146 HB3 TRP 86 HB3 TRP 86 -2.048 -26.772 -0.510 147 HD1 TRP 86 HD1 TRP 86 -3.539 -26.032 2.923 148 HE1 TRP 86 HE1 TRP 86 -6.082 -26.389 2.866 149 HE3 TRP 86 HE3 TRP 86 -3.999 -27.936 -1.819 150 HZ2 TRP 86 HZ2 TRP 86 -8.023 -27.573 1.094 151 HZ3 TRP 86 HZ3 TRP 86 -6.233 -28.580 -2.695 152 HH2 TRP 86 HH2 TRP 86 -8.243 -28.436 -1.236 153 H ALA 87 H ALA 87 -1.530 -29.133 -1.338 154 HA ALA 87 HA ALA 87 -3.737 -30.894 -1.039 155 HB1 ALA 87 HB1 ALA 87 -2.983 -30.020 -3.186 156 HB2 ALA 87 HB2 ALA 87 -1.420 -30.839 -3.020 157 HB3 ALA 87 HB3 ALA 87 -2.901 -31.796 -3.238 158 H ARG 88 H ARG 88 -0.229 -31.596 -0.772 159 HA ARG 88 HA ARG 88 -0.395 -34.407 -0.227 160 HB2 ARG 88 HB2 ARG 88 1.601 -32.246 0.608 161 HB3 ARG 88 HB3 ARG 88 1.810 -33.952 1.023 162 HG2 ARG 88 HG2 ARG 88 1.818 -34.581 -1.359 163 HG3 ARG 88 HG3 ARG 88 1.550 -32.906 -1.831 164 HD2 ARG 88 HD2 ARG 88 3.899 -33.325 -2.072 165 HD3 ARG 88 HD3 ARG 88 3.691 -32.286 -0.655 166 HE ARG 88 HE ARG 88 3.878 -35.251 -0.311 167 HH11 ARG 88 HH11 ARG 88 5.534 -32.152 0.239 168 HH12 ARG 88 HH12 ARG 88 6.688 -32.916 1.292 169 HH21 ARG 88 HH21 ARG 88 5.386 -36.080 1.051 170 HH22 ARG 88 HH22 ARG 88 6.619 -35.058 1.725 171 H ARG 89 H ARG 89 -0.662 -31.661 2.022 172 HA ARG 89 HA ARG 89 -0.975 -33.338 4.409 173 HB2 ARG 89 HB2 ARG 89 -1.362 -30.374 3.832 174 HB3 ARG 89 HB3 ARG 89 -1.685 -31.081 5.423 175 HG2 ARG 89 HG2 ARG 89 0.570 -31.826 5.698 176 HG3 ARG 89 HG3 ARG 89 0.970 -31.497 4.014 177 HD2 ARG 89 HD2 ARG 89 0.631 -29.048 4.427 178 HD3 ARG 89 HD3 ARG 89 0.245 -29.406 6.112 179 HE ARG 89 HE ARG 89 2.491 -29.572 6.574 180 HH11 ARG 89 HH11 ARG 89 2.217 -30.019 3.092 181 HH12 ARG 89 HH12 ARG 89 3.974 -30.058 2.896 182 HH21 ARG 89 HH21 ARG 89 4.710 -29.620 6.186 183 HH22 ARG 89 HH22 ARG 89 5.284 -29.835 4.555 184 H ASN 90 H ASN 90 -3.227 -32.093 2.055 185 HA ASN 90 HA ASN 90 -5.558 -32.953 3.690 186 HB2 ASN 90 HB2 ASN 90 -5.279 -31.307 1.152 187 HB3 ASN 90 HB3 ASN 90 -6.830 -31.885 1.767 188 HD21 ASN 90 HD22 ASN 90 -4.075 -29.772 2.575 189 HD22 ASN 90 HD21 ASN 90 -4.972 -28.864 3.784 190 H GLY 91 H GLY 91 -3.480 -34.598 1.719 191 HA2 GLY 91 HA2 GLY 91 -3.588 -36.736 0.901 192 HA3 GLY 91 HA3 GLY 91 -5.241 -36.866 1.505 193 H HIS 92 H HIS 92 -4.379 -34.323 -0.777 194 HA HIS 92 HA HIS 92 -6.223 -35.526 -2.802 195 HB2 HIS 92 HB2 HIS 92 -5.145 -32.692 -2.561 196 HB3 HIS 92 HB3 HIS 92 -6.332 -33.251 -3.739 197 HD1 HIS 92 HD1 HIS 92 -8.139 -34.908 -1.478 198 HD2 HIS 92 HD2 HIS 92 -6.791 -30.901 -1.476 199 HE1 HIS 92 HE1 HIS 92 -9.776 -33.594 0.004 200 HE2 HIS 92 HE2 HIS 92 -8.962 -31.153 -0.009 201 H ASN 93 H ASN 93 -5.721 -35.618 -5.014 202 HA ASN 93 HA ASN 93 -3.095 -36.677 -5.506 203 HB2 ASN 93 HB2 ASN 93 -5.215 -37.512 -6.510 204 HB3 ASN 93 HB3 ASN 93 -5.356 -36.022 -7.444 205 HD21 ASN 93 HD22 ASN 93 -5.463 -37.838 -9.157 206 HD22 ASN 93 HD21 ASN 93 -3.917 -38.289 -9.862 207 H VAL 94 H VAL 94 -1.286 -35.685 -6.070 208 HA VAL 94 HA VAL 94 -1.174 -33.634 -8.107 209 HB VAL 94 HB VAL 94 -1.585 -32.175 -6.189 210 HG11 VAL 94 HG11 VAL 94 0.941 -33.351 -4.935 211 HG12 VAL 94 HG12 VAL 94 0.045 -31.949 -4.345 212 HG13 VAL 94 HG13 VAL 94 -0.719 -33.545 -4.327 213 HG21 VAL 94 HG21 VAL 94 1.318 -31.891 -6.968 214 HG22 VAL 94 HG22 VAL 94 -0.042 -31.480 -8.025 215 HG23 VAL 94 HG23 VAL 94 0.174 -30.634 -6.477 216 H SER 95 H SER 95 0.768 -33.609 -9.174 217 HA SER 95 HA SER 95 2.612 -35.785 -8.829 218 HB2 SER 95 HB2 SER 95 2.732 -33.246 -10.493 219 HB3 SER 95 HB3 SER 95 3.869 -34.608 -10.647 220 HG SER 95 HG SER 95 2.118 -34.752 -12.154 221 H THR 96 H THR 96 4.890 -35.709 -8.291 222 HA THR 96 HA THR 96 5.498 -34.100 -5.991 223 HB THR 96 HB THR 96 7.800 -35.083 -6.231 224 HG1 THR 96 HG1 THR 96 8.035 -36.693 -7.795 225 HG21 THR 96 HG21 THR 96 5.521 -37.097 -6.469 226 HG22 THR 96 HG22 THR 96 7.121 -37.381 -5.754 227 HG23 THR 96 HG23 THR 96 5.998 -36.258 -4.974 228 H ARG 97 H ARG 97 6.173 -33.636 -9.365 229 HA ARG 97 HA ARG 97 7.139 -30.892 -8.930 230 HB2 ARG 97 HB2 ARG 97 9.150 -31.072 -10.149 231 HB3 ARG 97 HB3 ARG 97 9.208 -32.296 -8.900 232 HG2 ARG 97 HG2 ARG 97 8.591 -32.785 -11.852 233 HG3 ARG 97 HG3 ARG 97 10.148 -33.028 -11.058 234 HD2 ARG 97 HD2 ARG 97 9.092 -34.735 -9.564 235 HD3 ARG 97 HD3 ARG 97 7.586 -34.559 -10.497 236 HE ARG 97 HE ARG 97 9.790 -35.150 -12.246 237 HH11 ARG 97 HH11 ARG 97 7.672 -36.744 -9.936 238 HH12 ARG 97 HH12 ARG 97 7.798 -38.280 -10.749 239 HH21 ARG 97 HH21 ARG 97 9.910 -37.149 -13.225 240 HH22 ARG 97 HH22 ARG 97 9.048 -38.504 -12.559 241 H GLY 98 H GLY 98 7.338 -29.695 -11.038 242 HA2 GLY 98 HA2 GLY 98 6.570 -29.076 -13.145 243 HA3 GLY 98 HA3 GLY 98 5.985 -30.716 -13.397 244 H ARG 99 H ARG 99 3.995 -30.240 -14.220 245 HA ARG 99 HA ARG 99 2.289 -28.105 -13.297 246 HB2 ARG 99 HB2 ARG 99 1.731 -30.489 -15.122 247 HB3 ARG 99 HB3 ARG 99 0.603 -29.160 -14.841 248 HG2 ARG 99 HG2 ARG 99 2.249 -27.533 -15.717 249 HG3 ARG 99 HG3 ARG 99 3.394 -28.849 -16.036 250 HD2 ARG 99 HD2 ARG 99 1.757 -29.900 -17.570 251 HD3 ARG 99 HD3 ARG 99 0.619 -28.573 -17.265 252 HE ARG 99 HE ARG 99 3.073 -27.431 -18.117 253 HH11 ARG 99 HH11 ARG 99 0.527 -29.371 -19.548 254 HH12 ARG 99 HH12 ARG 99 0.825 -28.752 -21.148 255 HH21 ARG 99 HH21 ARG 99 3.402 -26.678 -20.184 256 HH22 ARG 99 HH22 ARG 99 2.421 -27.269 -21.492 257 H ILE 100 H ILE 100 0.202 -28.190 -12.458 258 HA ILE 100 HA ILE 100 -0.410 -30.457 -10.611 259 HB ILE 100 HB ILE 100 -0.686 -27.477 -10.113 260 HG12 ILE 100 HG11 ILE 100 1.115 -29.629 -8.931 261 HG13 ILE 100 HG12 ILE 100 1.594 -28.209 -9.851 262 HG21 ILE 100 HG21 ILE 100 -1.507 -29.733 -8.209 263 HG22 ILE 100 HG22 ILE 100 -1.627 -27.986 -7.932 264 HG23 ILE 100 HG23 ILE 100 -2.632 -28.732 -9.153 265 HD11 ILE 100 HD11 ILE 100 2.125 -27.814 -7.575 266 HD12 ILE 100 HD12 ILE 100 0.758 -26.754 -7.996 267 HD13 ILE 100 HD13 ILE 100 0.493 -28.227 -7.030 268 HA PRO 101 HA PRO 101 -4.250 -30.493 -12.924 269 HB2 PRO 101 HB2 PRO 101 -5.922 -31.801 -11.130 270 HB3 PRO 101 HB3 PRO 101 -4.689 -32.611 -12.150 271 HG2 PRO 101 HG2 PRO 101 -4.457 -31.720 -9.270 272 HG3 PRO 101 HG3 PRO 101 -3.972 -33.291 -9.986 273 HD2 PRO 101 HD2 PRO 101 -2.183 -31.339 -9.511 274 HD3 PRO 101 HD3 PRO 101 -2.062 -32.328 -10.996 275 H ALA 102 H ALA 102 -5.885 -29.042 -13.241 276 HA ALA 102 HA ALA 102 -6.131 -26.808 -11.595 277 HB1 ALA 102 HB1 ALA 102 -8.108 -27.802 -13.655 278 HB2 ALA 102 HB2 ALA 102 -7.943 -26.139 -13.023 279 HB3 ALA 102 HB3 ALA 102 -6.631 -26.854 -13.988 280 H ASP 103 H ASP 103 -7.994 -29.807 -11.420 281 HA ASP 103 HA ASP 103 -10.124 -28.962 -9.860 282 HB2 ASP 103 HB2 ASP 103 -8.658 -31.625 -9.883 283 HB3 ASP 103 HB3 ASP 103 -10.193 -31.349 -9.069 284 H VAL 104 H VAL 104 -6.810 -29.913 -8.810 285 HA VAL 104 HA VAL 104 -7.532 -29.555 -6.029 286 HB VAL 104 HB VAL 104 -5.909 -31.310 -6.861 287 HG11 VAL 104 HG11 VAL 104 -4.355 -29.826 -8.096 288 HG12 VAL 104 HG12 VAL 104 -3.885 -29.047 -6.573 289 HG13 VAL 104 HG13 VAL 104 -3.549 -30.772 -6.847 290 HG21 VAL 104 HG21 VAL 104 -4.720 -31.321 -4.758 291 HG22 VAL 104 HG22 VAL 104 -5.081 -29.602 -4.481 292 HG23 VAL 104 HG23 VAL 104 -6.396 -30.802 -4.478 293 H ILE 105 H ILE 105 -5.964 -27.587 -8.500 294 HA ILE 105 HA ILE 105 -5.183 -25.408 -6.774 295 HB ILE 105 HB ILE 105 -5.977 -25.618 -9.704 296 HG12 ILE 105 HG11 ILE 105 -3.225 -24.873 -8.660 297 HG13 ILE 105 HG12 ILE 105 -3.718 -26.562 -8.552 298 HG21 ILE 105 HG21 ILE 105 -4.966 -23.161 -8.209 299 HG22 ILE 105 HG22 ILE 105 -4.951 -23.331 -9.977 300 HG23 ILE 105 HG23 ILE 105 -6.487 -23.334 -9.117 301 HD11 ILE 105 HD11 ILE 105 -3.777 -24.983 -11.147 302 HD12 ILE 105 HD12 ILE 105 -2.465 -26.056 -10.622 303 HD13 ILE 105 HD13 ILE 105 -4.081 -26.726 -10.896 304 H ASP 106 H ASP 106 -8.291 -26.036 -8.545 305 HA ASP 106 HA ASP 106 -9.684 -23.873 -7.476 306 HB2 ASP 106 HB2 ASP 106 -10.432 -25.203 -9.397 307 HB3 ASP 106 HB3 ASP 106 -10.709 -26.594 -8.347 308 H ALA 107 H ALA 107 -9.491 -27.262 -6.175 309 HA ALA 107 HA ALA 107 -11.010 -26.865 -3.909 310 HB1 ALA 107 HB1 ALA 107 -9.881 -28.838 -3.018 311 HB2 ALA 107 HB2 ALA 107 -10.197 -29.052 -4.741 312 HB3 ALA 107 HB3 ALA 107 -8.555 -28.649 -4.179 313 H TYR 108 H TYR 108 -7.491 -26.187 -4.322 314 HA TYR 108 HA TYR 108 -6.956 -25.285 -1.673 315 HB2 TYR 108 HB2 TYR 108 -5.180 -25.800 -3.202 316 HB3 TYR 108 HB3 TYR 108 -5.734 -24.628 -4.373 317 HD1 TYR 108 HD1 TYR 108 -3.983 -25.069 -1.164 318 HD2 TYR 108 HD2 TYR 108 -5.279 -22.235 -4.148 319 HE1 TYR 108 HE1 TYR 108 -2.450 -23.363 -0.209 320 HE2 TYR 108 HE2 TYR 108 -3.747 -20.528 -3.189 321 HH TYR 108 HH TYR 108 -2.166 -20.057 -1.570 322 H HIS 109 H HIS 109 -7.977 -23.377 -4.586 323 HA HIS 109 HA HIS 109 -8.201 -20.897 -3.150 324 HB2 HIS 109 HB2 HIS 109 -9.389 -21.861 -5.770 325 HB3 HIS 109 HB3 HIS 109 -9.712 -20.253 -5.126 326 HD1 HIS 109 HD1 HIS 109 -7.231 -18.855 -4.464 327 HD2 HIS 109 HD2 HIS 109 -7.364 -21.887 -7.391 328 HE1 HIS 109 HE1 HIS 109 -5.149 -18.522 -5.940 329 HE2 HIS 109 HE2 HIS 109 -5.239 -20.361 -7.736 330 H ALA 110 H ALA 110 -10.630 -23.497 -3.579 331 HA ALA 110 HA ALA 110 -12.755 -22.085 -2.251 332 HB1 ALA 110 HB1 ALA 110 -13.094 -24.133 -3.588 333 HB2 ALA 110 HB2 ALA 110 -12.195 -25.081 -2.381 334 HB3 ALA 110 HB3 ALA 110 -13.732 -24.310 -1.941 335 H ALA 111 H ALA 111 -10.167 -24.263 -0.915 336 HA ALA 111 HA ALA 111 -11.010 -24.135 1.722 337 HB1 ALA 111 HB1 ALA 111 -8.204 -24.532 0.614 338 HB2 ALA 111 HB2 ALA 111 -8.773 -25.024 2.221 339 HB3 ALA 111 HB3 ALA 111 -9.460 -25.791 0.772 340 H THR 112 H THR 112 -8.752 -21.948 -0.027 341 HA THR 112 HA THR 112 -8.149 -20.381 2.356 342 HB THR 112 HB THR 112 -7.096 -18.774 0.828 343 HG1 THR 112 HG1 THR 112 -6.989 -19.287 -1.365 344 HG21 THR 112 HG21 THR 112 -6.320 -21.659 0.220 345 HG22 THR 112 HG22 THR 112 -5.293 -20.223 0.041 346 HG23 THR 112 HG23 THR 112 -5.823 -20.742 1.650 347 H LEU 113 H LEU 113 -10.412 -19.825 -0.393 348 HA LEU 113 HA LEU 113 -11.209 -17.242 0.752 349 HB2 LEU 113 HB2 LEU 113 -12.269 -18.721 -1.673 350 HB3 LEU 113 HB3 LEU 113 -12.602 -17.047 -1.257 351 HG LEU 113 HG LEU 113 -9.856 -18.166 -1.959 352 HD11 LEU 113 HD11 LEU 113 -11.756 -16.395 -3.549 353 HD12 LEU 113 HD12 LEU 113 -10.120 -16.888 -4.046 354 HD13 LEU 113 HD13 LEU 113 -11.394 -18.105 -3.876 355 HD21 LEU 113 HD21 LEU 113 -9.607 -16.233 -0.475 356 HD22 LEU 113 HD22 LEU 113 -9.176 -15.780 -2.127 357 HD23 LEU 113 HD23 LEU 113 -10.751 -15.297 -1.467 358 H GLU 114 H GLU 114 -12.946 -20.289 0.113 359 HA GLU 114 HA GLU 114 -15.442 -19.164 1.090 360 HB2 GLU 114 HB2 GLU 114 -14.807 -22.063 0.437 361 HB3 GLU 114 HB3 GLU 114 -16.401 -21.381 0.704 362 HG2 GLU 114 HG2 GLU 114 -14.532 -20.573 -1.567 363 HG3 GLU 114 HG3 GLU 114 -15.887 -21.685 -1.694 364 H HIS 115 H HIS 115 -12.947 -21.091 2.692 365 HA HIS 115 HA HIS 115 -14.493 -21.803 5.006 366 HB2 HIS 115 HB2 HIS 115 -12.261 -22.745 4.330 367 HB3 HIS 115 HB3 HIS 115 -11.499 -21.235 4.831 368 HD1 HIS 115 HD1 HIS 115 -10.638 -21.317 7.304 369 HD2 HIS 115 HD2 HIS 115 -13.805 -23.988 6.446 370 HE1 HIS 115 HE1 HIS 115 -11.027 -22.700 9.443 371 HE2 HIS 115 HE2 HIS 115 -12.960 -24.320 8.912 372 H HIS 116 H HIS 116 -13.135 -18.746 4.058 373 HA HIS 116 HA HIS 116 -13.661 -17.466 6.689 374 HB2 HIS 116 HB2 HIS 116 -12.423 -16.394 4.119 375 HB3 HIS 116 HB3 HIS 116 -12.612 -15.480 5.610 376 HD1 HIS 116 HD1 HIS 116 -10.104 -17.698 3.978 377 HD2 HIS 116 HD2 HIS 116 -11.350 -16.635 7.888 378 HE1 HIS 116 HE1 HIS 116 -8.182 -18.339 5.566 379 HE2 HIS 116 HE2 HIS 116 -8.938 -17.679 7.938 380 H HIS 117 H HIS 117 -15.638 -18.237 4.123 381 HA HIS 117 HA HIS 117 -17.225 -15.739 4.125 382 HB2 HIS 117 HB2 HIS 117 -16.792 -17.032 2.028 383 HB3 HIS 117 HB3 HIS 117 -17.694 -18.392 2.679 384 HD1 HIS 117 HD1 HIS 117 -18.405 -14.619 1.895 385 HD2 HIS 117 HD2 HIS 117 -20.162 -18.462 1.895 386 HE1 HIS 117 HE1 HIS 117 -20.772 -14.336 0.933 387 HE2 HIS 117 HE2 HIS 117 -21.837 -16.679 0.926 388 H HIS 118 H HIS 118 -19.513 -15.722 4.708 389 HA HIS 118 HA HIS 118 -19.830 -16.855 7.348 390 HB2 HIS 118 HB2 HIS 118 -20.513 -14.561 6.646 391 HB3 HIS 118 HB3 HIS 118 -21.820 -15.251 5.688 392 HD1 HIS 118 HD1 HIS 118 -20.713 -14.956 9.400 393 HD2 HIS 118 HD2 HIS 118 -24.074 -15.799 6.974 394 HE1 HIS 118 HE1 HIS 118 -22.744 -15.083 10.981 395 HE2 HIS 118 HE2 HIS 118 -24.783 -15.596 9.496 396 H HIS 119 H HIS 119 -21.387 -17.635 4.276 397 HA HIS 119 HA HIS 119 -22.848 -19.223 3.558 398 HB2 HIS 119 HB2 HIS 119 -21.822 -20.885 5.893 399 HB3 HIS 119 HB3 HIS 119 -22.700 -21.499 4.507 400 HD1 HIS 119 HD1 HIS 119 -21.357 -21.460 2.095 401 HD2 HIS 119 HD2 HIS 119 -19.208 -20.513 5.609 402 HE1 HIS 119 HE1 HIS 119 -18.862 -21.556 1.462 403 HE2 HIS 119 HE2 HIS 119 -17.548 -20.954 3.613 404 H HIS 120 H HIS 120 -24.716 -20.819 4.320 405 HA HIS 120 HA HIS 120 -26.748 -19.115 5.523 406 HB2 HIS 120 HB2 HIS 120 -26.893 -22.019 4.623 407 HB3 HIS 120 HB3 HIS 120 -28.259 -20.995 5.045 408 HD1 HIS 120 HD1 HIS 120 -26.894 -22.252 2.030 409 HD2 HIS 120 HD2 HIS 120 -27.959 -18.414 3.436 410 HE1 HIS 120 HE1 HIS 120 -27.273 -20.794 -0.063 411 HE2 HIS 120 HE2 HIS 120 -27.926 -18.453 0.802 Start of MODEL 3 1 H1 SER 66 H1 SER 66 23.390 -32.617 -3.229 2 H2 SER 66 H2 SER 66 25.012 -32.511 -3.024 3 H3 SER 66 H3 SER 66 24.007 -32.220 -1.761 4 HA SER 66 HA SER 66 24.880 -30.154 -2.577 5 HB2 SER 66 HB2 SER 66 23.609 -30.934 -5.238 6 HB3 SER 66 HB3 SER 66 24.443 -29.409 -4.866 7 HG SER 66 HG SER 66 25.841 -30.924 -5.893 8 H GLY 67 H GLY 67 23.647 -28.188 -2.540 9 HA2 GLY 67 HA2 GLY 67 21.314 -28.372 -1.003 10 HA3 GLY 67 HA3 GLY 67 21.917 -26.913 -1.787 11 H SER 68 H SER 68 21.497 -28.058 -4.537 12 HA SER 68 HA SER 68 18.900 -27.194 -5.131 13 HB2 SER 68 HB2 SER 68 20.550 -29.199 -6.715 14 HB3 SER 68 HB3 SER 68 19.264 -28.144 -7.335 15 HG SER 68 HG SER 68 21.336 -27.252 -7.749 16 H GLY 69 H GLY 69 19.812 -30.327 -3.860 17 HA2 GLY 69 HA2 GLY 69 17.410 -31.771 -4.656 18 HA3 GLY 69 HA3 GLY 69 18.595 -32.237 -3.434 19 H ARG 70 H ARG 70 17.924 -29.316 -2.307 20 HA ARG 70 HA ARG 70 15.423 -30.061 -0.812 21 HB2 ARG 70 HB2 ARG 70 17.526 -30.526 0.458 22 HB3 ARG 70 HB3 ARG 70 17.958 -28.816 0.340 23 HG2 ARG 70 HG2 ARG 70 15.915 -28.214 1.644 24 HG3 ARG 70 HG3 ARG 70 15.425 -29.915 1.653 25 HD2 ARG 70 HD2 ARG 70 16.395 -29.421 3.784 26 HD3 ARG 70 HD3 ARG 70 17.505 -30.487 2.903 27 HE ARG 70 HE ARG 70 18.162 -27.685 2.498 28 HH11 ARG 70 HH21 ARG 70 18.505 -30.189 4.916 29 HH12 ARG 70 HH22 ARG 70 19.907 -29.441 5.633 30 HH21 ARG 70 HH11 ARG 70 19.953 -26.777 3.452 31 HH22 ARG 70 HH12 ARG 70 20.706 -27.559 4.809 32 H GLY 71 H GLY 71 17.471 -27.344 -1.924 33 HA2 GLY 71 HA2 GLY 71 15.694 -25.270 -1.019 34 HA3 GLY 71 HA3 GLY 71 16.991 -25.091 -2.193 35 H ARG 72 H ARG 72 13.975 -24.322 -1.934 36 HA ARG 72 HA ARG 72 12.625 -25.405 -4.247 37 HB2 ARG 72 HB2 ARG 72 11.529 -24.400 -2.248 38 HB3 ARG 72 HB3 ARG 72 12.147 -22.810 -2.718 39 HG2 ARG 72 HG2 ARG 72 10.806 -22.887 -4.803 40 HG3 ARG 72 HG3 ARG 72 10.263 -24.525 -4.398 41 HD2 ARG 72 HD2 ARG 72 8.529 -22.911 -3.860 42 HD3 ARG 72 HD3 ARG 72 9.131 -23.659 -2.380 43 HE ARG 72 HE ARG 72 9.953 -20.912 -3.368 44 HH11 ARG 72 HH11 ARG 72 9.150 -22.894 -0.552 45 HH12 ARG 72 HH12 ARG 72 9.384 -21.536 0.514 46 HH21 ARG 72 HH21 ARG 72 10.168 -19.370 -2.073 47 HH22 ARG 72 HH22 ARG 72 9.971 -19.526 -0.323 48 H GLY 73 H GLY 73 14.674 -22.576 -3.810 49 HA2 GLY 73 HA2 GLY 73 15.777 -21.249 -5.394 50 HA3 GLY 73 HA3 GLY 73 14.933 -22.058 -6.710 51 H ALA 74 H ALA 74 15.297 -19.116 -5.520 52 HA ALA 74 HA ALA 74 12.559 -18.204 -5.194 53 HB1 ALA 74 HB1 ALA 74 13.585 -15.984 -5.064 54 HB2 ALA 74 HB2 ALA 74 14.413 -17.146 -4.007 55 HB3 ALA 74 HB3 ALA 74 15.150 -16.663 -5.554 56 H ILE 75 H ILE 75 11.143 -17.847 -6.812 57 HA ILE 75 HA ILE 75 11.973 -16.701 -9.281 58 HB ILE 75 HB ILE 75 12.426 -19.142 -9.469 59 HG12 ILE 75 HG12 ILE 75 10.524 -18.173 -11.611 60 HG13 ILE 75 HG13 ILE 75 12.167 -17.544 -11.418 61 HG21 ILE 75 HG21 ILE 75 9.406 -19.195 -9.559 62 HG22 ILE 75 HG22 ILE 75 10.465 -20.590 -9.905 63 HG23 ILE 75 HG23 ILE 75 10.476 -19.852 -8.297 64 HD11 ILE 75 HD11 ILE 75 12.127 -19.280 -13.135 65 HD12 ILE 75 HD12 ILE 75 13.071 -19.842 -11.738 66 HD13 ILE 75 HD13 ILE 75 11.419 -20.444 -12.002 67 H ASP 76 H ASP 76 10.109 -16.382 -7.131 68 HA ASP 76 HA ASP 76 8.116 -15.423 -6.567 69 HB2 ASP 76 HB2 ASP 76 8.938 -13.637 -8.043 70 HB3 ASP 76 HB3 ASP 76 8.079 -14.359 -9.404 71 H ARG 77 H ARG 77 7.891 -17.189 -9.575 72 HA ARG 77 HA ARG 77 5.109 -18.070 -9.328 73 HB2 ARG 77 HB2 ARG 77 7.423 -18.820 -11.162 74 HB3 ARG 77 HB3 ARG 77 5.802 -19.501 -11.318 75 HG2 ARG 77 HG2 ARG 77 4.867 -17.606 -12.160 76 HG3 ARG 77 HG3 ARG 77 5.890 -16.506 -11.245 77 HD2 ARG 77 HD2 ARG 77 6.910 -18.136 -13.600 78 HD3 ARG 77 HD3 ARG 77 6.243 -16.499 -13.735 79 HE ARG 77 HE ARG 77 8.293 -16.538 -11.714 80 HH11 ARG 77 HH11 ARG 77 8.052 -16.539 -15.214 81 HH12 ARG 77 HH12 ARG 77 9.591 -15.741 -15.397 82 HH21 ARG 77 HH21 ARG 77 10.176 -15.552 -11.987 83 HH22 ARG 77 HH22 ARG 77 10.788 -15.189 -13.587 84 H GLU 78 H GLU 78 6.147 -18.478 -7.022 85 HA GLU 78 HA GLU 78 7.190 -21.251 -6.690 86 HB2 GLU 78 HB2 GLU 78 7.256 -18.678 -5.078 87 HB3 GLU 78 HB3 GLU 78 7.728 -20.233 -4.367 88 HG2 GLU 78 HG2 GLU 78 9.493 -20.483 -6.016 89 HG3 GLU 78 HG3 GLU 78 8.943 -19.020 -6.859 90 H GLN 79 H GLN 79 4.160 -19.755 -6.462 91 HA GLN 79 HA GLN 79 3.158 -20.915 -4.023 92 HB2 GLN 79 HB2 GLN 79 1.723 -19.901 -6.517 93 HB3 GLN 79 HB3 GLN 79 0.916 -20.371 -5.012 94 HG2 GLN 79 HG2 GLN 79 2.210 -18.647 -3.770 95 HG3 GLN 79 HG3 GLN 79 2.972 -18.128 -5.276 96 HE21 GLN 79 HE22 GLN 79 1.802 -16.089 -4.087 97 HE22 GLN 79 HE21 GLN 79 0.230 -15.733 -4.786 98 H SER 80 H SER 80 3.763 -22.419 -7.100 99 HA SER 80 HA SER 80 1.876 -24.549 -7.051 100 HB2 SER 80 HB2 SER 80 3.575 -25.717 -8.472 101 HB3 SER 80 HB3 SER 80 3.234 -24.061 -8.999 102 HG SER 80 HG SER 80 5.492 -24.437 -8.942 103 H ALA 81 H ALA 81 5.085 -24.282 -5.457 104 HA ALA 81 HA ALA 81 5.092 -26.826 -4.267 105 HB1 ALA 81 HB1 ALA 81 7.069 -25.376 -4.482 106 HB2 ALA 81 HB2 ALA 81 6.362 -24.218 -3.326 107 HB3 ALA 81 HB3 ALA 81 6.823 -25.847 -2.791 108 H ALA 82 H ALA 82 3.687 -23.742 -3.090 109 HA ALA 82 HA ALA 82 2.855 -24.748 -0.522 110 HB1 ALA 82 HB1 ALA 82 1.780 -22.409 -2.163 111 HB2 ALA 82 HB2 ALA 82 1.509 -22.697 -0.435 112 HB3 ALA 82 HB3 ALA 82 3.142 -22.343 -1.024 113 H ILE 83 H ILE 83 1.178 -24.561 -3.701 114 HA ILE 83 HA ILE 83 -1.313 -25.676 -2.772 115 HB ILE 83 HB ILE 83 -0.074 -25.616 -5.546 116 HG12 ILE 83 HG12 ILE 83 -2.351 -23.903 -4.473 117 HG13 ILE 83 HG13 ILE 83 -0.684 -23.391 -4.321 118 HG21 ILE 83 HG21 ILE 83 -1.777 -27.396 -5.492 119 HG22 ILE 83 HG22 ILE 83 -2.926 -26.311 -4.677 120 HG23 ILE 83 HG23 ILE 83 -2.444 -26.009 -6.351 121 HD11 ILE 83 HD11 ILE 83 -0.413 -23.503 -6.799 122 HD12 ILE 83 HD12 ILE 83 -2.146 -23.880 -6.942 123 HD13 ILE 83 HD13 ILE 83 -1.629 -22.333 -6.260 124 H ARG 84 H ARG 84 1.598 -27.250 -4.200 125 HA ARG 84 HA ARG 84 0.602 -29.959 -4.013 126 HB2 ARG 84 HB2 ARG 84 3.394 -28.733 -4.134 127 HB3 ARG 84 HB3 ARG 84 3.159 -30.477 -3.942 128 HG2 ARG 84 HG2 ARG 84 1.899 -30.638 -5.984 129 HG3 ARG 84 HG3 ARG 84 1.917 -28.888 -6.220 130 HD2 ARG 84 HD2 ARG 84 4.306 -28.885 -6.603 131 HD3 ARG 84 HD3 ARG 84 4.445 -30.578 -6.112 132 HE ARG 84 HE ARG 84 3.070 -31.224 -8.070 133 HH11 ARG 84 HH11 ARG 84 4.848 -28.195 -8.415 134 HH12 ARG 84 HH12 ARG 84 4.691 -28.242 -10.149 135 HH21 ARG 84 HH21 ARG 84 2.958 -31.209 -10.193 136 HH22 ARG 84 HH22 ARG 84 3.626 -29.889 -11.144 137 H GLU 85 H GLU 85 2.603 -28.109 -1.627 138 HA GLU 85 HA GLU 85 2.596 -30.128 0.288 139 HB2 GLU 85 HB2 GLU 85 4.018 -28.051 0.273 140 HB3 GLU 85 HB3 GLU 85 2.622 -27.158 0.908 141 HG2 GLU 85 HG2 GLU 85 2.553 -28.833 2.823 142 HG3 GLU 85 HG3 GLU 85 4.037 -29.546 2.190 143 H TRP 86 H TRP 86 0.222 -27.390 -0.031 144 HA TRP 86 HA TRP 86 -1.472 -28.087 2.041 145 HB2 TRP 86 HB2 TRP 86 -1.700 -26.022 0.831 146 HB3 TRP 86 HB3 TRP 86 -2.055 -26.870 -0.670 147 HD1 TRP 86 HD1 TRP 86 -3.660 -25.746 2.577 148 HE1 TRP 86 HE1 TRP 86 -6.193 -26.162 2.526 149 HE3 TRP 86 HE3 TRP 86 -3.988 -28.264 -1.879 150 HZ2 TRP 86 HZ2 TRP 86 -8.038 -27.766 0.968 151 HZ3 TRP 86 HZ3 TRP 86 -6.137 -29.270 -2.596 152 HH2 TRP 86 HH2 TRP 86 -8.156 -29.074 -1.141 153 H ALA 87 H ALA 87 -1.557 -29.336 -1.347 154 HA ALA 87 HA ALA 87 -3.811 -31.028 -0.965 155 HB1 ALA 87 HB1 ALA 87 -3.018 -32.115 -3.056 156 HB2 ALA 87 HB2 ALA 87 -2.947 -30.345 -3.167 157 HB3 ALA 87 HB3 ALA 87 -1.458 -31.279 -2.901 158 H ARG 88 H ARG 88 -0.308 -31.739 -0.555 159 HA ARG 88 HA ARG 88 -0.590 -34.469 0.253 160 HB2 ARG 88 HB2 ARG 88 1.519 -33.335 -0.452 161 HB3 ARG 88 HB3 ARG 88 1.539 -32.436 1.068 162 HG2 ARG 88 HG2 ARG 88 1.693 -34.572 2.333 163 HG3 ARG 88 HG3 ARG 88 1.662 -35.482 0.818 164 HD2 ARG 88 HD2 ARG 88 3.770 -33.415 1.577 165 HD3 ARG 88 HD3 ARG 88 3.942 -35.166 1.811 166 HE ARG 88 HE ARG 88 3.320 -34.872 -0.897 167 HH11 ARG 88 HH11 ARG 88 5.973 -33.862 1.158 168 HH12 ARG 88 HH12 ARG 88 7.117 -33.870 -0.154 169 HH21 ARG 88 HH21 ARG 88 4.836 -34.866 -2.531 170 HH22 ARG 88 HH22 ARG 88 6.485 -34.437 -2.185 171 H ARG 89 H ARG 89 -0.554 -31.488 2.251 172 HA ARG 89 HA ARG 89 -0.938 -32.746 4.809 173 HB2 ARG 89 HB2 ARG 89 -1.668 -29.979 3.753 174 HB3 ARG 89 HB3 ARG 89 -1.914 -30.460 5.432 175 HG2 ARG 89 HG2 ARG 89 0.478 -30.876 5.736 176 HG3 ARG 89 HG3 ARG 89 0.801 -30.503 4.043 177 HD2 ARG 89 HD2 ARG 89 -0.070 -28.203 4.365 178 HD3 ARG 89 HD3 ARG 89 -0.399 -28.543 6.061 179 HE ARG 89 HE ARG 89 2.188 -27.943 4.803 180 HH11 ARG 89 HH11 ARG 89 0.831 -29.353 7.742 181 HH12 ARG 89 HH12 ARG 89 2.298 -29.035 8.626 182 HH21 ARG 89 HH21 ARG 89 3.879 -27.584 5.897 183 HH22 ARG 89 HH22 ARG 89 4.042 -28.041 7.598 184 H ASN 90 H ASN 90 -3.301 -31.894 2.328 185 HA ASN 90 HA ASN 90 -5.568 -32.747 4.037 186 HB2 ASN 90 HB2 ASN 90 -5.366 -31.429 1.303 187 HB3 ASN 90 HB3 ASN 90 -6.888 -32.021 1.964 188 HD21 ASN 90 HD22 ASN 90 -4.335 -29.620 2.408 189 HD22 ASN 90 HD21 ASN 90 -5.270 -28.624 3.522 190 H GLY 91 H GLY 91 -3.397 -34.505 2.225 191 HA2 GLY 91 HA2 GLY 91 -3.417 -36.668 1.459 192 HA3 GLY 91 HA3 GLY 91 -5.020 -36.876 2.164 193 H HIS 92 H HIS 92 -4.515 -34.351 -0.231 194 HA HIS 92 HA HIS 92 -6.432 -35.699 -2.059 195 HB2 HIS 92 HB2 HIS 92 -6.710 -33.303 -1.178 196 HB3 HIS 92 HB3 HIS 92 -5.396 -32.843 -2.243 197 HD1 HIS 92 HD1 HIS 92 -9.057 -33.995 -2.304 198 HD2 HIS 92 HD2 HIS 92 -5.974 -32.769 -4.926 199 HE1 HIS 92 HE1 HIS 92 -10.172 -33.544 -4.583 200 HE2 HIS 92 HE2 HIS 92 -8.312 -32.792 -6.180 201 H ASN 93 H ASN 93 -6.022 -36.033 -4.280 202 HA ASN 93 HA ASN 93 -3.318 -36.839 -4.887 203 HB2 ASN 93 HB2 ASN 93 -5.830 -36.648 -6.606 204 HB3 ASN 93 HB3 ASN 93 -4.306 -37.327 -7.167 205 HD21 ASN 93 HD22 ASN 93 -6.442 -38.948 -7.343 206 HD22 ASN 93 HD21 ASN 93 -6.352 -40.192 -6.101 207 H VAL 94 H VAL 94 -1.716 -35.897 -6.026 208 HA VAL 94 HA VAL 94 -2.172 -33.687 -7.864 209 HB VAL 94 HB VAL 94 -2.028 -32.523 -5.673 210 HG11 VAL 94 HG11 VAL 94 0.076 -32.299 -4.478 211 HG12 VAL 94 HG12 VAL 94 -0.421 -33.997 -4.499 212 HG13 VAL 94 HG13 VAL 94 0.878 -33.430 -5.577 213 HG21 VAL 94 HG21 VAL 94 0.324 -31.864 -7.485 214 HG22 VAL 94 HG22 VAL 94 -1.375 -31.433 -7.806 215 HG23 VAL 94 HG23 VAL 94 -0.554 -30.777 -6.384 216 H SER 95 H SER 95 -0.514 -33.499 -9.420 217 HA SER 95 HA SER 95 1.365 -35.757 -9.528 218 HB2 SER 95 HB2 SER 95 0.158 -35.023 -11.544 219 HB3 SER 95 HB3 SER 95 1.000 -33.457 -11.477 220 HG SER 95 HG SER 95 2.042 -35.028 -12.862 221 H THR 96 H THR 96 3.569 -35.694 -9.346 222 HA THR 96 HA THR 96 4.747 -33.507 -7.810 223 HB THR 96 HB THR 96 6.770 -35.000 -7.828 224 HG1 THR 96 HG1 THR 96 6.476 -37.078 -8.702 225 HG21 THR 96 HG21 THR 96 4.180 -36.408 -7.026 226 HG22 THR 96 HG22 THR 96 5.817 -36.733 -6.406 227 HG23 THR 96 HG23 THR 96 5.032 -35.186 -6.057 228 H ARG 97 H ARG 97 4.516 -34.107 -11.154 229 HA ARG 97 HA ARG 97 6.709 -32.161 -11.753 230 HB2 ARG 97 HB2 ARG 97 7.376 -33.460 -13.690 231 HB3 ARG 97 HB3 ARG 97 7.539 -34.406 -12.217 232 HG2 ARG 97 HG2 ARG 97 5.391 -35.581 -12.733 233 HG3 ARG 97 HG3 ARG 97 5.260 -34.666 -14.240 234 HD2 ARG 97 HD2 ARG 97 7.561 -36.517 -13.500 235 HD3 ARG 97 HD3 ARG 97 6.175 -36.984 -14.498 236 HE ARG 97 HE ARG 97 7.184 -34.734 -15.773 237 HH11 ARG 97 HH21 ARG 97 8.502 -37.895 -15.014 238 HH12 ARG 97 HH22 ARG 97 9.604 -37.862 -16.363 239 HH21 ARG 97 HH11 ARG 97 8.627 -34.746 -17.460 240 HH22 ARG 97 HH12 ARG 97 9.662 -36.122 -17.715 241 H GLY 98 H GLY 98 6.523 -31.055 -13.792 242 HA2 GLY 98 HA2 GLY 98 5.401 -29.720 -15.306 243 HA3 GLY 98 HA3 GLY 98 4.167 -30.972 -15.399 244 H ARG 99 H ARG 99 2.678 -29.195 -15.678 245 HA ARG 99 HA ARG 99 2.137 -27.261 -13.564 246 HB2 ARG 99 HB2 ARG 99 0.502 -28.124 -15.994 247 HB3 ARG 99 HB3 ARG 99 0.068 -26.797 -14.911 248 HG2 ARG 99 HG2 ARG 99 2.206 -25.640 -15.457 249 HG3 ARG 99 HG3 ARG 99 2.616 -26.948 -16.585 250 HD2 ARG 99 HD2 ARG 99 0.575 -26.457 -17.899 251 HD3 ARG 99 HD3 ARG 99 0.176 -25.139 -16.776 252 HE ARG 99 HE ARG 99 2.811 -24.696 -17.743 253 HH11 ARG 99 HH11 ARG 99 -0.443 -24.619 -19.045 254 HH12 ARG 99 HH12 ARG 99 -0.023 -23.466 -20.280 255 HH21 ARG 99 HH21 ARG 99 3.285 -23.234 -19.346 256 HH22 ARG 99 HH22 ARG 99 2.040 -22.707 -20.443 257 H ILE 100 H ILE 100 0.302 -27.100 -12.267 258 HA ILE 100 HA ILE 100 -0.514 -29.624 -11.025 259 HB ILE 100 HB ILE 100 -1.032 -26.730 -10.322 260 HG12 ILE 100 HG12 ILE 100 0.738 -28.927 -9.132 261 HG13 ILE 100 HG13 ILE 100 1.296 -27.526 -10.050 262 HG21 ILE 100 HG21 ILE 100 -1.994 -27.473 -8.206 263 HG22 ILE 100 HG22 ILE 100 -2.945 -28.138 -9.506 264 HG23 ILE 100 HG23 ILE 100 -1.775 -29.177 -8.645 265 HD11 ILE 100 HD11 ILE 100 0.087 -27.525 -7.277 266 HD12 ILE 100 HD12 ILE 100 1.720 -27.071 -7.782 267 HD13 ILE 100 HD13 ILE 100 0.342 -26.042 -8.236 268 HA PRO 101 HA PRO 101 -4.388 -29.856 -13.293 269 HB2 PRO 101 HB2 PRO 101 -5.600 -31.281 -10.971 270 HB3 PRO 101 HB3 PRO 101 -5.397 -31.833 -12.653 271 HG2 PRO 101 HG2 PRO 101 -3.874 -32.799 -10.582 272 HG3 PRO 101 HG3 PRO 101 -3.222 -32.598 -12.244 273 HD2 PRO 101 HD2 PRO 101 -2.888 -30.793 -9.845 274 HD3 PRO 101 HD3 PRO 101 -1.681 -31.312 -11.068 275 H ALA 102 H ALA 102 -6.230 -28.636 -13.466 276 HA ALA 102 HA ALA 102 -6.637 -26.462 -11.771 277 HB1 ALA 102 HB1 ALA 102 -7.297 -26.577 -14.126 278 HB2 ALA 102 HB2 ALA 102 -8.611 -27.710 -13.703 279 HB3 ALA 102 HB3 ALA 102 -8.622 -26.041 -13.071 280 H ASP 103 H ASP 103 -8.100 -29.682 -11.542 281 HA ASP 103 HA ASP 103 -10.128 -29.267 -9.719 282 HB2 ASP 103 HB2 ASP 103 -9.685 -31.425 -10.734 283 HB3 ASP 103 HB3 ASP 103 -8.091 -31.508 -9.983 284 H VAL 104 H VAL 104 -6.612 -29.571 -9.087 285 HA VAL 104 HA VAL 104 -6.930 -29.414 -6.228 286 HB VAL 104 HB VAL 104 -4.311 -29.015 -7.609 287 HG11 VAL 104 HG11 VAL 104 -4.335 -28.746 -5.168 288 HG12 VAL 104 HG12 VAL 104 -5.073 -30.348 -4.979 289 HG13 VAL 104 HG13 VAL 104 -3.423 -30.183 -5.623 290 HG21 VAL 104 HG21 VAL 104 -5.143 -31.026 -8.712 291 HG22 VAL 104 HG22 VAL 104 -3.953 -31.507 -7.504 292 HG23 VAL 104 HG23 VAL 104 -5.683 -31.696 -7.159 293 H ILE 105 H ILE 105 -6.022 -27.154 -8.833 294 HA ILE 105 HA ILE 105 -5.373 -24.912 -7.138 295 HB ILE 105 HB ILE 105 -6.390 -25.151 -9.994 296 HG12 ILE 105 HG12 ILE 105 -3.648 -24.143 -9.162 297 HG13 ILE 105 HG13 ILE 105 -3.947 -25.868 -9.030 298 HG21 ILE 105 HG21 ILE 105 -5.458 -22.633 -8.546 299 HG22 ILE 105 HG22 ILE 105 -5.681 -22.777 -10.300 300 HG23 ILE 105 HG23 ILE 105 -7.072 -22.933 -9.230 301 HD11 ILE 105 HD11 ILE 105 -2.933 -25.273 -11.193 302 HD12 ILE 105 HD12 ILE 105 -4.515 -26.063 -11.346 303 HD13 ILE 105 HD13 ILE 105 -4.370 -24.305 -11.596 304 H ASP 106 H ASP 106 -8.523 -25.870 -8.662 305 HA ASP 106 HA ASP 106 -10.088 -23.935 -7.430 306 HB2 ASP 106 HB2 ASP 106 -10.839 -25.360 -9.278 307 HB3 ASP 106 HB3 ASP 106 -10.816 -26.770 -8.215 308 H ALA 107 H ALA 107 -9.299 -27.261 -6.231 309 HA ALA 107 HA ALA 107 -10.624 -27.184 -3.833 310 HB1 ALA 107 HB1 ALA 107 -9.054 -28.976 -3.173 311 HB2 ALA 107 HB2 ALA 107 -9.543 -29.169 -4.854 312 HB3 ALA 107 HB3 ALA 107 -7.938 -28.511 -4.473 313 H TYR 108 H TYR 108 -7.255 -26.091 -4.425 314 HA TYR 108 HA TYR 108 -6.663 -25.195 -1.796 315 HB2 TYR 108 HB2 TYR 108 -5.029 -25.615 -3.590 316 HB3 TYR 108 HB3 TYR 108 -5.638 -24.247 -4.503 317 HD1 TYR 108 HD1 TYR 108 -3.661 -25.321 -1.600 318 HD2 TYR 108 HD2 TYR 108 -5.100 -21.926 -3.827 319 HE1 TYR 108 HE1 TYR 108 -1.963 -23.873 -0.485 320 HE2 TYR 108 HE2 TYR 108 -3.414 -20.478 -2.714 321 HH TYR 108 HH TYR 108 -1.669 -20.368 -1.213 322 H HIS 109 H HIS 109 -8.000 -23.370 -4.618 323 HA HIS 109 HA HIS 109 -8.297 -20.875 -3.193 324 HB2 HIS 109 HB2 HIS 109 -9.405 -22.005 -5.771 325 HB3 HIS 109 HB3 HIS 109 -10.112 -20.544 -5.089 326 HD1 HIS 109 HD1 HIS 109 -8.910 -18.317 -5.619 327 HD2 HIS 109 HD2 HIS 109 -6.529 -21.761 -6.170 328 HE1 HIS 109 HE1 HIS 109 -6.687 -17.515 -6.648 329 HE2 HIS 109 HE2 HIS 109 -5.246 -19.617 -6.984 330 H ALA 110 H ALA 110 -10.597 -23.649 -3.511 331 HA ALA 110 HA ALA 110 -12.734 -22.351 -2.161 332 HB1 ALA 110 HB1 ALA 110 -12.991 -24.440 -3.449 333 HB2 ALA 110 HB2 ALA 110 -11.998 -25.311 -2.257 334 HB3 ALA 110 HB3 ALA 110 -13.572 -24.636 -1.788 335 H ALA 111 H ALA 111 -10.006 -24.334 -0.840 336 HA ALA 111 HA ALA 111 -10.777 -24.259 1.820 337 HB1 ALA 111 HB1 ALA 111 -8.473 -24.929 2.264 338 HB2 ALA 111 HB2 ALA 111 -9.104 -25.756 0.819 339 HB3 ALA 111 HB3 ALA 111 -7.981 -24.380 0.648 340 H THR 112 H THR 112 -8.825 -21.877 -0.017 341 HA THR 112 HA THR 112 -8.299 -20.240 2.357 342 HB THR 112 HB THR 112 -7.295 -18.630 0.801 343 HG1 THR 112 HG1 THR 112 -7.146 -19.152 -1.363 344 HG21 THR 112 HG21 THR 112 -5.935 -20.491 1.715 345 HG22 THR 112 HG22 THR 112 -6.362 -21.496 0.312 346 HG23 THR 112 HG23 THR 112 -5.408 -20.012 0.094 347 H LEU 113 H LEU 113 -10.676 -20.005 -0.335 348 HA LEU 113 HA LEU 113 -11.509 -17.368 0.545 349 HB2 LEU 113 HB2 LEU 113 -11.179 -17.972 -1.824 350 HB3 LEU 113 HB3 LEU 113 -12.432 -19.216 -1.675 351 HG LEU 113 HG LEU 113 -14.118 -17.532 -1.240 352 HD11 LEU 113 HD11 LEU 113 -13.633 -15.113 -1.676 353 HD12 LEU 113 HD12 LEU 113 -12.816 -15.704 -0.231 354 HD13 LEU 113 HD13 LEU 113 -11.900 -15.494 -1.741 355 HD21 LEU 113 HD21 LEU 113 -12.482 -16.964 -3.746 356 HD22 LEU 113 HD22 LEU 113 -13.677 -18.264 -3.546 357 HD23 LEU 113 HD23 LEU 113 -14.204 -16.571 -3.515 358 H GLU 114 H GLU 114 -12.955 -20.632 0.604 359 HA GLU 114 HA GLU 114 -15.516 -19.540 1.581 360 HB2 GLU 114 HB2 GLU 114 -14.747 -22.428 1.037 361 HB3 GLU 114 HB3 GLU 114 -16.345 -21.841 1.431 362 HG2 GLU 114 HG2 GLU 114 -14.750 -21.185 -1.077 363 HG3 GLU 114 HG3 GLU 114 -16.145 -22.248 -0.959 364 H HIS 115 H HIS 115 -16.598 -20.167 3.458 365 HA HIS 115 HA HIS 115 -15.048 -21.427 5.673 366 HB2 HIS 115 HB2 HIS 115 -14.621 -18.997 5.769 367 HB3 HIS 115 HB3 HIS 115 -16.349 -18.671 5.806 368 HD1 HIS 115 HD1 HIS 115 -17.278 -18.372 8.222 369 HD2 HIS 115 HD2 HIS 115 -13.688 -20.589 7.963 370 HE1 HIS 115 HE1 HIS 115 -16.497 -18.783 10.647 371 HE2 HIS 115 HE2 HIS 115 -14.313 -20.146 10.477 372 H HIS 116 H HIS 116 -16.262 -23.082 6.256 373 HA HIS 116 HA HIS 116 -18.041 -24.485 6.630 374 HB2 HIS 116 HB2 HIS 116 -19.068 -22.059 8.138 375 HB3 HIS 116 HB3 HIS 116 -19.529 -23.730 8.422 376 HD1 HIS 116 HD1 HIS 116 -18.043 -21.731 10.560 377 HD2 HIS 116 HD2 HIS 116 -16.457 -24.975 8.370 378 HE1 HIS 116 HE1 HIS 116 -15.994 -22.579 11.884 379 HE2 HIS 116 HE2 HIS 116 -15.037 -24.551 10.534 380 H HIS 117 H HIS 117 -18.330 -23.760 4.101 381 HA HIS 117 HA HIS 117 -20.828 -22.511 3.416 382 HB2 HIS 117 HB2 HIS 117 -18.742 -22.745 1.972 383 HB3 HIS 117 HB3 HIS 117 -19.197 -24.416 1.677 384 HD1 HIS 117 HD1 HIS 117 -21.461 -24.741 0.073 385 HD2 HIS 117 HD2 HIS 117 -20.052 -20.802 0.738 386 HE1 HIS 117 HE1 HIS 117 -22.600 -23.247 -1.682 387 HE2 HIS 117 HE2 HIS 117 -21.746 -20.853 -1.269 388 H HIS 118 H HIS 118 -22.776 -23.375 2.646 389 HA HIS 118 HA HIS 118 -23.766 -25.837 3.776 390 HB2 HIS 118 HB2 HIS 118 -25.190 -23.874 3.338 391 HB3 HIS 118 HB3 HIS 118 -24.905 -24.013 1.602 392 HD1 HIS 118 HD1 HIS 118 -26.830 -25.788 4.438 393 HD2 HIS 118 HD2 HIS 118 -26.287 -25.870 0.246 394 HE1 HIS 118 HE1 HIS 118 -28.556 -27.464 3.509 395 HE2 HIS 118 HE2 HIS 118 -28.182 -27.549 0.958 396 H HIS 119 H HIS 119 -24.391 -27.775 2.773 397 HA HIS 119 HA HIS 119 -23.609 -28.312 -0.047 398 HB2 HIS 119 HB2 HIS 119 -22.835 -30.078 2.319 399 HB3 HIS 119 HB3 HIS 119 -22.676 -30.536 0.625 400 HD1 HIS 119 HD1 HIS 119 -20.803 -28.695 3.313 401 HD2 HIS 119 HD2 HIS 119 -20.880 -29.029 -0.900 402 HE1 HIS 119 HE1 HIS 119 -18.566 -27.740 2.468 403 HE2 HIS 119 HE2 HIS 119 -18.619 -27.958 -0.104 404 H HIS 120 H HIS 120 -24.944 -29.711 -1.099 405 HA HIS 120 HA HIS 120 -27.024 -30.439 -1.680 406 HB2 HIS 120 HB2 HIS 120 -27.454 -32.694 -0.851 407 HB3 HIS 120 HB3 HIS 120 -25.780 -32.429 -1.302 408 HD1 HIS 120 HD1 HIS 120 -27.679 -32.052 2.035 409 HD2 HIS 120 HD2 HIS 120 -24.183 -33.679 0.342 410 HE1 HIS 120 HE1 HIS 120 -26.403 -33.236 3.986 411 HE2 HIS 120 HE2 HIS 120 -24.258 -34.205 2.921 Start of MODEL 4 1 H1 SER 66 H1 SER 66 31.401 -35.115 -8.399 2 H2 SER 66 H2 SER 66 31.082 -36.635 -7.867 3 H3 SER 66 H3 SER 66 29.923 -35.781 -8.650 4 HA SER 66 HA SER 66 31.084 -35.137 -6.014 5 HB2 SER 66 HB2 SER 66 28.861 -33.668 -7.495 6 HB3 SER 66 HB3 SER 66 29.493 -33.293 -5.879 7 HG SER 66 HG SER 66 30.473 -31.985 -7.508 8 H GLY 67 H GLY 67 29.684 -35.406 -4.196 9 HA2 GLY 67 HA2 GLY 67 27.934 -37.725 -4.310 10 HA3 GLY 67 HA3 GLY 67 28.282 -36.720 -2.906 11 H SER 68 H SER 68 25.783 -37.732 -3.262 12 HA SER 68 HA SER 68 23.974 -36.010 -4.685 13 HB2 SER 68 HB2 SER 68 23.373 -38.044 -2.508 14 HB3 SER 68 HB3 SER 68 22.225 -37.377 -3.685 15 HG SER 68 HG SER 68 23.029 -39.433 -4.345 16 H GLY 69 H GLY 69 25.359 -35.599 -1.547 17 HA2 GLY 69 HA2 GLY 69 25.043 -33.951 0.063 18 HA3 GLY 69 HA3 GLY 69 23.909 -33.160 -1.018 19 H ARG 70 H ARG 70 22.667 -32.654 0.878 20 HA ARG 70 HA ARG 70 21.470 -34.753 2.530 21 HB2 ARG 70 HB2 ARG 70 20.919 -31.760 2.330 22 HB3 ARG 70 HB3 ARG 70 20.198 -32.847 3.528 23 HG2 ARG 70 HG2 ARG 70 22.421 -33.430 4.406 24 HG3 ARG 70 HG3 ARG 70 23.192 -32.347 3.231 25 HD2 ARG 70 HD2 ARG 70 21.985 -30.419 4.197 26 HD3 ARG 70 HD3 ARG 70 21.204 -31.493 5.379 27 HE ARG 70 HE ARG 70 23.970 -31.913 5.648 28 HH11 ARG 70 HH21 ARG 70 21.832 -29.177 6.137 29 HH12 ARG 70 HH22 ARG 70 22.852 -28.483 7.371 30 HH21 ARG 70 HH11 ARG 70 25.224 -30.977 7.218 31 HH22 ARG 70 HH12 ARG 70 24.736 -29.482 7.957 32 H GLY 71 H GLY 71 20.525 -33.328 -0.474 33 HA2 GLY 71 HA2 GLY 71 18.787 -33.822 -1.892 34 HA3 GLY 71 HA3 GLY 71 18.345 -35.147 -0.821 35 H ARG 72 H ARG 72 18.354 -31.914 0.516 36 HA ARG 72 HA ARG 72 15.457 -32.078 1.043 37 HB2 ARG 72 HB2 ARG 72 17.577 -30.096 1.972 38 HB3 ARG 72 HB3 ARG 72 15.880 -30.081 2.475 39 HG2 ARG 72 HG2 ARG 72 16.114 -32.338 3.453 40 HG3 ARG 72 HG3 ARG 72 17.813 -32.392 2.957 41 HD2 ARG 72 HD2 ARG 72 18.278 -30.392 4.356 42 HD3 ARG 72 HD3 ARG 72 16.582 -30.398 4.893 43 HE ARG 72 HE ARG 72 17.689 -32.979 5.367 44 HH11 ARG 72 HH11 ARG 72 17.963 -29.742 6.700 45 HH12 ARG 72 HH12 ARG 72 18.454 -30.329 8.265 46 HH21 ARG 72 HH21 ARG 72 18.317 -33.660 7.388 47 HH22 ARG 72 HH22 ARG 72 18.643 -32.497 8.639 48 H GLY 73 H GLY 73 13.948 -30.447 0.612 49 HA2 GLY 73 HA2 GLY 73 14.114 -29.188 -1.994 50 HA3 GLY 73 HA3 GLY 73 12.798 -29.039 -0.836 51 H ALA 74 H ALA 74 13.917 -26.964 -2.483 52 HA ALA 74 HA ALA 74 14.721 -24.980 -0.414 53 HB1 ALA 74 HB1 ALA 74 16.531 -24.166 -1.868 54 HB2 ALA 74 HB2 ALA 74 16.770 -25.880 -1.515 55 HB3 ALA 74 HB3 ALA 74 16.122 -25.386 -3.094 56 H ILE 75 H ILE 75 12.169 -25.414 -1.591 57 HA ILE 75 HA ILE 75 11.706 -22.735 -2.795 58 HB ILE 75 HB ILE 75 10.366 -25.296 -3.752 59 HG12 ILE 75 HG12 ILE 75 12.364 -23.486 -5.187 60 HG13 ILE 75 HG13 ILE 75 12.681 -25.121 -4.604 61 HG21 ILE 75 HG21 ILE 75 9.227 -23.855 -5.403 62 HG22 ILE 75 HG22 ILE 75 8.839 -23.322 -3.784 63 HG23 ILE 75 HG23 ILE 75 10.041 -22.418 -4.736 64 HD11 ILE 75 HD11 ILE 75 12.352 -25.272 -6.945 65 HD12 ILE 75 HD12 ILE 75 10.926 -25.990 -6.180 66 HD13 ILE 75 HD13 ILE 75 10.840 -24.358 -6.890 67 H ASP 76 H ASP 76 10.090 -21.629 -1.881 68 HA ASP 76 HA ASP 76 8.069 -22.999 -0.156 69 HB2 ASP 76 HB2 ASP 76 9.993 -22.399 1.268 70 HB3 ASP 76 HB3 ASP 76 9.866 -20.722 0.747 71 H ARG 77 H ARG 77 9.077 -19.853 -1.589 72 HA ARG 77 HA ARG 77 6.463 -18.634 -1.265 73 HB2 ARG 77 HB2 ARG 77 8.904 -17.829 -2.900 74 HB3 ARG 77 HB3 ARG 77 7.460 -16.825 -2.688 75 HG2 ARG 77 HG2 ARG 77 7.796 -16.823 -0.229 76 HG3 ARG 77 HG3 ARG 77 9.282 -17.773 -0.431 77 HD2 ARG 77 HD2 ARG 77 10.245 -15.967 -1.829 78 HD3 ARG 77 HD3 ARG 77 8.762 -15.006 -1.598 79 HE ARG 77 HE ARG 77 9.774 -15.731 0.963 80 HH11 ARG 77 HH11 ARG 77 10.705 -13.616 -1.670 81 HH12 ARG 77 HH12 ARG 77 11.574 -12.526 -0.621 82 HH21 ARG 77 HH21 ARG 77 10.887 -14.302 2.251 83 HH22 ARG 77 HH22 ARG 77 11.660 -12.907 1.553 84 H GLU 78 H GLU 78 7.767 -20.628 -3.790 85 HA GLU 78 HA GLU 78 6.153 -19.695 -5.968 86 HB2 GLU 78 HB2 GLU 78 8.215 -21.163 -6.111 87 HB3 GLU 78 HB3 GLU 78 7.183 -22.505 -5.596 88 HG2 GLU 78 HG2 GLU 78 7.256 -22.593 -7.971 89 HG3 GLU 78 HG3 GLU 78 5.662 -21.970 -7.536 90 H GLN 79 H GLN 79 4.059 -19.953 -6.471 91 HA GLN 79 HA GLN 79 2.292 -20.978 -4.455 92 HB2 GLN 79 HB2 GLN 79 1.702 -20.168 -7.327 93 HB3 GLN 79 HB3 GLN 79 0.500 -20.410 -6.060 94 HG2 GLN 79 HG2 GLN 79 2.689 -18.274 -6.066 95 HG3 GLN 79 HG3 GLN 79 0.987 -18.022 -6.396 96 HE21 GLN 79 HE22 GLN 79 3.393 -18.424 -3.794 97 HE22 GLN 79 HE21 GLN 79 2.223 -18.179 -2.511 98 H SER 80 H SER 80 3.516 -22.478 -7.445 99 HA SER 80 HA SER 80 1.936 -24.833 -7.445 100 HB2 SER 80 HB2 SER 80 4.910 -24.613 -8.079 101 HB3 SER 80 HB3 SER 80 3.788 -25.849 -8.676 102 HG SER 80 HG SER 80 2.701 -24.227 -9.862 103 H ALA 81 H ALA 81 5.012 -24.186 -5.631 104 HA ALA 81 HA ALA 81 5.056 -26.699 -4.331 105 HB1 ALA 81 HB1 ALA 81 6.330 -24.060 -3.507 106 HB2 ALA 81 HB2 ALA 81 6.780 -25.668 -2.916 107 HB3 ALA 81 HB3 ALA 81 7.031 -25.250 -4.625 108 H ALA 82 H ALA 82 3.680 -23.536 -3.328 109 HA ALA 82 HA ALA 82 2.805 -24.333 -0.744 110 HB1 ALA 82 HB1 ALA 82 1.353 -22.370 -0.874 111 HB2 ALA 82 HB2 ALA 82 2.942 -21.989 -1.564 112 HB3 ALA 82 HB3 ALA 82 1.550 -22.296 -2.633 113 H ILE 83 H ILE 83 1.030 -24.520 -3.892 114 HA ILE 83 HA ILE 83 -1.322 -25.727 -2.717 115 HB ILE 83 HB ILE 83 -0.378 -25.567 -5.600 116 HG12 ILE 83 HG12 ILE 83 -2.512 -24.037 -4.042 117 HG13 ILE 83 HG13 ILE 83 -0.929 -23.400 -4.411 118 HG21 ILE 83 HG21 ILE 83 -3.115 -26.423 -4.510 119 HG22 ILE 83 HG22 ILE 83 -2.703 -26.197 -6.222 120 HG23 ILE 83 HG23 ILE 83 -1.956 -27.499 -5.313 121 HD11 ILE 83 HD11 ILE 83 -2.433 -22.439 -5.969 122 HD12 ILE 83 HD12 ILE 83 -1.457 -23.616 -6.872 123 HD13 ILE 83 HD13 ILE 83 -3.135 -23.997 -6.400 124 H ARG 84 H ARG 84 1.584 -27.160 -4.300 125 HA ARG 84 HA ARG 84 0.748 -29.897 -4.091 126 HB2 ARG 84 HB2 ARG 84 2.674 -29.173 -5.442 127 HB3 ARG 84 HB3 ARG 84 3.540 -28.650 -3.994 128 HG2 ARG 84 HG2 ARG 84 3.671 -30.965 -3.183 129 HG3 ARG 84 HG3 ARG 84 2.693 -31.535 -4.545 130 HD2 ARG 84 HD2 ARG 84 5.386 -30.137 -4.838 131 HD3 ARG 84 HD3 ARG 84 5.200 -31.880 -4.735 132 HE ARG 84 HE ARG 84 3.796 -31.820 -6.789 133 HH11 ARG 84 HH11 ARG 84 6.060 -29.154 -6.403 134 HH12 ARG 84 HH12 ARG 84 6.129 -28.879 -8.120 135 HH21 ARG 84 HH21 ARG 84 3.958 -31.451 -8.886 136 HH22 ARG 84 HH22 ARG 84 4.921 -30.139 -9.509 137 H GLU 85 H GLU 85 2.658 -27.948 -1.713 138 HA GLU 85 HA GLU 85 2.678 -29.903 0.294 139 HB2 GLU 85 HB2 GLU 85 4.136 -27.891 0.182 140 HB3 GLU 85 HB3 GLU 85 2.740 -26.925 0.687 141 HG2 GLU 85 HG2 GLU 85 3.934 -27.393 2.673 142 HG3 GLU 85 HG3 GLU 85 2.523 -28.455 2.671 143 H TRP 86 H TRP 86 0.229 -27.256 -0.136 144 HA TRP 86 HA TRP 86 -1.410 -27.978 1.978 145 HB2 TRP 86 HB2 TRP 86 -1.761 -25.947 0.740 146 HB3 TRP 86 HB3 TRP 86 -2.082 -26.832 -0.750 147 HD1 TRP 86 HD1 TRP 86 -3.695 -25.943 2.602 148 HE1 TRP 86 HE1 TRP 86 -6.224 -26.380 2.495 149 HE3 TRP 86 HE3 TRP 86 -3.961 -28.094 -2.046 150 HZ2 TRP 86 HZ2 TRP 86 -8.087 -27.683 0.714 151 HZ3 TRP 86 HZ3 TRP 86 -6.140 -28.877 -2.936 152 HH2 TRP 86 HH2 TRP 86 -8.198 -28.712 -1.551 153 H ALA 87 H ALA 87 -1.542 -29.257 -1.390 154 HA ALA 87 HA ALA 87 -3.670 -31.094 -0.966 155 HB1 ALA 87 HB1 ALA 87 -2.785 -32.140 -3.073 156 HB2 ALA 87 HB2 ALA 87 -2.935 -30.370 -3.179 157 HB3 ALA 87 HB3 ALA 87 -1.342 -31.116 -2.943 158 H ARG 88 H ARG 88 -0.125 -31.582 -0.664 159 HA ARG 88 HA ARG 88 -0.134 -34.331 0.057 160 HB2 ARG 88 HB2 ARG 88 1.836 -32.870 -0.620 161 HB3 ARG 88 HB3 ARG 88 1.823 -32.187 1.011 162 HG2 ARG 88 HG2 ARG 88 2.195 -34.527 1.921 163 HG3 ARG 88 HG3 ARG 88 2.248 -35.108 0.250 164 HD2 ARG 88 HD2 ARG 88 4.515 -34.855 0.841 165 HD3 ARG 88 HD3 ARG 88 4.159 -33.452 -0.151 166 HE ARG 88 HE ARG 88 4.481 -32.037 1.684 167 HH11 ARG 88 HH11 ARG 88 4.548 -35.352 2.878 168 HH12 ARG 88 HH12 ARG 88 5.129 -34.861 4.445 169 HH21 ARG 88 HH21 ARG 88 5.092 -31.482 3.699 170 HH22 ARG 88 HH22 ARG 88 5.474 -32.712 4.885 171 H ARG 89 H ARG 89 -0.269 -31.456 2.197 172 HA ARG 89 HA ARG 89 -0.463 -32.987 4.658 173 HB2 ARG 89 HB2 ARG 89 -1.085 -30.073 4.009 174 HB3 ARG 89 HB3 ARG 89 -1.145 -30.762 5.638 175 HG2 ARG 89 HG2 ARG 89 1.237 -31.448 5.460 176 HG3 ARG 89 HG3 ARG 89 1.323 -30.719 3.853 177 HD2 ARG 89 HD2 ARG 89 0.670 -28.508 4.901 178 HD3 ARG 89 HD3 ARG 89 0.784 -29.297 6.489 179 HE ARG 89 HE ARG 89 3.171 -29.591 4.784 180 HH11 ARG 89 HH11 ARG 89 1.808 -27.492 7.261 181 HH12 ARG 89 HH12 ARG 89 3.367 -26.792 7.596 182 HH21 ARG 89 HH21 ARG 89 4.970 -28.689 5.174 183 HH22 ARG 89 HH22 ARG 89 5.186 -27.480 6.440 184 H ASN 90 H ASN 90 -2.929 -31.923 2.395 185 HA ASN 90 HA ASN 90 -5.098 -32.831 4.206 186 HB2 ASN 90 HB2 ASN 90 -5.076 -31.412 1.522 187 HB3 ASN 90 HB3 ASN 90 -6.545 -32.050 2.261 188 HD21 ASN 90 HD22 ASN 90 -4.003 -29.614 2.646 189 HD22 ASN 90 HD21 ASN 90 -4.895 -28.681 3.847 190 H GLY 91 H GLY 91 -2.996 -34.527 2.313 191 HA2 GLY 91 HA2 GLY 91 -3.004 -36.724 1.658 192 HA3 GLY 91 HA3 GLY 91 -4.616 -36.903 2.355 193 H HIS 92 H HIS 92 -4.139 -34.482 -0.136 194 HA HIS 92 HA HIS 92 -5.969 -35.943 -1.972 195 HB2 HIS 92 HB2 HIS 92 -4.827 -33.121 -2.146 196 HB3 HIS 92 HB3 HIS 92 -6.080 -33.796 -3.179 197 HD1 HIS 92 HD1 HIS 92 -7.694 -35.073 -0.467 198 HD2 HIS 92 HD2 HIS 92 -6.487 -31.136 -1.409 199 HE1 HIS 92 HE1 HIS 92 -9.259 -33.504 0.834 200 HE2 HIS 92 HE2 HIS 92 -8.526 -31.102 0.248 201 H ASN 93 H ASN 93 -5.485 -36.342 -4.172 202 HA ASN 93 HA ASN 93 -2.784 -37.287 -4.610 203 HB2 ASN 93 HB2 ASN 93 -5.229 -37.131 -6.419 204 HB3 ASN 93 HB3 ASN 93 -3.706 -37.873 -6.898 205 HD21 ASN 93 HD22 ASN 93 -5.896 -39.440 -7.041 206 HD22 ASN 93 HD21 ASN 93 -5.854 -40.628 -5.747 207 H VAL 94 H VAL 94 -1.090 -36.319 -5.508 208 HA VAL 94 HA VAL 94 -1.323 -34.284 -7.583 209 HB VAL 94 HB VAL 94 -1.569 -32.930 -5.528 210 HG11 VAL 94 HG11 VAL 94 1.243 -33.807 -4.764 211 HG12 VAL 94 HG12 VAL 94 0.269 -32.566 -3.966 212 HG13 VAL 94 HG13 VAL 94 -0.255 -34.251 -3.915 213 HG21 VAL 94 HG21 VAL 94 0.035 -31.222 -6.049 214 HG22 VAL 94 HG22 VAL 94 1.111 -32.381 -6.853 215 HG23 VAL 94 HG23 VAL 94 -0.477 -31.997 -7.557 216 H SER 95 H SER 95 0.549 -34.125 -8.860 217 HA SER 95 HA SER 95 2.511 -36.293 -8.520 218 HB2 SER 95 HB2 SER 95 1.624 -35.763 -10.763 219 HB3 SER 95 HB3 SER 95 2.349 -34.147 -10.656 220 HG SER 95 HG SER 95 3.581 -36.664 -10.958 221 H THR 96 H THR 96 4.677 -36.087 -8.055 222 HA THR 96 HA THR 96 5.647 -33.603 -6.800 223 HB THR 96 HB THR 96 7.700 -34.976 -6.399 224 HG1 THR 96 HG1 THR 96 7.519 -37.212 -6.861 225 HG21 THR 96 HG21 THR 96 5.862 -34.910 -4.730 226 HG22 THR 96 HG22 THR 96 5.104 -36.316 -5.510 227 HG23 THR 96 HG23 THR 96 6.698 -36.470 -4.740 228 H ARG 97 H ARG 97 5.804 -35.044 -9.941 229 HA ARG 97 HA ARG 97 8.026 -33.188 -10.782 230 HB2 ARG 97 HB2 ARG 97 7.260 -35.910 -11.910 231 HB3 ARG 97 HB3 ARG 97 8.534 -34.872 -12.536 232 HG2 ARG 97 HG2 ARG 97 8.493 -36.195 -9.788 233 HG3 ARG 97 HG3 ARG 97 9.439 -36.706 -11.174 234 HD2 ARG 97 HD2 ARG 97 9.759 -34.072 -9.674 235 HD3 ARG 97 HD3 ARG 97 10.799 -35.470 -9.514 236 HE ARG 97 HE ARG 97 10.756 -33.512 -11.696 237 HH11 ARG 97 HH11 ARG 97 11.957 -36.696 -10.815 238 HH12 ARG 97 HH12 ARG 97 13.169 -36.674 -12.061 239 HH21 ARG 97 HH21 ARG 97 12.315 -33.573 -13.277 240 HH22 ARG 97 HH22 ARG 97 13.372 -34.947 -13.403 241 H GLY 98 H GLY 98 4.876 -34.486 -11.714 242 HA2 GLY 98 HA2 GLY 98 4.695 -32.909 -14.186 243 HA3 GLY 98 HA3 GLY 98 3.449 -33.924 -13.467 244 H ARG 99 H ARG 99 2.499 -31.759 -14.470 245 HA ARG 99 HA ARG 99 2.367 -29.444 -12.682 246 HB2 ARG 99 HB2 ARG 99 0.649 -30.278 -15.065 247 HB3 ARG 99 HB3 ARG 99 0.504 -28.740 -14.207 248 HG2 ARG 99 HG2 ARG 99 2.868 -28.191 -14.790 249 HG3 ARG 99 HG3 ARG 99 2.993 -29.709 -15.685 250 HD2 ARG 99 HD2 ARG 99 1.150 -28.989 -17.178 251 HD3 ARG 99 HD3 ARG 99 1.026 -27.459 -16.315 252 HE ARG 99 HE ARG 99 3.134 -28.327 -18.203 253 HH11 ARG 99 HH11 ARG 99 2.256 -25.818 -15.907 254 HH12 ARG 99 HH12 ARG 99 3.407 -24.690 -16.574 255 HH21 ARG 99 HH21 ARG 99 4.563 -26.850 -18.992 256 HH22 ARG 99 HH22 ARG 99 4.679 -25.267 -18.282 257 H ILE 100 H ILE 100 0.491 -28.700 -11.577 258 HA ILE 100 HA ILE 100 -0.878 -30.812 -10.069 259 HB ILE 100 HB ILE 100 -1.057 -27.802 -9.800 260 HG12 ILE 100 HG12 ILE 100 0.637 -29.931 -8.419 261 HG13 ILE 100 HG13 ILE 100 1.200 -28.558 -9.359 262 HG21 ILE 100 HG21 ILE 100 -3.070 -28.983 -8.884 263 HG22 ILE 100 HG22 ILE 100 -2.003 -30.009 -7.893 264 HG23 ILE 100 HG23 ILE 100 -2.109 -28.257 -7.622 265 HD11 ILE 100 HD11 ILE 100 -0.046 -28.494 -6.608 266 HD12 ILE 100 HD12 ILE 100 1.593 -28.042 -7.107 267 HD13 ILE 100 HD13 ILE 100 0.216 -27.033 -7.604 268 HA PRO 101 HA PRO 101 -4.507 -30.636 -12.756 269 HB2 PRO 101 HB2 PRO 101 -6.098 -31.645 -10.437 270 HB3 PRO 101 HB3 PRO 101 -5.920 -32.341 -12.071 271 HG2 PRO 101 HG2 PRO 101 -4.690 -33.446 -9.893 272 HG3 PRO 101 HG3 PRO 101 -3.889 -33.396 -11.505 273 HD2 PRO 101 HD2 PRO 101 -3.479 -31.553 -9.140 274 HD3 PRO 101 HD3 PRO 101 -2.271 -32.326 -10.214 275 H ALA 102 H ALA 102 -6.035 -29.065 -13.204 276 HA ALA 102 HA ALA 102 -6.223 -26.766 -11.635 277 HB1 ALA 102 HB1 ALA 102 -7.933 -26.063 -13.173 278 HB2 ALA 102 HB2 ALA 102 -6.615 -26.873 -14.046 279 HB3 ALA 102 HB3 ALA 102 -8.153 -27.735 -13.754 280 H ASP 103 H ASP 103 -8.327 -29.633 -11.582 281 HA ASP 103 HA ASP 103 -10.370 -28.688 -9.972 282 HB2 ASP 103 HB2 ASP 103 -10.322 -30.869 -11.117 283 HB3 ASP 103 HB3 ASP 103 -9.071 -31.434 -10.007 284 H VAL 104 H VAL 104 -7.099 -29.772 -9.016 285 HA VAL 104 HA VAL 104 -7.624 -29.614 -6.184 286 HB VAL 104 HB VAL 104 -4.988 -29.904 -7.588 287 HG11 VAL 104 HG11 VAL 104 -5.746 -30.515 -4.709 288 HG12 VAL 104 HG12 VAL 104 -4.185 -30.891 -5.468 289 HG13 VAL 104 HG13 VAL 104 -4.671 -29.208 -5.256 290 HG21 VAL 104 HG21 VAL 104 -6.472 -31.823 -8.151 291 HG22 VAL 104 HG22 VAL 104 -5.158 -32.329 -7.092 292 HG23 VAL 104 HG23 VAL 104 -6.788 -32.072 -6.423 293 H ILE 105 H ILE 105 -6.049 -27.554 -8.653 294 HA ILE 105 HA ILE 105 -5.217 -25.450 -6.870 295 HB ILE 105 HB ILE 105 -6.009 -25.544 -9.807 296 HG12 ILE 105 HG12 ILE 105 -3.236 -24.926 -8.729 297 HG13 ILE 105 HG13 ILE 105 -3.788 -26.589 -8.646 298 HG21 ILE 105 HG21 ILE 105 -6.436 -23.253 -9.168 299 HG22 ILE 105 HG22 ILE 105 -4.915 -23.171 -8.237 300 HG23 ILE 105 HG23 ILE 105 -4.893 -23.292 -10.013 301 HD11 ILE 105 HD11 ILE 105 -3.778 -24.991 -11.227 302 HD12 ILE 105 HD12 ILE 105 -2.501 -26.112 -10.702 303 HD13 ILE 105 HD13 ILE 105 -4.141 -26.723 -10.994 304 H ASP 106 H ASP 106 -8.342 -25.908 -8.641 305 HA ASP 106 HA ASP 106 -9.685 -23.765 -7.474 306 HB2 ASP 106 HB2 ASP 106 -10.487 -25.013 -9.424 307 HB3 ASP 106 HB3 ASP 106 -10.786 -26.429 -8.411 308 H ALA 107 H ALA 107 -9.504 -27.195 -6.306 309 HA ALA 107 HA ALA 107 -10.982 -26.959 -4.010 310 HB1 ALA 107 HB1 ALA 107 -9.739 -28.928 -3.237 311 HB2 ALA 107 HB2 ALA 107 -10.079 -29.068 -4.965 312 HB3 ALA 107 HB3 ALA 107 -8.449 -28.624 -4.420 313 H TYR 108 H TYR 108 -7.483 -26.204 -4.375 314 HA TYR 108 HA TYR 108 -6.978 -25.349 -1.708 315 HB2 TYR 108 HB2 TYR 108 -5.146 -25.784 -3.153 316 HB3 TYR 108 HB3 TYR 108 -5.733 -24.695 -4.388 317 HD1 TYR 108 HD2 TYR 108 -4.248 -24.814 -0.974 318 HD2 TYR 108 HD1 TYR 108 -5.220 -22.353 -4.380 319 HE1 TYR 108 HE2 TYR 108 -2.832 -22.994 -0.053 320 HE2 TYR 108 HE1 TYR 108 -3.815 -20.516 -3.444 321 HH TYR 108 HH TYR 108 -2.029 -20.848 -0.347 322 H HIS 109 H HIS 109 -7.940 -23.369 -4.603 323 HA HIS 109 HA HIS 109 -8.141 -20.938 -3.103 324 HB2 HIS 109 HB2 HIS 109 -9.321 -21.781 -5.768 325 HB3 HIS 109 HB3 HIS 109 -9.585 -20.180 -5.082 326 HD1 HIS 109 HD1 HIS 109 -7.049 -18.920 -4.326 327 HD2 HIS 109 HD2 HIS 109 -7.290 -21.820 -7.375 328 HE1 HIS 109 HE1 HIS 109 -4.955 -18.598 -5.791 329 HE2 HIS 109 HE2 HIS 109 -5.105 -20.368 -7.660 330 H ALA 110 H ALA 110 -10.633 -23.477 -3.607 331 HA ALA 110 HA ALA 110 -12.726 -22.029 -2.292 332 HB1 ALA 110 HB1 ALA 110 -13.743 -24.241 -1.995 333 HB2 ALA 110 HB2 ALA 110 -13.113 -24.051 -3.639 334 HB3 ALA 110 HB3 ALA 110 -12.222 -25.030 -2.455 335 H ALA 111 H ALA 111 -10.242 -24.315 -0.958 336 HA ALA 111 HA ALA 111 -11.090 -24.207 1.673 337 HB1 ALA 111 HB1 ALA 111 -8.290 -24.633 0.563 338 HB2 ALA 111 HB2 ALA 111 -8.862 -25.161 2.160 339 HB3 ALA 111 HB3 ALA 111 -9.558 -25.882 0.691 340 H THR 112 H THR 112 -8.859 -22.005 -0.022 341 HA THR 112 HA THR 112 -8.248 -20.488 2.418 342 HB THR 112 HB THR 112 -7.021 -18.956 0.948 343 HG1 THR 112 HG1 THR 112 -6.819 -19.505 -1.236 344 HG21 THR 112 HG21 THR 112 -5.911 -20.999 1.839 345 HG22 THR 112 HG22 THR 112 -6.369 -21.880 0.368 346 HG23 THR 112 HG23 THR 112 -5.257 -20.503 0.270 347 H LEU 113 H LEU 113 -10.227 -19.746 -0.512 348 HA LEU 113 HA LEU 113 -10.910 -17.123 0.565 349 HB2 LEU 113 HB2 LEU 113 -12.022 -18.571 -1.863 350 HB3 LEU 113 HB3 LEU 113 -12.203 -16.861 -1.508 351 HG LEU 113 HG LEU 113 -9.570 -18.277 -2.073 352 HD11 LEU 113 HD11 LEU 113 -9.628 -17.052 -4.214 353 HD12 LEU 113 HD12 LEU 113 -11.023 -18.128 -4.052 354 HD13 LEU 113 HD13 LEU 113 -11.222 -16.381 -3.794 355 HD21 LEU 113 HD21 LEU 113 -9.181 -16.316 -0.646 356 HD22 LEU 113 HD22 LEU 113 -8.633 -15.984 -2.287 357 HD23 LEU 113 HD23 LEU 113 -10.178 -15.306 -1.721 358 H GLU 114 H GLU 114 -12.674 -20.165 0.236 359 HA GLU 114 HA GLU 114 -15.120 -18.954 1.392 360 HB2 GLU 114 HB2 GLU 114 -14.708 -21.786 0.394 361 HB3 GLU 114 HB3 GLU 114 -16.225 -21.070 0.899 362 HG2 GLU 114 HG2 GLU 114 -14.554 -20.220 -1.502 363 HG3 GLU 114 HG3 GLU 114 -16.069 -21.106 -1.533 364 H HIS 115 H HIS 115 -12.469 -19.659 2.899 365 HA HIS 115 HA HIS 115 -13.016 -21.596 4.871 366 HB2 HIS 115 HB2 HIS 115 -10.857 -20.192 4.217 367 HB3 HIS 115 HB3 HIS 115 -11.375 -19.128 5.516 368 HD1 HIS 115 HD1 HIS 115 -9.874 -22.522 4.799 369 HD2 HIS 115 HD2 HIS 115 -11.300 -20.254 8.067 370 HE1 HIS 115 HE1 HIS 115 -9.023 -23.712 6.947 371 HE2 HIS 115 HE2 HIS 115 -9.894 -22.308 8.927 372 H HIS 116 H HIS 116 -14.335 -18.406 4.659 373 HA HIS 116 HA HIS 116 -15.682 -18.665 7.322 374 HB2 HIS 116 HB2 HIS 116 -15.612 -16.219 7.476 375 HB3 HIS 116 HB3 HIS 116 -14.006 -16.903 7.338 376 HD1 HIS 116 HD1 HIS 116 -16.535 -14.911 5.203 377 HD2 HIS 116 HD2 HIS 116 -12.496 -16.155 5.285 378 HE1 HIS 116 HE1 HIS 116 -15.345 -13.671 3.272 379 HE2 HIS 116 HE2 HIS 116 -12.887 -14.438 3.329 380 H HIS 117 H HIS 117 -16.674 -19.750 4.755 381 HA HIS 117 HA HIS 117 -18.672 -18.090 3.581 382 HB2 HIS 117 HB2 HIS 117 -17.677 -20.178 2.619 383 HB3 HIS 117 HB3 HIS 117 -18.614 -21.134 3.759 384 HD1 HIS 117 HD1 HIS 117 -18.866 -19.269 0.466 385 HD2 HIS 117 HD2 HIS 117 -21.307 -21.328 3.241 386 HE1 HIS 117 HE1 HIS 117 -21.132 -19.662 -0.698 387 HE2 HIS 117 HE2 HIS 117 -22.607 -20.936 1.000 388 H HIS 118 H HIS 118 -20.937 -17.995 3.806 389 HA HIS 118 HA HIS 118 -21.837 -17.845 6.518 390 HB2 HIS 118 HB2 HIS 118 -24.018 -17.136 5.483 391 HB3 HIS 118 HB3 HIS 118 -22.609 -16.224 4.988 392 HD1 HIS 118 HD1 HIS 118 -25.163 -18.733 3.505 393 HD2 HIS 118 HD2 HIS 118 -21.999 -16.125 2.435 394 HE1 HIS 118 HE1 HIS 118 -25.194 -18.553 0.946 395 HE2 HIS 118 HE2 HIS 118 -23.268 -16.965 0.293 396 H HIS 119 H HIS 119 -23.274 -18.996 7.733 397 HA HIS 119 HA HIS 119 -23.588 -21.832 7.031 398 HB2 HIS 119 HB2 HIS 119 -24.278 -22.148 9.307 399 HB3 HIS 119 HB3 HIS 119 -22.845 -21.140 9.270 400 HD1 HIS 119 HD1 HIS 119 -26.587 -20.958 10.161 401 HD2 HIS 119 HD2 HIS 119 -23.043 -18.653 10.266 402 HE1 HIS 119 HE1 HIS 119 -27.112 -18.882 11.586 403 HE2 HIS 119 HE2 HIS 119 -24.945 -17.485 11.651 404 H HIS 120 H HIS 120 -25.729 -19.063 7.098 405 HA HIS 120 HA HIS 120 -28.184 -20.647 6.727 406 HB2 HIS 120 HB2 HIS 120 -28.052 -18.421 7.957 407 HB3 HIS 120 HB3 HIS 120 -27.771 -17.655 6.390 408 HD1 HIS 120 HD1 HIS 120 -30.060 -19.625 4.944 409 HD2 HIS 120 HD2 HIS 120 -30.362 -17.104 8.312 410 HE1 HIS 120 HE1 HIS 120 -32.578 -19.027 5.189 411 HE2 HIS 120 HE2 HIS 120 -32.742 -17.485 7.253 Start of MODEL 5 1 H1 SER 66 H1 SER 66 -2.431 -1.250 -15.158 2 H2 SER 66 H2 SER 66 -3.943 -1.418 -14.549 3 H3 SER 66 H3 SER 66 -2.665 -1.264 -13.533 4 HA SER 66 HA SER 66 -3.178 -3.531 -15.348 5 HB2 SER 66 HB2 SER 66 -0.883 -3.183 -13.367 6 HB3 SER 66 HB3 SER 66 -1.199 -4.607 -14.382 7 HG SER 66 HG SER 66 0.340 -3.205 -15.353 8 H GLY 67 H GLY 67 -3.764 -5.527 -14.336 9 HA2 GLY 67 HA2 GLY 67 -5.524 -5.280 -12.043 10 HA3 GLY 67 HA3 GLY 67 -5.133 -6.745 -12.932 11 H SER 68 H SER 68 -5.479 -6.820 -10.222 12 HA SER 68 HA SER 68 -2.928 -6.750 -8.794 13 HB2 SER 68 HB2 SER 68 -4.267 -7.615 -6.903 14 HB3 SER 68 HB3 SER 68 -4.933 -6.133 -7.614 15 HG SER 68 HG SER 68 -6.563 -7.727 -7.228 16 H GLY 69 H GLY 69 -2.078 -8.600 -7.613 17 HA2 GLY 69 HA2 GLY 69 -2.701 -11.321 -8.171 18 HA3 GLY 69 HA3 GLY 69 -1.399 -10.809 -9.250 19 H ARG 70 H ARG 70 -0.667 -12.771 -7.745 20 HA ARG 70 HA ARG 70 0.341 -12.099 -5.098 21 HB2 ARG 70 HB2 ARG 70 -0.368 -14.385 -5.846 22 HB3 ARG 70 HB3 ARG 70 1.032 -14.451 -6.915 23 HG2 ARG 70 HG2 ARG 70 2.531 -14.241 -4.902 24 HG3 ARG 70 HG3 ARG 70 1.099 -14.210 -3.862 25 HD2 ARG 70 HD2 ARG 70 0.467 -16.450 -4.609 26 HD3 ARG 70 HD3 ARG 70 1.796 -16.477 -5.775 27 HE ARG 70 HE ARG 70 3.394 -16.376 -3.866 28 HH11 ARG 70 HH11 ARG 70 0.211 -17.698 -3.120 29 HH12 ARG 70 HH12 ARG 70 0.737 -18.234 -1.544 30 HH21 ARG 70 HH21 ARG 70 4.031 -17.281 -2.053 31 HH22 ARG 70 HH22 ARG 70 2.894 -18.085 -0.976 32 H GLY 71 H GLY 71 2.387 -11.537 -4.445 33 HA2 GLY 71 HA2 GLY 71 4.517 -10.649 -4.535 34 HA3 GLY 71 HA3 GLY 71 4.799 -11.732 -5.897 35 H ARG 72 H ARG 72 5.627 -10.643 -7.542 36 HA ARG 72 HA ARG 72 4.910 -7.813 -8.119 37 HB2 ARG 72 HB2 ARG 72 7.092 -9.598 -9.266 38 HB3 ARG 72 HB3 ARG 72 6.843 -7.894 -9.670 39 HG2 ARG 72 HG2 ARG 72 7.181 -7.263 -7.293 40 HG3 ARG 72 HG3 ARG 72 7.550 -8.948 -6.896 41 HD2 ARG 72 HD2 ARG 72 9.085 -7.218 -8.885 42 HD3 ARG 72 HD3 ARG 72 9.583 -7.531 -7.231 43 HE ARG 72 HE ARG 72 9.747 -9.357 -9.528 44 HH11 ARG 72 HH21 ARG 72 9.969 -9.220 -6.025 45 HH12 ARG 72 HH22 ARG 72 10.850 -10.721 -5.938 46 HH21 ARG 72 HH11 ARG 72 10.864 -11.259 -9.333 47 HH22 ARG 72 HH12 ARG 72 11.348 -11.836 -7.767 48 H GLY 73 H GLY 73 3.220 -10.361 -8.781 49 HA2 GLY 73 HA2 GLY 73 1.531 -10.644 -10.361 50 HA3 GLY 73 HA3 GLY 73 2.276 -9.447 -11.424 51 H ALA 74 H ALA 74 4.645 -11.642 -10.474 52 HA ALA 74 HA ALA 74 4.016 -13.778 -12.403 53 HB1 ALA 74 HB1 ALA 74 5.329 -12.151 -13.727 54 HB2 ALA 74 HB2 ALA 74 6.601 -12.155 -12.490 55 HB3 ALA 74 HB3 ALA 74 6.267 -13.626 -13.426 56 H ILE 75 H ILE 75 4.929 -15.743 -11.900 57 HA ILE 75 HA ILE 75 6.255 -15.975 -9.235 58 HB ILE 75 HB ILE 75 3.774 -17.390 -10.255 59 HG12 ILE 75 HG12 ILE 75 3.306 -15.190 -9.264 60 HG13 ILE 75 HG13 ILE 75 2.623 -16.498 -8.328 61 HG21 ILE 75 HG21 ILE 75 5.403 -18.090 -7.782 62 HG22 ILE 75 HG22 ILE 75 3.725 -18.614 -8.074 63 HG23 ILE 75 HG23 ILE 75 4.993 -19.145 -9.158 64 HD11 ILE 75 HD11 ILE 75 3.595 -14.699 -6.931 65 HD12 ILE 75 HD12 ILE 75 4.352 -16.262 -6.606 66 HD13 ILE 75 HD13 ILE 75 5.197 -15.032 -7.575 67 H ASP 76 H ASP 76 7.817 -17.402 -9.054 68 HA ASP 76 HA ASP 76 8.237 -19.453 -11.191 69 HB2 ASP 76 HB2 ASP 76 10.115 -17.944 -11.023 70 HB3 ASP 76 HB3 ASP 76 10.232 -18.215 -9.277 71 H ARG 77 H ARG 77 6.597 -20.707 -10.314 72 HA ARG 77 HA ARG 77 5.703 -22.479 -9.222 73 HB2 ARG 77 HB2 ARG 77 8.636 -22.984 -8.585 74 HB3 ARG 77 HB3 ARG 77 7.371 -24.208 -8.488 75 HG2 ARG 77 HG2 ARG 77 7.049 -24.292 -10.820 76 HG3 ARG 77 HG3 ARG 77 7.894 -22.767 -11.122 77 HD2 ARG 77 HD2 ARG 77 9.254 -25.240 -9.999 78 HD3 ARG 77 HD3 ARG 77 9.197 -24.835 -11.726 79 HE ARG 77 HE ARG 77 10.212 -22.533 -10.832 80 HH11 ARG 77 HH11 ARG 77 11.334 -25.769 -10.046 81 HH12 ARG 77 HH12 ARG 77 12.925 -25.188 -9.635 82 HH21 ARG 77 HH21 ARG 77 12.118 -21.859 -10.212 83 HH22 ARG 77 HH22 ARG 77 13.376 -22.992 -9.748 84 H GLU 78 H GLU 78 7.140 -20.276 -7.042 85 HA GLU 78 HA GLU 78 6.901 -21.471 -4.578 86 HB2 GLU 78 HB2 GLU 78 7.634 -19.129 -5.056 87 HB3 GLU 78 HB3 GLU 78 5.945 -18.657 -5.251 88 HG2 GLU 78 HG2 GLU 78 5.561 -19.458 -2.851 89 HG3 GLU 78 HG3 GLU 78 7.309 -19.671 -2.717 90 H GLN 79 H GLN 79 4.147 -19.968 -6.318 91 HA GLN 79 HA GLN 79 2.157 -20.633 -4.345 92 HB2 GLN 79 HB2 GLN 79 1.878 -18.845 -6.005 93 HB3 GLN 79 HB3 GLN 79 1.954 -20.012 -7.328 94 HG2 GLN 79 HG2 GLN 79 -0.332 -19.319 -6.955 95 HG3 GLN 79 HG3 GLN 79 -0.155 -21.034 -6.615 96 HE21 GLN 79 HE22 GLN 79 -0.283 -21.724 -4.295 97 HE22 GLN 79 HE21 GLN 79 -1.072 -20.636 -3.149 98 H SER 80 H SER 80 3.280 -22.359 -7.276 99 HA SER 80 HA SER 80 1.394 -24.519 -7.162 100 HB2 SER 80 HB2 SER 80 4.171 -24.261 -8.378 101 HB3 SER 80 HB3 SER 80 3.082 -25.653 -8.645 102 HG SER 80 HG SER 80 2.856 -24.040 -10.293 103 H ALA 81 H ALA 81 4.734 -24.214 -5.805 104 HA ALA 81 HA ALA 81 4.816 -26.721 -4.557 105 HB1 ALA 81 HB1 ALA 81 6.605 -25.701 -3.194 106 HB2 ALA 81 HB2 ALA 81 6.767 -25.263 -4.905 107 HB3 ALA 81 HB3 ALA 81 6.111 -24.084 -3.748 108 H ALA 82 H ALA 82 3.589 -23.564 -3.267 109 HA ALA 82 HA ALA 82 2.772 -24.544 -0.739 110 HB1 ALA 82 HB1 ALA 82 1.551 -22.309 -2.413 111 HB2 ALA 82 HB2 ALA 82 1.346 -22.547 -0.669 112 HB3 ALA 82 HB3 ALA 82 2.949 -22.156 -1.323 113 H ILE 83 H ILE 83 0.999 -24.628 -3.869 114 HA ILE 83 HA ILE 83 -1.418 -25.787 -2.760 115 HB ILE 83 HB ILE 83 -0.320 -25.713 -5.594 116 HG12 ILE 83 HG12 ILE 83 -2.695 -24.273 -4.383 117 HG13 ILE 83 HG13 ILE 83 -1.098 -23.566 -4.341 118 HG21 ILE 83 HG21 ILE 83 -1.815 -27.670 -5.428 119 HG22 ILE 83 HG22 ILE 83 -3.044 -26.696 -4.599 120 HG23 ILE 83 HG23 ILE 83 -2.649 -26.383 -6.295 121 HD11 ILE 83 HD11 ILE 83 -2.274 -22.612 -6.188 122 HD12 ILE 83 HD12 ILE 83 -1.025 -23.687 -6.860 123 HD13 ILE 83 HD13 ILE 83 -2.733 -24.198 -6.811 124 H ARG 84 H ARG 84 1.527 -27.265 -4.197 125 HA ARG 84 HA ARG 84 0.652 -29.992 -3.920 126 HB2 ARG 84 HB2 ARG 84 2.569 -29.214 -5.330 127 HB3 ARG 84 HB3 ARG 84 3.498 -28.864 -3.869 128 HG2 ARG 84 HG2 ARG 84 3.382 -31.277 -3.232 129 HG3 ARG 84 HG3 ARG 84 2.449 -31.610 -4.706 130 HD2 ARG 84 HD2 ARG 84 4.344 -30.901 -6.097 131 HD3 ARG 84 HD3 ARG 84 5.257 -30.440 -4.643 132 HE ARG 84 HE ARG 84 4.443 -33.188 -4.444 133 HH11 ARG 84 HH11 ARG 84 6.813 -31.255 -6.159 134 HH12 ARG 84 HH12 ARG 84 7.945 -32.573 -6.270 135 HH21 ARG 84 HH21 ARG 84 5.949 -34.823 -4.590 136 HH22 ARG 84 HH22 ARG 84 7.456 -34.541 -5.403 137 H GLU 85 H GLU 85 2.616 -28.004 -1.650 138 HA GLU 85 HA GLU 85 2.735 -29.887 0.415 139 HB2 GLU 85 HB2 GLU 85 2.780 -26.852 0.452 140 HB3 GLU 85 HB3 GLU 85 2.986 -27.825 1.910 141 HG2 GLU 85 HG2 GLU 85 4.917 -28.978 0.923 142 HG3 GLU 85 HG3 GLU 85 4.771 -28.018 -0.550 143 H TRP 86 H TRP 86 0.238 -27.288 -0.049 144 HA TRP 86 HA TRP 86 -1.401 -27.947 2.083 145 HB2 TRP 86 HB2 TRP 86 -1.741 -25.939 0.818 146 HB3 TRP 86 HB3 TRP 86 -2.028 -26.839 -0.664 147 HD1 TRP 86 HD1 TRP 86 -3.751 -25.860 2.600 148 HE1 TRP 86 HE1 TRP 86 -6.276 -26.309 2.414 149 HE3 TRP 86 HE3 TRP 86 -3.844 -28.147 -1.992 150 HZ2 TRP 86 HZ2 TRP 86 -8.066 -27.666 0.601 151 HZ3 TRP 86 HZ3 TRP 86 -5.981 -28.979 -2.933 152 HH2 TRP 86 HH2 TRP 86 -8.091 -28.770 -1.627 153 H ALA 87 H ALA 87 -1.545 -29.301 -1.254 154 HA ALA 87 HA ALA 87 -3.737 -31.048 -0.794 155 HB1 ALA 87 HB1 ALA 87 -2.938 -30.411 -3.033 156 HB2 ALA 87 HB2 ALA 87 -1.400 -31.247 -2.752 157 HB3 ALA 87 HB3 ALA 87 -2.908 -32.178 -2.862 158 H ARG 88 H ARG 88 -0.204 -31.679 -0.503 159 HA ARG 88 HA ARG 88 -0.376 -34.390 0.373 160 HB2 ARG 88 HB2 ARG 88 1.662 -33.229 -0.458 161 HB3 ARG 88 HB3 ARG 88 1.736 -32.287 1.038 162 HG2 ARG 88 HG2 ARG 88 2.002 -34.394 2.344 163 HG3 ARG 88 HG3 ARG 88 1.912 -35.334 0.839 164 HD2 ARG 88 HD2 ARG 88 3.940 -34.178 0.005 165 HD3 ARG 88 HD3 ARG 88 4.014 -33.230 1.512 166 HE ARG 88 HE ARG 88 3.949 -36.010 2.169 167 HH11 ARG 88 HH11 ARG 88 6.217 -33.716 0.798 168 HH12 ARG 88 HH12 ARG 88 7.606 -34.614 1.356 169 HH21 ARG 88 HH21 ARG 88 5.762 -37.112 2.842 170 HH22 ARG 88 HH22 ARG 88 7.343 -36.491 2.478 171 H ARG 89 H ARG 89 -0.288 -31.394 2.342 172 HA ARG 89 HA ARG 89 -0.489 -32.686 4.908 173 HB2 ARG 89 HB2 ARG 89 -1.142 -29.876 3.935 174 HB3 ARG 89 HB3 ARG 89 -1.303 -30.362 5.625 175 HG2 ARG 89 HG2 ARG 89 1.070 -30.914 5.780 176 HG3 ARG 89 HG3 ARG 89 1.302 -30.644 4.057 177 HD2 ARG 89 HD2 ARG 89 2.136 -28.726 5.218 178 HD3 ARG 89 HD3 ARG 89 0.664 -28.257 4.347 179 HE ARG 89 HE ARG 89 0.060 -29.054 7.062 180 HH11 ARG 89 HH21 ARG 89 1.469 -26.330 5.360 181 HH12 ARG 89 HH22 ARG 89 1.028 -25.201 6.608 182 HH21 ARG 89 HH11 ARG 89 -0.504 -27.552 8.606 183 HH22 ARG 89 HH12 ARG 89 -0.065 -25.880 8.396 184 H ASN 90 H ASN 90 -3.007 -31.811 2.606 185 HA ASN 90 HA ASN 90 -5.143 -32.640 4.502 186 HB2 ASN 90 HB2 ASN 90 -5.171 -31.363 1.744 187 HB3 ASN 90 HB3 ASN 90 -6.619 -31.956 2.546 188 HD21 ASN 90 HD22 ASN 90 -4.087 -29.492 2.729 189 HD22 ASN 90 HD21 ASN 90 -4.952 -28.500 3.897 190 H GLY 91 H GLY 91 -3.061 -34.423 2.667 191 HA2 GLY 91 HA2 GLY 91 -3.081 -36.630 2.053 192 HA3 GLY 91 HA3 GLY 91 -4.679 -36.800 2.778 193 H HIS 92 H HIS 92 -4.259 -34.420 0.240 194 HA HIS 92 HA HIS 92 -6.116 -35.923 -1.537 195 HB2 HIS 92 HB2 HIS 92 -5.012 -33.090 -1.759 196 HB3 HIS 92 HB3 HIS 92 -6.267 -33.789 -2.768 197 HD1 HIS 92 HD1 HIS 92 -7.794 -35.054 0.031 198 HD2 HIS 92 HD2 HIS 92 -6.729 -31.122 -1.088 199 HE1 HIS 92 HE1 HIS 92 -9.395 -33.484 1.286 200 HE2 HIS 92 HE2 HIS 92 -8.746 -31.086 0.605 201 H ASN 93 H ASN 93 -5.694 -36.332 -3.732 202 HA ASN 93 HA ASN 93 -2.977 -37.100 -4.381 203 HB2 ASN 93 HB2 ASN 93 -4.984 -38.331 -5.178 204 HB3 ASN 93 HB3 ASN 93 -5.475 -36.925 -6.124 205 HD21 ASN 93 HD22 ASN 93 -2.992 -39.482 -5.830 206 HD22 ASN 93 HD21 ASN 93 -2.413 -39.296 -7.476 207 H VAL 94 H VAL 94 -1.445 -36.101 -5.603 208 HA VAL 94 HA VAL 94 -2.052 -33.811 -7.320 209 HB VAL 94 HB VAL 94 -1.792 -32.699 -5.171 210 HG11 VAL 94 HG11 VAL 94 0.317 -32.625 -3.945 211 HG12 VAL 94 HG12 VAL 94 -0.300 -34.274 -3.986 212 HG13 VAL 94 HG13 VAL 94 1.043 -33.805 -5.056 213 HG21 VAL 94 HG21 VAL 94 -0.215 -31.019 -5.816 214 HG22 VAL 94 HG22 VAL 94 0.644 -32.126 -6.898 215 HG23 VAL 94 HG23 VAL 94 -1.019 -31.609 -7.277 216 H SER 95 H SER 95 -0.682 -33.576 -8.978 217 HA SER 95 HA SER 95 0.829 -35.793 -9.797 218 HB2 SER 95 HB2 SER 95 0.852 -32.934 -10.822 219 HB3 SER 95 HB3 SER 95 1.426 -34.366 -11.713 220 HG SER 95 HG SER 95 -0.697 -33.948 -12.337 221 H THR 96 H THR 96 2.938 -36.367 -9.720 222 HA THR 96 HA THR 96 4.863 -34.786 -8.148 223 HB THR 96 HB THR 96 6.315 -36.790 -8.477 224 HG1 THR 96 HG1 THR 96 5.341 -38.607 -9.453 225 HG21 THR 96 HG21 THR 96 4.758 -36.654 -6.544 226 HG22 THR 96 HG22 THR 96 3.502 -37.474 -7.503 227 HG23 THR 96 HG23 THR 96 5.011 -38.318 -7.085 228 H ARG 97 H ARG 97 4.206 -35.285 -11.499 229 HA ARG 97 HA ARG 97 6.561 -33.615 -12.310 230 HB2 ARG 97 HB2 ARG 97 5.419 -36.038 -13.774 231 HB3 ARG 97 HB3 ARG 97 6.616 -34.950 -14.445 232 HG2 ARG 97 HG2 ARG 97 7.096 -36.690 -11.976 233 HG3 ARG 97 HG3 ARG 97 7.485 -37.138 -13.633 234 HD2 ARG 97 HD2 ARG 97 9.512 -36.397 -12.737 235 HD3 ARG 97 HD3 ARG 97 8.954 -35.088 -13.795 236 HE ARG 97 HE ARG 97 8.117 -34.739 -11.020 237 HH11 ARG 97 HH11 ARG 97 10.962 -34.292 -13.030 238 HH12 ARG 97 HH12 ARG 97 11.591 -33.035 -12.000 239 HH21 ARG 97 HH21 ARG 97 8.929 -33.136 -9.801 240 HH22 ARG 97 HH22 ARG 97 10.459 -32.394 -10.199 241 H GLY 98 H GLY 98 6.211 -32.312 -14.164 242 HA2 GLY 98 HA2 GLY 98 5.003 -30.915 -15.565 243 HA3 GLY 98 HA3 GLY 98 3.687 -32.081 -15.519 244 H ARG 99 H ARG 99 2.328 -30.193 -15.613 245 HA ARG 99 HA ARG 99 2.222 -28.254 -13.442 246 HB2 ARG 99 HB2 ARG 99 1.664 -27.847 -15.877 247 HB3 ARG 99 HB3 ARG 99 0.187 -28.787 -15.649 248 HG2 ARG 99 HG2 ARG 99 -0.584 -27.125 -13.950 249 HG3 ARG 99 HG3 ARG 99 0.929 -26.221 -14.168 250 HD2 ARG 99 HD2 ARG 99 0.361 -25.874 -16.557 251 HD3 ARG 99 HD3 ARG 99 -1.152 -26.773 -16.325 252 HE ARG 99 HE ARG 99 -1.030 -24.637 -14.424 253 HH11 ARG 99 HH11 ARG 99 -1.510 -25.050 -17.870 254 HH12 ARG 99 HH12 ARG 99 -2.431 -23.576 -18.014 255 HH21 ARG 99 HH21 ARG 99 -2.212 -22.758 -14.679 256 HH22 ARG 99 HH22 ARG 99 -2.805 -22.313 -16.249 257 H ILE 100 H ILE 100 0.670 -28.004 -11.847 258 HA ILE 100 HA ILE 100 -0.564 -30.370 -10.722 259 HB ILE 100 HB ILE 100 -0.729 -27.426 -10.016 260 HG12 ILE 100 HG12 ILE 100 0.679 -29.846 -8.783 261 HG13 ILE 100 HG13 ILE 100 1.447 -28.531 -9.670 262 HG21 ILE 100 HG21 ILE 100 -2.857 -28.536 -9.277 263 HG22 ILE 100 HG22 ILE 100 -1.888 -29.720 -8.370 264 HG23 ILE 100 HG23 ILE 100 -1.866 -28.000 -7.947 265 HD11 ILE 100 HD11 ILE 100 0.164 -28.390 -6.925 266 HD12 ILE 100 HD12 ILE 100 1.856 -28.152 -7.374 267 HD13 ILE 100 HD13 ILE 100 0.646 -26.948 -7.865 268 HA PRO 101 HA PRO 101 -4.343 -30.236 -13.096 269 HB2 PRO 101 HB2 PRO 101 -5.817 -31.415 -10.784 270 HB3 PRO 101 HB3 PRO 101 -5.629 -32.046 -12.440 271 HG2 PRO 101 HG2 PRO 101 -4.292 -33.134 -10.316 272 HG3 PRO 101 HG3 PRO 101 -3.530 -33.008 -11.940 273 HD2 PRO 101 HD2 PRO 101 -3.182 -31.202 -9.544 274 HD3 PRO 101 HD3 PRO 101 -1.947 -31.880 -10.653 275 H ALA 102 H ALA 102 -5.943 -28.739 -13.443 276 HA ALA 102 HA ALA 102 -6.186 -26.500 -11.809 277 HB1 ALA 102 HB1 ALA 102 -6.668 -26.565 -14.208 278 HB2 ALA 102 HB2 ALA 102 -8.161 -27.497 -13.877 279 HB3 ALA 102 HB3 ALA 102 -7.978 -25.827 -13.263 280 H ASP 103 H ASP 103 -8.167 -29.456 -11.744 281 HA ASP 103 HA ASP 103 -10.194 -28.607 -10.059 282 HB2 ASP 103 HB2 ASP 103 -8.817 -31.311 -10.263 283 HB3 ASP 103 HB3 ASP 103 -10.313 -31.033 -9.377 284 H VAL 104 H VAL 104 -6.865 -29.591 -9.215 285 HA VAL 104 HA VAL 104 -7.337 -29.515 -6.359 286 HB VAL 104 HB VAL 104 -4.691 -29.612 -7.770 287 HG11 VAL 104 HG11 VAL 104 -5.475 -30.459 -4.958 288 HG12 VAL 104 HG12 VAL 104 -3.875 -30.683 -5.695 289 HG13 VAL 104 HG13 VAL 104 -4.478 -29.054 -5.392 290 HG21 VAL 104 HG21 VAL 104 -6.394 -31.953 -6.810 291 HG22 VAL 104 HG22 VAL 104 -6.022 -31.574 -8.502 292 HG23 VAL 104 HG23 VAL 104 -4.725 -32.072 -7.417 293 H ILE 105 H ILE 105 -5.904 -27.350 -8.815 294 HA ILE 105 HA ILE 105 -5.105 -25.234 -7.034 295 HB ILE 105 HB ILE 105 -5.984 -25.329 -9.949 296 HG12 ILE 105 HG12 ILE 105 -3.206 -24.583 -8.990 297 HG13 ILE 105 HG13 ILE 105 -3.666 -26.272 -8.844 298 HG21 ILE 105 HG21 ILE 105 -4.968 -23.031 -10.164 299 HG22 ILE 105 HG22 ILE 105 -6.482 -23.063 -9.265 300 HG23 ILE 105 HG23 ILE 105 -4.932 -22.926 -8.391 301 HD11 ILE 105 HD11 ILE 105 -4.112 -26.452 -11.193 302 HD12 ILE 105 HD12 ILE 105 -3.814 -24.713 -11.448 303 HD13 ILE 105 HD13 ILE 105 -2.487 -25.785 -10.953 304 H ASP 106 H ASP 106 -8.259 -25.782 -8.731 305 HA ASP 106 HA ASP 106 -9.650 -23.714 -7.501 306 HB2 ASP 106 HB2 ASP 106 -10.436 -24.943 -9.463 307 HB3 ASP 106 HB3 ASP 106 -10.639 -26.404 -8.488 308 H ALA 107 H ALA 107 -9.337 -27.157 -6.417 309 HA ALA 107 HA ALA 107 -10.812 -27.014 -4.112 310 HB1 ALA 107 HB1 ALA 107 -9.498 -28.980 -3.396 311 HB2 ALA 107 HB2 ALA 107 -9.858 -29.083 -5.120 312 HB3 ALA 107 HB3 ALA 107 -8.233 -28.602 -4.589 313 H TYR 108 H TYR 108 -7.333 -26.201 -4.462 314 HA TYR 108 HA TYR 108 -6.816 -25.401 -1.777 315 HB2 TYR 108 HB2 TYR 108 -5.012 -25.786 -3.280 316 HB3 TYR 108 HB3 TYR 108 -5.632 -24.661 -4.467 317 HD1 TYR 108 HD2 TYR 108 -3.980 -24.917 -1.152 318 HD2 TYR 108 HD1 TYR 108 -5.170 -22.308 -4.376 319 HE1 TYR 108 HE2 TYR 108 -2.456 -23.156 -0.281 320 HE2 TYR 108 HE1 TYR 108 -3.656 -20.537 -3.496 321 HH TYR 108 HH TYR 108 -1.643 -21.007 -0.567 322 H HIS 109 H HIS 109 -7.831 -23.372 -4.613 323 HA HIS 109 HA HIS 109 -8.065 -20.971 -3.068 324 HB2 HIS 109 HB2 HIS 109 -9.304 -21.806 -5.704 325 HB3 HIS 109 HB3 HIS 109 -9.633 -20.241 -4.957 326 HD1 HIS 109 HD1 HIS 109 -7.171 -18.840 -4.276 327 HD2 HIS 109 HD2 HIS 109 -7.306 -21.692 -7.378 328 HE1 HIS 109 HE1 HIS 109 -5.138 -18.360 -5.781 329 HE2 HIS 109 HE2 HIS 109 -5.234 -20.085 -7.688 330 H ALA 110 H ALA 110 -10.541 -23.517 -3.650 331 HA ALA 110 HA ALA 110 -12.665 -22.158 -2.377 332 HB1 ALA 110 HB1 ALA 110 -12.941 -24.204 -3.723 333 HB2 ALA 110 HB2 ALA 110 -12.081 -25.151 -2.492 334 HB3 ALA 110 HB3 ALA 110 -13.641 -24.403 -2.105 335 H ALA 111 H ALA 111 -10.167 -24.359 -0.940 336 HA ALA 111 HA ALA 111 -11.099 -24.195 1.676 337 HB1 ALA 111 HB1 ALA 111 -8.289 -24.730 0.636 338 HB2 ALA 111 HB2 ALA 111 -8.900 -25.147 2.250 339 HB3 ALA 111 HB3 ALA 111 -9.599 -25.929 0.815 340 H THR 112 H THR 112 -8.676 -22.125 -0.009 341 HA THR 112 HA THR 112 -8.072 -20.598 2.398 342 HB THR 112 HB THR 112 -6.811 -19.098 0.944 343 HG1 THR 112 HG1 THR 112 -6.659 -19.550 -1.245 344 HG21 THR 112 HG21 THR 112 -5.741 -21.173 1.778 345 HG22 THR 112 HG22 THR 112 -6.256 -22.030 0.311 346 HG23 THR 112 HG23 THR 112 -5.111 -20.686 0.198 347 H LEU 113 H LEU 113 -10.382 -20.055 -0.289 348 HA LEU 113 HA LEU 113 -11.027 -17.381 0.621 349 HB2 LEU 113 HB2 LEU 113 -11.096 -17.992 -1.742 350 HB3 LEU 113 HB3 LEU 113 -12.270 -19.270 -1.409 351 HG LEU 113 HG LEU 113 -13.937 -17.644 -0.734 352 HD11 LEU 113 HD11 LEU 113 -13.610 -15.216 -1.236 353 HD12 LEU 113 HD12 LEU 113 -12.573 -15.772 0.076 354 HD13 LEU 113 HD13 LEU 113 -11.888 -15.535 -1.550 355 HD21 LEU 113 HD21 LEU 113 -13.815 -18.383 -3.079 356 HD22 LEU 113 HD22 LEU 113 -14.396 -16.710 -2.969 357 HD23 LEU 113 HD23 LEU 113 -12.715 -17.039 -3.454 358 H GLU 114 H GLU 114 -12.825 -20.485 0.619 359 HA GLU 114 HA GLU 114 -15.044 -19.252 2.066 360 HB2 GLU 114 HB2 GLU 114 -14.641 -22.142 1.206 361 HB3 GLU 114 HB3 GLU 114 -16.084 -21.471 1.948 362 HG2 GLU 114 HG2 GLU 114 -16.200 -19.783 0.052 363 HG3 GLU 114 HG3 GLU 114 -14.908 -20.676 -0.743 364 H HIS 115 H HIS 115 -14.503 -18.632 4.102 365 HA HIS 115 HA HIS 115 -12.916 -20.294 5.886 366 HB2 HIS 115 HB2 HIS 115 -14.346 -17.630 6.176 367 HB3 HIS 115 HB3 HIS 115 -13.563 -18.415 7.533 368 HD1 HIS 115 HD1 HIS 115 -12.387 -17.356 3.929 369 HD2 HIS 115 HD2 HIS 115 -11.110 -17.851 7.935 370 HE1 HIS 115 HE1 HIS 115 -9.949 -16.548 4.027 371 HE2 HIS 115 HE2 HIS 115 -9.175 -16.852 6.466 372 H HIS 116 H HIS 116 -16.173 -20.592 5.133 373 HA HIS 116 HA HIS 116 -17.062 -21.567 7.754 374 HB2 HIS 116 HB2 HIS 116 -19.191 -21.857 6.767 375 HB3 HIS 116 HB3 HIS 116 -18.551 -20.350 6.147 376 HD1 HIS 116 HD1 HIS 116 -19.416 -23.921 5.005 377 HD2 HIS 116 HD2 HIS 116 -18.139 -20.196 3.466 378 HE1 HIS 116 HE1 HIS 116 -19.536 -24.110 2.438 379 HE2 HIS 116 HE2 HIS 116 -18.684 -21.869 1.498 380 H HIS 117 H HIS 117 -15.072 -23.073 5.508 381 HA HIS 117 HA HIS 117 -16.269 -25.649 5.294 382 HB2 HIS 117 HB2 HIS 117 -14.208 -26.407 4.364 383 HB3 HIS 117 HB3 HIS 117 -14.519 -24.789 3.775 384 HD1 HIS 117 HD1 HIS 117 -12.642 -22.962 4.332 385 HD2 HIS 117 HD2 HIS 117 -12.131 -26.757 6.128 386 HE1 HIS 117 HE1 HIS 117 -10.269 -22.982 5.351 387 HE2 HIS 117 HE2 HIS 117 -9.970 -25.296 6.440 388 H HIS 118 H HIS 118 -15.769 -27.648 6.226 389 HA HIS 118 HA HIS 118 -15.795 -29.059 7.995 390 HB2 HIS 118 HB2 HIS 118 -13.359 -28.776 7.296 391 HB3 HIS 118 HB3 HIS 118 -13.133 -27.806 8.743 392 HD1 HIS 118 HD1 HIS 118 -13.229 -29.206 11.099 393 HD2 HIS 118 HD2 HIS 118 -13.690 -31.424 7.532 394 HE1 HIS 118 HE1 HIS 118 -12.938 -31.695 11.743 395 HE2 HIS 118 HE2 HIS 118 -13.236 -33.035 9.564 396 H HIS 119 H HIS 119 -17.477 -27.029 8.578 397 HA HIS 119 HA HIS 119 -17.106 -25.971 11.267 398 HB2 HIS 119 HB2 HIS 119 -18.495 -24.843 9.557 399 HB3 HIS 119 HB3 HIS 119 -19.605 -26.212 9.525 400 HD1 HIS 119 HD1 HIS 119 -18.535 -23.327 11.877 401 HD2 HIS 119 HD2 HIS 119 -21.467 -26.339 11.409 402 HE1 HIS 119 HE1 HIS 119 -20.331 -22.883 13.673 403 HE2 HIS 119 HE2 HIS 119 -22.120 -24.718 13.370 404 H HIS 120 H HIS 120 -18.222 -26.537 13.171 405 HA HIS 120 HA HIS 120 -19.671 -29.113 13.331 406 HB2 HIS 120 HB2 HIS 120 -17.324 -29.674 13.799 407 HB3 HIS 120 HB3 HIS 120 -17.245 -28.426 15.040 408 HD1 HIS 120 HD1 HIS 120 -18.586 -28.948 17.353 409 HD2 HIS 120 HD2 HIS 120 -18.553 -31.984 14.418 410 HE1 HIS 120 HE1 HIS 120 -19.381 -31.106 18.529 411 HE2 HIS 120 HE2 HIS 120 -19.356 -32.952 16.733 Start of MODEL 6 1 H1 SER 66 H1 SER 66 30.703 -22.543 -13.247 2 H2 SER 66 H2 SER 66 31.080 -21.246 -14.174 3 H3 SER 66 H3 SER 66 31.746 -21.410 -12.682 4 HA SER 66 HA SER 66 30.050 -19.741 -12.606 5 HB2 SER 66 HB2 SER 66 28.170 -21.932 -13.574 6 HB3 SER 66 HB3 SER 66 27.724 -20.268 -13.143 7 HG SER 66 HG SER 66 28.030 -20.511 -15.409 8 H GLY 67 H GLY 67 28.670 -19.427 -10.746 9 HA2 GLY 67 HA2 GLY 67 27.760 -21.491 -9.006 10 HA3 GLY 67 HA3 GLY 67 29.336 -20.943 -8.437 11 H SER 68 H SER 68 27.404 -20.645 -6.725 12 HA SER 68 HA SER 68 26.235 -19.296 -5.362 13 HB2 SER 68 HB2 SER 68 28.106 -17.144 -6.380 14 HB3 SER 68 HB3 SER 68 27.202 -17.127 -4.854 15 HG SER 68 HG SER 68 29.378 -17.857 -4.583 16 H GLY 69 H GLY 69 25.077 -19.455 -8.108 17 HA2 GLY 69 HA2 GLY 69 23.680 -16.923 -8.563 18 HA3 GLY 69 HA3 GLY 69 23.399 -18.449 -9.392 19 H ARG 70 H ARG 70 21.388 -16.746 -8.621 20 HA ARG 70 HA ARG 70 19.329 -16.570 -7.682 21 HB2 ARG 70 HB2 ARG 70 19.647 -19.554 -7.157 22 HB3 ARG 70 HB3 ARG 70 18.146 -18.656 -7.021 23 HG2 ARG 70 HG2 ARG 70 18.235 -18.073 -9.420 24 HG3 ARG 70 HG3 ARG 70 19.763 -18.945 -9.585 25 HD2 ARG 70 HD2 ARG 70 17.926 -20.344 -10.382 26 HD3 ARG 70 HD3 ARG 70 18.685 -21.055 -8.963 27 HE ARG 70 HE ARG 70 16.730 -20.794 -7.746 28 HH11 ARG 70 HH11 ARG 70 16.240 -18.944 -10.742 29 HH12 ARG 70 HH12 ARG 70 14.544 -18.703 -10.312 30 HH21 ARG 70 HH21 ARG 70 14.552 -20.294 -7.385 31 HH22 ARG 70 HH22 ARG 70 13.712 -19.378 -8.655 32 H GLY 71 H GLY 71 17.910 -16.586 -5.930 33 HA2 GLY 71 HA2 GLY 71 19.122 -15.826 -3.407 34 HA3 GLY 71 HA3 GLY 71 17.403 -16.036 -3.730 35 H ARG 72 H ARG 72 19.197 -16.945 -1.549 36 HA ARG 72 HA ARG 72 19.841 -19.639 -1.451 37 HB2 ARG 72 HB2 ARG 72 20.341 -17.873 0.253 38 HB3 ARG 72 HB3 ARG 72 18.675 -17.993 0.833 39 HG2 ARG 72 HG2 ARG 72 19.079 -20.385 1.450 40 HG3 ARG 72 HG3 ARG 72 20.711 -20.275 0.782 41 HD2 ARG 72 HD2 ARG 72 20.855 -20.083 3.174 42 HD3 ARG 72 HD3 ARG 72 21.260 -18.512 2.454 43 HE ARG 72 HE ARG 72 18.445 -18.661 3.118 44 HH11 ARG 72 HH11 ARG 72 21.539 -18.207 4.702 45 HH12 ARG 72 HH12 ARG 72 20.839 -17.334 6.036 46 HH21 ARG 72 HH21 ARG 72 17.607 -17.535 4.839 47 HH22 ARG 72 HH22 ARG 72 18.655 -16.979 6.111 48 H GLY 73 H GLY 73 18.589 -21.246 -2.192 49 HA2 GLY 73 HA2 GLY 73 16.918 -22.818 -2.317 50 HA3 GLY 73 HA3 GLY 73 16.390 -22.304 -0.714 51 H ALA 74 H ALA 74 16.377 -19.888 -3.277 52 HA ALA 74 HA ALA 74 13.594 -19.403 -2.753 53 HB1 ALA 74 HB1 ALA 74 15.477 -18.105 -4.762 54 HB2 ALA 74 HB2 ALA 74 13.904 -17.472 -4.243 55 HB3 ALA 74 HB3 ALA 74 15.231 -17.596 -3.073 56 H ILE 75 H ILE 75 11.805 -19.514 -4.049 57 HA ILE 75 HA ILE 75 11.998 -21.063 -6.589 58 HB ILE 75 HB ILE 75 9.778 -21.231 -4.525 59 HG12 ILE 75 HG11 ILE 75 11.949 -23.261 -5.225 60 HG13 ILE 75 HG12 ILE 75 11.839 -22.339 -3.725 61 HG21 ILE 75 HG21 ILE 75 8.976 -21.591 -6.868 62 HG22 ILE 75 HG22 ILE 75 10.215 -22.849 -7.090 63 HG23 ILE 75 HG23 ILE 75 8.881 -23.065 -5.941 64 HD11 ILE 75 HD11 ILE 75 9.945 -24.529 -4.621 65 HD12 ILE 75 HD12 ILE 75 11.048 -24.514 -3.241 66 HD13 ILE 75 HD13 ILE 75 9.631 -23.443 -3.242 67 H ASP 76 H ASP 76 10.732 -20.383 -8.297 68 HA ASP 76 HA ASP 76 9.691 -17.589 -8.156 69 HB2 ASP 76 HB2 ASP 76 10.442 -19.370 -10.496 70 HB3 ASP 76 HB3 ASP 76 9.713 -17.775 -10.655 71 H ARG 77 H ARG 77 8.681 -20.794 -9.416 72 HA ARG 77 HA ARG 77 5.821 -20.024 -9.455 73 HB2 ARG 77 HB2 ARG 77 7.218 -22.637 -10.171 74 HB3 ARG 77 HB3 ARG 77 5.484 -22.322 -10.331 75 HG2 ARG 77 HG2 ARG 77 5.945 -20.458 -11.898 76 HG3 ARG 77 HG3 ARG 77 7.685 -20.785 -11.780 77 HD2 ARG 77 HD2 ARG 77 7.317 -23.069 -12.664 78 HD3 ARG 77 HD3 ARG 77 5.577 -22.729 -12.807 79 HE ARG 77 HE ARG 77 6.953 -20.687 -14.201 80 HH11 ARG 77 HH11 ARG 77 6.454 -24.135 -14.601 81 HH12 ARG 77 HH12 ARG 77 6.642 -24.057 -16.332 82 HH21 ARG 77 HH21 ARG 77 7.183 -20.656 -16.410 83 HH22 ARG 77 HH22 ARG 77 7.042 -22.126 -17.327 84 H GLU 78 H GLU 78 6.784 -19.631 -7.013 85 HA GLU 78 HA GLU 78 6.827 -21.891 -5.255 86 HB2 GLU 78 HB2 GLU 78 7.995 -19.708 -5.007 87 HB3 GLU 78 HB3 GLU 78 6.452 -18.953 -4.587 88 HG2 GLU 78 HG2 GLU 78 6.263 -20.401 -2.594 89 HG3 GLU 78 HG3 GLU 78 7.724 -21.278 -3.064 90 H GLN 79 H GLN 79 4.110 -19.934 -6.335 91 HA GLN 79 HA GLN 79 2.184 -20.780 -4.373 92 HB2 GLN 79 HB2 GLN 79 1.858 -20.078 -7.324 93 HB3 GLN 79 HB3 GLN 79 0.519 -20.369 -6.210 94 HG2 GLN 79 HG2 GLN 79 1.324 -18.513 -4.748 95 HG3 GLN 79 HG3 GLN 79 2.596 -18.155 -5.920 96 HE21 GLN 79 HE22 GLN 79 1.905 -17.382 -8.127 97 HE22 GLN 79 HE21 GLN 79 0.332 -16.617 -8.271 98 H SER 80 H SER 80 3.469 -22.457 -7.295 99 HA SER 80 HA SER 80 1.640 -24.689 -7.160 100 HB2 SER 80 HB2 SER 80 4.471 -24.591 -8.277 101 HB3 SER 80 HB3 SER 80 3.268 -25.862 -8.563 102 HG SER 80 HG SER 80 3.289 -24.309 -10.268 103 H ALA 81 H ALA 81 4.936 -24.196 -5.741 104 HA ALA 81 HA ALA 81 5.068 -26.672 -4.428 105 HB1 ALA 81 HB1 ALA 81 6.308 -24.008 -3.613 106 HB2 ALA 81 HB2 ALA 81 6.829 -25.613 -3.075 107 HB3 ALA 81 HB3 ALA 81 6.991 -25.165 -4.784 108 H ALA 82 H ALA 82 3.657 -23.570 -3.291 109 HA ALA 82 HA ALA 82 2.896 -24.485 -0.691 110 HB1 ALA 82 HB1 ALA 82 3.048 -22.110 -1.361 111 HB2 ALA 82 HB2 ALA 82 1.647 -22.321 -2.440 112 HB3 ALA 82 HB3 ALA 82 1.454 -22.500 -0.686 113 H ILE 83 H ILE 83 1.044 -24.521 -3.795 114 HA ILE 83 HA ILE 83 -1.310 -25.744 -2.653 115 HB ILE 83 HB ILE 83 -0.327 -25.549 -5.519 116 HG12 ILE 83 HG12 ILE 83 -2.545 -24.100 -4.006 117 HG13 ILE 83 HG13 ILE 83 -0.963 -23.415 -4.258 118 HG21 ILE 83 HG21 ILE 83 -1.867 -27.511 -5.309 119 HG22 ILE 83 HG22 ILE 83 -3.058 -26.477 -4.499 120 HG23 ILE 83 HG23 ILE 83 -2.627 -26.207 -6.199 121 HD11 ILE 83 HD11 ILE 83 -1.352 -23.577 -6.759 122 HD12 ILE 83 HD12 ILE 83 -3.045 -23.995 -6.381 123 HD13 ILE 83 HD13 ILE 83 -2.388 -22.436 -5.879 124 H ARG 84 H ARG 84 1.604 -27.165 -4.196 125 HA ARG 84 HA ARG 84 0.841 -29.919 -3.985 126 HB2 ARG 84 HB2 ARG 84 2.826 -29.070 -5.251 127 HB3 ARG 84 HB3 ARG 84 3.592 -28.618 -3.734 128 HG2 ARG 84 HG2 ARG 84 3.506 -31.108 -3.079 129 HG3 ARG 84 HG3 ARG 84 2.921 -31.425 -4.712 130 HD2 ARG 84 HD2 ARG 84 5.300 -31.825 -4.638 131 HD3 ARG 84 HD3 ARG 84 5.017 -30.377 -5.617 132 HE ARG 84 HE ARG 84 5.505 -29.713 -2.827 133 HH11 ARG 84 HH11 ARG 84 7.370 -30.826 -5.590 134 HH12 ARG 84 HH12 ARG 84 8.766 -29.897 -5.117 135 HH21 ARG 84 HH21 ARG 84 7.361 -28.639 -2.247 136 HH22 ARG 84 HH22 ARG 84 8.773 -28.749 -3.245 137 H GLU 85 H GLU 85 2.643 -27.901 -1.582 138 HA GLU 85 HA GLU 85 2.715 -29.877 0.378 139 HB2 GLU 85 HB2 GLU 85 4.018 -27.710 0.318 140 HB3 GLU 85 HB3 GLU 85 2.570 -26.902 0.953 141 HG2 GLU 85 HG2 GLU 85 2.615 -28.562 2.882 142 HG3 GLU 85 HG3 GLU 85 4.144 -29.175 2.254 143 H TRP 86 H TRP 86 0.221 -27.273 -0.021 144 HA TRP 86 HA TRP 86 -1.468 -28.012 2.049 145 HB2 TRP 86 HB2 TRP 86 -1.770 -25.960 0.830 146 HB3 TRP 86 HB3 TRP 86 -2.056 -26.824 -0.675 147 HD1 TRP 86 HD1 TRP 86 -3.776 -25.879 2.592 148 HE1 TRP 86 HE1 TRP 86 -6.308 -26.286 2.392 149 HE3 TRP 86 HE3 TRP 86 -3.878 -28.158 -1.997 150 HZ2 TRP 86 HZ2 TRP 86 -8.108 -27.635 0.581 151 HZ3 TRP 86 HZ3 TRP 86 -6.026 -28.962 -2.952 152 HH2 TRP 86 HH2 TRP 86 -8.137 -28.736 -1.651 153 H ALA 87 H ALA 87 -1.499 -29.267 -1.328 154 HA ALA 87 HA ALA 87 -3.683 -31.055 -0.980 155 HB1 ALA 87 HB1 ALA 87 -2.752 -32.106 -3.063 156 HB2 ALA 87 HB2 ALA 87 -2.890 -30.340 -3.165 157 HB3 ALA 87 HB3 ALA 87 -1.307 -31.082 -2.896 158 H ARG 88 H ARG 88 -0.162 -31.596 -0.520 159 HA ARG 88 HA ARG 88 -0.336 -34.348 0.263 160 HB2 ARG 88 HB2 ARG 88 1.685 -33.051 -0.491 161 HB3 ARG 88 HB3 ARG 88 1.769 -32.286 1.090 162 HG2 ARG 88 HG2 ARG 88 1.858 -35.313 0.694 163 HG3 ARG 88 HG3 ARG 88 3.287 -34.287 0.571 164 HD2 ARG 88 HD2 ARG 88 2.949 -33.500 2.894 165 HD3 ARG 88 HD3 ARG 88 1.580 -34.624 3.062 166 HE ARG 88 HE ARG 88 3.808 -36.106 2.138 167 HH11 ARG 88 HH11 ARG 88 2.884 -34.463 5.098 168 HH12 ARG 88 HH12 ARG 88 3.850 -35.519 6.091 169 HH21 ARG 88 HH21 ARG 88 5.009 -37.420 3.468 170 HH22 ARG 88 HH22 ARG 88 5.014 -37.150 5.185 171 H ARG 89 H ARG 89 -0.354 -31.382 2.287 172 HA ARG 89 HA ARG 89 -0.691 -32.637 4.847 173 HB2 ARG 89 HB2 ARG 89 -1.551 -29.920 3.762 174 HB3 ARG 89 HB3 ARG 89 -1.783 -30.397 5.444 175 HG2 ARG 89 HG2 ARG 89 0.612 -30.678 5.790 176 HG3 ARG 89 HG3 ARG 89 0.945 -30.321 4.091 177 HD2 ARG 89 HD2 ARG 89 -0.060 -28.064 4.359 178 HD3 ARG 89 HD3 ARG 89 -0.390 -28.396 6.058 179 HE ARG 89 HE ARG 89 2.175 -27.665 4.828 180 HH11 ARG 89 HH11 ARG 89 0.855 -29.097 7.774 181 HH12 ARG 89 HH12 ARG 89 2.288 -28.672 8.668 182 HH21 ARG 89 HH21 ARG 89 3.820 -27.187 5.939 183 HH22 ARG 89 HH22 ARG 89 3.980 -27.594 7.653 184 H ASN 90 H ASN 90 -3.104 -31.860 2.382 185 HA ASN 90 HA ASN 90 -5.313 -32.839 4.097 186 HB2 ASN 90 HB2 ASN 90 -5.211 -31.494 1.369 187 HB3 ASN 90 HB3 ASN 90 -6.685 -32.156 2.063 188 HD21 ASN 90 HD22 ASN 90 -4.241 -29.625 2.479 189 HD22 ASN 90 HD21 ASN 90 -5.218 -28.682 3.598 190 H GLY 91 H GLY 91 -3.068 -34.522 2.348 191 HA2 GLY 91 HA2 GLY 91 -2.983 -36.703 1.666 192 HA3 GLY 91 HA3 GLY 91 -4.599 -36.944 2.330 193 H HIS 92 H HIS 92 -4.143 -34.517 -0.164 194 HA HIS 92 HA HIS 92 -5.910 -36.025 -2.021 195 HB2 HIS 92 HB2 HIS 92 -4.817 -33.184 -2.181 196 HB3 HIS 92 HB3 HIS 92 -6.025 -33.885 -3.249 197 HD1 HIS 92 HD1 HIS 92 -7.632 -35.195 -0.507 198 HD2 HIS 92 HD2 HIS 92 -6.640 -31.237 -1.616 199 HE1 HIS 92 HE1 HIS 92 -9.325 -33.666 0.673 200 HE2 HIS 92 HE2 HIS 92 -8.723 -31.254 -0.012 201 H ASN 93 H ASN 93 -5.409 -36.397 -4.215 202 HA ASN 93 HA ASN 93 -2.721 -37.328 -4.702 203 HB2 ASN 93 HB2 ASN 93 -4.787 -38.397 -5.582 204 HB3 ASN 93 HB3 ASN 93 -5.087 -36.984 -6.595 205 HD21 ASN 93 HD22 ASN 93 -5.096 -38.878 -8.214 206 HD22 ASN 93 HD21 ASN 93 -3.538 -39.261 -8.934 207 H VAL 94 H VAL 94 -1.005 -36.228 -5.417 208 HA VAL 94 HA VAL 94 -1.203 -34.121 -7.420 209 HB VAL 94 HB VAL 94 -1.566 -32.923 -5.241 210 HG11 VAL 94 HG11 VAL 94 0.297 -32.509 -3.727 211 HG12 VAL 94 HG12 VAL 94 -0.078 -34.235 -3.769 212 HG13 VAL 94 HG13 VAL 94 1.340 -33.607 -4.641 213 HG21 VAL 94 HG21 VAL 94 -0.170 -31.064 -5.734 214 HG22 VAL 94 HG22 VAL 94 1.002 -32.065 -6.612 215 HG23 VAL 94 HG23 VAL 94 -0.640 -31.816 -7.263 216 H SER 95 H SER 95 0.789 -33.751 -8.528 217 HA SER 95 HA SER 95 2.733 -35.906 -8.379 218 HB2 SER 95 HB2 SER 95 2.135 -34.735 -10.505 219 HB3 SER 95 HB3 SER 95 2.929 -33.274 -9.884 220 HG SER 95 HG SER 95 4.064 -35.765 -10.630 221 H THR 96 H THR 96 4.934 -35.797 -7.788 222 HA THR 96 HA THR 96 5.631 -34.010 -5.577 223 HB THR 96 HB THR 96 7.862 -35.170 -5.749 224 HG1 THR 96 HG1 THR 96 7.958 -36.962 -7.150 225 HG21 THR 96 HG21 THR 96 5.453 -37.044 -5.630 226 HG22 THR 96 HG22 THR 96 7.066 -37.348 -4.952 227 HG23 THR 96 HG23 THR 96 6.060 -36.053 -4.286 228 H ARG 97 H ARG 97 6.484 -34.257 -9.007 229 HA ARG 97 HA ARG 97 7.945 -31.628 -8.868 230 HB2 ARG 97 HB2 ARG 97 9.400 -33.680 -8.828 231 HB3 ARG 97 HB3 ARG 97 8.766 -34.118 -10.418 232 HG2 ARG 97 HG2 ARG 97 9.755 -32.090 -11.405 233 HG3 ARG 97 HG3 ARG 97 10.225 -31.509 -9.799 234 HD2 ARG 97 HD2 ARG 97 12.178 -32.431 -10.892 235 HD3 ARG 97 HD3 ARG 97 11.738 -33.450 -9.533 236 HE ARG 97 HE ARG 97 11.209 -35.206 -10.958 237 HH11 ARG 97 HH11 ARG 97 11.756 -32.386 -12.978 238 HH12 ARG 97 HH12 ARG 97 11.780 -33.333 -14.440 239 HH21 ARG 97 HH21 ARG 97 11.240 -36.342 -12.856 240 HH22 ARG 97 HH22 ARG 97 11.496 -35.517 -14.367 241 H GLY 98 H GLY 98 5.673 -33.566 -10.685 242 HA2 GLY 98 HA2 GLY 98 5.805 -32.017 -13.164 243 HA3 GLY 98 HA3 GLY 98 4.641 -33.264 -12.726 244 H ARG 99 H ARG 99 3.296 -31.635 -13.910 245 HA ARG 99 HA ARG 99 2.506 -29.147 -12.637 246 HB2 ARG 99 HB2 ARG 99 1.205 -30.818 -14.835 247 HB3 ARG 99 HB3 ARG 99 0.631 -29.226 -14.323 248 HG2 ARG 99 HG2 ARG 99 2.813 -28.213 -14.957 249 HG3 ARG 99 HG3 ARG 99 3.406 -29.805 -15.449 250 HD2 ARG 99 HD2 ARG 99 2.737 -28.644 -17.430 251 HD3 ARG 99 HD3 ARG 99 1.578 -29.953 -17.135 252 HE ARG 99 HE ARG 99 0.705 -27.431 -15.974 253 HH11 ARG 99 HH11 ARG 99 0.841 -29.070 -19.068 254 HH12 ARG 99 HH12 ARG 99 -0.507 -28.175 -19.712 255 HH21 ARG 99 HH21 ARG 99 -1.020 -26.328 -16.846 256 HH22 ARG 99 HH22 ARG 99 -1.524 -26.652 -18.476 257 H ILE 100 H ILE 100 0.471 -28.606 -11.775 258 HA ILE 100 HA ILE 100 -0.780 -30.740 -10.123 259 HB ILE 100 HB ILE 100 -0.868 -27.737 -9.789 260 HG12 ILE 100 HG12 ILE 100 0.682 -29.969 -8.392 261 HG13 ILE 100 HG13 ILE 100 1.346 -28.618 -9.310 262 HG21 ILE 100 HG21 ILE 100 -1.967 -29.934 -7.966 263 HG22 ILE 100 HG22 ILE 100 -1.997 -28.186 -7.658 264 HG23 ILE 100 HG23 ILE 100 -2.954 -28.844 -8.964 265 HD11 ILE 100 HD11 ILE 100 0.402 -27.055 -7.570 266 HD12 ILE 100 HD12 ILE 100 0.034 -28.507 -6.593 267 HD13 ILE 100 HD13 ILE 100 1.704 -28.138 -7.039 268 HA PRO 101 HA PRO 101 -4.347 -30.437 -12.866 269 HB2 PRO 101 HB2 PRO 101 -5.989 -31.490 -10.604 270 HB3 PRO 101 HB3 PRO 101 -5.793 -32.139 -12.256 271 HG2 PRO 101 HG2 PRO 101 -4.617 -33.331 -10.099 272 HG3 PRO 101 HG3 PRO 101 -3.786 -33.236 -11.687 273 HD2 PRO 101 HD2 PRO 101 -3.396 -31.468 -9.260 274 HD3 PRO 101 HD3 PRO 101 -2.177 -32.229 -10.327 275 H ALA 102 H ALA 102 -5.846 -28.835 -13.287 276 HA ALA 102 HA ALA 102 -6.037 -26.582 -11.661 277 HB1 ALA 102 HB1 ALA 102 -7.967 -27.470 -13.814 278 HB2 ALA 102 HB2 ALA 102 -7.724 -25.818 -13.189 279 HB3 ALA 102 HB3 ALA 102 -6.413 -26.623 -14.079 280 H ASP 103 H ASP 103 -8.161 -29.435 -11.696 281 HA ASP 103 HA ASP 103 -10.211 -28.498 -10.085 282 HB2 ASP 103 HB2 ASP 103 -10.199 -30.650 -11.285 283 HB3 ASP 103 HB3 ASP 103 -8.953 -31.264 -10.198 284 H VAL 104 H VAL 104 -6.969 -29.633 -9.124 285 HA VAL 104 HA VAL 104 -7.533 -29.557 -6.288 286 HB VAL 104 HB VAL 104 -4.871 -29.811 -7.657 287 HG11 VAL 104 HG11 VAL 104 -4.123 -30.873 -5.545 288 HG12 VAL 104 HG12 VAL 104 -4.610 -29.196 -5.298 289 HG13 VAL 104 HG13 VAL 104 -5.705 -30.514 -4.818 290 HG21 VAL 104 HG21 VAL 104 -5.060 -32.254 -7.224 291 HG22 VAL 104 HG22 VAL 104 -6.711 -32.015 -6.613 292 HG23 VAL 104 HG23 VAL 104 -6.327 -31.713 -8.321 293 H ILE 105 H ILE 105 -5.925 -27.442 -8.680 294 HA ILE 105 HA ILE 105 -5.115 -25.383 -6.838 295 HB ILE 105 HB ILE 105 -5.859 -25.408 -9.784 296 HG12 ILE 105 HG11 ILE 105 -3.099 -24.814 -8.656 297 HG13 ILE 105 HG12 ILE 105 -3.656 -26.480 -8.602 298 HG21 ILE 105 HG21 ILE 105 -6.293 -23.130 -9.087 299 HG22 ILE 105 HG22 ILE 105 -4.779 -23.069 -8.148 300 HG23 ILE 105 HG23 ILE 105 -4.741 -23.154 -9.923 301 HD11 ILE 105 HD11 ILE 105 -3.972 -26.579 -10.960 302 HD12 ILE 105 HD12 ILE 105 -3.601 -24.848 -11.159 303 HD13 ILE 105 HD13 ILE 105 -2.336 -25.977 -10.630 304 H ASP 106 H ASP 106 -8.213 -25.787 -8.668 305 HA ASP 106 HA ASP 106 -9.571 -23.676 -7.461 306 HB2 ASP 106 HB2 ASP 106 -10.342 -24.862 -9.462 307 HB3 ASP 106 HB3 ASP 106 -10.652 -26.315 -8.503 308 H ALA 107 H ALA 107 -9.399 -27.143 -6.389 309 HA ALA 107 HA ALA 107 -10.923 -26.963 -4.115 310 HB1 ALA 107 HB1 ALA 107 -9.690 -28.951 -3.363 311 HB2 ALA 107 HB2 ALA 107 -10.000 -29.051 -5.098 312 HB3 ALA 107 HB3 ALA 107 -8.383 -28.617 -4.518 313 H TYR 108 H TYR 108 -7.422 -26.209 -4.396 314 HA TYR 108 HA TYR 108 -6.951 -25.428 -1.699 315 HB2 TYR 108 HB2 TYR 108 -5.092 -25.801 -3.119 316 HB3 TYR 108 HB3 TYR 108 -5.688 -24.732 -4.364 317 HD1 TYR 108 HD2 TYR 108 -4.191 -24.815 -0.959 318 HD2 TYR 108 HD1 TYR 108 -5.227 -22.376 -4.361 319 HE1 TYR 108 HE2 TYR 108 -2.776 -22.977 -0.063 320 HE2 TYR 108 HE1 TYR 108 -3.831 -20.523 -3.449 321 HH TYR 108 HH TYR 108 -2.001 -20.829 -0.376 322 H HIS 109 H HIS 109 -7.874 -23.358 -4.540 323 HA HIS 109 HA HIS 109 -8.124 -20.979 -2.970 324 HB2 HIS 109 HB2 HIS 109 -9.287 -21.765 -5.663 325 HB3 HIS 109 HB3 HIS 109 -9.565 -20.182 -4.934 326 HD1 HIS 109 HD1 HIS 109 -7.024 -18.945 -4.128 327 HD2 HIS 109 HD2 HIS 109 -7.269 -21.731 -7.281 328 HE1 HIS 109 HE1 HIS 109 -4.941 -18.560 -5.595 329 HE2 HIS 109 HE2 HIS 109 -5.101 -20.252 -7.530 330 H ALA 110 H ALA 110 -10.595 -23.488 -3.645 331 HA ALA 110 HA ALA 110 -12.741 -22.101 -2.379 332 HB1 ALA 110 HB1 ALA 110 -13.035 -24.068 -3.842 333 HB2 ALA 110 HB2 ALA 110 -12.218 -25.099 -2.649 334 HB3 ALA 110 HB3 ALA 110 -13.774 -24.345 -2.253 335 H ALA 111 H ALA 111 -10.251 -24.331 -0.969 336 HA ALA 111 HA ALA 111 -11.252 -24.234 1.635 337 HB1 ALA 111 HB1 ALA 111 -8.437 -24.784 0.635 338 HB2 ALA 111 HB2 ALA 111 -9.076 -25.204 2.237 339 HB3 ALA 111 HB3 ALA 111 -9.758 -25.968 0.785 340 H THR 112 H THR 112 -8.772 -22.153 0.033 341 HA THR 112 HA THR 112 -8.186 -20.705 2.499 342 HB THR 112 HB THR 112 -6.781 -19.259 1.098 343 HG1 THR 112 HG1 THR 112 -6.562 -19.796 -1.097 344 HG21 THR 112 HG21 THR 112 -5.880 -21.408 1.962 345 HG22 THR 112 HG22 THR 112 -6.353 -22.206 0.445 346 HG23 THR 112 HG23 THR 112 -5.143 -20.913 0.429 347 H LEU 113 H LEU 113 -10.371 -20.050 -0.213 348 HA LEU 113 HA LEU 113 -10.946 -17.346 0.876 349 HB2 LEU 113 HB2 LEU 113 -11.958 -18.686 -1.658 350 HB3 LEU 113 HB3 LEU 113 -12.163 -16.995 -1.210 351 HG LEU 113 HG LEU 113 -9.494 -18.351 -1.801 352 HD11 LEU 113 HD11 LEU 113 -10.907 -18.083 -3.795 353 HD12 LEU 113 HD12 LEU 113 -11.133 -16.358 -3.425 354 HD13 LEU 113 HD13 LEU 113 -9.522 -16.984 -3.851 355 HD21 LEU 113 HD21 LEU 113 -9.163 -16.500 -0.231 356 HD22 LEU 113 HD22 LEU 113 -8.586 -16.035 -1.831 357 HD23 LEU 113 HD23 LEU 113 -10.146 -15.421 -1.246 358 H GLU 114 H GLU 114 -12.667 -20.373 0.234 359 HA GLU 114 HA GLU 114 -14.827 -21.047 0.633 360 HB2 GLU 114 HB2 GLU 114 -13.344 -21.230 2.719 361 HB3 GLU 114 HB3 GLU 114 -14.301 -19.914 3.395 362 HG2 GLU 114 HG2 GLU 114 -16.368 -21.336 3.085 363 HG3 GLU 114 HG3 GLU 114 -15.360 -22.605 2.397 364 H HIS 115 H HIS 115 -14.954 -18.591 -0.641 365 HA HIS 115 HA HIS 115 -16.139 -16.763 -1.186 366 HB2 HIS 115 HB2 HIS 115 -17.937 -18.463 -1.244 367 HB3 HIS 115 HB3 HIS 115 -18.407 -18.031 0.391 368 HD1 HIS 115 HD1 HIS 115 -18.426 -16.574 -3.188 369 HD2 HIS 115 HD2 HIS 115 -19.901 -15.831 0.707 370 HE1 HIS 115 HE1 HIS 115 -20.140 -14.665 -3.408 371 HE2 HIS 115 HE2 HIS 115 -21.042 -14.224 -1.034 372 H HIS 116 H HIS 116 -15.903 -17.249 2.251 373 HA HIS 116 HA HIS 116 -16.783 -14.476 2.871 374 HB2 HIS 116 HB2 HIS 116 -16.258 -16.881 4.668 375 HB3 HIS 116 HB3 HIS 116 -16.948 -15.343 5.171 376 HD1 HIS 116 HD1 HIS 116 -17.918 -18.515 3.213 377 HD2 HIS 116 HD2 HIS 116 -19.515 -14.836 4.566 378 HE1 HIS 116 HE1 HIS 116 -20.481 -18.694 2.966 379 HE2 HIS 116 HE2 HIS 116 -21.445 -16.446 3.783 380 H HIS 117 H HIS 117 -13.748 -16.195 2.705 381 HA HIS 117 HA HIS 117 -12.396 -14.237 4.520 382 HB2 HIS 117 HB2 HIS 117 -12.187 -16.614 5.085 383 HB3 HIS 117 HB3 HIS 117 -11.552 -16.975 3.489 384 HD1 HIS 117 HD1 HIS 117 -8.978 -17.085 3.419 385 HD2 HIS 117 HD2 HIS 117 -10.545 -14.709 6.547 386 HE1 HIS 117 HE1 HIS 117 -6.955 -16.269 4.810 387 HE2 HIS 117 HE2 HIS 117 -7.922 -14.856 6.725 388 H HIS 118 H HIS 118 -11.315 -12.617 3.669 389 HA HIS 118 HA HIS 118 -10.069 -12.794 0.947 390 HB2 HIS 118 HB2 HIS 118 -11.923 -10.590 1.947 391 HB3 HIS 118 HB3 HIS 118 -11.034 -10.564 0.425 392 HD1 HIS 118 HD1 HIS 118 -11.779 -12.497 -1.428 393 HD2 HIS 118 HD2 HIS 118 -14.267 -11.828 1.922 394 HE1 HIS 118 HE1 HIS 118 -14.047 -13.586 -1.986 395 HE2 HIS 118 HE2 HIS 118 -15.554 -13.211 0.070 396 H HIS 119 H HIS 119 -8.766 -12.965 3.515 397 HA HIS 119 HA HIS 119 -6.984 -10.559 3.419 398 HB2 HIS 119 HB2 HIS 119 -7.997 -11.884 5.973 399 HB3 HIS 119 HB3 HIS 119 -6.921 -10.498 5.874 400 HD1 HIS 119 HD1 HIS 119 -8.330 -8.398 4.203 401 HD2 HIS 119 HD2 HIS 119 -10.363 -11.149 6.684 402 HE1 HIS 119 HE1 HIS 119 -10.639 -7.362 4.703 403 HE2 HIS 119 HE2 HIS 119 -11.867 -9.043 6.214 404 H HIS 120 H HIS 120 -4.878 -10.886 4.409 405 HA HIS 120 HA HIS 120 -3.869 -13.695 4.484 406 HB2 HIS 120 HB2 HIS 120 -2.550 -11.374 3.019 407 HB3 HIS 120 HB3 HIS 120 -1.874 -12.983 3.232 408 HD1 HIS 120 HD1 HIS 120 -3.617 -11.111 0.667 409 HD2 HIS 120 HD2 HIS 120 -3.727 -15.046 2.200 410 HE1 HIS 120 HE1 HIS 120 -4.718 -12.568 -1.154 411 HE2 HIS 120 HE2 HIS 120 -4.762 -14.972 -0.222 Start of MODEL 7 1 H1 SER 66 H1 SER 66 25.479 -23.522 15.583 2 H2 SER 66 H2 SER 66 26.308 -24.928 15.414 3 H3 SER 66 H3 SER 66 24.990 -24.631 14.487 4 HA SER 66 HA SER 66 25.003 -25.013 17.408 5 HB2 SER 66 HB2 SER 66 22.607 -24.559 15.584 6 HB3 SER 66 HB3 SER 66 22.569 -24.845 17.336 7 HG SER 66 HG SER 66 22.483 -22.594 16.828 8 H GLY 67 H GLY 67 24.102 -26.995 18.194 9 HA2 GLY 67 HA2 GLY 67 24.753 -29.304 16.589 10 HA3 GLY 67 HA3 GLY 67 24.080 -29.286 18.217 11 H SER 68 H SER 68 21.721 -27.628 17.062 12 HA SER 68 HA SER 68 20.331 -29.562 15.319 13 HB2 SER 68 HB2 SER 68 19.873 -30.223 17.709 14 HB3 SER 68 HB3 SER 68 19.104 -28.644 17.945 15 HG SER 68 HG SER 68 17.618 -30.347 17.365 16 H GLY 69 H GLY 69 18.294 -28.672 14.463 17 HA2 GLY 69 HA2 GLY 69 17.429 -25.997 14.673 18 HA3 GLY 69 HA3 GLY 69 18.623 -26.046 13.374 19 H ARG 70 H ARG 70 16.299 -25.236 12.578 20 HA ARG 70 HA ARG 70 15.052 -27.483 11.025 21 HB2 ARG 70 HB2 ARG 70 13.575 -25.212 12.439 22 HB3 ARG 70 HB3 ARG 70 12.854 -26.334 11.277 23 HG2 ARG 70 HG2 ARG 70 13.412 -28.250 12.770 24 HG3 ARG 70 HG3 ARG 70 14.058 -27.113 13.971 25 HD2 ARG 70 HD2 ARG 70 11.851 -26.019 14.130 26 HD3 ARG 70 HD3 ARG 70 11.197 -27.158 12.931 27 HE ARG 70 HE ARG 70 12.375 -28.657 15.051 28 HH11 ARG 70 HH11 ARG 70 9.568 -26.604 14.606 29 HH12 ARG 70 HH12 ARG 70 8.666 -27.405 15.863 30 HH21 ARG 70 HH21 ARG 70 11.166 -29.657 16.619 31 HH22 ARG 70 HH22 ARG 70 9.559 -29.096 16.976 32 H GLY 71 H GLY 71 14.393 -27.143 9.087 33 HA2 GLY 71 HA2 GLY 71 14.070 -24.994 7.450 34 HA3 GLY 71 HA3 GLY 71 15.829 -25.110 7.552 35 H ARG 72 H ARG 72 14.413 -25.423 5.238 36 HA ARG 72 HA ARG 72 15.216 -28.142 4.360 37 HB2 ARG 72 HB2 ARG 72 13.144 -28.558 3.144 38 HB3 ARG 72 HB3 ARG 72 12.856 -28.394 4.870 39 HG2 ARG 72 HG2 ARG 72 12.046 -26.048 4.496 40 HG3 ARG 72 HG3 ARG 72 12.263 -26.276 2.747 41 HD2 ARG 72 HD2 ARG 72 10.664 -28.167 2.803 42 HD3 ARG 72 HD3 ARG 72 10.472 -27.953 4.555 43 HE ARG 72 HE ARG 72 9.873 -25.487 3.197 44 HH11 ARG 72 HH11 ARG 72 8.382 -28.638 3.755 45 HH12 ARG 72 HH12 ARG 72 6.768 -27.946 3.627 46 HH21 ARG 72 HH21 ARG 72 7.805 -24.771 2.961 47 HH22 ARG 72 HH22 ARG 72 6.464 -25.927 3.022 48 H GLY 73 H GLY 73 15.790 -28.400 2.247 49 HA2 GLY 73 HA2 GLY 73 16.721 -25.993 0.838 50 HA3 GLY 73 HA3 GLY 73 17.070 -27.672 0.443 51 H ALA 74 H ALA 74 13.849 -27.852 0.637 52 HA ALA 74 HA ALA 74 13.424 -27.827 -2.214 53 HB1 ALA 74 HB1 ALA 74 11.153 -28.554 -1.590 54 HB2 ALA 74 HB2 ALA 74 12.374 -29.440 -0.660 55 HB3 ALA 74 HB3 ALA 74 11.458 -28.117 0.104 56 H ILE 75 H ILE 75 11.532 -26.768 -3.244 57 HA ILE 75 HA ILE 75 11.602 -23.899 -3.029 58 HB ILE 75 HB ILE 75 9.561 -25.656 -4.438 59 HG12 ILE 75 HG12 ILE 75 11.712 -26.289 -5.317 60 HG13 ILE 75 HG13 ILE 75 10.869 -25.316 -6.499 61 HG21 ILE 75 HG21 ILE 75 10.302 -22.727 -4.883 62 HG22 ILE 75 HG22 ILE 75 9.218 -23.692 -5.912 63 HG23 ILE 75 HG23 ILE 75 8.771 -23.352 -4.242 64 HD11 ILE 75 HD11 ILE 75 13.245 -24.747 -6.429 65 HD12 ILE 75 HD12 ILE 75 12.284 -23.350 -5.918 66 HD13 ILE 75 HD13 ILE 75 13.143 -24.340 -4.709 67 H ASP 76 H ASP 76 10.204 -22.472 -2.063 68 HA ASP 76 HA ASP 76 8.140 -23.598 -0.182 69 HB2 ASP 76 HB2 ASP 76 10.386 -23.297 0.852 70 HB3 ASP 76 HB3 ASP 76 10.312 -21.577 0.478 71 H ARG 77 H ARG 77 9.343 -20.469 -1.540 72 HA ARG 77 HA ARG 77 6.906 -19.076 -0.799 73 HB2 ARG 77 HB2 ARG 77 9.238 -18.131 -0.843 74 HB3 ARG 77 HB3 ARG 77 9.184 -18.162 -2.611 75 HG2 ARG 77 HG2 ARG 77 7.315 -16.543 -2.598 76 HG3 ARG 77 HG3 ARG 77 7.222 -16.645 -0.832 77 HD2 ARG 77 HD2 ARG 77 8.360 -14.617 -1.402 78 HD3 ARG 77 HD3 ARG 77 9.521 -15.730 -0.664 79 HE ARG 77 HE ARG 77 9.518 -15.951 -3.557 80 HH11 ARG 77 HH11 ARG 77 10.720 -13.828 -1.039 81 HH12 ARG 77 HH12 ARG 77 12.034 -13.249 -2.025 82 HH21 ARG 77 HH21 ARG 77 11.230 -15.179 -4.761 83 HH22 ARG 77 HH22 ARG 77 12.303 -13.992 -4.083 84 H GLU 78 H GLU 78 7.801 -20.825 -3.643 85 HA GLU 78 HA GLU 78 6.153 -19.434 -5.541 86 HB2 GLU 78 HB2 GLU 78 8.108 -20.901 -6.067 87 HB3 GLU 78 HB3 GLU 78 7.137 -22.309 -5.618 88 HG2 GLU 78 HG2 GLU 78 5.549 -21.836 -7.432 89 HG3 GLU 78 HG3 GLU 78 6.388 -20.331 -7.813 90 H GLN 79 H GLN 79 4.020 -19.701 -6.158 91 HA GLN 79 HA GLN 79 2.192 -20.803 -4.283 92 HB2 GLN 79 HB2 GLN 79 1.782 -19.982 -7.187 93 HB3 GLN 79 HB3 GLN 79 0.482 -20.377 -6.057 94 HG2 GLN 79 HG2 GLN 79 1.196 -18.544 -4.553 95 HG3 GLN 79 HG3 GLN 79 2.492 -18.117 -5.665 96 HE21 GLN 79 HE22 GLN 79 -1.069 -18.145 -5.258 97 HE22 GLN 79 HE21 GLN 79 -1.359 -17.007 -6.567 98 H SER 80 H SER 80 3.451 -22.255 -7.322 99 HA SER 80 HA SER 80 1.856 -24.591 -7.338 100 HB2 SER 80 HB2 SER 80 4.777 -24.321 -8.155 101 HB3 SER 80 HB3 SER 80 3.646 -25.587 -8.685 102 HG SER 80 HG SER 80 3.824 -23.859 -10.221 103 H ALA 81 H ALA 81 4.953 -24.011 -5.567 104 HA ALA 81 HA ALA 81 5.071 -26.605 -4.416 105 HB1 ALA 81 HB1 ALA 81 7.019 -25.141 -4.675 106 HB2 ALA 81 HB2 ALA 81 6.331 -23.985 -3.506 107 HB3 ALA 81 HB3 ALA 81 6.793 -25.612 -2.981 108 H ALA 82 H ALA 82 3.684 -23.503 -3.218 109 HA ALA 82 HA ALA 82 2.831 -24.459 -0.680 110 HB1 ALA 82 HB1 ALA 82 1.348 -22.507 -0.700 111 HB2 ALA 82 HB2 ALA 82 2.948 -22.074 -1.341 112 HB3 ALA 82 HB3 ALA 82 1.578 -22.314 -2.450 113 H ILE 83 H ILE 83 1.100 -24.512 -3.838 114 HA ILE 83 HA ILE 83 -1.270 -25.787 -2.791 115 HB ILE 83 HB ILE 83 -0.187 -25.503 -5.616 116 HG12 ILE 83 HG12 ILE 83 -2.517 -24.171 -4.163 117 HG13 ILE 83 HG13 ILE 83 -0.938 -23.435 -4.317 118 HG21 ILE 83 HG21 ILE 83 -2.460 -26.195 -6.392 119 HG22 ILE 83 HG22 ILE 83 -1.665 -27.514 -5.550 120 HG23 ILE 83 HG23 ILE 83 -2.922 -26.566 -4.723 121 HD11 ILE 83 HD11 ILE 83 -2.897 -23.993 -6.559 122 HD12 ILE 83 HD12 ILE 83 -2.308 -22.436 -5.968 123 HD13 ILE 83 HD13 ILE 83 -1.197 -23.515 -6.834 124 H ARG 84 H ARG 84 1.678 -27.167 -4.364 125 HA ARG 84 HA ARG 84 0.875 -29.923 -4.166 126 HB2 ARG 84 HB2 ARG 84 3.542 -28.471 -4.320 127 HB3 ARG 84 HB3 ARG 84 3.524 -30.191 -3.928 128 HG2 ARG 84 HG2 ARG 84 2.348 -30.763 -5.922 129 HG3 ARG 84 HG3 ARG 84 2.096 -29.067 -6.359 130 HD2 ARG 84 HD2 ARG 84 4.466 -28.762 -6.777 131 HD3 ARG 84 HD3 ARG 84 4.840 -30.362 -6.123 132 HE ARG 84 HE ARG 84 3.492 -31.358 -7.988 133 HH11 ARG 84 HH11 ARG 84 5.034 -28.256 -8.654 134 HH12 ARG 84 HH12 ARG 84 4.909 -28.511 -10.373 135 HH21 ARG 84 HH21 ARG 84 3.419 -31.596 -10.095 136 HH22 ARG 84 HH22 ARG 84 3.988 -30.340 -11.183 137 H GLU 85 H GLU 85 2.716 -27.964 -1.753 138 HA GLU 85 HA GLU 85 2.780 -29.969 0.182 139 HB2 GLU 85 HB2 GLU 85 4.204 -28.048 0.304 140 HB3 GLU 85 HB3 GLU 85 2.823 -26.952 0.507 141 HG2 GLU 85 HG2 GLU 85 2.326 -27.816 2.686 142 HG3 GLU 85 HG3 GLU 85 3.335 -29.240 2.430 143 H TRP 86 H TRP 86 0.285 -27.333 -0.136 144 HA TRP 86 HA TRP 86 -1.327 -28.125 1.973 145 HB2 TRP 86 HB2 TRP 86 -1.641 -26.030 0.789 146 HB3 TRP 86 HB3 TRP 86 -2.074 -26.882 -0.692 147 HD1 TRP 86 HD1 TRP 86 -3.444 -26.042 2.775 148 HE1 TRP 86 HE1 TRP 86 -5.993 -26.340 2.803 149 HE3 TRP 86 HE3 TRP 86 -4.087 -28.016 -1.913 150 HZ2 TRP 86 HZ2 TRP 86 -8.033 -27.403 1.065 151 HZ3 TRP 86 HZ3 TRP 86 -6.365 -28.595 -2.724 152 HH2 TRP 86 HH2 TRP 86 -8.336 -28.318 -1.233 153 H ALA 87 H ALA 87 -1.484 -29.253 -1.436 154 HA ALA 87 HA ALA 87 -3.657 -31.053 -1.116 155 HB1 ALA 87 HB1 ALA 87 -1.287 -31.039 -3.035 156 HB2 ALA 87 HB2 ALA 87 -2.747 -32.033 -3.248 157 HB3 ALA 87 HB3 ALA 87 -2.856 -30.259 -3.287 158 H ARG 88 H ARG 88 -0.110 -31.681 -0.850 159 HA ARG 88 HA ARG 88 -0.316 -34.452 -0.203 160 HB2 ARG 88 HB2 ARG 88 1.731 -33.271 -0.971 161 HB3 ARG 88 HB3 ARG 88 1.849 -32.439 0.584 162 HG2 ARG 88 HG2 ARG 88 2.156 -34.613 1.736 163 HG3 ARG 88 HG3 ARG 88 1.936 -35.471 0.195 164 HD2 ARG 88 HD2 ARG 88 3.955 -34.366 -0.709 165 HD3 ARG 88 HD3 ARG 88 4.168 -33.494 0.830 166 HE ARG 88 HE ARG 88 4.017 -36.276 1.404 167 HH11 ARG 88 HH11 ARG 88 6.279 -34.115 -0.181 168 HH12 ARG 88 HH12 ARG 88 7.648 -35.120 0.199 169 HH21 ARG 88 HH21 ARG 88 5.816 -37.513 1.860 170 HH22 ARG 88 HH22 ARG 88 7.383 -37.001 1.315 171 H ARG 89 H ARG 89 -0.214 -31.621 1.993 172 HA ARG 89 HA ARG 89 -0.390 -33.175 4.441 173 HB2 ARG 89 HB2 ARG 89 -0.944 -30.242 3.805 174 HB3 ARG 89 HB3 ARG 89 -1.046 -30.927 5.433 175 HG2 ARG 89 HG2 ARG 89 1.314 -31.651 5.322 176 HG3 ARG 89 HG3 ARG 89 1.464 -30.973 3.696 177 HD2 ARG 89 HD2 ARG 89 0.895 -28.721 4.599 178 HD3 ARG 89 HD3 ARG 89 0.790 -29.396 6.227 179 HE ARG 89 HE ARG 89 3.237 -28.856 4.646 180 HH11 ARG 89 HH11 ARG 89 2.116 -30.456 7.576 181 HH12 ARG 89 HH12 ARG 89 3.721 -30.431 8.257 182 HH21 ARG 89 HH21 ARG 89 5.109 -28.847 5.504 183 HH22 ARG 89 HH22 ARG 89 5.424 -29.532 7.099 184 H ASN 90 H ASN 90 -2.890 -32.073 2.240 185 HA ASN 90 HA ASN 90 -5.005 -33.020 4.120 186 HB2 ASN 90 HB2 ASN 90 -5.118 -31.344 1.585 187 HB3 ASN 90 HB3 ASN 90 -6.539 -31.968 2.422 188 HD21 ASN 90 HD22 ASN 90 -3.880 -29.668 2.665 189 HD22 ASN 90 HD21 ASN 90 -4.563 -28.803 4.044 190 H GLY 91 H GLY 91 -3.091 -34.596 1.970 191 HA2 GLY 91 HA2 GLY 91 -3.231 -36.714 1.115 192 HA3 GLY 91 HA3 GLY 91 -4.826 -36.889 1.847 193 H HIS 92 H HIS 92 -4.307 -34.269 -0.425 194 HA HIS 92 HA HIS 92 -6.254 -35.480 -2.323 195 HB2 HIS 92 HB2 HIS 92 -5.041 -32.686 -2.295 196 HB3 HIS 92 HB3 HIS 92 -6.371 -33.235 -3.301 197 HD1 HIS 92 HD1 HIS 92 -8.033 -34.683 -0.820 198 HD2 HIS 92 HD2 HIS 92 -6.434 -30.785 -1.091 199 HE1 HIS 92 HE1 HIS 92 -9.426 -33.219 0.766 200 HE2 HIS 92 HE2 HIS 92 -8.458 -30.834 0.584 201 H ASN 93 H ASN 93 -5.897 -35.577 -4.590 202 HA ASN 93 HA ASN 93 -3.333 -36.718 -5.231 203 HB2 ASN 93 HB2 ASN 93 -5.529 -37.554 -6.035 204 HB3 ASN 93 HB3 ASN 93 -5.724 -36.097 -7.013 205 HD21 ASN 93 HD22 ASN 93 -5.979 -38.004 -8.633 206 HD22 ASN 93 HD21 ASN 93 -4.492 -38.501 -9.431 207 H VAL 94 H VAL 94 -1.559 -35.765 -5.933 208 HA VAL 94 HA VAL 94 -1.584 -33.831 -8.081 209 HB VAL 94 HB VAL 94 -1.740 -32.270 -6.206 210 HG11 VAL 94 HG11 VAL 94 -0.676 -33.587 -4.404 211 HG12 VAL 94 HG12 VAL 94 0.903 -33.436 -5.215 212 HG13 VAL 94 HG13 VAL 94 0.088 -32.002 -4.589 213 HG21 VAL 94 HG21 VAL 94 1.052 -32.149 -7.372 214 HG22 VAL 94 HG22 VAL 94 -0.422 -31.702 -8.256 215 HG23 VAL 94 HG23 VAL 94 0.035 -30.812 -6.794 216 H SER 95 H SER 95 0.300 -33.949 -9.334 217 HA SER 95 HA SER 95 2.184 -36.121 -8.636 218 HB2 SER 95 HB2 SER 95 1.212 -36.141 -10.872 219 HB3 SER 95 HB3 SER 95 1.892 -34.533 -11.200 220 HG SER 95 HG SER 95 3.193 -36.370 -11.948 221 H THR 96 H THR 96 4.413 -35.844 -8.466 222 HA THR 96 HA THR 96 5.424 -33.242 -7.596 223 HB THR 96 HB THR 96 7.600 -34.499 -7.432 224 HG1 THR 96 HG1 THR 96 7.492 -36.726 -7.711 225 HG21 THR 96 HG21 THR 96 5.994 -34.407 -5.521 226 HG22 THR 96 HG22 THR 96 5.236 -35.905 -6.108 227 HG23 THR 96 HG23 THR 96 6.929 -35.915 -5.567 228 H ARG 97 H ARG 97 5.079 -34.735 -10.649 229 HA ARG 97 HA ARG 97 7.111 -32.938 -11.949 230 HB2 ARG 97 HB2 ARG 97 5.945 -35.628 -12.782 231 HB3 ARG 97 HB3 ARG 97 6.910 -34.616 -13.857 232 HG2 ARG 97 HG2 ARG 97 8.855 -35.258 -12.959 233 HG3 ARG 97 HG3 ARG 97 8.315 -35.002 -11.303 234 HD2 ARG 97 HD2 ARG 97 7.614 -37.450 -12.969 235 HD3 ARG 97 HD3 ARG 97 8.972 -37.367 -11.843 236 HE ARG 97 HE ARG 97 7.221 -36.767 -10.060 237 HH11 ARG 97 HH11 ARG 97 6.415 -38.989 -12.660 238 HH12 ARG 97 HH12 ARG 97 5.245 -39.831 -11.680 239 HH21 ARG 97 HH21 ARG 97 5.801 -37.867 -8.895 240 HH22 ARG 97 HH22 ARG 97 4.888 -39.196 -9.580 241 H GLY 98 H GLY 98 6.547 -32.060 -14.010 242 HA2 GLY 98 HA2 GLY 98 5.224 -30.891 -15.498 243 HA3 GLY 98 HA3 GLY 98 3.982 -32.107 -15.197 244 H ARG 99 H ARG 99 2.472 -30.388 -15.558 245 HA ARG 99 HA ARG 99 2.195 -28.184 -13.618 246 HB2 ARG 99 HB2 ARG 99 0.394 -29.143 -15.891 247 HB3 ARG 99 HB3 ARG 99 0.084 -27.719 -14.888 248 HG2 ARG 99 HG2 ARG 99 2.232 -26.710 -15.634 249 HG3 ARG 99 HG3 ARG 99 2.529 -28.110 -16.678 250 HD2 ARG 99 HD2 ARG 99 0.446 -27.642 -17.919 251 HD3 ARG 99 HD3 ARG 99 0.148 -26.225 -16.885 252 HE ARG 99 HE ARG 99 2.749 -25.968 -18.013 253 HH11 ARG 99 HH11 ARG 99 -0.564 -25.867 -19.157 254 HH12 ARG 99 HH12 ARG 99 -0.171 -24.813 -20.487 255 HH21 ARG 99 HH21 ARG 99 3.181 -24.616 -19.728 256 HH22 ARG 99 HH22 ARG 99 1.902 -24.130 -20.798 257 H ILE 100 H ILE 100 0.374 -27.850 -12.292 258 HA ILE 100 HA ILE 100 -0.488 -30.246 -10.827 259 HB ILE 100 HB ILE 100 -0.928 -27.290 -10.352 260 HG12 ILE 100 HG12 ILE 100 0.896 -29.340 -9.005 261 HG13 ILE 100 HG13 ILE 100 1.414 -28.066 -10.113 262 HG21 ILE 100 HG21 ILE 100 -1.845 -27.805 -8.181 263 HG22 ILE 100 HG22 ILE 100 -2.799 -28.689 -9.352 264 HG23 ILE 100 HG23 ILE 100 -1.574 -29.540 -8.381 265 HD11 ILE 100 HD11 ILE 100 0.504 -26.359 -8.491 266 HD12 ILE 100 HD12 ILE 100 0.289 -27.693 -7.328 267 HD13 ILE 100 HD13 ILE 100 1.907 -27.305 -7.945 268 HA PRO 101 HA PRO 101 -4.451 -30.523 -12.986 269 HB2 PRO 101 HB2 PRO 101 -5.978 -31.816 -11.076 270 HB3 PRO 101 HB3 PRO 101 -4.736 -32.624 -12.090 271 HG2 PRO 101 HG2 PRO 101 -4.437 -31.532 -9.277 272 HG3 PRO 101 HG3 PRO 101 -3.952 -33.145 -9.887 273 HD2 PRO 101 HD2 PRO 101 -2.199 -31.143 -9.636 274 HD3 PRO 101 HD3 PRO 101 -2.115 -32.213 -11.066 275 H ALA 102 H ALA 102 -6.098 -29.073 -13.266 276 HA ALA 102 HA ALA 102 -6.367 -26.848 -11.606 277 HB1 ALA 102 HB1 ALA 102 -8.224 -26.227 -12.994 278 HB2 ALA 102 HB2 ALA 102 -6.926 -26.915 -13.991 279 HB3 ALA 102 HB3 ALA 102 -8.376 -27.892 -13.613 280 H ASP 103 H ASP 103 -8.123 -29.909 -11.367 281 HA ASP 103 HA ASP 103 -10.243 -29.121 -9.770 282 HB2 ASP 103 HB2 ASP 103 -10.016 -31.321 -10.815 283 HB3 ASP 103 HB3 ASP 103 -8.663 -31.714 -9.751 284 H VAL 104 H VAL 104 -6.884 -29.970 -8.779 285 HA VAL 104 HA VAL 104 -7.542 -29.610 -5.993 286 HB VAL 104 HB VAL 104 -5.857 -31.284 -6.879 287 HG11 VAL 104 HG11 VAL 104 -4.409 -29.673 -8.115 288 HG12 VAL 104 HG12 VAL 104 -3.917 -28.951 -6.570 289 HG13 VAL 104 HG13 VAL 104 -3.536 -30.651 -6.944 290 HG21 VAL 104 HG21 VAL 104 -5.059 -29.584 -4.492 291 HG22 VAL 104 HG22 VAL 104 -6.323 -30.839 -4.487 292 HG23 VAL 104 HG23 VAL 104 -4.638 -31.280 -4.802 293 H ILE 105 H ILE 105 -6.108 -27.585 -8.507 294 HA ILE 105 HA ILE 105 -5.396 -25.367 -6.800 295 HB ILE 105 HB ILE 105 -6.224 -25.585 -9.722 296 HG12 ILE 105 HG12 ILE 105 -3.469 -24.800 -8.718 297 HG13 ILE 105 HG13 ILE 105 -3.919 -26.495 -8.605 298 HG21 ILE 105 HG21 ILE 105 -6.761 -23.314 -9.080 299 HG22 ILE 105 HG22 ILE 105 -5.214 -23.133 -8.215 300 HG23 ILE 105 HG23 ILE 105 -5.249 -23.280 -9.984 301 HD11 ILE 105 HD11 ILE 105 -2.723 -25.933 -10.713 302 HD12 ILE 105 HD12 ILE 105 -4.317 -26.669 -10.941 303 HD13 ILE 105 HD13 ILE 105 -4.095 -24.920 -11.199 304 H ASP 106 H ASP 106 -8.492 -26.133 -8.526 305 HA ASP 106 HA ASP 106 -9.952 -23.985 -7.539 306 HB2 ASP 106 HB2 ASP 106 -10.662 -25.410 -9.400 307 HB3 ASP 106 HB3 ASP 106 -10.903 -26.764 -8.289 308 H ALA 107 H ALA 107 -9.655 -27.307 -6.120 309 HA ALA 107 HA ALA 107 -11.161 -26.878 -3.845 310 HB1 ALA 107 HB1 ALA 107 -9.963 -28.811 -2.927 311 HB2 ALA 107 HB2 ALA 107 -10.329 -29.068 -4.641 312 HB3 ALA 107 HB3 ALA 107 -8.681 -28.619 -4.143 313 H TYR 108 H TYR 108 -7.649 -26.218 -4.304 314 HA TYR 108 HA TYR 108 -7.092 -25.204 -1.699 315 HB2 TYR 108 HB2 TYR 108 -5.327 -25.829 -3.207 316 HB3 TYR 108 HB3 TYR 108 -5.864 -24.701 -4.432 317 HD1 TYR 108 HD1 TYR 108 -4.300 -24.948 -1.062 318 HD2 TYR 108 HD2 TYR 108 -5.178 -22.407 -4.435 319 HE1 TYR 108 HE1 TYR 108 -2.707 -23.245 -0.190 320 HE2 TYR 108 HE2 TYR 108 -3.618 -20.686 -3.545 321 HH TYR 108 HH TYR 108 -2.134 -20.128 -1.874 322 H HIS 109 H HIS 109 -8.142 -23.429 -4.680 323 HA HIS 109 HA HIS 109 -8.316 -20.848 -3.423 324 HB2 HIS 109 HB2 HIS 109 -9.829 -22.010 -5.805 325 HB3 HIS 109 HB3 HIS 109 -9.901 -20.328 -5.313 326 HD1 HIS 109 HD1 HIS 109 -8.769 -21.194 -8.163 327 HD2 HIS 109 HD2 HIS 109 -6.568 -20.177 -4.702 328 HE1 HIS 109 HE1 HIS 109 -6.474 -20.354 -8.976 329 HE2 HIS 109 HE2 HIS 109 -5.140 -19.748 -6.857 330 H ALA 110 H ALA 110 -10.902 -23.388 -3.717 331 HA ALA 110 HA ALA 110 -12.846 -21.860 -2.342 332 HB1 ALA 110 HB1 ALA 110 -13.332 -23.916 -3.624 333 HB2 ALA 110 HB2 ALA 110 -12.454 -24.889 -2.426 334 HB3 ALA 110 HB3 ALA 110 -13.950 -24.050 -1.969 335 H ALA 111 H ALA 111 -10.458 -24.228 -0.957 336 HA ALA 111 HA ALA 111 -11.247 -23.976 1.682 337 HB1 ALA 111 HB1 ALA 111 -8.499 -24.587 0.523 338 HB2 ALA 111 HB2 ALA 111 -9.036 -24.977 2.169 339 HB3 ALA 111 HB3 ALA 111 -9.820 -25.754 0.782 340 H THR 112 H THR 112 -8.908 -21.994 -0.130 341 HA THR 112 HA THR 112 -8.079 -20.489 2.256 342 HB THR 112 HB THR 112 -6.640 -19.218 0.667 343 HG1 THR 112 HG1 THR 112 -7.342 -21.192 -1.211 344 HG21 THR 112 HG21 THR 112 -5.101 -21.064 0.190 345 HG22 THR 112 HG22 THR 112 -5.766 -21.193 1.826 346 HG23 THR 112 HG23 THR 112 -6.374 -22.255 0.538 347 H LEU 113 H LEU 113 -10.228 -19.788 -0.508 348 HA LEU 113 HA LEU 113 -10.442 -16.957 0.309 349 HB2 LEU 113 HB2 LEU 113 -11.778 -18.464 -1.969 350 HB3 LEU 113 HB3 LEU 113 -11.776 -16.718 -1.743 351 HG LEU 113 HG LEU 113 -9.306 -18.415 -2.250 352 HD11 LEU 113 HD11 LEU 113 -10.821 -18.281 -4.200 353 HD12 LEU 113 HD12 LEU 113 -10.803 -16.511 -4.098 354 HD13 LEU 113 HD13 LEU 113 -9.310 -17.400 -4.485 355 HD21 LEU 113 HD21 LEU 113 -8.168 -16.249 -2.679 356 HD22 LEU 113 HD22 LEU 113 -9.624 -15.383 -2.123 357 HD23 LEU 113 HD23 LEU 113 -8.695 -16.400 -1.001 358 H GLU 114 H GLU 114 -12.530 -19.820 0.246 359 HA GLU 114 HA GLU 114 -14.843 -18.288 1.222 360 HB2 GLU 114 HB2 GLU 114 -14.992 -20.218 -0.397 361 HB3 GLU 114 HB3 GLU 114 -14.685 -21.306 0.962 362 HG2 GLU 114 HG2 GLU 114 -16.680 -20.435 2.129 363 HG3 GLU 114 HG3 GLU 114 -16.961 -19.280 0.825 364 H HIS 115 H HIS 115 -13.502 -17.478 3.070 365 HA HIS 115 HA HIS 115 -12.521 -19.025 5.165 366 HB2 HIS 115 HB2 HIS 115 -12.122 -16.603 4.759 367 HB3 HIS 115 HB3 HIS 115 -13.754 -16.237 5.302 368 HD1 HIS 115 HD1 HIS 115 -10.438 -17.668 6.745 369 HD2 HIS 115 HD2 HIS 115 -14.062 -15.811 7.882 370 HE1 HIS 115 HE1 HIS 115 -10.219 -17.127 9.253 371 HE2 HIS 115 HE2 HIS 115 -12.434 -15.998 9.938 372 H HIS 116 H HIS 116 -15.888 -18.337 4.598 373 HA HIS 116 HA HIS 116 -16.771 -19.181 7.272 374 HB2 HIS 116 HB2 HIS 116 -17.725 -17.314 5.700 375 HB3 HIS 116 HB3 HIS 116 -18.610 -18.624 4.937 376 HD1 HIS 116 HD1 HIS 116 -19.860 -20.195 7.247 377 HD2 HIS 116 HD2 HIS 116 -19.175 -16.029 7.347 378 HE1 HIS 116 HE1 HIS 116 -21.502 -19.225 8.997 379 HE2 HIS 116 HE2 HIS 116 -21.066 -16.684 9.051 380 H HIS 117 H HIS 117 -15.684 -21.105 4.774 381 HA HIS 117 HA HIS 117 -17.772 -23.010 4.482 382 HB2 HIS 117 HB2 HIS 117 -16.209 -24.447 3.451 383 HB3 HIS 117 HB3 HIS 117 -15.762 -22.817 3.008 384 HD1 HIS 117 HD1 HIS 117 -13.376 -21.954 3.887 385 HD2 HIS 117 HD2 HIS 117 -14.490 -25.869 5.005 386 HE1 HIS 117 HE1 HIS 117 -11.244 -23.078 4.851 387 HE2 HIS 117 HE2 HIS 117 -11.946 -25.465 5.521 388 H HIS 118 H HIS 118 -18.182 -25.041 5.356 389 HA HIS 118 HA HIS 118 -16.916 -25.880 7.898 390 HB2 HIS 118 HB2 HIS 118 -18.728 -24.160 8.427 391 HB3 HIS 118 HB3 HIS 118 -19.908 -25.251 7.718 392 HD1 HIS 118 HD1 HIS 118 -20.929 -26.995 9.434 393 HD2 HIS 118 HD2 HIS 118 -17.307 -25.152 10.645 394 HE1 HIS 118 HE1 HIS 118 -20.512 -27.719 11.870 395 HE2 HIS 118 HE2 HIS 118 -18.306 -26.593 12.600 396 H HIS 119 H HIS 119 -17.731 -27.994 8.649 397 HA HIS 119 HA HIS 119 -18.167 -29.872 6.433 398 HB2 HIS 119 HB2 HIS 119 -17.886 -31.602 8.244 399 HB3 HIS 119 HB3 HIS 119 -16.526 -30.552 7.922 400 HD1 HIS 119 HD1 HIS 119 -15.495 -29.310 9.972 401 HD2 HIS 119 HD2 HIS 119 -19.263 -31.088 10.659 402 HE1 HIS 119 HE1 HIS 119 -15.929 -29.155 12.508 403 HE2 HIS 119 HE2 HIS 119 -18.221 -30.251 12.914 404 H HIS 120 H HIS 120 -20.230 -28.728 5.976 405 HA HIS 120 HA HIS 120 -22.473 -28.432 5.965 406 HB2 HIS 120 HB2 HIS 120 -22.591 -31.328 6.876 407 HB3 HIS 120 HB3 HIS 120 -23.877 -30.427 6.084 408 HD1 HIS 120 HD1 HIS 120 -21.286 -32.817 5.193 409 HD2 HIS 120 HD2 HIS 120 -22.985 -29.339 3.502 410 HE1 HIS 120 HE1 HIS 120 -20.759 -32.905 2.671 411 HE2 HIS 120 HE2 HIS 120 -21.791 -30.778 1.648 Start of MODEL 8 1 H1 SER 66 H1 SER 66 2.610 -1.727 -23.462 2 H2 SER 66 H2 SER 66 2.809 -2.090 -21.881 3 H3 SER 66 H3 SER 66 3.694 -0.891 -22.560 4 HA SER 66 HA SER 66 3.863 -3.755 -23.235 5 HB2 SER 66 HB2 SER 66 5.551 -1.461 -24.308 6 HB3 SER 66 HB3 SER 66 5.734 -3.183 -24.703 7 HG SER 66 HG SER 66 4.486 -2.096 -26.287 8 H GLY 67 H GLY 67 5.788 -4.856 -22.551 9 HA2 GLY 67 HA2 GLY 67 7.591 -5.344 -21.186 10 HA3 GLY 67 HA3 GLY 67 7.805 -3.630 -20.864 11 H SER 68 H SER 68 8.376 -4.420 -18.719 12 HA SER 68 HA SER 68 6.070 -4.437 -16.876 13 HB2 SER 68 HB2 SER 68 6.649 -6.847 -17.375 14 HB3 SER 68 HB3 SER 68 8.253 -6.543 -16.684 15 HG SER 68 HG SER 68 5.702 -6.441 -15.400 16 H GLY 69 H GLY 69 6.605 -3.830 -14.729 17 HA2 GLY 69 HA2 GLY 69 8.676 -1.844 -14.455 18 HA3 GLY 69 HA3 GLY 69 7.584 -2.404 -13.192 19 H ARG 70 H ARG 70 10.306 -1.753 -12.842 20 HA ARG 70 HA ARG 70 11.754 -4.348 -12.435 21 HB2 ARG 70 HB2 ARG 70 13.002 -1.600 -12.797 22 HB3 ARG 70 HB3 ARG 70 13.807 -3.169 -12.859 23 HG2 ARG 70 HG2 ARG 70 11.869 -2.009 -14.904 24 HG3 ARG 70 HG3 ARG 70 13.604 -2.199 -15.087 25 HD2 ARG 70 HD2 ARG 70 13.416 -4.626 -15.147 26 HD3 ARG 70 HD3 ARG 70 11.716 -4.556 -14.697 27 HE ARG 70 HE ARG 70 11.085 -3.806 -16.803 28 HH11 ARG 70 HH11 ARG 70 14.576 -4.256 -16.790 29 HH12 ARG 70 HH12 ARG 70 14.683 -4.128 -18.527 30 HH21 ARG 70 HH21 ARG 70 11.315 -3.611 -18.989 31 HH22 ARG 70 HH22 ARG 70 12.876 -3.795 -19.741 32 H GLY 71 H GLY 71 13.540 -4.167 -10.753 33 HA2 GLY 71 HA2 GLY 71 14.200 -3.887 -8.556 34 HA3 GLY 71 HA3 GLY 71 13.212 -2.424 -8.478 35 H ARG 72 H ARG 72 12.067 -5.701 -9.193 36 HA ARG 72 HA ARG 72 10.501 -5.836 -6.653 37 HB2 ARG 72 HB2 ARG 72 8.497 -6.437 -7.883 38 HB3 ARG 72 HB3 ARG 72 9.067 -4.852 -8.402 39 HG2 ARG 72 HG2 ARG 72 9.958 -5.761 -10.477 40 HG3 ARG 72 HG3 ARG 72 9.682 -7.423 -9.939 41 HD2 ARG 72 HD2 ARG 72 7.217 -6.960 -9.857 42 HD3 ARG 72 HD3 ARG 72 7.537 -5.351 -10.505 43 HE ARG 72 HE ARG 72 8.017 -6.236 -12.603 44 HH11 ARG 72 HH21 ARG 72 7.947 -9.018 -10.417 45 HH12 ARG 72 HH22 ARG 72 7.645 -10.117 -11.735 46 HH21 ARG 72 HH11 ARG 72 7.507 -7.697 -14.169 47 HH22 ARG 72 HH12 ARG 72 7.531 -9.406 -13.813 48 H GLY 73 H GLY 73 9.483 -7.938 -6.275 49 HA2 GLY 73 HA2 GLY 73 11.249 -10.224 -6.793 50 HA3 GLY 73 HA3 GLY 73 9.762 -10.223 -5.853 51 H ALA 74 H ALA 74 10.320 -12.293 -7.500 52 HA ALA 74 HA ALA 74 7.949 -12.344 -9.203 53 HB1 ALA 74 HB1 ALA 74 9.707 -11.593 -10.795 54 HB2 ALA 74 HB2 ALA 74 10.713 -12.981 -10.340 55 HB3 ALA 74 HB3 ALA 74 9.163 -13.239 -11.169 56 H ILE 75 H ILE 75 7.268 -14.502 -9.733 57 HA ILE 75 HA ILE 75 8.205 -16.523 -7.755 58 HB ILE 75 HB ILE 75 5.614 -16.314 -9.309 59 HG12 ILE 75 HG12 ILE 75 4.585 -16.334 -7.002 60 HG13 ILE 75 HG13 ILE 75 6.190 -16.172 -6.303 61 HG21 ILE 75 HG21 ILE 75 6.514 -18.514 -7.392 62 HG22 ILE 75 HG22 ILE 75 4.876 -18.330 -8.053 63 HG23 ILE 75 HG23 ILE 75 6.197 -18.705 -9.135 64 HD11 ILE 75 HD11 ILE 75 4.956 -14.132 -8.210 65 HD12 ILE 75 HD12 ILE 75 4.786 -14.069 -6.445 66 HD13 ILE 75 HD13 ILE 75 6.386 -13.909 -7.166 67 H ASP 76 H ASP 76 9.280 -18.248 -8.371 68 HA ASP 76 HA ASP 76 9.435 -19.029 -11.250 69 HB2 ASP 76 HB2 ASP 76 11.554 -18.766 -10.076 70 HB3 ASP 76 HB3 ASP 76 11.070 -19.954 -8.869 71 H ARG 77 H ARG 77 9.098 -20.778 -8.132 72 HA ARG 77 HA ARG 77 6.710 -22.221 -9.195 73 HB2 ARG 77 HB2 ARG 77 7.640 -24.345 -8.734 74 HB3 ARG 77 HB3 ARG 77 8.842 -23.411 -9.628 75 HG2 ARG 77 HG2 ARG 77 9.930 -22.884 -7.335 76 HG3 ARG 77 HG3 ARG 77 8.853 -24.114 -6.662 77 HD2 ARG 77 HD2 ARG 77 10.963 -25.153 -7.105 78 HD3 ARG 77 HD3 ARG 77 9.808 -25.765 -8.307 79 HE ARG 77 HE ARG 77 11.162 -23.434 -9.341 80 HH11 ARG 77 HH11 ARG 77 11.957 -26.814 -8.752 81 HH12 ARG 77 HH12 ARG 77 13.174 -26.793 -9.999 82 HH21 ARG 77 HH21 ARG 77 12.580 -23.459 -10.772 83 HH22 ARG 77 HH22 ARG 77 13.553 -24.879 -11.171 84 H GLU 78 H GLU 78 7.659 -20.381 -6.642 85 HA GLU 78 HA GLU 78 7.142 -21.852 -4.344 86 HB2 GLU 78 HB2 GLU 78 8.159 -19.600 -4.476 87 HB3 GLU 78 HB3 GLU 78 6.567 -18.896 -4.777 88 HG2 GLU 78 HG2 GLU 78 5.792 -19.655 -2.559 89 HG3 GLU 78 HG3 GLU 78 7.321 -20.496 -2.286 90 H GLN 79 H GLN 79 4.631 -19.995 -6.174 91 HA GLN 79 HA GLN 79 2.519 -20.699 -4.362 92 HB2 GLN 79 HB2 GLN 79 1.010 -19.811 -5.953 93 HB3 GLN 79 HB3 GLN 79 2.461 -18.806 -5.942 94 HG2 GLN 79 HG2 GLN 79 3.207 -20.001 -8.059 95 HG3 GLN 79 HG3 GLN 79 1.655 -20.837 -8.074 96 HE21 GLN 79 HE22 GLN 79 2.033 -19.532 -10.340 97 HE22 GLN 79 HE21 GLN 79 1.167 -18.008 -10.352 98 H SER 80 H SER 80 3.800 -22.361 -7.193 99 HA SER 80 HA SER 80 1.785 -24.435 -7.362 100 HB2 SER 80 HB2 SER 80 3.373 -23.771 -9.188 101 HB3 SER 80 HB3 SER 80 4.694 -24.512 -8.274 102 HG SER 80 HG SER 80 3.762 -25.954 -9.828 103 H ALA 81 H ALA 81 5.076 -24.367 -5.863 104 HA ALA 81 HA ALA 81 4.951 -26.853 -4.610 105 HB1 ALA 81 HB1 ALA 81 6.391 -24.310 -3.738 106 HB2 ALA 81 HB2 ALA 81 6.769 -25.960 -3.189 107 HB3 ALA 81 HB3 ALA 81 6.995 -25.520 -4.892 108 H ALA 82 H ALA 82 3.769 -23.677 -3.363 109 HA ALA 82 HA ALA 82 2.936 -24.614 -0.811 110 HB1 ALA 82 HB1 ALA 82 1.567 -22.573 -0.772 111 HB2 ALA 82 HB2 ALA 82 3.185 -22.238 -1.415 112 HB3 ALA 82 HB3 ALA 82 1.799 -22.357 -2.520 113 H ILE 83 H ILE 83 1.074 -24.488 -3.915 114 HA ILE 83 HA ILE 83 -1.321 -25.642 -2.790 115 HB ILE 83 HB ILE 83 -0.322 -25.399 -5.645 116 HG12 ILE 83 HG12 ILE 83 -2.507 -23.953 -4.069 117 HG13 ILE 83 HG13 ILE 83 -0.913 -23.303 -4.363 118 HG21 ILE 83 HG21 ILE 83 -3.065 -26.361 -4.674 119 HG22 ILE 83 HG22 ILE 83 -2.632 -26.012 -6.363 120 HG23 ILE 83 HG23 ILE 83 -1.869 -27.351 -5.537 121 HD11 ILE 83 HD11 ILE 83 -1.391 -23.412 -6.855 122 HD12 ILE 83 HD12 ILE 83 -3.082 -23.795 -6.426 123 HD13 ILE 83 HD13 ILE 83 -2.367 -22.262 -5.917 124 H ARG 84 H ARG 84 1.529 -27.158 -4.373 125 HA ARG 84 HA ARG 84 0.619 -29.875 -4.235 126 HB2 ARG 84 HB2 ARG 84 2.672 -29.034 -5.469 127 HB3 ARG 84 HB3 ARG 84 3.455 -28.784 -3.915 128 HG2 ARG 84 HG2 ARG 84 2.940 -31.384 -3.557 129 HG3 ARG 84 HG3 ARG 84 2.726 -31.372 -5.306 130 HD2 ARG 84 HD2 ARG 84 5.009 -31.976 -4.857 131 HD3 ARG 84 HD3 ARG 84 5.029 -30.318 -5.483 132 HE ARG 84 HE ARG 84 4.950 -30.659 -2.524 133 HH11 ARG 84 HH11 ARG 84 7.130 -30.116 -5.225 134 HH12 ARG 84 HH12 ARG 84 8.363 -29.469 -4.182 135 HH21 ARG 84 HH21 ARG 84 6.491 -29.867 -1.293 136 HH22 ARG 84 HH22 ARG 84 8.021 -29.340 -1.976 137 H GLU 85 H GLU 85 2.619 -28.068 -1.812 138 HA GLU 85 HA GLU 85 2.591 -30.191 -0.002 139 HB2 GLU 85 HB2 GLU 85 4.037 -27.943 -0.152 140 HB3 GLU 85 HB3 GLU 85 2.866 -27.391 1.044 141 HG2 GLU 85 HG2 GLU 85 4.776 -28.333 2.187 142 HG3 GLU 85 HG3 GLU 85 3.394 -29.406 2.429 143 H TRP 86 H TRP 86 0.356 -27.374 -0.192 144 HA TRP 86 HA TRP 86 -1.291 -28.002 1.955 145 HB2 TRP 86 HB2 TRP 86 -1.501 -25.932 0.728 146 HB3 TRP 86 HB3 TRP 86 -1.903 -26.788 -0.755 147 HD1 TRP 86 HD1 TRP 86 -3.435 -25.555 2.478 148 HE1 TRP 86 HE1 TRP 86 -5.983 -25.887 2.444 149 HE3 TRP 86 HE3 TRP 86 -3.861 -28.180 -1.902 150 HZ2 TRP 86 HZ2 TRP 86 -7.905 -27.385 0.891 151 HZ3 TRP 86 HZ3 TRP 86 -6.045 -29.123 -2.600 152 HH2 TRP 86 HH2 TRP 86 -8.069 -28.769 -1.163 153 H ALA 87 H ALA 87 -1.481 -29.227 -1.436 154 HA ALA 87 HA ALA 87 -3.747 -30.890 -1.011 155 HB1 ALA 87 HB1 ALA 87 -2.977 -30.166 -3.216 156 HB2 ALA 87 HB2 ALA 87 -1.471 -31.085 -3.049 157 HB3 ALA 87 HB3 ALA 87 -3.022 -31.941 -3.165 158 H ARG 88 H ARG 88 -0.261 -31.672 -0.791 159 HA ARG 88 HA ARG 88 -0.430 -34.409 -0.045 160 HB2 ARG 88 HB2 ARG 88 1.628 -33.083 -0.667 161 HB3 ARG 88 HB3 ARG 88 1.563 -32.302 0.910 162 HG2 ARG 88 HG2 ARG 88 1.768 -34.626 1.962 163 HG3 ARG 88 HG3 ARG 88 2.066 -35.244 0.320 164 HD2 ARG 88 HD2 ARG 88 3.987 -33.625 0.131 165 HD3 ARG 88 HD3 ARG 88 3.641 -33.092 1.791 166 HE ARG 88 HE ARG 88 4.105 -35.972 1.524 167 HH11 ARG 88 HH11 ARG 88 5.710 -32.875 2.127 168 HH12 ARG 88 HH12 ARG 88 7.103 -33.664 2.827 169 HH21 ARG 88 HH21 ARG 88 5.910 -36.866 2.466 170 HH22 ARG 88 HH22 ARG 88 7.202 -35.851 3.031 171 H ARG 89 H ARG 89 -0.505 -31.512 2.066 172 HA ARG 89 HA ARG 89 -0.879 -32.957 4.550 173 HB2 ARG 89 HB2 ARG 89 -1.338 -30.061 3.728 174 HB3 ARG 89 HB3 ARG 89 -1.580 -30.645 5.377 175 HG2 ARG 89 HG2 ARG 89 0.757 -31.317 5.573 176 HG3 ARG 89 HG3 ARG 89 1.055 -30.981 3.872 177 HD2 ARG 89 HD2 ARG 89 1.957 -29.172 5.143 178 HD3 ARG 89 HD3 ARG 89 0.543 -28.578 4.252 179 HE ARG 89 HE ARG 89 -0.207 -29.453 6.905 180 HH11 ARG 89 HH11 ARG 89 1.446 -26.753 5.388 181 HH12 ARG 89 HH12 ARG 89 1.031 -25.660 6.680 182 HH21 ARG 89 HH21 ARG 89 -0.725 -27.993 8.499 183 HH22 ARG 89 HH22 ARG 89 -0.166 -26.353 8.390 184 H ASN 90 H ASN 90 -3.205 -31.789 2.177 185 HA ASN 90 HA ASN 90 -5.503 -32.532 3.895 186 HB2 ASN 90 HB2 ASN 90 -5.237 -31.199 1.177 187 HB3 ASN 90 HB3 ASN 90 -6.785 -31.745 1.803 188 HD21 ASN 90 HD22 ASN 90 -4.149 -29.467 2.356 189 HD22 ASN 90 HD21 ASN 90 -5.070 -28.439 3.452 190 H GLY 91 H GLY 91 -3.471 -34.332 1.900 191 HA2 GLY 91 HA2 GLY 91 -3.595 -36.516 1.206 192 HA3 GLY 91 HA3 GLY 91 -5.213 -36.649 1.907 193 H HIS 92 H HIS 92 -4.596 -34.120 -0.453 194 HA HIS 92 HA HIS 92 -6.497 -35.404 -2.349 195 HB2 HIS 92 HB2 HIS 92 -6.772 -33.015 -1.511 196 HB3 HIS 92 HB3 HIS 92 -5.364 -32.579 -2.470 197 HD1 HIS 92 HD1 HIS 92 -9.072 -33.331 -2.787 198 HD2 HIS 92 HD2 HIS 92 -5.674 -32.785 -5.239 199 HE1 HIS 92 HE1 HIS 92 -9.949 -32.956 -5.183 200 HE2 HIS 92 HE2 HIS 92 -7.886 -32.635 -6.686 201 H ASN 93 H ASN 93 -5.982 -35.896 -4.486 202 HA ASN 93 HA ASN 93 -3.317 -36.817 -4.952 203 HB2 ASN 93 HB2 ASN 93 -5.432 -37.830 -5.837 204 HB3 ASN 93 HB3 ASN 93 -5.615 -36.452 -6.922 205 HD21 ASN 93 HD22 ASN 93 -5.664 -38.418 -8.465 206 HD22 ASN 93 HD21 ASN 93 -4.102 -38.918 -9.095 207 H VAL 94 H VAL 94 -1.570 -35.921 -5.933 208 HA VAL 94 HA VAL 94 -1.812 -33.736 -7.849 209 HB VAL 94 HB VAL 94 -1.804 -32.514 -5.707 210 HG11 VAL 94 HG11 VAL 94 -0.425 -34.022 -4.312 211 HG12 VAL 94 HG12 VAL 94 1.011 -33.587 -5.257 212 HG13 VAL 94 HG13 VAL 94 0.174 -32.360 -4.292 213 HG21 VAL 94 HG21 VAL 94 -0.850 -31.520 -7.774 214 HG22 VAL 94 HG22 VAL 94 -0.155 -30.872 -6.282 215 HG23 VAL 94 HG23 VAL 94 0.772 -32.037 -7.248 216 H SER 95 H SER 95 -0.097 -33.651 -9.288 217 HA SER 95 HA SER 95 1.732 -35.977 -9.208 218 HB2 SER 95 HB2 SER 95 0.389 -35.620 -11.210 219 HB3 SER 95 HB3 SER 95 1.128 -34.020 -11.443 220 HG SER 95 HG SER 95 2.095 -35.831 -12.647 221 H THR 96 H THR 96 3.930 -35.892 -9.363 222 HA THR 96 HA THR 96 5.351 -33.305 -8.914 223 HB THR 96 HB THR 96 7.288 -34.762 -8.363 224 HG1 THR 96 HG1 THR 96 6.846 -36.995 -8.088 225 HG21 THR 96 HG21 THR 96 5.728 -34.002 -6.566 226 HG22 THR 96 HG22 THR 96 4.793 -35.501 -6.763 227 HG23 THR 96 HG23 THR 96 6.482 -35.569 -6.211 228 H ARG 97 H ARG 97 4.440 -35.229 -11.512 229 HA ARG 97 HA ARG 97 7.019 -35.094 -12.980 230 HB2 ARG 97 HB2 ARG 97 4.416 -36.458 -13.762 231 HB3 ARG 97 HB3 ARG 97 5.990 -36.677 -14.506 232 HG2 ARG 97 HG2 ARG 97 5.118 -37.566 -11.731 233 HG3 ARG 97 HG3 ARG 97 5.504 -38.588 -13.107 234 HD2 ARG 97 HD2 ARG 97 7.469 -36.856 -11.547 235 HD3 ARG 97 HD3 ARG 97 7.293 -38.614 -11.439 236 HE ARG 97 HE ARG 97 7.787 -38.139 -14.136 237 HH11 ARG 97 HH11 ARG 97 9.583 -37.558 -11.182 238 HH12 ARG 97 HH12 ARG 97 11.123 -37.646 -11.993 239 HH21 ARG 97 HH21 ARG 97 9.788 -38.231 -15.111 240 HH22 ARG 97 HH22 ARG 97 11.228 -38.038 -14.156 241 H GLY 98 H GLY 98 4.540 -32.974 -12.704 242 HA2 GLY 98 HA2 GLY 98 5.271 -31.389 -14.992 243 HA3 GLY 98 HA3 GLY 98 3.739 -32.220 -15.281 244 H ARG 99 H ARG 99 2.919 -29.988 -15.425 245 HA ARG 99 HA ARG 99 2.751 -28.256 -13.098 246 HB2 ARG 99 HB2 ARG 99 1.125 -28.336 -15.678 247 HB3 ARG 99 HB3 ARG 99 0.983 -27.083 -14.442 248 HG2 ARG 99 HG2 ARG 99 3.390 -26.512 -14.733 249 HG3 ARG 99 HG3 ARG 99 3.512 -27.713 -16.029 250 HD2 ARG 99 HD2 ARG 99 1.758 -26.475 -17.316 251 HD3 ARG 99 HD3 ARG 99 1.660 -25.293 -16.013 252 HE ARG 99 HE ARG 99 3.722 -24.371 -16.618 253 HH11 ARG 99 HH11 ARG 99 3.166 -27.162 -18.674 254 HH12 ARG 99 HH12 ARG 99 4.437 -26.708 -19.775 255 HH21 ARG 99 HH21 ARG 99 5.324 -23.861 -18.060 256 HH22 ARG 99 HH22 ARG 99 5.631 -24.890 -19.424 257 H ILE 100 H ILE 100 0.936 -27.738 -11.836 258 HA ILE 100 HA ILE 100 -0.484 -30.056 -10.859 259 HB ILE 100 HB ILE 100 -0.618 -27.134 -10.089 260 HG12 ILE 100 HG12 ILE 100 0.695 -29.621 -8.884 261 HG13 ILE 100 HG13 ILE 100 1.513 -28.250 -9.626 262 HG21 ILE 100 HG21 ILE 100 -1.950 -29.499 -8.682 263 HG22 ILE 100 HG22 ILE 100 -1.900 -27.821 -8.102 264 HG23 ILE 100 HG23 ILE 100 -2.802 -28.196 -9.547 265 HD11 ILE 100 HD11 ILE 100 0.564 -26.785 -7.787 266 HD12 ILE 100 HD12 ILE 100 0.043 -28.292 -6.977 267 HD13 ILE 100 HD13 ILE 100 1.758 -28.003 -7.297 268 HA PRO 101 HA PRO 101 -4.044 -29.474 -13.558 269 HB2 PRO 101 HB2 PRO 101 -5.735 -31.395 -12.552 270 HB3 PRO 101 HB3 PRO 101 -4.327 -31.739 -13.600 271 HG2 PRO 101 HG2 PRO 101 -4.532 -31.958 -10.604 272 HG3 PRO 101 HG3 PRO 101 -3.743 -33.076 -11.749 273 HD2 PRO 101 HD2 PRO 101 -2.374 -31.196 -10.274 274 HD3 PRO 101 HD3 PRO 101 -1.834 -31.750 -11.888 275 H ALA 102 H ALA 102 -6.050 -28.460 -13.549 276 HA ALA 102 HA ALA 102 -6.255 -26.456 -11.671 277 HB1 ALA 102 HB1 ALA 102 -8.245 -25.764 -12.847 278 HB2 ALA 102 HB2 ALA 102 -7.003 -26.300 -13.992 279 HB3 ALA 102 HB3 ALA 102 -8.384 -27.367 -13.620 280 H ASP 103 H ASP 103 -7.959 -29.575 -11.493 281 HA ASP 103 HA ASP 103 -9.942 -28.811 -9.701 282 HB2 ASP 103 HB2 ASP 103 -10.288 -31.074 -9.210 283 HB3 ASP 103 HB3 ASP 103 -9.791 -31.014 -10.892 284 H VAL 104 H VAL 104 -6.512 -29.487 -9.048 285 HA VAL 104 HA VAL 104 -6.833 -29.490 -6.191 286 HB VAL 104 HB VAL 104 -4.217 -28.928 -7.511 287 HG11 VAL 104 HG11 VAL 104 -5.002 -30.463 -5.005 288 HG12 VAL 104 HG12 VAL 104 -3.337 -30.267 -5.619 289 HG13 VAL 104 HG13 VAL 104 -4.264 -28.861 -5.075 290 HG21 VAL 104 HG21 VAL 104 -3.771 -31.372 -7.678 291 HG22 VAL 104 HG22 VAL 104 -5.484 -31.683 -7.329 292 HG23 VAL 104 HG23 VAL 104 -5.015 -30.822 -8.800 293 H ILE 105 H ILE 105 -5.965 -27.086 -8.639 294 HA ILE 105 HA ILE 105 -5.268 -24.943 -6.814 295 HB ILE 105 HB ILE 105 -6.161 -25.040 -9.720 296 HG12 ILE 105 HG12 ILE 105 -3.411 -24.157 -8.800 297 HG13 ILE 105 HG13 ILE 105 -3.763 -25.870 -8.661 298 HG21 ILE 105 HG21 ILE 105 -5.305 -22.687 -9.887 299 HG22 ILE 105 HG22 ILE 105 -6.776 -22.834 -8.924 300 HG23 ILE 105 HG23 ILE 105 -5.199 -22.629 -8.115 301 HD11 ILE 105 HD11 ILE 105 -4.066 -24.317 -11.254 302 HD12 ILE 105 HD12 ILE 105 -2.664 -25.307 -10.790 303 HD13 ILE 105 HD13 ILE 105 -4.244 -26.076 -10.997 304 H ASP 106 H ASP 106 -8.352 -25.835 -8.466 305 HA ASP 106 HA ASP 106 -9.967 -23.972 -7.151 306 HB2 ASP 106 HB2 ASP 106 -10.647 -25.274 -9.116 307 HB3 ASP 106 HB3 ASP 106 -10.631 -26.762 -8.161 308 H ALA 107 H ALA 107 -9.201 -27.382 -6.152 309 HA ALA 107 HA ALA 107 -10.581 -27.463 -3.786 310 HB1 ALA 107 HB1 ALA 107 -9.453 -29.389 -4.847 311 HB2 ALA 107 HB2 ALA 107 -7.862 -28.713 -4.413 312 HB3 ALA 107 HB3 ALA 107 -8.997 -29.246 -3.155 313 H TYR 108 H TYR 108 -7.225 -26.268 -4.250 314 HA TYR 108 HA TYR 108 -6.710 -25.402 -1.590 315 HB2 TYR 108 HB2 TYR 108 -4.922 -25.622 -3.152 316 HB3 TYR 108 HB3 TYR 108 -5.688 -24.559 -4.320 317 HD1 TYR 108 HD2 TYR 108 -4.147 -24.591 -0.906 318 HD2 TYR 108 HD1 TYR 108 -5.263 -22.227 -4.339 319 HE1 TYR 108 HE2 TYR 108 -2.867 -22.664 0.010 320 HE2 TYR 108 HE1 TYR 108 -3.975 -20.304 -3.429 321 HH TYR 108 HH TYR 108 -2.649 -19.520 -1.715 322 H HIS 109 H HIS 109 -8.108 -23.556 -4.399 323 HA HIS 109 HA HIS 109 -8.490 -21.241 -2.757 324 HB2 HIS 109 HB2 HIS 109 -9.521 -21.948 -5.501 325 HB3 HIS 109 HB3 HIS 109 -10.044 -20.489 -4.640 326 HD1 HIS 109 HD1 HIS 109 -7.656 -19.160 -3.468 327 HD2 HIS 109 HD2 HIS 109 -7.508 -21.352 -7.076 328 HE1 HIS 109 HE1 HIS 109 -5.605 -18.277 -4.777 329 HE2 HIS 109 HE2 HIS 109 -5.519 -19.625 -6.973 330 H ALA 110 H ALA 110 -10.647 -24.024 -3.119 331 HA ALA 110 HA ALA 110 -12.905 -22.832 -1.982 332 HB1 ALA 110 HB1 ALA 110 -13.514 -25.075 -1.238 333 HB2 ALA 110 HB2 ALA 110 -12.815 -25.156 -2.865 334 HB3 ALA 110 HB3 ALA 110 -11.851 -25.642 -1.453 335 H ALA 111 H ALA 111 -9.971 -24.148 -0.313 336 HA ALA 111 HA ALA 111 -10.781 -23.457 2.278 337 HB1 ALA 111 HB1 ALA 111 -8.455 -23.861 2.888 338 HB2 ALA 111 HB2 ALA 111 -8.992 -25.089 1.723 339 HB3 ALA 111 HB3 ALA 111 -7.952 -23.748 1.193 340 H THR 112 H THR 112 -8.849 -21.555 -0.123 341 HA THR 112 HA THR 112 -8.390 -19.361 1.705 342 HB THR 112 HB THR 112 -7.638 -18.031 -0.130 343 HG1 THR 112 HG1 THR 112 -9.097 -18.451 -1.748 344 HG21 THR 112 HG21 THR 112 -5.892 -19.413 -1.071 345 HG22 THR 112 HG22 THR 112 -6.125 -19.856 0.632 346 HG23 THR 112 HG23 THR 112 -6.766 -20.896 -0.659 347 H LEU 113 H LEU 113 -11.035 -19.938 -0.639 348 HA LEU 113 HA LEU 113 -12.293 -17.381 -0.244 349 HB2 LEU 113 HB2 LEU 113 -12.544 -18.677 -2.293 350 HB3 LEU 113 HB3 LEU 113 -13.186 -20.053 -1.395 351 HG LEU 113 HG LEU 113 -15.189 -18.807 -0.813 352 HD11 LEU 113 HD11 LEU 113 -14.372 -16.484 -0.790 353 HD12 LEU 113 HD12 LEU 113 -14.041 -16.566 -2.536 354 HD13 LEU 113 HD13 LEU 113 -15.710 -16.637 -1.928 355 HD21 LEU 113 HD21 LEU 113 -15.126 -20.141 -2.881 356 HD22 LEU 113 HD22 LEU 113 -16.188 -18.733 -3.059 357 HD23 LEU 113 HD23 LEU 113 -14.566 -18.718 -3.791 358 H GLU 114 H GLU 114 -12.905 -20.633 1.119 359 HA GLU 114 HA GLU 114 -15.182 -19.773 2.642 360 HB2 GLU 114 HB2 GLU 114 -13.397 -22.187 2.974 361 HB3 GLU 114 HB3 GLU 114 -14.812 -21.883 3.986 362 HG2 GLU 114 HG2 GLU 114 -15.001 -22.017 0.955 363 HG3 GLU 114 HG3 GLU 114 -15.199 -23.415 2.005 364 H HIS 115 H HIS 115 -11.846 -19.166 3.381 365 HA HIS 115 HA HIS 115 -12.280 -18.591 6.215 366 HB2 HIS 115 HB2 HIS 115 -10.130 -17.855 4.204 367 HB3 HIS 115 HB3 HIS 115 -10.204 -17.042 5.756 368 HD1 HIS 115 HD1 HIS 115 -9.751 -20.661 4.430 369 HD2 HIS 115 HD2 HIS 115 -9.347 -18.267 7.894 370 HE1 HIS 115 HE1 HIS 115 -8.548 -22.114 6.197 371 HE2 HIS 115 HE2 HIS 115 -8.299 -20.641 8.296 372 H HIS 116 H HIS 116 -13.119 -16.878 3.301 373 HA HIS 116 HA HIS 116 -14.075 -14.507 4.881 374 HB2 HIS 116 HB2 HIS 116 -13.672 -14.795 1.871 375 HB3 HIS 116 HB3 HIS 116 -14.125 -13.329 2.732 376 HD1 HIS 116 HD1 HIS 116 -12.135 -12.400 4.532 377 HD2 HIS 116 HD2 HIS 116 -11.102 -15.259 1.591 378 HE1 HIS 116 HE1 HIS 116 -9.564 -12.377 4.359 379 HE2 HIS 116 HE2 HIS 116 -8.946 -14.113 2.554 380 H HIS 117 H HIS 117 -15.238 -17.032 2.672 381 HA HIS 117 HA HIS 117 -17.290 -17.761 2.083 382 HB2 HIS 117 HB2 HIS 117 -18.602 -18.570 3.939 383 HB3 HIS 117 HB3 HIS 117 -16.889 -18.797 4.213 384 HD1 HIS 117 HD1 HIS 117 -19.751 -16.467 5.387 385 HD2 HIS 117 HD2 HIS 117 -15.937 -17.889 6.501 386 HE1 HIS 117 HE1 HIS 117 -19.349 -15.675 7.822 387 HE2 HIS 117 HE2 HIS 117 -17.006 -16.533 8.473 388 H HIS 118 H HIS 118 -17.270 -15.188 1.259 389 HA HIS 118 HA HIS 118 -20.174 -14.506 1.345 390 HB2 HIS 118 HB2 HIS 118 -17.858 -12.572 1.753 391 HB3 HIS 118 HB3 HIS 118 -19.425 -12.038 1.170 392 HD1 HIS 118 HD1 HIS 118 -17.820 -13.402 4.388 393 HD2 HIS 118 HD2 HIS 118 -21.466 -11.898 2.863 394 HE1 HIS 118 HE1 HIS 118 -19.303 -12.862 6.433 395 HE2 HIS 118 HE2 HIS 118 -21.538 -11.982 5.486 396 H HIS 119 H HIS 119 -21.021 -13.634 -0.550 397 HA HIS 119 HA HIS 119 -19.797 -14.568 -2.999 398 HB2 HIS 119 HB2 HIS 119 -22.235 -14.624 -2.555 399 HB3 HIS 119 HB3 HIS 119 -22.286 -12.863 -2.542 400 HD1 HIS 119 HD1 HIS 119 -21.748 -15.790 -5.016 401 HD2 HIS 119 HD2 HIS 119 -22.415 -11.615 -4.885 402 HE1 HIS 119 HE1 HIS 119 -22.175 -15.040 -7.445 403 HE2 HIS 119 HE2 HIS 119 -22.587 -12.500 -7.352 404 H HIS 120 H HIS 120 -19.101 -13.430 -4.798 405 HA HIS 120 HA HIS 120 -18.615 -10.508 -4.662 406 HB2 HIS 120 HB2 HIS 120 -16.459 -12.607 -5.169 407 HB3 HIS 120 HB3 HIS 120 -16.289 -10.893 -5.521 408 HD1 HIS 120 HD1 HIS 120 -16.152 -13.295 -2.569 409 HD2 HIS 120 HD2 HIS 120 -16.193 -9.157 -3.419 410 HE1 HIS 120 HE1 HIS 120 -15.392 -12.102 -0.417 411 HE2 HIS 120 HE2 HIS 120 -15.413 -9.576 -0.941 Start of MODEL 9 1 H1 SER 66 H1 SER 66 15.429 -5.454 -24.733 2 H2 SER 66 H2 SER 66 15.307 -6.529 -25.966 3 H3 SER 66 H3 SER 66 15.352 -4.922 -26.280 4 HA SER 66 HA SER 66 13.256 -4.570 -25.147 5 HB2 SER 66 HB2 SER 66 13.083 -6.648 -27.371 6 HB3 SER 66 HB3 SER 66 11.802 -5.535 -26.858 7 HG SER 66 HG SER 66 12.949 -4.714 -28.664 8 H GLY 67 H GLY 67 11.323 -5.468 -24.201 9 HA2 GLY 67 HA2 GLY 67 10.907 -8.228 -23.616 10 HA3 GLY 67 HA3 GLY 67 11.709 -7.472 -22.237 11 H SER 68 H SER 68 9.403 -8.450 -21.576 12 HA SER 68 HA SER 68 7.146 -6.657 -22.051 13 HB2 SER 68 HB2 SER 68 5.880 -8.342 -20.773 14 HB3 SER 68 HB3 SER 68 6.823 -9.044 -22.103 15 HG SER 68 HG SER 68 7.127 -10.293 -20.247 16 H GLY 69 H GLY 69 9.646 -6.378 -19.857 17 HA2 GLY 69 HA2 GLY 69 9.959 -5.060 -17.982 18 HA3 GLY 69 HA3 GLY 69 8.500 -4.207 -18.477 19 H ARG 70 H ARG 70 6.901 -4.209 -17.016 20 HA ARG 70 HA ARG 70 6.867 -5.661 -14.567 21 HB2 ARG 70 HB2 ARG 70 5.751 -3.466 -15.062 22 HB3 ARG 70 HB3 ARG 70 4.587 -4.304 -16.077 23 HG2 ARG 70 HG2 ARG 70 3.627 -3.739 -13.911 24 HG3 ARG 70 HG3 ARG 70 3.660 -5.478 -14.137 25 HD2 ARG 70 HD2 ARG 70 4.295 -4.935 -11.842 26 HD3 ARG 70 HD3 ARG 70 5.653 -5.654 -12.676 27 HE ARG 70 HE ARG 70 6.847 -3.666 -12.534 28 HH11 ARG 70 HH11 ARG 70 3.566 -2.962 -11.504 29 HH12 ARG 70 HH12 ARG 70 3.998 -1.380 -10.908 30 HH21 ARG 70 HH21 ARG 70 7.322 -1.641 -11.754 31 HH22 ARG 70 HH22 ARG 70 6.071 -0.666 -11.039 32 H GLY 71 H GLY 71 5.768 -6.651 -17.720 33 HA2 GLY 71 HA2 GLY 71 3.987 -8.782 -16.925 34 HA3 GLY 71 HA3 GLY 71 4.750 -8.556 -18.498 35 H ARG 72 H ARG 72 7.450 -8.616 -16.710 36 HA ARG 72 HA ARG 72 8.034 -11.427 -17.196 37 HB2 ARG 72 HB2 ARG 72 9.596 -9.260 -15.724 38 HB3 ARG 72 HB3 ARG 72 10.206 -10.876 -16.078 39 HG2 ARG 72 HG2 ARG 72 9.988 -10.455 -18.518 40 HG3 ARG 72 HG3 ARG 72 9.334 -8.849 -18.188 41 HD2 ARG 72 HD2 ARG 72 11.642 -8.584 -18.745 42 HD3 ARG 72 HD3 ARG 72 11.441 -8.238 -17.019 43 HE ARG 72 HE ARG 72 12.179 -11.018 -17.590 44 HH11 ARG 72 HH11 ARG 72 13.593 -7.844 -17.106 45 HH12 ARG 72 HH12 ARG 72 15.129 -8.504 -16.616 46 HH21 ARG 72 HH21 ARG 72 14.156 -11.793 -16.934 47 HH22 ARG 72 HH22 ARG 72 15.434 -10.683 -16.533 48 H GLY 73 H GLY 73 8.554 -13.044 -15.705 49 HA2 GLY 73 HA2 GLY 73 6.916 -13.222 -13.335 50 HA3 GLY 73 HA3 GLY 73 8.136 -14.378 -13.848 51 H ALA 74 H ALA 74 7.430 -13.075 -11.190 52 HA ALA 74 HA ALA 74 10.180 -12.341 -10.348 53 HB1 ALA 74 HB1 ALA 74 9.327 -10.350 -9.181 54 HB2 ALA 74 HB2 ALA 74 8.948 -10.257 -10.910 55 HB3 ALA 74 HB3 ALA 74 7.676 -10.703 -9.750 56 H ILE 75 H ILE 75 8.795 -14.803 -9.969 57 HA ILE 75 HA ILE 75 8.975 -15.010 -7.045 58 HB ILE 75 HB ILE 75 6.585 -14.520 -7.583 59 HG12 ILE 75 HG12 ILE 75 7.061 -17.249 -6.341 60 HG13 ILE 75 HG13 ILE 75 7.335 -15.700 -5.541 61 HG21 ILE 75 HG21 ILE 75 6.444 -17.310 -8.807 62 HG22 ILE 75 HG22 ILE 75 5.143 -16.113 -8.658 63 HG23 ILE 75 HG23 ILE 75 6.480 -15.805 -9.757 64 HD11 ILE 75 HD11 ILE 75 4.902 -15.142 -5.855 65 HD12 ILE 75 HD12 ILE 75 4.651 -16.784 -6.498 66 HD13 ILE 75 HD13 ILE 75 5.191 -16.557 -4.827 67 H ASP 76 H ASP 76 9.634 -17.029 -6.305 68 HA ASP 76 HA ASP 76 10.868 -18.769 -8.306 69 HB2 ASP 76 HB2 ASP 76 12.041 -17.935 -6.278 70 HB3 ASP 76 HB3 ASP 76 10.953 -18.898 -5.276 71 H ARG 77 H ARG 77 8.233 -18.939 -8.667 72 HA ARG 77 HA ARG 77 6.287 -20.134 -8.639 73 HB2 ARG 77 HB2 ARG 77 7.785 -21.273 -10.175 74 HB3 ARG 77 HB3 ARG 77 8.321 -22.379 -8.912 75 HG2 ARG 77 HG2 ARG 77 6.340 -23.571 -8.908 76 HG3 ARG 77 HG3 ARG 77 5.366 -22.212 -9.494 77 HD2 ARG 77 HD2 ARG 77 7.374 -23.754 -11.185 78 HD3 ARG 77 HD3 ARG 77 5.664 -24.149 -11.103 79 HE ARG 77 HE ARG 77 6.893 -21.992 -12.599 80 HH11 ARG 77 HH11 ARG 77 3.828 -22.808 -11.038 81 HH12 ARG 77 HH12 ARG 77 2.926 -21.814 -12.151 82 HH21 ARG 77 HH21 ARG 77 5.660 -20.726 -13.929 83 HH22 ARG 77 HH22 ARG 77 3.938 -20.651 -13.721 84 H GLU 78 H GLU 78 6.988 -19.448 -6.023 85 HA GLU 78 HA GLU 78 6.685 -21.519 -4.134 86 HB2 GLU 78 HB2 GLU 78 7.503 -19.204 -3.723 87 HB3 GLU 78 HB3 GLU 78 5.846 -18.608 -3.856 88 HG2 GLU 78 HG2 GLU 78 5.180 -19.936 -1.897 89 HG3 GLU 78 HG3 GLU 78 6.788 -20.667 -1.818 90 H GLN 79 H GLN 79 4.133 -19.820 -5.948 91 HA GLN 79 HA GLN 79 1.925 -20.667 -4.322 92 HB2 GLN 79 HB2 GLN 79 2.075 -19.914 -7.269 93 HB3 GLN 79 HB3 GLN 79 0.571 -20.218 -6.388 94 HG2 GLN 79 HG2 GLN 79 1.103 -18.400 -4.793 95 HG3 GLN 79 HG3 GLN 79 2.597 -18.052 -5.661 96 HE21 GLN 79 HE22 GLN 79 1.114 -15.884 -5.453 97 HE22 GLN 79 HE21 GLN 79 0.218 -15.557 -6.929 98 H SER 80 H SER 80 3.403 -22.264 -7.227 99 HA SER 80 HA SER 80 1.610 -24.504 -7.215 100 HB2 SER 80 HB2 SER 80 4.508 -24.493 -8.127 101 HB3 SER 80 HB3 SER 80 3.228 -25.581 -8.670 102 HG SER 80 HG SER 80 2.140 -23.685 -9.526 103 H ALA 81 H ALA 81 4.766 -23.994 -5.559 104 HA ALA 81 HA ALA 81 4.915 -26.527 -4.350 105 HB1 ALA 81 HB1 ALA 81 6.542 -25.464 -2.851 106 HB2 ALA 81 HB2 ALA 81 6.807 -24.951 -4.527 107 HB3 ALA 81 HB3 ALA 81 6.006 -23.856 -3.378 108 H ALA 82 H ALA 82 3.373 -23.492 -3.154 109 HA ALA 82 HA ALA 82 2.481 -24.528 -0.658 110 HB1 ALA 82 HB1 ALA 82 0.984 -22.588 -0.661 111 HB2 ALA 82 HB2 ALA 82 2.601 -22.132 -1.230 112 HB3 ALA 82 HB3 ALA 82 1.269 -22.337 -2.397 113 H ILE 83 H ILE 83 0.821 -24.527 -3.866 114 HA ILE 83 HA ILE 83 -1.571 -25.825 -2.943 115 HB ILE 83 HB ILE 83 -0.278 -25.785 -5.697 116 HG12 ILE 83 HG12 ILE 83 -2.754 -24.279 -4.823 117 HG13 ILE 83 HG13 ILE 83 -1.173 -23.583 -4.531 118 HG21 ILE 83 HG21 ILE 83 -1.799 -27.702 -5.633 119 HG22 ILE 83 HG22 ILE 83 -3.042 -26.750 -4.795 120 HG23 ILE 83 HG23 ILE 83 -2.642 -26.406 -6.479 121 HD11 ILE 83 HD11 ILE 83 -2.090 -22.697 -6.591 122 HD12 ILE 83 HD12 ILE 83 -0.677 -23.695 -6.974 123 HD13 ILE 83 HD13 ILE 83 -2.315 -24.322 -7.252 124 H ARG 84 H ARG 84 1.474 -27.217 -4.284 125 HA ARG 84 HA ARG 84 0.693 -29.985 -4.041 126 HB2 ARG 84 HB2 ARG 84 3.400 -28.582 -4.052 127 HB3 ARG 84 HB3 ARG 84 3.254 -30.337 -3.948 128 HG2 ARG 84 HG2 ARG 84 2.233 -30.520 -6.094 129 HG3 ARG 84 HG3 ARG 84 1.960 -28.774 -6.208 130 HD2 ARG 84 HD2 ARG 84 4.366 -28.361 -6.293 131 HD3 ARG 84 HD3 ARG 84 4.701 -30.097 -6.115 132 HE ARG 84 HE ARG 84 3.244 -30.254 -8.314 133 HH11 ARG 84 HH21 ARG 84 5.862 -28.008 -7.665 134 HH12 ARG 84 HH22 ARG 84 6.227 -27.811 -9.352 135 HH21 ARG 84 HH11 ARG 84 3.781 -29.951 -10.479 136 HH22 ARG 84 HH12 ARG 84 5.061 -28.860 -10.882 137 H GLU 85 H GLU 85 2.523 -27.946 -1.685 138 HA GLU 85 HA GLU 85 2.656 -29.913 0.282 139 HB2 GLU 85 HB2 GLU 85 3.931 -27.739 0.192 140 HB3 GLU 85 HB3 GLU 85 2.486 -26.930 0.827 141 HG2 GLU 85 HG2 GLU 85 2.552 -28.551 2.782 142 HG3 GLU 85 HG3 GLU 85 4.072 -29.183 2.152 143 H TRP 86 H TRP 86 0.099 -27.351 -0.092 144 HA TRP 86 HA TRP 86 -1.499 -28.107 2.039 145 HB2 TRP 86 HB2 TRP 86 -1.863 -26.058 0.824 146 HB3 TRP 86 HB3 TRP 86 -2.210 -26.936 -0.661 147 HD1 TRP 86 HD1 TRP 86 -3.772 -26.014 2.698 148 HE1 TRP 86 HE1 TRP 86 -6.293 -26.496 2.657 149 HE3 TRP 86 HE3 TRP 86 -4.105 -28.269 -1.898 150 HZ2 TRP 86 HZ2 TRP 86 -8.162 -27.901 0.965 151 HZ3 TRP 86 HZ3 TRP 86 -6.277 -29.175 -2.690 152 HH2 TRP 86 HH2 TRP 86 -8.302 -29.025 -1.244 153 H ALA 87 H ALA 87 -1.599 -29.363 -1.334 154 HA ALA 87 HA ALA 87 -3.728 -31.211 -0.937 155 HB1 ALA 87 HB1 ALA 87 -2.953 -30.507 -3.148 156 HB2 ALA 87 HB2 ALA 87 -1.367 -31.242 -2.867 157 HB3 ALA 87 HB3 ALA 87 -2.810 -32.275 -3.001 158 H ARG 88 H ARG 88 -0.172 -31.673 -0.547 159 HA ARG 88 HA ARG 88 -0.275 -34.407 0.275 160 HB2 ARG 88 HB2 ARG 88 1.736 -33.096 -0.499 161 HB3 ARG 88 HB3 ARG 88 1.774 -32.288 1.071 162 HG2 ARG 88 HG2 ARG 88 2.075 -34.537 2.174 163 HG3 ARG 88 HG3 ARG 88 2.030 -35.291 0.575 164 HD2 ARG 88 HD2 ARG 88 4.327 -35.098 1.183 165 HD3 ARG 88 HD3 ARG 88 4.017 -33.896 -0.076 166 HE ARG 88 HE ARG 88 3.748 -32.893 2.682 167 HH11 ARG 88 HH21 ARG 88 6.109 -33.424 0.144 168 HH12 ARG 88 HH22 ARG 88 7.228 -32.270 0.818 169 HH21 ARG 88 HH11 ARG 88 5.239 -31.451 3.504 170 HH22 ARG 88 HH12 ARG 88 6.740 -31.190 2.667 171 H ARG 89 H ARG 89 -0.341 -31.439 2.279 172 HA ARG 89 HA ARG 89 -0.570 -32.688 4.858 173 HB2 ARG 89 HB2 ARG 89 -1.532 -30.001 3.787 174 HB3 ARG 89 HB3 ARG 89 -1.707 -30.475 5.475 175 HG2 ARG 89 HG2 ARG 89 0.705 -30.692 5.756 176 HG3 ARG 89 HG3 ARG 89 0.985 -30.325 4.049 177 HD2 ARG 89 HD2 ARG 89 -0.067 -28.102 4.344 178 HD3 ARG 89 HD3 ARG 89 -0.351 -28.439 6.053 179 HE ARG 89 HE ARG 89 2.167 -27.647 4.757 180 HH11 ARG 89 HH11 ARG 89 0.941 -29.082 7.738 181 HH12 ARG 89 HH12 ARG 89 2.384 -28.629 8.603 182 HH21 ARG 89 HH21 ARG 89 3.830 -27.133 5.827 183 HH22 ARG 89 HH22 ARG 89 4.034 -27.514 7.540 184 H ASN 90 H ASN 90 -3.049 -32.057 2.430 185 HA ASN 90 HA ASN 90 -5.193 -33.078 4.211 186 HB2 ASN 90 HB2 ASN 90 -5.198 -31.762 1.468 187 HB3 ASN 90 HB3 ASN 90 -6.633 -32.466 2.208 188 HD21 ASN 90 HD22 ASN 90 -4.277 -29.839 2.533 189 HD22 ASN 90 HD21 ASN 90 -5.264 -28.924 3.666 190 H GLY 91 H GLY 91 -2.914 -34.676 2.442 191 HA2 GLY 91 HA2 GLY 91 -2.742 -36.849 1.765 192 HA3 GLY 91 HA3 GLY 91 -4.347 -37.161 2.426 193 H HIS 92 H HIS 92 -4.042 -34.688 -0.036 194 HA HIS 92 HA HIS 92 -5.724 -36.282 -1.899 195 HB2 HIS 92 HB2 HIS 92 -4.837 -33.368 -2.015 196 HB3 HIS 92 HB3 HIS 92 -6.002 -34.133 -3.082 197 HD1 HIS 92 HD1 HIS 92 -7.445 -35.592 -0.293 198 HD2 HIS 92 HD2 HIS 92 -6.816 -31.568 -1.437 199 HE1 HIS 92 HE1 HIS 92 -9.238 -34.199 0.916 200 HE2 HIS 92 HE2 HIS 92 -8.855 -31.751 0.215 201 H ASN 93 H ASN 93 -5.201 -36.721 -4.039 202 HA ASN 93 HA ASN 93 -2.399 -37.139 -4.670 203 HB2 ASN 93 HB2 ASN 93 -4.286 -38.617 -5.400 204 HB3 ASN 93 HB3 ASN 93 -4.877 -37.319 -6.441 205 HD21 ASN 93 HD22 ASN 93 -4.621 -39.162 -8.056 206 HD22 ASN 93 HD21 ASN 93 -3.036 -39.319 -8.808 207 H VAL 94 H VAL 94 -1.031 -35.935 -5.960 208 HA VAL 94 HA VAL 94 -1.964 -33.668 -7.548 209 HB VAL 94 HB VAL 94 -1.843 -32.755 -5.228 210 HG11 VAL 94 HG11 VAL 94 0.286 -32.303 -4.148 211 HG12 VAL 94 HG12 VAL 94 0.113 -34.040 -4.380 212 HG13 VAL 94 HG13 VAL 94 1.179 -33.100 -5.453 213 HG21 VAL 94 HG21 VAL 94 0.177 -31.481 -7.109 214 HG22 VAL 94 HG22 VAL 94 -1.596 -31.320 -7.223 215 HG23 VAL 94 HG23 VAL 94 -0.741 -30.699 -5.807 216 H SER 95 H SER 95 -0.575 -33.055 -9.126 217 HA SER 95 HA SER 95 1.559 -34.808 -9.906 218 HB2 SER 95 HB2 SER 95 0.780 -32.042 -10.878 219 HB3 SER 95 HB3 SER 95 1.853 -33.178 -11.731 220 HG SER 95 HG SER 95 -0.323 -33.275 -12.499 221 H THR 96 H THR 96 3.492 -34.886 -8.861 222 HA THR 96 HA THR 96 4.582 -32.644 -7.356 223 HB THR 96 HB THR 96 6.506 -34.277 -7.012 224 HG1 THR 96 HG1 THR 96 6.069 -36.415 -7.674 225 HG21 THR 96 HG21 THR 96 3.706 -35.305 -6.351 226 HG22 THR 96 HG22 THR 96 5.217 -35.757 -5.533 227 HG23 THR 96 HG23 THR 96 4.608 -34.097 -5.409 228 H ARG 97 H ARG 97 5.660 -34.405 -10.266 229 HA ARG 97 HA ARG 97 7.595 -32.221 -10.895 230 HB2 ARG 97 HB2 ARG 97 8.466 -34.491 -10.712 231 HB3 ARG 97 HB3 ARG 97 7.309 -35.082 -11.899 232 HG2 ARG 97 HG2 ARG 97 9.550 -34.862 -12.849 233 HG3 ARG 97 HG3 ARG 97 8.398 -33.824 -13.678 234 HD2 ARG 97 HD2 ARG 97 9.279 -31.882 -12.231 235 HD3 ARG 97 HD3 ARG 97 10.497 -32.998 -11.634 236 HE ARG 97 HE ARG 97 11.633 -32.862 -13.654 237 HH11 ARG 97 HH21 ARG 97 8.471 -31.355 -14.177 238 HH12 ARG 97 HH22 ARG 97 8.984 -30.664 -15.695 239 HH21 ARG 97 HH11 ARG 97 12.170 -31.953 -15.595 240 HH22 ARG 97 HH12 ARG 97 11.004 -31.004 -16.477 241 H GLY 98 H GLY 98 4.643 -33.607 -12.157 242 HA2 GLY 98 HA2 GLY 98 4.753 -32.078 -14.689 243 HA3 GLY 98 HA3 GLY 98 3.490 -33.188 -14.182 244 H ARG 99 H ARG 99 2.623 -30.973 -15.296 245 HA ARG 99 HA ARG 99 2.194 -28.674 -13.646 246 HB2 ARG 99 HB2 ARG 99 2.006 -28.779 -16.124 247 HB3 ARG 99 HB3 ARG 99 0.526 -29.732 -15.973 248 HG2 ARG 99 HG2 ARG 99 -0.588 -27.841 -14.812 249 HG3 ARG 99 HG3 ARG 99 0.905 -26.886 -14.912 250 HD2 ARG 99 HD2 ARG 99 -0.663 -27.965 -17.291 251 HD3 ARG 99 HD3 ARG 99 -0.811 -26.323 -16.644 252 HE ARG 99 HE ARG 99 1.911 -26.620 -17.153 253 HH11 ARG 99 HH11 ARG 99 -0.979 -26.684 -19.141 254 HH12 ARG 99 HH12 ARG 99 -0.122 -26.175 -20.569 255 HH21 ARG 99 HH21 ARG 99 2.944 -25.973 -19.017 256 HH22 ARG 99 HH22 ARG 99 2.037 -25.766 -20.485 257 H ILE 100 H ILE 100 0.540 -28.072 -12.296 258 HA ILE 100 HA ILE 100 -0.751 -30.185 -10.811 259 HB ILE 100 HB ILE 100 -0.994 -27.183 -10.567 260 HG12 ILE 100 HG12 ILE 100 0.673 -29.292 -9.099 261 HG13 ILE 100 HG13 ILE 100 1.288 -28.041 -10.181 262 HG21 ILE 100 HG21 ILE 100 -1.977 -27.590 -8.363 263 HG22 ILE 100 HG22 ILE 100 -2.986 -28.349 -9.573 264 HG23 ILE 100 HG23 ILE 100 -1.884 -29.348 -8.596 265 HD11 ILE 100 HD11 ILE 100 1.741 -27.297 -8.004 266 HD12 ILE 100 HD12 ILE 100 0.376 -26.310 -8.566 267 HD13 ILE 100 HD13 ILE 100 0.101 -27.657 -7.433 268 HA PRO 101 HA PRO 101 -4.561 -30.227 -13.222 269 HB2 PRO 101 HB2 PRO 101 -5.912 -31.419 -10.848 270 HB3 PRO 101 HB3 PRO 101 -5.757 -32.070 -12.501 271 HG2 PRO 101 HG2 PRO 101 -4.321 -33.092 -10.408 272 HG3 PRO 101 HG3 PRO 101 -3.614 -32.953 -12.056 273 HD2 PRO 101 HD2 PRO 101 -3.249 -31.086 -9.697 274 HD3 PRO 101 HD3 PRO 101 -2.034 -31.763 -10.822 275 H ALA 102 H ALA 102 -6.269 -28.808 -13.499 276 HA ALA 102 HA ALA 102 -6.539 -26.563 -11.877 277 HB1 ALA 102 HB1 ALA 102 -8.560 -27.702 -13.823 278 HB2 ALA 102 HB2 ALA 102 -8.451 -26.018 -13.237 279 HB3 ALA 102 HB3 ALA 102 -7.151 -26.691 -14.248 280 H ASP 103 H ASP 103 -8.326 -29.626 -11.679 281 HA ASP 103 HA ASP 103 -10.318 -28.903 -9.899 282 HB2 ASP 103 HB2 ASP 103 -10.160 -31.066 -11.049 283 HB3 ASP 103 HB3 ASP 103 -8.747 -31.492 -10.073 284 H VAL 104 H VAL 104 -6.885 -29.658 -9.219 285 HA VAL 104 HA VAL 104 -7.234 -29.543 -6.352 286 HB VAL 104 HB VAL 104 -4.627 -29.548 -7.837 287 HG11 VAL 104 HG11 VAL 104 -3.730 -30.550 -5.749 288 HG12 VAL 104 HG12 VAL 104 -4.389 -28.941 -5.463 289 HG13 VAL 104 HG13 VAL 104 -5.323 -30.376 -4.990 290 HG21 VAL 104 HG21 VAL 104 -4.570 -32.014 -7.412 291 HG22 VAL 104 HG22 VAL 104 -6.233 -31.931 -6.806 292 HG23 VAL 104 HG23 VAL 104 -5.879 -31.571 -8.510 293 H ILE 105 H ILE 105 -6.064 -27.354 -8.909 294 HA ILE 105 HA ILE 105 -5.293 -25.172 -7.184 295 HB ILE 105 HB ILE 105 -6.317 -25.338 -10.043 296 HG12 ILE 105 HG12 ILE 105 -3.555 -24.399 -9.232 297 HG13 ILE 105 HG13 ILE 105 -3.890 -26.113 -9.045 298 HG21 ILE 105 HG21 ILE 105 -5.343 -22.866 -8.544 299 HG22 ILE 105 HG22 ILE 105 -5.493 -22.980 -10.312 300 HG23 ILE 105 HG23 ILE 105 -6.934 -23.110 -9.309 301 HD11 ILE 105 HD11 ILE 105 -4.279 -24.616 -11.659 302 HD12 ILE 105 HD12 ILE 105 -2.854 -25.585 -11.220 303 HD13 ILE 105 HD13 ILE 105 -4.436 -26.367 -11.363 304 H ASP 106 H ASP 106 -8.493 -25.931 -8.700 305 HA ASP 106 HA ASP 106 -9.940 -23.936 -7.415 306 HB2 ASP 106 HB2 ASP 106 -10.749 -25.263 -9.316 307 HB3 ASP 106 HB3 ASP 106 -10.855 -26.691 -8.282 308 H ALA 107 H ALA 107 -9.350 -27.326 -6.293 309 HA ALA 107 HA ALA 107 -10.668 -27.236 -3.889 310 HB1 ALA 107 HB1 ALA 107 -9.211 -29.100 -3.255 311 HB2 ALA 107 HB2 ALA 107 -9.647 -29.240 -4.958 312 HB3 ALA 107 HB3 ALA 107 -8.030 -28.659 -4.509 313 H TYR 108 H TYR 108 -7.279 -26.201 -4.507 314 HA TYR 108 HA TYR 108 -6.692 -25.310 -1.851 315 HB2 TYR 108 HB2 TYR 108 -4.987 -25.792 -3.511 316 HB3 TYR 108 HB3 TYR 108 -5.575 -24.519 -4.566 317 HD1 TYR 108 HD2 TYR 108 -4.019 -25.171 -1.240 318 HD2 TYR 108 HD1 TYR 108 -4.817 -22.262 -4.318 319 HE1 TYR 108 HE2 TYR 108 -2.438 -23.598 -0.145 320 HE2 TYR 108 HE1 TYR 108 -3.233 -20.677 -3.219 321 HH TYR 108 HH TYR 108 -1.489 -21.493 -0.194 322 H HIS 109 H HIS 109 -7.962 -23.471 -4.721 323 HA HIS 109 HA HIS 109 -8.245 -20.970 -3.338 324 HB2 HIS 109 HB2 HIS 109 -9.827 -22.116 -5.680 325 HB3 HIS 109 HB3 HIS 109 -9.920 -20.449 -5.124 326 HD1 HIS 109 HD1 HIS 109 -8.997 -21.028 -8.061 327 HD2 HIS 109 HD2 HIS 109 -6.506 -20.382 -4.713 328 HE1 HIS 109 HE1 HIS 109 -6.749 -20.164 -8.979 329 HE2 HIS 109 HE2 HIS 109 -5.239 -19.767 -6.931 330 H ALA 110 H ALA 110 -10.531 -23.745 -3.453 331 HA ALA 110 HA ALA 110 -12.602 -22.410 -1.999 332 HB1 ALA 110 HB1 ALA 110 -11.862 -25.373 -2.028 333 HB2 ALA 110 HB2 ALA 110 -13.409 -24.677 -1.509 334 HB3 ALA 110 HB3 ALA 110 -12.908 -24.550 -3.205 335 H ALA 111 H ALA 111 -9.738 -24.288 -0.780 336 HA ALA 111 HA ALA 111 -10.404 -23.945 1.910 337 HB1 ALA 111 HB1 ALA 111 -7.680 -24.382 0.621 338 HB2 ALA 111 HB2 ALA 111 -8.082 -24.669 2.326 339 HB3 ALA 111 HB3 ALA 111 -8.855 -25.645 1.055 340 H THR 112 H THR 112 -8.342 -21.892 -0.215 341 HA THR 112 HA THR 112 -7.601 -20.117 1.970 342 HB THR 112 HB THR 112 -6.551 -18.720 0.264 343 HG1 THR 112 HG1 THR 112 -6.615 -19.336 -1.874 344 HG21 THR 112 HG21 THR 112 -4.861 -20.293 -0.492 345 HG22 THR 112 HG22 THR 112 -5.313 -20.660 1.177 346 HG23 THR 112 HG23 THR 112 -5.917 -21.672 -0.151 347 H LEU 113 H LEU 113 -10.225 -19.980 -0.405 348 HA LEU 113 HA LEU 113 -10.911 -17.216 0.470 349 HB2 LEU 113 HB2 LEU 113 -12.084 -18.901 -1.757 350 HB3 LEU 113 HB3 LEU 113 -12.381 -17.191 -1.470 351 HG LEU 113 HG LEU 113 -9.696 -18.405 -2.258 352 HD11 LEU 113 HD11 LEU 113 -11.672 -16.730 -3.855 353 HD12 LEU 113 HD12 LEU 113 -10.086 -17.312 -4.418 354 HD13 LEU 113 HD13 LEU 113 -11.375 -18.470 -4.061 355 HD21 LEU 113 HD21 LEU 113 -10.530 -15.493 -1.943 356 HD22 LEU 113 HD22 LEU 113 -9.348 -16.366 -0.944 357 HD23 LEU 113 HD23 LEU 113 -8.995 -16.053 -2.646 358 H GLU 114 H GLU 114 -12.439 -20.426 0.314 359 HA GLU 114 HA GLU 114 -14.845 -19.392 1.720 360 HB2 GLU 114 HB2 GLU 114 -14.427 -22.184 0.609 361 HB3 GLU 114 HB3 GLU 114 -15.932 -21.418 1.112 362 HG2 GLU 114 HG2 GLU 114 -15.519 -19.667 -0.710 363 HG3 GLU 114 HG3 GLU 114 -14.247 -20.731 -1.319 364 H HIS 115 H HIS 115 -11.946 -20.850 2.647 365 HA HIS 115 HA HIS 115 -11.193 -21.895 4.526 366 HB2 HIS 115 HB2 HIS 115 -13.315 -20.254 5.932 367 HB3 HIS 115 HB3 HIS 115 -11.760 -20.786 6.575 368 HD1 HIS 115 HD1 HIS 115 -13.203 -17.730 5.300 369 HD2 HIS 115 HD2 HIS 115 -9.632 -19.874 4.592 370 HE1 HIS 115 HE1 HIS 115 -11.585 -16.087 4.162 371 HE2 HIS 115 HE2 HIS 115 -9.422 -17.411 3.699 372 H HIS 116 H HIS 116 -12.871 -23.529 3.145 373 HA HIS 116 HA HIS 116 -13.997 -25.484 3.191 374 HB2 HIS 116 HB2 HIS 116 -11.835 -25.918 4.460 375 HB3 HIS 116 HB3 HIS 116 -12.789 -25.915 5.938 376 HD1 HIS 116 HD1 HIS 116 -12.509 -27.914 2.605 377 HD2 HIS 116 HD2 HIS 116 -13.974 -28.197 6.560 378 HE1 HIS 116 HE1 HIS 116 -13.254 -30.360 2.936 379 HE2 HIS 116 HE2 HIS 116 -14.140 -30.522 5.347 380 H HIS 117 H HIS 117 -15.655 -23.282 4.049 381 HA HIS 117 HA HIS 117 -17.595 -24.446 5.944 382 HB2 HIS 117 HB2 HIS 117 -17.763 -22.055 4.067 383 HB3 HIS 117 HB3 HIS 117 -19.069 -22.563 5.132 384 HD1 HIS 117 HD1 HIS 117 -15.814 -20.676 5.216 385 HD2 HIS 117 HD2 HIS 117 -18.656 -22.368 7.842 386 HE1 HIS 117 HE1 HIS 117 -15.379 -19.627 7.555 387 HE2 HIS 117 HE2 HIS 117 -17.115 -20.680 9.144 388 H HIS 118 H HIS 118 -19.437 -25.595 5.470 389 HA HIS 118 HA HIS 118 -19.525 -26.983 2.906 390 HB2 HIS 118 HB2 HIS 118 -19.979 -28.133 5.039 391 HB3 HIS 118 HB3 HIS 118 -21.379 -27.105 5.323 392 HD1 HIS 118 HD1 HIS 118 -20.223 -29.944 2.953 393 HD2 HIS 118 HD2 HIS 118 -23.661 -27.782 4.133 394 HE1 HIS 118 HE1 HIS 118 -22.242 -31.146 1.892 395 HE2 HIS 118 HE2 HIS 118 -24.330 -29.829 2.620 396 H HIS 119 H HIS 119 -20.876 -26.757 1.223 397 HA HIS 119 HA HIS 119 -23.392 -25.267 1.341 398 HB2 HIS 119 HB2 HIS 119 -22.820 -23.679 -0.463 399 HB3 HIS 119 HB3 HIS 119 -21.833 -23.411 0.950 400 HD1 HIS 119 HD1 HIS 119 -21.495 -24.933 -2.626 401 HD2 HIS 119 HD2 HIS 119 -19.230 -23.389 0.610 402 HE1 HIS 119 HE1 HIS 119 -19.079 -24.629 -3.476 403 HE2 HIS 119 HE2 HIS 119 -17.718 -23.653 -1.514 404 H HIS 120 H HIS 120 -24.573 -25.385 -0.742 405 HA HIS 120 HA HIS 120 -24.456 -27.958 -2.052 406 HB2 HIS 120 HB2 HIS 120 -26.153 -26.991 -3.565 407 HB3 HIS 120 HB3 HIS 120 -26.551 -26.806 -1.861 408 HD1 HIS 120 HD1 HIS 120 -24.228 -24.324 -3.671 409 HD2 HIS 120 HD2 HIS 120 -28.155 -24.709 -2.171 410 HE1 HIS 120 HE1 HIS 120 -25.298 -21.954 -3.789 411 HE2 HIS 120 HE2 HIS 120 -27.694 -22.214 -2.866 Start of MODEL 10 1 H1 SER 66 H1 SER 66 6.978 -15.368 -23.425 2 H2 SER 66 H2 SER 66 6.244 -15.286 -24.886 3 H3 SER 66 H3 SER 66 7.551 -14.350 -24.573 4 HA SER 66 HA SER 66 5.531 -13.036 -24.487 5 HB2 SER 66 HB2 SER 66 3.927 -13.485 -22.604 6 HB3 SER 66 HB3 SER 66 3.941 -14.727 -23.863 7 HG SER 66 HG SER 66 3.990 -15.617 -21.724 8 H GLY 67 H GLY 67 5.188 -11.296 -22.906 9 HA2 GLY 67 HA2 GLY 67 7.655 -10.530 -21.583 10 HA3 GLY 67 HA3 GLY 67 6.158 -9.610 -21.661 11 H SER 68 H SER 68 7.658 -9.554 -19.402 12 HA SER 68 HA SER 68 6.526 -11.440 -17.408 13 HB2 SER 68 HB2 SER 68 8.705 -9.353 -17.146 14 HB3 SER 68 HB3 SER 68 8.185 -10.472 -15.875 15 HG SER 68 HG SER 68 9.298 -11.195 -18.411 16 H GLY 69 H GLY 69 5.336 -8.650 -18.655 17 HA2 GLY 69 HA2 GLY 69 3.584 -7.307 -17.990 18 HA3 GLY 69 HA3 GLY 69 3.428 -8.296 -16.544 19 H ARG 70 H ARG 70 2.776 -6.154 -15.702 20 HA ARG 70 HA ARG 70 4.496 -3.916 -15.436 21 HB2 ARG 70 HB2 ARG 70 2.023 -3.940 -15.107 22 HB3 ARG 70 HB3 ARG 70 2.236 -4.811 -13.587 23 HG2 ARG 70 HG2 ARG 70 3.532 -2.901 -12.665 24 HG3 ARG 70 HG3 ARG 70 3.353 -2.027 -14.191 25 HD2 ARG 70 HD2 ARG 70 1.051 -2.943 -12.420 26 HD3 ARG 70 HD3 ARG 70 1.765 -1.318 -12.394 27 HE ARG 70 HE ARG 70 1.069 -1.721 -15.057 28 HH11 ARG 70 HH11 ARG 70 -0.736 -1.616 -12.054 29 HH12 ARG 70 HH12 ARG 70 -2.195 -1.079 -12.843 30 HH21 ARG 70 HH21 ARG 70 -0.831 -1.067 -16.004 31 HH22 ARG 70 HH22 ARG 70 -2.243 -0.779 -15.026 32 H GLY 71 H GLY 71 6.182 -3.460 -14.206 33 HA2 GLY 71 HA2 GLY 71 7.845 -3.586 -12.620 34 HA3 GLY 71 HA3 GLY 71 6.745 -4.497 -11.585 35 H ARG 72 H ARG 72 7.237 -5.990 -14.649 36 HA ARG 72 HA ARG 72 7.946 -8.075 -15.161 37 HB2 ARG 72 HB2 ARG 72 10.565 -7.060 -14.006 38 HB3 ARG 72 HB3 ARG 72 10.370 -8.435 -15.103 39 HG2 ARG 72 HG2 ARG 72 9.398 -6.908 -16.828 40 HG3 ARG 72 HG3 ARG 72 9.698 -5.526 -15.768 41 HD2 ARG 72 HD2 ARG 72 11.840 -7.424 -16.806 42 HD3 ARG 72 HD3 ARG 72 11.435 -5.854 -17.525 43 HE ARG 72 HE ARG 72 11.978 -5.339 -14.818 44 HH11 ARG 72 HH21 ARG 72 13.815 -6.481 -17.574 45 HH12 ARG 72 HH22 ARG 72 15.326 -5.881 -16.940 46 HH21 ARG 72 HH11 ARG 72 13.940 -4.598 -14.062 47 HH22 ARG 72 HH12 ARG 72 15.381 -4.823 -15.009 48 H GLY 73 H GLY 73 6.402 -8.441 -13.129 49 HA2 GLY 73 HA2 GLY 73 7.391 -9.740 -10.807 50 HA3 GLY 73 HA3 GLY 73 5.801 -10.005 -11.528 51 H ALA 74 H ALA 74 7.906 -11.845 -10.312 52 HA ALA 74 HA ALA 74 8.101 -13.861 -12.502 53 HB1 ALA 74 HB1 ALA 74 10.427 -14.309 -11.831 54 HB2 ALA 74 HB2 ALA 74 10.235 -12.630 -12.366 55 HB3 ALA 74 HB3 ALA 74 10.346 -13.001 -10.632 56 H ILE 75 H ILE 75 8.303 -16.017 -11.875 57 HA ILE 75 HA ILE 75 7.615 -16.678 -9.056 58 HB ILE 75 HB ILE 75 6.329 -17.962 -11.499 59 HG12 ILE 75 HG12 ILE 75 5.081 -16.111 -9.416 60 HG13 ILE 75 HG13 ILE 75 5.439 -15.680 -11.087 61 HG21 ILE 75 HG21 ILE 75 6.651 -19.552 -9.603 62 HG22 ILE 75 HG22 ILE 75 5.838 -18.412 -8.511 63 HG23 ILE 75 HG23 ILE 75 4.960 -19.205 -9.839 64 HD11 ILE 75 HD11 ILE 75 3.103 -16.130 -10.955 65 HD12 ILE 75 HD12 ILE 75 3.857 -17.442 -11.879 66 HD13 ILE 75 HD13 ILE 75 3.360 -17.700 -10.187 67 H ASP 76 H ASP 76 8.813 -18.262 -8.197 68 HA ASP 76 HA ASP 76 10.571 -19.935 -9.955 69 HB2 ASP 76 HB2 ASP 76 11.784 -18.113 -8.834 70 HB3 ASP 76 HB3 ASP 76 11.224 -18.686 -7.263 71 H ARG 77 H ARG 77 8.439 -21.108 -9.765 72 HA ARG 77 HA ARG 77 7.111 -22.813 -9.152 73 HB2 ARG 77 HB2 ARG 77 9.353 -23.895 -9.464 74 HB3 ARG 77 HB3 ARG 77 9.547 -23.911 -7.708 75 HG2 ARG 77 HG2 ARG 77 7.535 -25.378 -7.505 76 HG3 ARG 77 HG3 ARG 77 7.282 -25.256 -9.255 77 HD2 ARG 77 HD2 ARG 77 8.328 -27.366 -8.778 78 HD3 ARG 77 HD3 ARG 77 9.478 -26.332 -9.644 79 HE ARG 77 HE ARG 77 9.680 -26.237 -6.701 80 HH11 ARG 77 HH11 ARG 77 10.898 -27.909 -9.536 81 HH12 ARG 77 HH12 ARG 77 12.323 -28.465 -8.708 82 HH21 ARG 77 HH21 ARG 77 11.527 -26.979 -5.708 83 HH22 ARG 77 HH22 ARG 77 12.664 -27.948 -6.594 84 H GLU 78 H GLU 78 8.398 -21.142 -6.433 85 HA GLU 78 HA GLU 78 7.321 -22.384 -4.272 86 HB2 GLU 78 HB2 GLU 78 8.793 -20.393 -4.305 87 HB3 GLU 78 HB3 GLU 78 7.402 -19.372 -4.708 88 HG2 GLU 78 HG2 GLU 78 6.344 -19.950 -2.547 89 HG3 GLU 78 HG3 GLU 78 7.656 -21.076 -2.185 90 H GLN 79 H GLN 79 5.395 -20.202 -6.385 91 HA GLN 79 HA GLN 79 3.040 -20.316 -4.681 92 HB2 GLN 79 HB2 GLN 79 3.338 -19.567 -7.627 93 HB3 GLN 79 HB3 GLN 79 1.866 -19.369 -6.662 94 HG2 GLN 79 HG2 GLN 79 3.132 -17.892 -5.080 95 HG3 GLN 79 HG3 GLN 79 4.542 -17.999 -6.136 96 HE21 GLN 79 HE22 GLN 79 4.170 -15.531 -5.997 97 HE22 GLN 79 HE21 GLN 79 3.093 -14.856 -7.211 98 H SER 80 H SER 80 4.266 -22.501 -7.168 99 HA SER 80 HA SER 80 1.751 -24.063 -7.175 100 HB2 SER 80 HB2 SER 80 2.687 -25.471 -8.728 101 HB3 SER 80 HB3 SER 80 3.400 -23.919 -9.156 102 HG SER 80 HG SER 80 5.316 -24.558 -8.088 103 H ALA 81 H ALA 81 5.032 -24.291 -5.723 104 HA ALA 81 HA ALA 81 4.678 -26.683 -4.334 105 HB1 ALA 81 HB1 ALA 81 6.822 -25.492 -4.673 106 HB2 ALA 81 HB2 ALA 81 6.316 -24.278 -3.474 107 HB3 ALA 81 HB3 ALA 81 6.562 -25.963 -2.982 108 H ALA 82 H ALA 82 3.682 -23.405 -3.312 109 HA ALA 82 HA ALA 82 2.656 -23.979 -0.756 110 HB1 ALA 82 HB1 ALA 82 1.636 -22.093 -2.943 111 HB2 ALA 82 HB2 ALA 82 1.186 -22.021 -1.220 112 HB3 ALA 82 HB3 ALA 82 2.866 -21.731 -1.721 113 H ILE 83 H ILE 83 1.102 -24.562 -3.942 114 HA ILE 83 HA ILE 83 -1.363 -25.615 -2.765 115 HB ILE 83 HB ILE 83 -0.377 -25.625 -5.642 116 HG12 ILE 83 HG12 ILE 83 -2.295 -23.792 -4.127 117 HG13 ILE 83 HG13 ILE 83 -0.708 -23.357 -4.743 118 HG21 ILE 83 HG21 ILE 83 -3.145 -26.245 -4.499 119 HG22 ILE 83 HG22 ILE 83 -2.735 -26.156 -6.223 120 HG23 ILE 83 HG23 ILE 83 -2.050 -27.433 -5.232 121 HD11 ILE 83 HD11 ILE 83 -3.183 -23.941 -6.396 122 HD12 ILE 83 HD12 ILE 83 -2.301 -22.419 -6.221 123 HD13 ILE 83 HD13 ILE 83 -1.546 -23.774 -7.085 124 H ARG 84 H ARG 84 1.619 -27.019 -4.175 125 HA ARG 84 HA ARG 84 0.835 -29.789 -4.027 126 HB2 ARG 84 HB2 ARG 84 3.623 -28.606 -3.634 127 HB3 ARG 84 HB3 ARG 84 3.266 -30.300 -3.959 128 HG2 ARG 84 HG2 ARG 84 2.430 -29.771 -6.193 129 HG3 ARG 84 HG3 ARG 84 2.560 -28.051 -5.861 130 HD2 ARG 84 HD2 ARG 84 5.102 -28.545 -5.445 131 HD3 ARG 84 HD3 ARG 84 4.799 -30.017 -6.343 132 HE ARG 84 HE ARG 84 4.843 -27.232 -7.347 133 HH11 ARG 84 HH11 ARG 84 3.760 -30.480 -8.227 134 HH12 ARG 84 HH12 ARG 84 3.689 -30.023 -9.927 135 HH21 ARG 84 HH21 ARG 84 4.697 -26.807 -9.494 136 HH22 ARG 84 HH22 ARG 84 4.270 -28.101 -10.611 137 H GLU 85 H GLU 85 2.554 -27.786 -1.582 138 HA GLU 85 HA GLU 85 2.582 -29.764 0.376 139 HB2 GLU 85 HB2 GLU 85 2.782 -26.759 0.527 140 HB3 GLU 85 HB3 GLU 85 2.845 -27.760 1.983 141 HG2 GLU 85 HG2 GLU 85 4.642 -28.193 -0.423 142 HG3 GLU 85 HG3 GLU 85 5.098 -27.211 0.979 143 H TRP 86 H TRP 86 0.123 -27.140 -0.087 144 HA TRP 86 HA TRP 86 -1.598 -27.884 1.959 145 HB2 TRP 86 HB2 TRP 86 -1.918 -25.844 0.712 146 HB3 TRP 86 HB3 TRP 86 -2.183 -26.736 -0.783 147 HD1 TRP 86 HD1 TRP 86 -3.927 -25.767 2.458 148 HE1 TRP 86 HE1 TRP 86 -6.431 -26.312 2.311 149 HE3 TRP 86 HE3 TRP 86 -3.969 -28.157 -2.078 150 HZ2 TRP 86 HZ2 TRP 86 -8.165 -27.882 0.597 151 HZ3 TRP 86 HZ3 TRP 86 -6.069 -29.161 -2.940 152 HH2 TRP 86 HH2 TRP 86 -8.152 -29.075 -1.580 153 H ALA 87 H ALA 87 -1.527 -29.172 -1.408 154 HA ALA 87 HA ALA 87 -3.698 -30.985 -1.095 155 HB1 ALA 87 HB1 ALA 87 -2.833 -30.242 -3.265 156 HB2 ALA 87 HB2 ALA 87 -1.275 -31.029 -2.940 157 HB3 ALA 87 HB3 ALA 87 -2.733 -32.014 -3.165 158 H ARG 88 H ARG 88 -0.213 -31.403 -0.457 159 HA ARG 88 HA ARG 88 -0.310 -34.243 0.120 160 HB2 ARG 88 HB2 ARG 88 1.730 -32.944 -0.554 161 HB3 ARG 88 HB3 ARG 88 1.710 -32.133 1.016 162 HG2 ARG 88 HG2 ARG 88 1.991 -34.365 2.136 163 HG3 ARG 88 HG3 ARG 88 2.006 -35.134 0.543 164 HD2 ARG 88 HD2 ARG 88 4.294 -34.918 1.243 165 HD3 ARG 88 HD3 ARG 88 4.024 -33.772 -0.059 166 HE ARG 88 HE ARG 88 4.482 -32.010 1.366 167 HH11 ARG 88 HH21 ARG 88 4.070 -34.843 3.423 168 HH12 ARG 88 HH22 ARG 88 4.609 -33.979 4.835 169 HH21 ARG 88 HH11 ARG 88 5.075 -30.979 3.172 170 HH22 ARG 88 HH12 ARG 88 5.193 -31.849 4.691 171 H ARG 89 H ARG 89 -0.375 -31.332 2.169 172 HA ARG 89 HA ARG 89 -0.749 -32.542 4.720 173 HB2 ARG 89 HB2 ARG 89 -0.112 -30.217 4.336 174 HB3 ARG 89 HB3 ARG 89 -1.659 -29.864 3.562 175 HG2 ARG 89 HG2 ARG 89 -2.863 -30.231 5.618 176 HG3 ARG 89 HG3 ARG 89 -1.384 -30.762 6.450 177 HD2 ARG 89 HD2 ARG 89 -1.842 -27.987 5.263 178 HD3 ARG 89 HD3 ARG 89 -2.105 -28.407 6.965 179 HE ARG 89 HE ARG 89 0.523 -29.206 6.400 180 HH11 ARG 89 HH11 ARG 89 -1.188 -26.150 6.526 181 HH12 ARG 89 HH12 ARG 89 0.257 -25.250 6.902 182 HH21 ARG 89 HH21 ARG 89 2.330 -27.995 6.878 183 HH22 ARG 89 HH22 ARG 89 2.194 -26.276 7.093 184 H ASN 90 H ASN 90 -3.134 -31.810 2.194 185 HA ASN 90 HA ASN 90 -5.353 -32.871 3.847 186 HB2 ASN 90 HB2 ASN 90 -5.216 -31.482 1.148 187 HB3 ASN 90 HB3 ASN 90 -6.689 -32.222 1.777 188 HD21 ASN 90 HD22 ASN 90 -4.361 -29.605 2.348 189 HD22 ASN 90 HD21 ASN 90 -5.417 -28.732 3.458 190 H GLY 91 H GLY 91 -3.019 -34.494 2.219 191 HA2 GLY 91 HA2 GLY 91 -2.852 -36.703 1.635 192 HA3 GLY 91 HA3 GLY 91 -4.514 -36.944 2.174 193 H HIS 92 H HIS 92 -3.979 -34.576 -0.345 194 HA HIS 92 HA HIS 92 -5.451 -36.265 -2.302 195 HB2 HIS 92 HB2 HIS 92 -4.656 -33.329 -2.439 196 HB3 HIS 92 HB3 HIS 92 -5.730 -34.166 -3.552 197 HD1 HIS 92 HD1 HIS 92 -7.441 -35.613 -1.041 198 HD2 HIS 92 HD2 HIS 92 -6.547 -31.551 -1.784 199 HE1 HIS 92 HE1 HIS 92 -9.255 -34.235 0.158 200 HE2 HIS 92 HE2 HIS 92 -8.718 -31.764 -0.313 201 H ASN 93 H ASN 93 -4.719 -36.694 -4.398 202 HA ASN 93 HA ASN 93 -1.880 -37.204 -4.647 203 HB2 ASN 93 HB2 ASN 93 -3.704 -38.663 -5.545 204 HB3 ASN 93 HB3 ASN 93 -4.123 -37.399 -6.709 205 HD21 ASN 93 HD22 ASN 93 -3.714 -39.386 -8.156 206 HD22 ASN 93 HD21 ASN 93 -2.060 -39.580 -8.721 207 H VAL 94 H VAL 94 -0.306 -35.983 -5.567 208 HA VAL 94 HA VAL 94 -0.843 -33.966 -7.598 209 HB VAL 94 HB VAL 94 -1.321 -32.794 -5.410 210 HG11 VAL 94 HG11 VAL 94 0.486 -32.094 -3.963 211 HG12 VAL 94 HG12 VAL 94 0.463 -33.853 -4.024 212 HG13 VAL 94 HG13 VAL 94 1.688 -32.943 -4.941 213 HG21 VAL 94 HG21 VAL 94 1.008 -31.597 -6.947 214 HG22 VAL 94 HG22 VAL 94 -0.694 -31.576 -7.478 215 HG23 VAL 94 HG23 VAL 94 -0.221 -30.749 -5.989 216 H SER 95 H SER 95 1.024 -33.344 -8.768 217 HA SER 95 HA SER 95 3.331 -35.126 -8.552 218 HB2 SER 95 HB2 SER 95 2.553 -34.379 -10.755 219 HB3 SER 95 HB3 SER 95 2.878 -32.694 -10.309 220 HG SER 95 HG SER 95 4.684 -34.785 -10.882 221 H THR 96 H THR 96 5.462 -34.585 -7.997 222 HA THR 96 HA THR 96 5.882 -32.419 -6.073 223 HB THR 96 HB THR 96 8.241 -33.275 -6.103 224 HG1 THR 96 HG1 THR 96 8.570 -35.226 -7.261 225 HG21 THR 96 HG21 THR 96 6.543 -34.235 -4.547 226 HG22 THR 96 HG22 THR 96 6.141 -35.468 -5.762 227 HG23 THR 96 HG23 THR 96 7.766 -35.421 -5.038 228 H ARG 97 H ARG 97 6.374 -32.811 -9.520 229 HA ARG 97 HA ARG 97 7.660 -30.100 -9.675 230 HB2 ARG 97 HB2 ARG 97 9.388 -30.938 -11.160 231 HB3 ARG 97 HB3 ARG 97 9.437 -31.761 -9.599 232 HG2 ARG 97 HG2 ARG 97 8.301 -33.745 -10.612 233 HG3 ARG 97 HG3 ARG 97 8.235 -32.900 -12.165 234 HD2 ARG 97 HD2 ARG 97 10.102 -34.418 -12.238 235 HD3 ARG 97 HD3 ARG 97 10.726 -32.777 -12.184 236 HE ARG 97 HE ARG 97 11.634 -33.152 -10.073 237 HH11 ARG 97 HH21 ARG 97 9.659 -35.945 -10.854 238 HH12 ARG 97 HH22 ARG 97 10.335 -36.894 -9.559 239 HH21 ARG 97 HH11 ARG 97 12.419 -34.408 -8.423 240 HH22 ARG 97 HH12 ARG 97 11.848 -36.037 -8.217 241 H GLY 98 H GLY 98 5.539 -32.384 -11.280 242 HA2 GLY 98 HA2 GLY 98 5.479 -31.007 -13.847 243 HA3 GLY 98 HA3 GLY 98 4.408 -32.283 -13.287 244 H ARG 99 H ARG 99 3.034 -30.668 -14.652 245 HA ARG 99 HA ARG 99 2.041 -28.267 -13.385 246 HB2 ARG 99 HB2 ARG 99 1.950 -28.727 -15.812 247 HB3 ARG 99 HB3 ARG 99 0.783 -30.030 -15.532 248 HG2 ARG 99 HG2 ARG 99 -0.870 -28.416 -14.704 249 HG3 ARG 99 HG3 ARG 99 0.323 -27.109 -14.771 250 HD2 ARG 99 HD2 ARG 99 -1.157 -26.938 -16.693 251 HD3 ARG 99 HD3 ARG 99 0.471 -27.338 -17.217 252 HE ARG 99 HE ARG 99 -0.240 -29.422 -17.973 253 HH11 ARG 99 HH11 ARG 99 -2.927 -28.007 -16.211 254 HH12 ARG 99 HH12 ARG 99 -4.057 -29.181 -16.827 255 HH21 ARG 99 HH21 ARG 99 -1.722 -30.901 -18.680 256 HH22 ARG 99 HH22 ARG 99 -3.378 -30.796 -18.167 257 H ILE 100 H ILE 100 0.339 -27.915 -12.048 258 HA ILE 100 HA ILE 100 -0.742 -30.190 -10.526 259 HB ILE 100 HB ILE 100 -1.148 -27.219 -10.152 260 HG12 ILE 100 HG12 ILE 100 0.702 -29.251 -8.813 261 HG13 ILE 100 HG13 ILE 100 1.183 -27.891 -9.829 262 HG21 ILE 100 HG21 ILE 100 -1.862 -29.530 -8.278 263 HG22 ILE 100 HG22 ILE 100 -2.074 -27.800 -7.946 264 HG23 ILE 100 HG23 ILE 100 -3.039 -28.558 -9.191 265 HD11 ILE 100 HD11 ILE 100 0.106 -26.352 -8.099 266 HD12 ILE 100 HD12 ILE 100 0.045 -27.786 -7.034 267 HD13 ILE 100 HD13 ILE 100 1.599 -27.191 -7.640 268 HA PRO 101 HA PRO 101 -4.512 -30.267 -13.002 269 HB2 PRO 101 HB2 PRO 101 -5.899 -31.418 -10.620 270 HB3 PRO 101 HB3 PRO 101 -5.754 -32.079 -12.273 271 HG2 PRO 101 HG2 PRO 101 -4.329 -33.120 -10.188 272 HG3 PRO 101 HG3 PRO 101 -3.617 -32.977 -11.827 273 HD2 PRO 101 HD2 PRO 101 -3.249 -31.135 -9.453 274 HD3 PRO 101 HD3 PRO 101 -2.030 -31.804 -10.578 275 H ALA 102 H ALA 102 -6.146 -28.794 -13.360 276 HA ALA 102 HA ALA 102 -6.408 -26.544 -11.731 277 HB1 ALA 102 HB1 ALA 102 -6.878 -26.613 -14.133 278 HB2 ALA 102 HB2 ALA 102 -8.353 -27.568 -13.811 279 HB3 ALA 102 HB3 ALA 102 -8.206 -25.897 -13.193 280 H ASP 103 H ASP 103 -8.333 -29.528 -11.685 281 HA ASP 103 HA ASP 103 -10.374 -28.740 -9.991 282 HB2 ASP 103 HB2 ASP 103 -10.260 -30.888 -11.189 283 HB3 ASP 103 HB3 ASP 103 -8.926 -31.405 -10.156 284 H VAL 104 H VAL 104 -7.019 -29.657 -9.173 285 HA VAL 104 HA VAL 104 -7.464 -29.603 -6.317 286 HB VAL 104 HB VAL 104 -4.858 -29.708 -7.805 287 HG11 VAL 104 HG11 VAL 104 -4.529 -29.051 -5.455 288 HG12 VAL 104 HG12 VAL 104 -5.497 -30.439 -4.923 289 HG13 VAL 104 HG13 VAL 104 -3.936 -30.690 -5.732 290 HG21 VAL 104 HG21 VAL 104 -6.249 -31.694 -8.374 291 HG22 VAL 104 HG22 VAL 104 -4.884 -32.151 -7.363 292 HG23 VAL 104 HG23 VAL 104 -6.504 -32.000 -6.649 293 H ILE 105 H ILE 105 -6.091 -27.390 -8.777 294 HA ILE 105 HA ILE 105 -5.334 -25.289 -6.966 295 HB ILE 105 HB ILE 105 -6.222 -25.350 -9.875 296 HG12 ILE 105 HG12 ILE 105 -3.466 -24.559 -8.874 297 HG13 ILE 105 HG13 ILE 105 -3.892 -26.261 -8.810 298 HG21 ILE 105 HG21 ILE 105 -6.789 -23.117 -9.151 299 HG22 ILE 105 HG22 ILE 105 -5.236 -22.939 -8.290 300 HG23 ILE 105 HG23 ILE 105 -5.283 -23.026 -10.062 301 HD11 ILE 105 HD11 ILE 105 -2.721 -25.636 -10.906 302 HD12 ILE 105 HD12 ILE 105 -4.313 -26.378 -11.150 303 HD13 ILE 105 HD13 ILE 105 -4.101 -24.616 -11.356 304 H ASP 106 H ASP 106 -8.486 -25.891 -8.638 305 HA ASP 106 HA ASP 106 -9.907 -23.854 -7.376 306 HB2 ASP 106 HB2 ASP 106 -10.703 -25.079 -9.338 307 HB3 ASP 106 HB3 ASP 106 -10.868 -26.552 -8.378 308 H ALA 107 H ALA 107 -9.494 -27.307 -6.320 309 HA ALA 107 HA ALA 107 -10.925 -27.207 -3.987 310 HB1 ALA 107 HB1 ALA 107 -9.573 -29.152 -3.328 311 HB2 ALA 107 HB2 ALA 107 -9.951 -29.236 -5.045 312 HB3 ALA 107 HB3 ALA 107 -8.329 -28.736 -4.527 313 H TYR 108 H TYR 108 -7.471 -26.321 -4.414 314 HA TYR 108 HA TYR 108 -6.892 -25.530 -1.746 315 HB2 TYR 108 HB2 TYR 108 -5.111 -25.854 -3.248 316 HB3 TYR 108 HB3 TYR 108 -5.805 -24.823 -4.478 317 HD1 TYR 108 HD2 TYR 108 -4.152 -24.789 -1.142 318 HD2 TYR 108 HD1 TYR 108 -5.367 -22.466 -4.566 319 HE1 TYR 108 HE2 TYR 108 -2.778 -22.886 -0.329 320 HE2 TYR 108 HE1 TYR 108 -3.996 -20.554 -3.746 321 HH TYR 108 HH TYR 108 -2.084 -20.715 -0.714 322 H HIS 109 H HIS 109 -8.056 -23.492 -4.524 323 HA HIS 109 HA HIS 109 -8.314 -21.124 -2.933 324 HB2 HIS 109 HB2 HIS 109 -9.557 -21.957 -5.570 325 HB3 HIS 109 HB3 HIS 109 -9.914 -20.411 -4.809 326 HD1 HIS 109 HD1 HIS 109 -7.452 -18.998 -4.080 327 HD2 HIS 109 HD2 HIS 109 -7.583 -21.759 -7.264 328 HE1 HIS 109 HE1 HIS 109 -5.444 -18.446 -5.594 329 HE2 HIS 109 HE2 HIS 109 -5.533 -20.121 -7.544 330 H ALA 110 H ALA 110 -10.756 -23.712 -3.522 331 HA ALA 110 HA ALA 110 -12.868 -22.447 -2.176 332 HB1 ALA 110 HB1 ALA 110 -12.204 -25.414 -2.406 333 HB2 ALA 110 HB2 ALA 110 -13.793 -24.729 -2.008 334 HB3 ALA 110 HB3 ALA 110 -13.085 -24.452 -3.612 335 H ALA 111 H ALA 111 -10.201 -24.475 -0.836 336 HA ALA 111 HA ALA 111 -11.092 -24.436 1.816 337 HB1 ALA 111 HB1 ALA 111 -9.494 -26.043 0.898 338 HB2 ALA 111 HB2 ALA 111 -8.273 -24.756 0.731 339 HB3 ALA 111 HB3 ALA 111 -8.849 -25.237 2.340 340 H THR 112 H THR 112 -8.860 -22.191 0.086 341 HA THR 112 HA THR 112 -8.274 -20.696 2.522 342 HB THR 112 HB THR 112 -6.942 -19.237 1.073 343 HG1 THR 112 HG1 THR 112 -6.741 -19.756 -1.106 344 HG21 THR 112 HG21 THR 112 -6.435 -22.191 0.528 345 HG22 THR 112 HG22 THR 112 -5.257 -20.874 0.400 346 HG23 THR 112 HG23 THR 112 -5.937 -21.298 1.982 347 H LEU 113 H LEU 113 -10.389 -19.999 -0.316 348 HA LEU 113 HA LEU 113 -10.734 -17.253 0.489 349 HB2 LEU 113 HB2 LEU 113 -10.562 -18.034 -1.848 350 HB3 LEU 113 HB3 LEU 113 -12.036 -18.990 -1.637 351 HG LEU 113 HG LEU 113 -13.350 -16.988 -1.313 352 HD11 LEU 113 HD11 LEU 113 -11.709 -15.401 -0.390 353 HD12 LEU 113 HD12 LEU 113 -10.772 -15.453 -1.898 354 HD13 LEU 113 HD13 LEU 113 -12.402 -14.740 -1.869 355 HD21 LEU 113 HD21 LEU 113 -13.247 -16.170 -3.636 356 HD22 LEU 113 HD22 LEU 113 -11.634 -16.889 -3.827 357 HD23 LEU 113 HD23 LEU 113 -13.049 -17.930 -3.574 358 H GLU 114 H GLU 114 -12.693 -20.181 0.883 359 HA GLU 114 HA GLU 114 -15.187 -18.889 1.369 360 HB2 GLU 114 HB2 GLU 114 -15.020 -21.205 0.696 361 HB3 GLU 114 HB3 GLU 114 -14.154 -21.612 2.179 362 HG2 GLU 114 HG2 GLU 114 -16.527 -22.337 2.202 363 HG3 GLU 114 HG3 GLU 114 -16.117 -21.265 3.527 364 H HIS 115 H HIS 115 -15.619 -17.477 2.929 365 HA HIS 115 HA HIS 115 -14.118 -17.326 5.422 366 HB2 HIS 115 HB2 HIS 115 -16.482 -15.792 4.276 367 HB3 HIS 115 HB3 HIS 115 -15.879 -15.512 5.896 368 HD1 HIS 115 HD1 HIS 115 -13.609 -15.906 2.711 369 HD2 HIS 115 HD2 HIS 115 -14.810 -13.191 5.729 370 HE1 HIS 115 HE1 HIS 115 -12.143 -13.819 2.441 371 HE2 HIS 115 HE2 HIS 115 -12.873 -12.167 4.284 372 H HIS 116 H HIS 116 -16.997 -19.084 4.533 373 HA HIS 116 HA HIS 116 -18.073 -19.357 7.207 374 HB2 HIS 116 HB2 HIS 116 -19.324 -19.717 5.072 375 HB3 HIS 116 HB3 HIS 116 -18.395 -21.183 4.783 376 HD1 HIS 116 HD1 HIS 116 -20.864 -19.796 7.466 377 HD2 HIS 116 HD2 HIS 116 -19.427 -23.387 5.763 378 HE1 HIS 116 HE1 HIS 116 -22.272 -21.692 8.483 379 HE2 HIS 116 HE2 HIS 116 -21.386 -23.880 7.445 380 H HIS 117 H HIS 117 -15.348 -20.951 5.678 381 HA HIS 117 HA HIS 117 -15.249 -23.256 7.475 382 HB2 HIS 117 HB2 HIS 117 -13.120 -21.969 5.711 383 HB3 HIS 117 HB3 HIS 117 -12.922 -23.495 6.573 384 HD1 HIS 117 HD1 HIS 117 -15.986 -24.575 5.613 385 HD2 HIS 117 HD2 HIS 117 -12.674 -23.185 3.394 386 HE1 HIS 117 HE1 HIS 117 -16.224 -25.573 3.255 387 HE2 HIS 117 HE2 HIS 117 -14.200 -24.722 1.903 388 H HIS 118 H HIS 118 -13.958 -23.607 9.259 389 HA HIS 118 HA HIS 118 -12.372 -21.425 10.466 390 HB2 HIS 118 HB2 HIS 118 -14.806 -21.100 11.153 391 HB3 HIS 118 HB3 HIS 118 -14.745 -22.666 11.947 392 HD1 HIS 118 HD1 HIS 118 -13.905 -22.569 14.460 393 HD2 HIS 118 HD2 HIS 118 -13.002 -19.156 12.108 394 HE1 HIS 118 HE1 HIS 118 -12.941 -20.799 16.063 395 HE2 HIS 118 HE2 HIS 118 -12.397 -18.724 14.628 396 H HIS 119 H HIS 119 -11.124 -22.148 12.342 397 HA HIS 119 HA HIS 119 -10.127 -24.889 12.069 398 HB2 HIS 119 HB2 HIS 119 -8.412 -24.148 13.695 399 HB3 HIS 119 HB3 HIS 119 -8.516 -23.184 12.236 400 HD1 HIS 119 HD1 HIS 119 -9.802 -22.880 15.900 401 HD2 HIS 119 HD2 HIS 119 -8.481 -20.615 12.589 402 HE1 HIS 119 HE1 HIS 119 -9.618 -20.431 16.716 403 HE2 HIS 119 HE2 HIS 119 -8.820 -19.059 14.682 404 H HIS 120 H HIS 120 -12.329 -25.702 12.631 405 HA HIS 120 HA HIS 120 -13.915 -26.622 13.943 406 HB2 HIS 120 HB2 HIS 120 -11.888 -28.058 14.402 407 HB3 HIS 120 HB3 HIS 120 -11.682 -27.196 15.920 408 HD1 HIS 120 HD1 HIS 120 -14.306 -27.230 17.296 409 HD2 HIS 120 HD2 HIS 120 -13.074 -30.333 14.732 410 HE1 HIS 120 HE1 HIS 120 -15.683 -29.343 17.986 411 HE2 HIS 120 HE2 HIS 120 -14.912 -31.221 16.394 Start of MODEL 11 1 H1 SER 66 H1 SER 66 18.086 1.415 -10.952 2 H2 SER 66 H2 SER 66 19.571 0.727 -10.922 3 H3 SER 66 H3 SER 66 18.576 0.476 -12.197 4 HA SER 66 HA SER 66 18.629 -1.482 -10.833 5 HB2 SER 66 HB2 SER 66 17.593 0.325 -8.608 6 HB3 SER 66 HB3 SER 66 17.857 -1.428 -8.517 7 HG SER 66 HG SER 66 19.642 -0.246 -7.673 8 H GLY 67 H GLY 67 16.778 -2.856 -10.559 9 HA2 GLY 67 HA2 GLY 67 14.068 -1.984 -10.500 10 HA3 GLY 67 HA3 GLY 67 14.533 -2.242 -12.184 11 H SER 68 H SER 68 12.582 -3.742 -11.532 12 HA SER 68 HA SER 68 11.683 -5.795 -11.255 13 HB2 SER 68 HB2 SER 68 14.353 -6.743 -12.330 14 HB3 SER 68 HB3 SER 68 12.823 -7.638 -12.358 15 HG SER 68 HG SER 68 13.221 -6.550 -14.355 16 H GLY 69 H GLY 69 12.840 -4.828 -8.800 17 HA2 GLY 69 HA2 GLY 69 13.127 -5.552 -6.631 18 HA3 GLY 69 HA3 GLY 69 12.413 -7.076 -7.146 19 H ARG 70 H ARG 70 13.659 -8.781 -6.740 20 HA ARG 70 HA ARG 70 16.572 -8.566 -6.284 21 HB2 ARG 70 HB2 ARG 70 14.650 -10.926 -6.091 22 HB3 ARG 70 HB3 ARG 70 16.369 -10.974 -5.676 23 HG2 ARG 70 HG2 ARG 70 16.017 -9.205 -3.962 24 HG3 ARG 70 HG3 ARG 70 14.284 -9.210 -4.320 25 HD2 ARG 70 HD2 ARG 70 14.160 -11.614 -3.669 26 HD3 ARG 70 HD3 ARG 70 15.892 -11.598 -3.335 27 HE ARG 70 HE ARG 70 15.558 -10.394 -1.375 28 HH11 ARG 70 HH11 ARG 70 12.439 -10.608 -2.993 29 HH12 ARG 70 HH12 ARG 70 11.583 -10.040 -1.589 30 HH21 ARG 70 HH21 ARG 70 14.393 -9.683 0.365 31 HH22 ARG 70 HH22 ARG 70 12.661 -9.543 0.267 32 H GLY 71 H GLY 71 14.792 -8.930 -9.091 33 HA2 GLY 71 HA2 GLY 71 15.486 -9.331 -11.248 34 HA3 GLY 71 HA3 GLY 71 17.114 -9.633 -10.654 35 H ARG 72 H ARG 72 14.615 -11.628 -9.279 36 HA ARG 72 HA ARG 72 15.741 -14.019 -10.648 37 HB2 ARG 72 HB2 ARG 72 13.876 -13.849 -8.250 38 HB3 ARG 72 HB3 ARG 72 14.711 -15.286 -8.829 39 HG2 ARG 72 HG2 ARG 72 15.996 -12.827 -7.581 40 HG3 ARG 72 HG3 ARG 72 15.815 -14.425 -6.861 41 HD2 ARG 72 HD2 ARG 72 17.299 -15.377 -8.629 42 HD3 ARG 72 HD3 ARG 72 17.520 -13.741 -9.289 43 HE ARG 72 HE ARG 72 18.172 -13.716 -6.509 44 HH11 ARG 72 HH11 ARG 72 19.535 -14.943 -9.496 45 HH12 ARG 72 HH12 ARG 72 21.169 -14.857 -8.897 46 HH21 ARG 72 HH21 ARG 72 20.277 -13.618 -5.809 47 HH22 ARG 72 HH22 ARG 72 21.569 -14.127 -6.854 48 H GLY 73 H GLY 73 13.110 -12.069 -11.218 49 HA2 GLY 73 HA2 GLY 73 11.402 -12.308 -12.775 50 HA3 GLY 73 HA3 GLY 73 11.852 -13.989 -13.035 51 H ALA 74 H ALA 74 9.272 -13.490 -13.083 52 HA ALA 74 HA ALA 74 7.984 -13.733 -10.459 53 HB1 ALA 74 HB1 ALA 74 5.912 -13.546 -11.757 54 HB2 ALA 74 HB2 ALA 74 7.059 -12.287 -12.231 55 HB3 ALA 74 HB3 ALA 74 6.819 -13.711 -13.273 56 H ILE 75 H ILE 75 6.409 -15.355 -9.978 57 HA ILE 75 HA ILE 75 5.909 -17.468 -9.383 58 HB ILE 75 HB ILE 75 5.843 -18.008 -12.317 59 HG12 ILE 75 HG12 ILE 75 3.789 -16.430 -10.704 60 HG13 ILE 75 HG13 ILE 75 4.796 -15.809 -12.013 61 HG21 ILE 75 HG21 ILE 75 3.951 -18.892 -10.072 62 HG22 ILE 75 HG22 ILE 75 3.944 -19.485 -11.744 63 HG23 ILE 75 HG23 ILE 75 5.270 -19.902 -10.677 64 HD11 ILE 75 HD11 ILE 75 3.662 -17.381 -13.606 65 HD12 ILE 75 HD12 ILE 75 2.521 -17.791 -12.296 66 HD13 ILE 75 HD13 ILE 75 2.615 -16.135 -12.897 67 H ASP 76 H ASP 76 8.255 -17.427 -8.723 68 HA ASP 76 HA ASP 76 10.012 -19.447 -9.877 69 HB2 ASP 76 HB2 ASP 76 10.855 -17.416 -8.753 70 HB3 ASP 76 HB3 ASP 76 10.188 -17.988 -7.221 71 H ARG 77 H ARG 77 7.892 -20.810 -9.742 72 HA ARG 77 HA ARG 77 6.513 -22.380 -8.934 73 HB2 ARG 77 HB2 ARG 77 7.444 -24.443 -8.357 74 HB3 ARG 77 HB3 ARG 77 8.473 -23.690 -9.552 75 HG2 ARG 77 HG2 ARG 77 9.233 -23.382 -6.637 76 HG3 ARG 77 HG3 ARG 77 9.389 -24.970 -7.385 77 HD2 ARG 77 HD2 ARG 77 10.814 -24.068 -9.156 78 HD3 ARG 77 HD3 ARG 77 10.729 -22.456 -8.462 79 HE ARG 77 HE ARG 77 12.341 -24.701 -7.547 80 HH11 ARG 77 HH21 ARG 77 10.939 -21.675 -6.447 81 HH12 ARG 77 HH22 ARG 77 12.105 -21.506 -5.162 82 HH21 ARG 77 HH11 ARG 77 13.773 -24.433 -5.873 83 HH22 ARG 77 HH12 ARG 77 13.642 -23.051 -4.824 84 H GLU 78 H GLU 78 6.885 -20.138 -6.986 85 HA GLU 78 HA GLU 78 6.713 -21.220 -4.349 86 HB2 GLU 78 HB2 GLU 78 5.720 -18.546 -5.417 87 HB3 GLU 78 HB3 GLU 78 5.871 -18.977 -3.708 88 HG2 GLU 78 HG2 GLU 78 8.330 -19.370 -4.081 89 HG3 GLU 78 HG3 GLU 78 8.138 -18.754 -5.727 90 H GLN 79 H GLN 79 4.037 -20.030 -6.461 91 HA GLN 79 HA GLN 79 2.000 -20.790 -4.585 92 HB2 GLN 79 HB2 GLN 79 0.411 -20.266 -6.321 93 HB3 GLN 79 HB3 GLN 79 1.651 -19.026 -6.190 94 HG2 GLN 79 HG2 GLN 79 2.775 -19.996 -8.232 95 HG3 GLN 79 HG3 GLN 79 1.440 -21.141 -8.377 96 HE21 GLN 79 HE22 GLN 79 -0.748 -20.275 -8.908 97 HE22 GLN 79 HE21 GLN 79 -0.858 -18.681 -9.639 98 H SER 80 H SER 80 3.386 -22.552 -7.375 99 HA SER 80 HA SER 80 1.505 -24.738 -7.242 100 HB2 SER 80 HB2 SER 80 3.210 -25.932 -8.636 101 HB3 SER 80 HB3 SER 80 2.669 -24.368 -9.279 102 HG SER 80 HG SER 80 4.971 -24.626 -9.365 103 H ALA 81 H ALA 81 4.841 -24.348 -5.826 104 HA ALA 81 HA ALA 81 4.836 -26.747 -4.405 105 HB1 ALA 81 HB1 ALA 81 6.810 -25.321 -4.662 106 HB2 ALA 81 HB2 ALA 81 6.071 -24.070 -3.644 107 HB3 ALA 81 HB3 ALA 81 6.506 -25.647 -2.948 108 H ALA 82 H ALA 82 3.444 -23.572 -3.362 109 HA ALA 82 HA ALA 82 2.572 -24.436 -0.802 110 HB1 ALA 82 HB1 ALA 82 1.380 -22.309 -2.628 111 HB2 ALA 82 HB2 ALA 82 1.111 -22.466 -0.883 112 HB3 ALA 82 HB3 ALA 82 2.730 -22.075 -1.494 113 H ILE 83 H ILE 83 0.820 -24.542 -3.949 114 HA ILE 83 HA ILE 83 -1.594 -25.691 -2.891 115 HB ILE 83 HB ILE 83 -0.398 -25.614 -5.684 116 HG12 ILE 83 HG12 ILE 83 -2.798 -24.130 -4.543 117 HG13 ILE 83 HG13 ILE 83 -1.189 -23.459 -4.449 118 HG21 ILE 83 HG21 ILE 83 -1.929 -27.552 -5.608 119 HG22 ILE 83 HG22 ILE 83 -3.186 -26.553 -4.845 120 HG23 ILE 83 HG23 ILE 83 -2.674 -26.247 -6.517 121 HD11 ILE 83 HD11 ILE 83 -1.044 -23.590 -6.971 122 HD12 ILE 83 HD12 ILE 83 -2.766 -24.032 -6.966 123 HD13 ILE 83 HD13 ILE 83 -2.257 -22.467 -6.322 124 H ARG 84 H ARG 84 1.340 -27.229 -4.277 125 HA ARG 84 HA ARG 84 0.380 -29.942 -4.004 126 HB2 ARG 84 HB2 ARG 84 2.170 -29.348 -5.503 127 HB3 ARG 84 HB3 ARG 84 3.191 -28.775 -4.192 128 HG2 ARG 84 HG2 ARG 84 3.879 -30.884 -3.618 129 HG3 ARG 84 HG3 ARG 84 2.292 -31.599 -3.876 130 HD2 ARG 84 HD2 ARG 84 3.944 -32.500 -5.452 131 HD3 ARG 84 HD3 ARG 84 2.587 -31.682 -6.242 132 HE ARG 84 HE ARG 84 5.022 -30.049 -5.832 133 HH11 ARG 84 HH11 ARG 84 3.452 -32.227 -8.077 134 HH12 ARG 84 HH12 ARG 84 4.111 -31.424 -9.488 135 HH21 ARG 84 HH21 ARG 84 5.932 -29.130 -7.676 136 HH22 ARG 84 HH22 ARG 84 5.560 -29.792 -9.240 137 H GLU 85 H GLU 85 2.448 -27.985 -1.761 138 HA GLU 85 HA GLU 85 2.518 -29.891 0.293 139 HB2 GLU 85 HB2 GLU 85 3.942 -27.848 0.060 140 HB3 GLU 85 HB3 GLU 85 2.564 -26.912 0.652 141 HG2 GLU 85 HG2 GLU 85 3.907 -27.371 2.558 142 HG3 GLU 85 HG3 GLU 85 2.494 -28.429 2.650 143 H TRP 86 H TRP 86 0.062 -27.261 -0.193 144 HA TRP 86 HA TRP 86 -1.564 -27.892 1.962 145 HB2 TRP 86 HB2 TRP 86 -1.940 -25.915 0.627 146 HB3 TRP 86 HB3 TRP 86 -2.260 -26.874 -0.808 147 HD1 TRP 86 HD1 TRP 86 -3.884 -25.694 2.415 148 HE1 TRP 86 HE1 TRP 86 -6.384 -26.259 2.420 149 HE3 TRP 86 HE3 TRP 86 -4.127 -28.375 -1.950 150 HZ2 TRP 86 HZ2 TRP 86 -8.172 -27.975 0.928 151 HZ3 TRP 86 HZ3 TRP 86 -6.232 -29.541 -2.587 152 HH2 TRP 86 HH2 TRP 86 -8.240 -29.383 -1.125 153 H ALA 87 H ALA 87 -1.722 -29.303 -1.357 154 HA ALA 87 HA ALA 87 -3.879 -31.064 -0.780 155 HB1 ALA 87 HB1 ALA 87 -3.157 -32.166 -2.924 156 HB2 ALA 87 HB2 ALA 87 -3.201 -30.389 -3.039 157 HB3 ALA 87 HB3 ALA 87 -1.648 -31.226 -2.870 158 H ARG 88 H ARG 88 -0.356 -31.646 -0.663 159 HA ARG 88 HA ARG 88 -0.250 -34.350 0.153 160 HB2 ARG 88 HB2 ARG 88 1.653 -32.938 -0.545 161 HB3 ARG 88 HB3 ARG 88 1.473 -31.950 0.898 162 HG2 ARG 88 HG2 ARG 88 2.037 -34.026 2.278 163 HG3 ARG 88 HG3 ARG 88 2.426 -34.829 0.732 164 HD2 ARG 88 HD2 ARG 88 4.029 -32.943 0.237 165 HD3 ARG 88 HD3 ARG 88 3.616 -32.235 1.812 166 HE ARG 88 HE ARG 88 4.586 -34.971 2.021 167 HH11 ARG 88 HH11 ARG 88 5.643 -31.605 1.885 168 HH12 ARG 88 HH12 ARG 88 7.207 -32.003 2.550 169 HH21 ARG 88 HH21 ARG 88 6.596 -35.367 2.907 170 HH22 ARG 88 HH22 ARG 88 7.720 -34.060 3.127 171 H ARG 89 H ARG 89 -0.609 -31.428 2.209 172 HA ARG 89 HA ARG 89 -0.797 -32.964 4.696 173 HB2 ARG 89 HB2 ARG 89 -1.259 -30.028 4.037 174 HB3 ARG 89 HB3 ARG 89 -1.348 -30.708 5.671 175 HG2 ARG 89 HG2 ARG 89 0.988 -31.514 5.504 176 HG3 ARG 89 HG3 ARG 89 1.114 -30.859 3.869 177 HD2 ARG 89 HD2 ARG 89 0.628 -28.573 4.801 178 HD3 ARG 89 HD3 ARG 89 0.676 -29.289 6.430 179 HE ARG 89 HE ARG 89 3.022 -29.703 4.623 180 HH11 ARG 89 HH11 ARG 89 1.911 -27.933 7.462 181 HH12 ARG 89 HH12 ARG 89 3.542 -27.474 7.868 182 HH21 ARG 89 HH21 ARG 89 4.899 -29.116 5.123 183 HH22 ARG 89 HH22 ARG 89 5.261 -28.150 6.559 184 H ASN 90 H ASN 90 -3.200 -31.839 2.412 185 HA ASN 90 HA ASN 90 -5.424 -32.579 4.238 186 HB2 ASN 90 HB2 ASN 90 -5.284 -31.302 1.482 187 HB3 ASN 90 HB3 ASN 90 -6.796 -31.868 2.176 188 HD21 ASN 90 HD22 ASN 90 -4.198 -29.522 2.570 189 HD22 ASN 90 HD21 ASN 90 -5.088 -28.493 3.695 190 H GLY 91 H GLY 91 -3.427 -34.351 2.149 191 HA2 GLY 91 HA2 GLY 91 -3.550 -36.544 1.442 192 HA3 GLY 91 HA3 GLY 91 -5.122 -36.716 2.233 193 H HIS 92 H HIS 92 -4.622 -34.148 -0.123 194 HA HIS 92 HA HIS 92 -6.700 -35.333 -1.877 195 HB2 HIS 92 HB2 HIS 92 -6.741 -32.918 -1.027 196 HB3 HIS 92 HB3 HIS 92 -5.419 -32.584 -2.132 197 HD1 HIS 92 HD1 HIS 92 -9.171 -33.193 -2.044 198 HD2 HIS 92 HD2 HIS 92 -6.048 -32.707 -4.850 199 HE1 HIS 92 HE1 HIS 92 -10.293 -32.760 -4.325 200 HE2 HIS 92 HE2 HIS 92 -8.403 -32.471 -6.033 201 H ASN 93 H ASN 93 -6.406 -35.734 -4.108 202 HA ASN 93 HA ASN 93 -3.898 -36.913 -4.781 203 HB2 ASN 93 HB2 ASN 93 -6.144 -37.654 -5.576 204 HB3 ASN 93 HB3 ASN 93 -6.268 -36.200 -6.570 205 HD21 ASN 93 HD22 ASN 93 -6.634 -38.097 -8.173 206 HD22 ASN 93 HD21 ASN 93 -5.185 -38.688 -8.967 207 H VAL 94 H VAL 94 -2.091 -36.100 -5.640 208 HA VAL 94 HA VAL 94 -2.083 -34.031 -7.671 209 HB VAL 94 HB VAL 94 -2.104 -32.685 -5.557 210 HG11 VAL 94 HG11 VAL 94 0.686 -33.802 -5.055 211 HG12 VAL 94 HG12 VAL 94 -0.125 -32.514 -4.154 212 HG13 VAL 94 HG13 VAL 94 -0.765 -34.164 -4.089 213 HG21 VAL 94 HG21 VAL 94 -0.382 -31.133 -6.211 214 HG22 VAL 94 HG22 VAL 94 0.474 -32.378 -7.143 215 HG23 VAL 94 HG23 VAL 94 -1.133 -31.814 -7.661 216 H SER 95 H SER 95 -0.151 -34.090 -8.947 217 HA SER 95 HA SER 95 1.411 -36.522 -8.773 218 HB2 SER 95 HB2 SER 95 1.010 -35.408 -10.942 219 HB3 SER 95 HB3 SER 95 1.941 -34.003 -10.393 220 HG SER 95 HG SER 95 2.827 -36.595 -11.079 221 H THR 96 H THR 96 3.495 -36.852 -7.987 222 HA THR 96 HA THR 96 4.557 -34.970 -6.019 223 HB THR 96 HB THR 96 6.339 -36.712 -5.772 224 HG1 THR 96 HG1 THR 96 6.002 -38.670 -6.889 225 HG21 THR 96 HG21 THR 96 3.494 -37.811 -5.670 226 HG22 THR 96 HG22 THR 96 4.899 -38.414 -4.765 227 HG23 THR 96 HG23 THR 96 4.247 -36.807 -4.418 228 H ARG 97 H ARG 97 5.150 -35.544 -9.385 229 HA ARG 97 HA ARG 97 7.590 -33.777 -9.324 230 HB2 ARG 97 HB2 ARG 97 8.119 -36.228 -9.410 231 HB3 ARG 97 HB3 ARG 97 7.250 -36.340 -10.943 232 HG2 ARG 97 HG2 ARG 97 8.850 -34.784 -11.993 233 HG3 ARG 97 HG3 ARG 97 9.680 -34.549 -10.447 234 HD2 ARG 97 HD2 ARG 97 9.420 -37.210 -11.906 235 HD3 ARG 97 HD3 ARG 97 10.818 -36.127 -12.034 236 HE ARG 97 HE ARG 97 10.468 -36.576 -9.288 237 HH11 ARG 97 HH11 ARG 97 11.293 -38.560 -12.058 238 HH12 ARG 97 HH12 ARG 97 12.193 -39.697 -11.092 239 HH21 ARG 97 HH21 ARG 97 11.619 -38.075 -8.111 240 HH22 ARG 97 HH22 ARG 97 12.373 -39.419 -8.913 241 H GLY 98 H GLY 98 4.751 -34.788 -11.169 242 HA2 GLY 98 HA2 GLY 98 5.364 -33.194 -13.536 243 HA3 GLY 98 HA3 GLY 98 3.873 -34.059 -13.176 244 H ARG 99 H ARG 99 3.183 -31.995 -14.300 245 HA ARG 99 HA ARG 99 2.946 -29.546 -12.722 246 HB2 ARG 99 HB2 ARG 99 1.521 -30.484 -15.253 247 HB3 ARG 99 HB3 ARG 99 1.344 -28.877 -14.543 248 HG2 ARG 99 HG2 ARG 99 3.789 -28.487 -14.790 249 HG3 ARG 99 HG3 ARG 99 3.960 -30.048 -15.604 250 HD2 ARG 99 HD2 ARG 99 2.193 -27.755 -16.560 251 HD3 ARG 99 HD3 ARG 99 3.825 -28.099 -17.159 252 HE ARG 99 HE ARG 99 2.420 -30.494 -17.489 253 HH11 ARG 99 HH11 ARG 99 2.136 -27.254 -18.790 254 HH12 ARG 99 HH12 ARG 99 1.393 -27.812 -20.266 255 HH21 ARG 99 HH21 ARG 99 1.461 -31.140 -19.386 256 HH22 ARG 99 HH22 ARG 99 1.039 -29.963 -20.596 257 H ILE 100 H ILE 100 0.925 -28.614 -12.049 258 HA ILE 100 HA ILE 100 -0.659 -30.584 -10.513 259 HB ILE 100 HB ILE 100 -0.475 -27.582 -10.257 260 HG12 ILE 100 HG12 ILE 100 0.739 -29.930 -8.721 261 HG13 ILE 100 HG13 ILE 100 1.602 -28.706 -9.655 262 HG21 ILE 100 HG21 ILE 100 -2.708 -28.455 -9.510 263 HG22 ILE 100 HG22 ILE 100 -1.879 -29.618 -8.455 264 HG23 ILE 100 HG23 ILE 100 -1.752 -27.868 -8.172 265 HD11 ILE 100 HD11 ILE 100 0.713 -26.970 -8.019 266 HD12 ILE 100 HD12 ILE 100 0.205 -28.349 -7.006 267 HD13 ILE 100 HD13 ILE 100 1.921 -28.126 -7.415 268 HA PRO 101 HA PRO 101 -4.038 -29.873 -13.462 269 HB2 PRO 101 HB2 PRO 101 -5.908 -31.589 -12.399 270 HB3 PRO 101 HB3 PRO 101 -4.515 -32.100 -13.400 271 HG2 PRO 101 HG2 PRO 101 -4.832 -32.229 -10.417 272 HG3 PRO 101 HG3 PRO 101 -4.052 -33.399 -11.507 273 HD2 PRO 101 HD2 PRO 101 -2.677 -31.506 -9.993 274 HD3 PRO 101 HD3 PRO 101 -2.059 -32.232 -11.505 275 H ALA 102 H ALA 102 -5.979 -28.734 -13.533 276 HA ALA 102 HA ALA 102 -6.172 -26.618 -11.762 277 HB1 ALA 102 HB1 ALA 102 -8.295 -27.635 -13.671 278 HB2 ALA 102 HB2 ALA 102 -8.145 -25.987 -13.009 279 HB3 ALA 102 HB3 ALA 102 -6.898 -26.611 -14.110 280 H ASP 103 H ASP 103 -7.866 -29.698 -11.498 281 HA ASP 103 HA ASP 103 -9.898 -29.125 -9.729 282 HB2 ASP 103 HB2 ASP 103 -9.545 -31.323 -10.699 283 HB3 ASP 103 HB3 ASP 103 -7.986 -31.486 -9.886 284 H VAL 104 H VAL 104 -6.418 -29.602 -9.005 285 HA VAL 104 HA VAL 104 -6.790 -29.415 -6.156 286 HB VAL 104 HB VAL 104 -4.126 -29.008 -7.431 287 HG11 VAL 104 HG11 VAL 104 -3.318 -30.282 -5.495 288 HG12 VAL 104 HG12 VAL 104 -4.279 -28.892 -4.972 289 HG13 VAL 104 HG13 VAL 104 -4.993 -30.515 -4.939 290 HG21 VAL 104 HG21 VAL 104 -3.791 -31.495 -7.492 291 HG22 VAL 104 HG22 VAL 104 -5.533 -31.694 -7.213 292 HG23 VAL 104 HG23 VAL 104 -4.947 -30.905 -8.690 293 H ILE 105 H ILE 105 -5.801 -27.203 -8.716 294 HA ILE 105 HA ILE 105 -5.028 -24.965 -7.051 295 HB ILE 105 HB ILE 105 -5.994 -25.217 -9.929 296 HG12 ILE 105 HG12 ILE 105 -3.211 -24.320 -9.168 297 HG13 ILE 105 HG13 ILE 105 -3.582 -26.009 -8.861 298 HG21 ILE 105 HG21 ILE 105 -5.101 -22.897 -10.265 299 HG22 ILE 105 HG22 ILE 105 -6.557 -22.954 -9.271 300 HG23 ILE 105 HG23 ILE 105 -4.964 -22.731 -8.497 301 HD11 ILE 105 HD11 ILE 105 -2.533 -25.618 -11.070 302 HD12 ILE 105 HD12 ILE 105 -4.103 -26.427 -11.150 303 HD13 ILE 105 HD13 ILE 105 -3.974 -24.697 -11.572 304 H ASP 106 H ASP 106 -8.179 -25.807 -8.630 305 HA ASP 106 HA ASP 106 -9.691 -23.794 -7.432 306 HB2 ASP 106 HB2 ASP 106 -10.428 -25.167 -9.326 307 HB3 ASP 106 HB3 ASP 106 -10.495 -26.594 -8.290 308 H ALA 107 H ALA 107 -9.103 -27.174 -6.258 309 HA ALA 107 HA ALA 107 -10.525 -27.082 -3.921 310 HB1 ALA 107 HB1 ALA 107 -7.863 -28.487 -4.461 311 HB2 ALA 107 HB2 ALA 107 -9.035 -28.915 -3.195 312 HB3 ALA 107 HB3 ALA 107 -9.476 -29.105 -4.887 313 H TYR 108 H TYR 108 -7.093 -26.077 -4.339 314 HA TYR 108 HA TYR 108 -6.621 -25.175 -1.679 315 HB2 TYR 108 HB2 TYR 108 -4.828 -25.532 -3.248 316 HB3 TYR 108 HB3 TYR 108 -5.480 -24.354 -4.373 317 HD1 TYR 108 HD2 TYR 108 -3.857 -24.763 -1.055 318 HD2 TYR 108 HD1 TYR 108 -5.022 -21.995 -4.151 319 HE1 TYR 108 HE2 TYR 108 -2.429 -23.002 -0.016 320 HE2 TYR 108 HE1 TYR 108 -3.605 -20.235 -3.108 321 HH TYR 108 HH TYR 108 -2.136 -19.709 -1.410 322 H HIS 109 H HIS 109 -7.790 -23.291 -4.560 323 HA HIS 109 HA HIS 109 -8.133 -20.868 -3.076 324 HB2 HIS 109 HB2 HIS 109 -9.302 -21.841 -5.702 325 HB3 HIS 109 HB3 HIS 109 -9.757 -20.289 -4.997 326 HD1 HIS 109 HD1 HIS 109 -7.411 -18.701 -4.299 327 HD2 HIS 109 HD2 HIS 109 -7.309 -21.596 -7.364 328 HE1 HIS 109 HE1 HIS 109 -5.411 -18.093 -5.797 329 HE2 HIS 109 HE2 HIS 109 -5.349 -19.857 -7.671 330 H ALA 110 H ALA 110 -10.453 -23.568 -3.526 331 HA ALA 110 HA ALA 110 -12.617 -22.275 -2.180 332 HB1 ALA 110 HB1 ALA 110 -13.479 -24.579 -1.939 333 HB2 ALA 110 HB2 ALA 110 -12.866 -24.292 -3.576 334 HB3 ALA 110 HB3 ALA 110 -11.901 -25.235 -2.421 335 H ALA 111 H ALA 111 -9.913 -24.305 -0.879 336 HA ALA 111 HA ALA 111 -10.772 -24.247 1.768 337 HB1 ALA 111 HB1 ALA 111 -8.491 -25.004 2.275 338 HB2 ALA 111 HB2 ALA 111 -9.126 -25.819 0.832 339 HB3 ALA 111 HB3 ALA 111 -7.948 -24.497 0.657 340 H THR 112 H THR 112 -8.623 -21.951 0.010 341 HA THR 112 HA THR 112 -8.128 -20.345 2.390 342 HB THR 112 HB THR 112 -7.067 -18.734 0.890 343 HG1 THR 112 HG1 THR 112 -6.911 -19.198 -1.293 344 HG21 THR 112 HG21 THR 112 -6.215 -21.600 0.290 345 HG22 THR 112 HG22 THR 112 -5.217 -20.141 0.146 346 HG23 THR 112 HG23 THR 112 -5.774 -20.674 1.739 347 H LEU 113 H LEU 113 -10.471 -19.996 -0.320 348 HA LEU 113 HA LEU 113 -11.362 -17.413 0.627 349 HB2 LEU 113 HB2 LEU 113 -11.278 -18.008 -1.747 350 HB3 LEU 113 HB3 LEU 113 -12.408 -19.341 -1.470 351 HG LEU 113 HG LEU 113 -14.165 -17.790 -0.853 352 HD11 LEU 113 HD11 LEU 113 -12.187 -15.594 -1.626 353 HD12 LEU 113 HD12 LEU 113 -13.924 -15.351 -1.354 354 HD13 LEU 113 HD13 LEU 113 -12.888 -15.849 -0.011 355 HD21 LEU 113 HD21 LEU 113 -14.587 -16.897 -3.105 356 HD22 LEU 113 HD22 LEU 113 -12.878 -17.137 -3.536 357 HD23 LEU 113 HD23 LEU 113 -13.919 -18.536 -3.183 358 H GLU 114 H GLU 114 -12.848 -20.664 0.578 359 HA GLU 114 HA GLU 114 -15.147 -19.640 2.171 360 HB2 GLU 114 HB2 GLU 114 -14.760 -22.297 0.741 361 HB3 GLU 114 HB3 GLU 114 -16.211 -21.767 1.584 362 HG2 GLU 114 HG2 GLU 114 -16.387 -19.817 0.010 363 HG3 GLU 114 HG3 GLU 114 -15.025 -20.479 -0.907 364 H HIS 115 H HIS 115 -12.581 -22.038 2.438 365 HA HIS 115 HA HIS 115 -11.914 -23.546 3.906 366 HB2 HIS 115 HB2 HIS 115 -11.145 -22.806 5.846 367 HB3 HIS 115 HB3 HIS 115 -11.480 -21.281 5.054 368 HD1 HIS 115 HD1 HIS 115 -14.400 -20.625 5.885 369 HD2 HIS 115 HD2 HIS 115 -11.526 -22.501 8.343 370 HE1 HIS 115 HE1 HIS 115 -15.056 -20.078 8.328 371 HE2 HIS 115 HE2 HIS 115 -13.304 -21.244 9.815 372 H HIS 116 H HIS 116 -15.278 -22.935 4.321 373 HA HIS 116 HA HIS 116 -15.651 -25.789 5.187 374 HB2 HIS 116 HB2 HIS 116 -17.466 -23.388 5.708 375 HB3 HIS 116 HB3 HIS 116 -17.816 -25.053 6.158 376 HD1 HIS 116 HD1 HIS 116 -17.541 -22.588 8.240 377 HD2 HIS 116 HD2 HIS 116 -14.813 -25.710 7.433 378 HE1 HIS 116 HE1 HIS 116 -16.121 -22.892 10.369 379 HE2 HIS 116 HE2 HIS 116 -14.453 -24.786 9.857 380 H HIS 117 H HIS 117 -15.121 -25.393 2.587 381 HA HIS 117 HA HIS 117 -16.974 -24.508 0.749 382 HB2 HIS 117 HB2 HIS 117 -14.694 -25.133 0.202 383 HB3 HIS 117 HB3 HIS 117 -15.003 -26.824 0.576 384 HD1 HIS 117 HD1 HIS 117 -16.315 -24.210 -2.037 385 HD2 HIS 117 HD2 HIS 117 -15.489 -28.327 -1.474 386 HE1 HIS 117 HE1 HIS 117 -16.745 -25.363 -4.300 387 HE2 HIS 117 HE2 HIS 117 -16.234 -27.866 -3.954 388 H HIS 118 H HIS 118 -17.225 -27.709 2.308 389 HA HIS 118 HA HIS 118 -19.301 -28.706 0.584 390 HB2 HIS 118 HB2 HIS 118 -19.641 -30.427 2.280 391 HB3 HIS 118 HB3 HIS 118 -17.945 -30.202 1.907 392 HD1 HIS 118 HD1 HIS 118 -20.424 -29.854 4.822 393 HD2 HIS 118 HD2 HIS 118 -16.315 -29.416 3.889 394 HE1 HIS 118 HE1 HIS 118 -19.194 -29.571 7.053 395 HE2 HIS 118 HE2 HIS 118 -16.688 -29.324 6.487 396 H HIS 119 H HIS 119 -19.503 -26.535 3.302 397 HA HIS 119 HA HIS 119 -21.087 -25.497 4.470 398 HB2 HIS 119 HB2 HIS 119 -22.550 -25.606 1.811 399 HB3 HIS 119 HB3 HIS 119 -23.039 -24.611 3.175 400 HD1 HIS 119 HD1 HIS 119 -21.079 -22.748 4.014 401 HD2 HIS 119 HD2 HIS 119 -20.777 -24.515 0.187 402 HE1 HIS 119 HE1 HIS 119 -19.461 -21.270 2.648 403 HE2 HIS 119 HE2 HIS 119 -19.278 -22.348 0.315 404 H HIS 120 H HIS 120 -22.894 -28.107 2.816 405 HA HIS 120 HA HIS 120 -24.822 -28.457 4.975 406 HB2 HIS 120 HB2 HIS 120 -24.035 -30.331 2.708 407 HB3 HIS 120 HB3 HIS 120 -25.474 -30.458 3.711 408 HD1 HIS 120 HD1 HIS 120 -24.518 -29.157 0.425 409 HD2 HIS 120 HD2 HIS 120 -27.104 -28.018 3.570 410 HE1 HIS 120 HE1 HIS 120 -26.230 -27.522 -0.595 411 HE2 HIS 120 HE2 HIS 120 -27.803 -26.833 1.330 Start of MODEL 12 1 H1 SER 66 H1 SER 66 -4.505 -2.275 -26.326 2 H2 SER 66 H2 SER 66 -4.362 -0.847 -27.116 3 H3 SER 66 H3 SER 66 -3.063 -1.825 -26.957 4 HA SER 66 HA SER 66 -2.880 0.023 -25.443 5 HB2 SER 66 HB2 SER 66 -5.384 0.321 -25.238 6 HB3 SER 66 HB3 SER 66 -5.396 -1.043 -24.099 7 HG SER 66 HG SER 66 -5.209 1.022 -23.057 8 H GLY 67 H GLY 67 -2.020 -0.205 -23.225 9 HA2 GLY 67 HA2 GLY 67 -0.837 -1.307 -21.583 10 HA3 GLY 67 HA3 GLY 67 -1.762 -2.765 -21.920 11 H SER 68 H SER 68 0.368 -3.711 -21.352 12 HA SER 68 HA SER 68 2.613 -3.441 -23.166 13 HB2 SER 68 HB2 SER 68 3.705 -5.073 -21.805 14 HB3 SER 68 HB3 SER 68 2.851 -3.945 -20.749 15 HG SER 68 HG SER 68 1.230 -5.516 -20.427 16 H GLY 69 H GLY 69 -0.208 -5.407 -23.356 17 HA2 GLY 69 HA2 GLY 69 -0.878 -6.905 -24.983 18 HA3 GLY 69 HA3 GLY 69 0.683 -6.727 -25.790 19 H ARG 70 H ARG 70 1.153 -7.617 -22.531 20 HA ARG 70 HA ARG 70 2.072 -10.304 -23.283 21 HB2 ARG 70 HB2 ARG 70 2.055 -8.797 -20.639 22 HB3 ARG 70 HB3 ARG 70 2.805 -10.377 -20.885 23 HG2 ARG 70 HG2 ARG 70 4.328 -9.462 -22.573 24 HG3 ARG 70 HG3 ARG 70 3.611 -7.854 -22.418 25 HD2 ARG 70 HD2 ARG 70 5.000 -9.367 -20.170 26 HD3 ARG 70 HD3 ARG 70 5.748 -8.107 -21.173 27 HE ARG 70 HE ARG 70 3.410 -6.956 -20.153 28 HH11 ARG 70 HH11 ARG 70 6.395 -8.160 -18.752 29 HH12 ARG 70 HH12 ARG 70 6.284 -7.096 -17.374 30 HH21 ARG 70 HH21 ARG 70 3.316 -5.655 -18.373 31 HH22 ARG 70 HH22 ARG 70 4.579 -5.702 -17.174 32 H GLY 71 H GLY 71 -0.913 -9.157 -22.037 33 HA2 GLY 71 HA2 GLY 71 -2.859 -10.319 -21.514 34 HA3 GLY 71 HA3 GLY 71 -2.072 -11.799 -22.044 35 H ARG 72 H ARG 72 -2.417 -13.218 -20.456 36 HA ARG 72 HA ARG 72 -2.488 -12.465 -17.598 37 HB2 ARG 72 HB2 ARG 72 -2.981 -15.121 -19.011 38 HB3 ARG 72 HB3 ARG 72 -3.130 -14.861 -17.273 39 HG2 ARG 72 HG2 ARG 72 -4.901 -13.154 -17.660 40 HG3 ARG 72 HG3 ARG 72 -4.764 -13.410 -19.402 41 HD2 ARG 72 HD2 ARG 72 -6.670 -14.656 -18.612 42 HD3 ARG 72 HD3 ARG 72 -5.423 -15.782 -19.123 43 HE ARG 72 HE ARG 72 -5.162 -16.539 -16.943 44 HH11 ARG 72 HH11 ARG 72 -7.237 -13.707 -16.789 45 HH12 ARG 72 HH12 ARG 72 -7.674 -14.010 -15.131 46 HH21 ARG 72 HH21 ARG 72 -5.748 -16.848 -14.832 47 HH22 ARG 72 HH22 ARG 72 -6.845 -15.749 -14.052 48 H GLY 73 H GLY 73 -1.239 -13.346 -15.964 49 HA2 GLY 73 HA2 GLY 73 1.572 -13.839 -16.546 50 HA3 GLY 73 HA3 GLY 73 0.798 -13.828 -14.965 51 H ALA 74 H ALA 74 2.705 -15.628 -15.314 52 HA ALA 74 HA ALA 74 1.289 -18.223 -15.198 53 HB1 ALA 74 HB1 ALA 74 3.790 -17.722 -16.879 54 HB2 ALA 74 HB2 ALA 74 3.033 -19.303 -16.597 55 HB3 ALA 74 HB3 ALA 74 2.164 -18.057 -17.507 56 H ILE 75 H ILE 75 2.412 -19.865 -14.045 57 HA ILE 75 HA ILE 75 4.205 -18.796 -11.918 58 HB ILE 75 HB ILE 75 2.484 -21.297 -11.955 59 HG12 ILE 75 HG12 ILE 75 0.989 -19.428 -11.896 60 HG13 ILE 75 HG13 ILE 75 1.049 -20.148 -10.304 61 HG21 ILE 75 HG21 ILE 75 2.915 -21.365 -9.510 62 HG22 ILE 75 HG22 ILE 75 4.360 -21.650 -10.463 63 HG23 ILE 75 HG23 ILE 75 4.119 -20.060 -9.696 64 HD11 ILE 75 HD11 ILE 75 2.412 -17.552 -11.151 65 HD12 ILE 75 HD12 ILE 75 0.996 -17.731 -10.108 66 HD13 ILE 75 HD13 ILE 75 2.577 -18.300 -9.545 67 H ASP 76 H ASP 76 6.215 -19.611 -11.550 68 HA ASP 76 HA ASP 76 7.255 -21.722 -13.375 69 HB2 ASP 76 HB2 ASP 76 8.512 -19.643 -13.140 70 HB3 ASP 76 HB3 ASP 76 8.689 -19.924 -11.406 71 H ARG 77 H ARG 77 7.343 -21.076 -9.850 72 HA ARG 77 HA ARG 77 6.678 -23.867 -9.219 73 HB2 ARG 77 HB2 ARG 77 9.142 -23.891 -9.709 74 HB3 ARG 77 HB3 ARG 77 9.403 -22.688 -8.444 75 HG2 ARG 77 HG2 ARG 77 8.623 -24.288 -6.738 76 HG3 ARG 77 HG3 ARG 77 8.228 -25.470 -8.007 77 HD2 ARG 77 HD2 ARG 77 10.613 -25.557 -8.664 78 HD3 ARG 77 HD3 ARG 77 11.001 -24.353 -7.420 79 HE ARG 77 HE ARG 77 9.665 -26.558 -6.182 80 HH11 ARG 77 HH11 ARG 77 12.774 -25.893 -7.664 81 HH12 ARG 77 HH12 ARG 77 13.596 -27.088 -6.696 82 HH21 ARG 77 HH21 ARG 77 10.784 -28.071 -4.972 83 HH22 ARG 77 HH22 ARG 77 12.488 -28.291 -5.220 84 H GLU 78 H GLU 78 7.569 -20.719 -7.911 85 HA GLU 78 HA GLU 78 7.333 -20.746 -5.291 86 HB2 GLU 78 HB2 GLU 78 7.502 -18.723 -6.671 87 HB3 GLU 78 HB3 GLU 78 5.820 -18.877 -7.159 88 HG2 GLU 78 HG2 GLU 78 5.170 -18.537 -4.712 89 HG3 GLU 78 HG3 GLU 78 6.869 -18.209 -4.384 90 H GLN 79 H GLN 79 4.345 -20.730 -7.255 91 HA GLN 79 HA GLN 79 2.706 -21.060 -4.812 92 HB2 GLN 79 HB2 GLN 79 1.719 -20.528 -7.631 93 HB3 GLN 79 HB3 GLN 79 0.875 -20.283 -6.091 94 HG2 GLN 79 HG2 GLN 79 2.793 -18.661 -5.480 95 HG3 GLN 79 HG3 GLN 79 3.297 -18.768 -7.167 96 HE21 GLN 79 HE22 GLN 79 2.958 -16.353 -6.525 97 HE22 GLN 79 HE21 GLN 79 1.384 -15.693 -7.019 98 H SER 80 H SER 80 3.560 -22.942 -7.707 99 HA SER 80 HA SER 80 1.742 -25.104 -7.347 100 HB2 SER 80 HB2 SER 80 4.614 -25.197 -8.364 101 HB3 SER 80 HB3 SER 80 3.346 -26.406 -8.641 102 HG SER 80 HG SER 80 3.579 -24.901 -10.413 103 H ALA 81 H ALA 81 5.030 -24.534 -5.921 104 HA ALA 81 HA ALA 81 5.150 -26.883 -4.410 105 HB1 ALA 81 HB1 ALA 81 7.054 -25.381 -4.850 106 HB2 ALA 81 HB2 ALA 81 6.316 -24.129 -3.821 107 HB3 ALA 81 HB3 ALA 81 6.863 -25.665 -3.109 108 H ALA 82 H ALA 82 3.732 -23.705 -3.500 109 HA ALA 82 HA ALA 82 2.976 -24.442 -0.840 110 HB1 ALA 82 HB1 ALA 82 1.573 -22.426 -0.955 111 HB2 ALA 82 HB2 ALA 82 3.180 -22.117 -1.640 112 HB3 ALA 82 HB3 ALA 82 1.783 -22.349 -2.716 113 H ILE 83 H ILE 83 1.162 -24.648 -3.945 114 HA ILE 83 HA ILE 83 -1.236 -25.699 -2.704 115 HB ILE 83 HB ILE 83 -0.305 -25.567 -5.587 116 HG12 ILE 83 HG12 ILE 83 -2.377 -24.001 -3.979 117 HG13 ILE 83 HG13 ILE 83 -0.776 -23.414 -4.364 118 HG21 ILE 83 HG21 ILE 83 -2.650 -26.126 -6.225 119 HG22 ILE 83 HG22 ILE 83 -1.906 -27.466 -5.368 120 HG23 ILE 83 HG23 ILE 83 -3.050 -26.407 -4.517 121 HD11 ILE 83 HD11 ILE 83 -3.046 -23.883 -6.310 122 HD12 ILE 83 HD12 ILE 83 -2.255 -22.366 -5.880 123 HD13 ILE 83 HD13 ILE 83 -1.359 -23.578 -6.820 124 H ARG 84 H ARG 84 1.624 -27.287 -4.127 125 HA ARG 84 HA ARG 84 0.652 -29.994 -3.818 126 HB2 ARG 84 HB2 ARG 84 2.583 -29.308 -5.233 127 HB3 ARG 84 HB3 ARG 84 3.514 -28.906 -3.795 128 HG2 ARG 84 HG2 ARG 84 3.545 -31.254 -3.099 129 HG3 ARG 84 HG3 ARG 84 2.421 -31.691 -4.404 130 HD2 ARG 84 HD2 ARG 84 4.057 -31.012 -6.097 131 HD3 ARG 84 HD3 ARG 84 5.199 -30.510 -4.828 132 HE ARG 84 HE ARG 84 4.672 -33.162 -4.228 133 HH11 ARG 84 HH11 ARG 84 5.935 -31.557 -7.079 134 HH12 ARG 84 HH12 ARG 84 6.719 -33.007 -7.657 135 HH21 ARG 84 HH21 ARG 84 5.886 -34.909 -4.920 136 HH22 ARG 84 HH22 ARG 84 6.867 -34.768 -6.347 137 H GLU 85 H GLU 85 2.636 -27.963 -1.582 138 HA GLU 85 HA GLU 85 2.605 -29.771 0.553 139 HB2 GLU 85 HB2 GLU 85 4.019 -27.681 0.258 140 HB3 GLU 85 HB3 GLU 85 2.626 -26.776 0.860 141 HG2 GLU 85 HG2 GLU 85 4.046 -27.255 2.747 142 HG3 GLU 85 HG3 GLU 85 2.599 -28.265 2.860 143 H TRP 86 H TRP 86 0.190 -27.149 -0.147 144 HA TRP 86 HA TRP 86 -1.561 -27.702 1.926 145 HB2 TRP 86 HB2 TRP 86 -1.856 -25.778 0.502 146 HB3 TRP 86 HB3 TRP 86 -2.118 -26.796 -0.912 147 HD1 TRP 86 HD1 TRP 86 -3.878 -25.510 2.203 148 HE1 TRP 86 HE1 TRP 86 -6.372 -26.105 2.135 149 HE3 TRP 86 HE3 TRP 86 -3.943 -28.306 -2.097 150 HZ2 TRP 86 HZ2 TRP 86 -8.084 -27.899 0.640 151 HZ3 TRP 86 HZ3 TRP 86 -6.006 -29.507 -2.774 152 HH2 TRP 86 HH2 TRP 86 -8.066 -29.354 -1.375 153 H ALA 87 H ALA 87 -1.558 -29.229 -1.356 154 HA ALA 87 HA ALA 87 -3.786 -30.881 -0.793 155 HB1 ALA 87 HB1 ALA 87 -3.003 -30.311 -3.078 156 HB2 ALA 87 HB2 ALA 87 -1.509 -31.231 -2.824 157 HB3 ALA 87 HB3 ALA 87 -3.076 -32.070 -2.888 158 H ARG 88 H ARG 88 -0.303 -31.580 -0.463 159 HA ARG 88 HA ARG 88 -0.337 -34.260 0.454 160 HB2 ARG 88 HB2 ARG 88 1.672 -32.925 -0.097 161 HB3 ARG 88 HB3 ARG 88 1.375 -31.877 1.284 162 HG2 ARG 88 HG2 ARG 88 1.719 -33.882 2.801 163 HG3 ARG 88 HG3 ARG 88 2.196 -34.804 1.358 164 HD2 ARG 88 HD2 ARG 88 3.987 -33.101 0.924 165 HD3 ARG 88 HD3 ARG 88 3.474 -32.229 2.380 166 HE ARG 88 HE ARG 88 4.331 -35.077 2.603 167 HH11 ARG 88 HH11 ARG 88 5.055 -31.707 3.479 168 HH12 ARG 88 HH12 ARG 88 6.370 -32.217 4.502 169 HH21 ARG 88 HH21 ARG 88 5.973 -35.584 3.975 170 HH22 ARG 88 HH22 ARG 88 6.852 -34.336 4.806 171 H ARG 89 H ARG 89 -0.813 -31.261 2.342 172 HA ARG 89 HA ARG 89 -1.253 -32.710 4.860 173 HB2 ARG 89 HB2 ARG 89 -1.435 -29.765 4.121 174 HB3 ARG 89 HB3 ARG 89 -1.625 -30.403 5.762 175 HG2 ARG 89 HG2 ARG 89 0.637 -31.375 5.703 176 HG3 ARG 89 HG3 ARG 89 0.863 -30.818 4.042 177 HD2 ARG 89 HD2 ARG 89 0.530 -28.449 4.875 178 HD3 ARG 89 HD3 ARG 89 0.549 -29.111 6.526 179 HE ARG 89 HE ARG 89 2.812 -29.737 4.667 180 HH11 ARG 89 HH11 ARG 89 1.904 -27.892 7.530 181 HH12 ARG 89 HH12 ARG 89 3.575 -27.574 7.917 182 HH21 ARG 89 HH21 ARG 89 4.758 -29.301 5.151 183 HH22 ARG 89 HH22 ARG 89 5.211 -28.379 6.587 184 H ASN 90 H ASN 90 -3.366 -31.749 2.328 185 HA ASN 90 HA ASN 90 -5.764 -32.271 4.045 186 HB2 ASN 90 HB2 ASN 90 -5.466 -30.805 1.396 187 HB3 ASN 90 HB3 ASN 90 -7.018 -31.209 2.123 188 HD21 ASN 90 HD22 ASN 90 -4.138 -29.231 2.483 189 HD22 ASN 90 HD21 ASN 90 -4.827 -28.166 3.713 190 H GLY 91 H GLY 91 -3.805 -34.276 2.544 191 HA2 GLY 91 HA2 GLY 91 -4.024 -36.382 1.682 192 HA3 GLY 91 HA3 GLY 91 -5.689 -36.366 2.263 193 H HIS 92 H HIS 92 -4.639 -34.045 -0.171 194 HA HIS 92 HA HIS 92 -6.621 -35.195 -2.090 195 HB2 HIS 92 HB2 HIS 92 -5.446 -32.431 -1.685 196 HB3 HIS 92 HB3 HIS 92 -6.105 -32.891 -3.245 197 HD1 HIS 92 HD1 HIS 92 -7.614 -33.408 0.357 198 HD2 HIS 92 HD2 HIS 92 -8.447 -31.930 -3.521 199 HE1 HIS 92 HE1 HIS 92 -10.054 -32.606 0.389 200 HE2 HIS 92 HE2 HIS 92 -10.561 -31.719 -1.973 201 H ASN 93 H ASN 93 -6.152 -35.591 -4.249 202 HA ASN 93 HA ASN 93 -3.486 -36.577 -4.822 203 HB2 ASN 93 HB2 ASN 93 -4.397 -37.257 -6.943 204 HB3 ASN 93 HB3 ASN 93 -5.551 -37.642 -5.683 205 HD21 ASN 93 HD22 ASN 93 -5.169 -36.093 -8.724 206 HD22 ASN 93 HD21 ASN 93 -6.722 -35.280 -8.730 207 H VAL 94 H VAL 94 -1.926 -35.798 -6.203 208 HA VAL 94 HA VAL 94 -2.187 -33.285 -7.663 209 HB VAL 94 HB VAL 94 -1.827 -32.491 -5.353 210 HG11 VAL 94 HG11 VAL 94 0.250 -32.773 -4.160 211 HG12 VAL 94 HG12 VAL 94 -0.474 -34.356 -4.448 212 HG13 VAL 94 HG13 VAL 94 0.901 -33.825 -5.441 213 HG21 VAL 94 HG21 VAL 94 0.616 -31.910 -7.056 214 HG22 VAL 94 HG22 VAL 94 -0.996 -31.183 -7.286 215 HG23 VAL 94 HG23 VAL 94 -0.099 -30.903 -5.791 216 H SER 95 H SER 95 -0.426 -32.900 -9.112 217 HA SER 95 HA SER 95 0.762 -35.328 -10.106 218 HB2 SER 95 HB2 SER 95 1.757 -33.769 -11.809 219 HB3 SER 95 HB3 SER 95 -0.011 -33.741 -11.673 220 HG SER 95 HG SER 95 1.078 -31.631 -11.761 221 H THR 96 H THR 96 2.916 -35.927 -10.303 222 HA THR 96 HA THR 96 4.605 -35.138 -8.043 223 HB THR 96 HB THR 96 6.047 -37.025 -8.865 224 HG1 THR 96 HG1 THR 96 5.138 -38.328 -10.513 225 HG21 THR 96 HG21 THR 96 4.236 -37.407 -7.208 226 HG22 THR 96 HG22 THR 96 3.094 -37.737 -8.530 227 HG23 THR 96 HG23 THR 96 4.484 -38.809 -8.262 228 H ARG 97 H ARG 97 4.628 -34.617 -11.501 229 HA ARG 97 HA ARG 97 7.006 -32.829 -11.296 230 HB2 ARG 97 HB2 ARG 97 6.557 -34.971 -13.426 231 HB3 ARG 97 HB3 ARG 97 7.778 -33.696 -13.518 232 HG2 ARG 97 HG2 ARG 97 8.837 -34.546 -11.440 233 HG3 ARG 97 HG3 ARG 97 7.677 -35.877 -11.380 234 HD2 ARG 97 HD2 ARG 97 9.593 -35.351 -13.684 235 HD3 ARG 97 HD3 ARG 97 9.891 -36.493 -12.364 236 HE ARG 97 HE ARG 97 7.415 -37.243 -13.398 237 HH11 ARG 97 HH11 ARG 97 10.672 -37.098 -14.683 238 HH12 ARG 97 HH12 ARG 97 10.374 -38.377 -15.831 239 HH21 ARG 97 HH21 ARG 97 7.098 -38.858 -14.892 240 HH22 ARG 97 HH22 ARG 97 8.405 -39.350 -15.929 241 H GLY 98 H GLY 98 7.107 -31.234 -12.978 242 HA2 GLY 98 HA2 GLY 98 6.231 -29.620 -14.401 243 HA3 GLY 98 HA3 GLY 98 4.937 -30.740 -14.827 244 H ARG 99 H ARG 99 3.567 -28.850 -14.851 245 HA ARG 99 HA ARG 99 2.980 -27.428 -12.335 246 HB2 ARG 99 HB2 ARG 99 1.788 -27.212 -15.133 247 HB3 ARG 99 HB3 ARG 99 1.273 -26.236 -13.750 248 HG2 ARG 99 HG2 ARG 99 3.629 -25.416 -13.477 249 HG3 ARG 99 HG3 ARG 99 4.068 -26.265 -14.965 250 HD2 ARG 99 HD2 ARG 99 2.423 -24.907 -16.235 251 HD3 ARG 99 HD3 ARG 99 1.923 -24.111 -14.744 252 HE ARG 99 HE ARG 99 3.959 -22.915 -14.615 253 HH11 ARG 99 HH11 ARG 99 4.045 -24.912 -17.511 254 HH12 ARG 99 HH12 ARG 99 5.377 -24.005 -18.177 255 HH21 ARG 99 HH21 ARG 99 5.555 -21.847 -15.483 256 HH22 ARG 99 HH22 ARG 99 6.240 -22.282 -17.040 257 H ILE 100 H ILE 100 0.856 -27.181 -11.507 258 HA ILE 100 HA ILE 100 -0.355 -29.794 -10.956 259 HB ILE 100 HB ILE 100 -0.628 -27.041 -9.728 260 HG12 ILE 100 HG12 ILE 100 0.585 -29.693 -8.810 261 HG13 ILE 100 HG13 ILE 100 1.468 -28.250 -9.303 262 HG21 ILE 100 HG21 ILE 100 -2.032 -27.976 -7.974 263 HG22 ILE 100 HG22 ILE 100 -2.836 -28.159 -9.508 264 HG23 ILE 100 HG23 ILE 100 -2.038 -29.563 -8.765 265 HD11 ILE 100 HD11 ILE 100 1.553 -28.336 -6.960 266 HD12 ILE 100 HD12 ILE 100 0.430 -27.022 -7.365 267 HD13 ILE 100 HD13 ILE 100 -0.188 -28.594 -6.790 268 HA PRO 101 HA PRO 101 -3.830 -29.018 -13.690 269 HB2 PRO 101 HB2 PRO 101 -5.601 -30.956 -12.847 270 HB3 PRO 101 HB3 PRO 101 -4.171 -31.264 -13.879 271 HG2 PRO 101 HG2 PRO 101 -4.471 -31.694 -10.914 272 HG3 PRO 101 HG3 PRO 101 -3.645 -32.727 -12.113 273 HD2 PRO 101 HD2 PRO 101 -2.338 -30.970 -10.445 274 HD3 PRO 101 HD3 PRO 101 -1.720 -31.420 -12.059 275 H ALA 102 H ALA 102 -5.777 -27.916 -13.700 276 HA ALA 102 HA ALA 102 -6.041 -26.033 -11.715 277 HB1 ALA 102 HB1 ALA 102 -8.120 -26.808 -13.783 278 HB2 ALA 102 HB2 ALA 102 -7.984 -25.251 -12.927 279 HB3 ALA 102 HB3 ALA 102 -6.708 -25.747 -14.053 280 H ASP 103 H ASP 103 -7.783 -29.113 -11.799 281 HA ASP 103 HA ASP 103 -9.864 -28.549 -10.062 282 HB2 ASP 103 HB2 ASP 103 -8.233 -31.097 -10.393 283 HB3 ASP 103 HB3 ASP 103 -9.747 -31.001 -9.497 284 H VAL 104 H VAL 104 -6.457 -29.303 -9.264 285 HA VAL 104 HA VAL 104 -6.962 -29.418 -6.421 286 HB VAL 104 HB VAL 104 -4.214 -28.981 -7.464 287 HG11 VAL 104 HG11 VAL 104 -3.597 -30.528 -5.668 288 HG12 VAL 104 HG12 VAL 104 -4.565 -29.192 -5.040 289 HG13 VAL 104 HG13 VAL 104 -5.310 -30.792 -5.286 290 HG21 VAL 104 HG21 VAL 104 -3.898 -31.408 -7.885 291 HG22 VAL 104 HG22 VAL 104 -5.653 -31.654 -7.706 292 HG23 VAL 104 HG23 VAL 104 -4.996 -30.669 -9.041 293 H ILE 105 H ILE 105 -5.816 -26.984 -8.709 294 HA ILE 105 HA ILE 105 -5.095 -24.950 -6.775 295 HB ILE 105 HB ILE 105 -5.907 -24.901 -9.705 296 HG12 ILE 105 HG12 ILE 105 -3.175 -24.111 -8.680 297 HG13 ILE 105 HG13 ILE 105 -3.566 -25.820 -8.607 298 HG21 ILE 105 HG21 ILE 105 -4.975 -22.569 -7.979 299 HG22 ILE 105 HG22 ILE 105 -4.971 -22.564 -9.757 300 HG23 ILE 105 HG23 ILE 105 -6.504 -22.713 -8.899 301 HD11 ILE 105 HD11 ILE 105 -3.994 -25.931 -10.966 302 HD12 ILE 105 HD12 ILE 105 -3.761 -24.173 -11.148 303 HD13 ILE 105 HD13 ILE 105 -2.396 -25.220 -10.686 304 H ASP 106 H ASP 106 -8.168 -25.614 -8.560 305 HA ASP 106 HA ASP 106 -9.733 -23.709 -7.264 306 HB2 ASP 106 HB2 ASP 106 -10.394 -24.933 -9.282 307 HB3 ASP 106 HB3 ASP 106 -10.503 -26.433 -8.357 308 H ALA 107 H ALA 107 -9.157 -27.165 -6.303 309 HA ALA 107 HA ALA 107 -10.633 -27.196 -3.984 310 HB1 ALA 107 HB1 ALA 107 -7.976 -28.608 -4.540 311 HB2 ALA 107 HB2 ALA 107 -9.207 -29.097 -3.352 312 HB3 ALA 107 HB3 ALA 107 -9.578 -29.159 -5.077 313 H TYR 108 H TYR 108 -7.207 -26.185 -4.331 314 HA TYR 108 HA TYR 108 -6.712 -25.409 -1.642 315 HB2 TYR 108 HB2 TYR 108 -4.869 -25.636 -3.068 316 HB3 TYR 108 HB3 TYR 108 -5.580 -24.673 -4.343 317 HD1 TYR 108 HD1 TYR 108 -4.087 -24.440 -0.925 318 HD2 TYR 108 HD2 TYR 108 -5.221 -22.334 -4.516 319 HE1 TYR 108 HE1 TYR 108 -2.849 -22.425 -0.134 320 HE2 TYR 108 HE2 TYR 108 -3.983 -20.323 -3.725 321 HH TYR 108 HH TYR 108 -2.690 -19.399 -2.058 322 H HIS 109 H HIS 109 -7.941 -23.376 -4.401 323 HA HIS 109 HA HIS 109 -8.286 -21.048 -2.752 324 HB2 HIS 109 HB2 HIS 109 -9.524 -21.850 -5.402 325 HB3 HIS 109 HB3 HIS 109 -9.935 -20.344 -4.578 326 HD1 HIS 109 HD1 HIS 109 -7.551 -18.812 -3.891 327 HD2 HIS 109 HD2 HIS 109 -7.587 -21.535 -7.108 328 HE1 HIS 109 HE1 HIS 109 -5.597 -18.133 -5.433 329 HE2 HIS 109 HE2 HIS 109 -5.632 -19.786 -7.406 330 H ALA 110 H ALA 110 -10.630 -23.726 -3.406 331 HA ALA 110 HA ALA 110 -12.809 -22.521 -2.115 332 HB1 ALA 110 HB1 ALA 110 -12.045 -25.469 -2.232 333 HB2 ALA 110 HB2 ALA 110 -13.655 -24.824 -1.867 334 HB3 ALA 110 HB3 ALA 110 -12.946 -24.575 -3.473 335 H ALA 111 H ALA 111 -10.160 -24.498 -0.663 336 HA ALA 111 HA ALA 111 -11.075 -24.570 1.943 337 HB1 ALA 111 HB1 ALA 111 -8.215 -24.477 0.922 338 HB2 ALA 111 HB2 ALA 111 -8.760 -25.184 2.461 339 HB3 ALA 111 HB3 ALA 111 -9.255 -25.926 0.925 340 H THR 112 H THR 112 -9.276 -21.984 0.314 341 HA THR 112 HA THR 112 -8.979 -20.441 2.824 342 HB THR 112 HB THR 112 -7.680 -18.856 1.499 343 HG1 THR 112 HG1 THR 112 -7.191 -19.368 -0.640 344 HG21 THR 112 HG21 THR 112 -6.773 -21.731 1.014 345 HG22 THR 112 HG22 THR 112 -5.752 -20.279 1.064 346 HG23 THR 112 HG23 THR 112 -6.563 -20.835 2.538 347 H LEU 113 H LEU 113 -10.892 -20.183 -0.193 348 HA LEU 113 HA LEU 113 -11.849 -17.543 0.394 349 HB2 LEU 113 HB2 LEU 113 -11.561 -18.429 -1.881 350 HB3 LEU 113 HB3 LEU 113 -12.728 -19.717 -1.548 351 HG LEU 113 HG LEU 113 -14.520 -18.100 -1.317 352 HD11 LEU 113 HD11 LEU 113 -13.334 -16.080 -0.562 353 HD12 LEU 113 HD12 LEU 113 -12.435 -16.007 -2.095 354 HD13 LEU 113 HD13 LEU 113 -14.190 -15.732 -2.069 355 HD21 LEU 113 HD21 LEU 113 -14.027 -19.098 -3.522 356 HD22 LEU 113 HD22 LEU 113 -14.679 -17.459 -3.689 357 HD23 LEU 113 HD23 LEU 113 -12.937 -17.744 -3.894 358 H GLU 114 H GLU 114 -13.171 -20.807 0.945 359 HA GLU 114 HA GLU 114 -15.800 -20.126 1.729 360 HB2 GLU 114 HB2 GLU 114 -15.015 -22.420 1.372 361 HB3 GLU 114 HB3 GLU 114 -14.029 -22.338 2.847 362 HG2 GLU 114 HG2 GLU 114 -16.080 -22.042 4.200 363 HG3 GLU 114 HG3 GLU 114 -17.062 -22.012 2.735 364 H HIS 115 H HIS 115 -16.540 -18.815 3.273 365 HA HIS 115 HA HIS 115 -16.579 -17.307 4.955 366 HB2 HIS 115 HB2 HIS 115 -16.947 -19.661 5.984 367 HB3 HIS 115 HB3 HIS 115 -15.375 -19.446 6.733 368 HD1 HIS 115 HD1 HIS 115 -15.319 -16.973 8.279 369 HD2 HIS 115 HD2 HIS 115 -18.987 -18.826 7.313 370 HE1 HIS 115 HE1 HIS 115 -17.066 -16.074 9.970 371 HE2 HIS 115 HE2 HIS 115 -19.296 -17.208 9.363 372 H HIS 116 H HIS 116 -14.116 -17.181 3.378 373 HA HIS 116 HA HIS 116 -11.966 -16.474 3.318 374 HB2 HIS 116 HB2 HIS 116 -12.838 -14.601 5.543 375 HB3 HIS 116 HB3 HIS 116 -11.472 -14.370 4.460 376 HD1 HIS 116 HD1 HIS 116 -14.985 -13.359 4.718 377 HD2 HIS 116 HD2 HIS 116 -12.271 -14.390 1.649 378 HE1 HIS 116 HE1 HIS 116 -15.962 -12.414 2.529 379 HE2 HIS 116 HE2 HIS 116 -14.302 -13.036 0.666 380 H HIS 117 H HIS 117 -12.235 -18.833 4.823 381 HA HIS 117 HA HIS 117 -10.971 -18.935 7.333 382 HB2 HIS 117 HB2 HIS 117 -12.245 -20.777 6.530 383 HB3 HIS 117 HB3 HIS 117 -11.301 -20.910 5.058 384 HD1 HIS 117 HD1 HIS 117 -9.644 -22.820 5.070 385 HD2 HIS 117 HD2 HIS 117 -10.601 -21.349 8.915 386 HE1 HIS 117 HE1 HIS 117 -8.362 -24.312 6.767 387 HE2 HIS 117 HE2 HIS 117 -8.964 -23.406 9.107 388 H HIS 118 H HIS 118 -8.977 -18.648 8.045 389 HA HIS 118 HA HIS 118 -6.578 -19.246 6.431 390 HB2 HIS 118 HB2 HIS 118 -5.605 -17.006 6.755 391 HB3 HIS 118 HB3 HIS 118 -7.060 -16.941 5.788 392 HD1 HIS 118 HD1 HIS 118 -9.240 -15.742 6.946 393 HD2 HIS 118 HD2 HIS 118 -5.587 -15.663 9.080 394 HE1 HIS 118 HE1 HIS 118 -9.521 -13.995 8.828 395 HE2 HIS 118 HE2 HIS 118 -7.292 -13.960 10.121 396 H HIS 119 H HIS 119 -4.577 -19.170 7.682 397 HA HIS 119 HA HIS 119 -4.941 -20.380 10.324 398 HB2 HIS 119 HB2 HIS 119 -2.548 -20.825 10.214 399 HB3 HIS 119 HB3 HIS 119 -3.344 -21.304 8.726 400 HD1 HIS 119 HD1 HIS 119 -1.047 -18.436 10.038 401 HD2 HIS 119 HD2 HIS 119 -2.373 -20.322 6.479 402 HE1 HIS 119 HE1 HIS 119 0.353 -17.451 8.118 403 HE2 HIS 119 HE2 HIS 119 -0.453 -18.607 5.958 404 H HIS 120 H HIS 120 -3.588 -19.766 12.190 405 HA HIS 120 HA HIS 120 -3.788 -16.982 12.969 406 HB2 HIS 120 HB2 HIS 120 -2.203 -19.253 14.233 407 HB3 HIS 120 HB3 HIS 120 -2.571 -17.709 14.979 408 HD1 HIS 120 HD1 HIS 120 -3.748 -21.047 15.303 409 HD2 HIS 120 HD2 HIS 120 -5.566 -17.270 14.790 410 HE1 HIS 120 HE1 HIS 120 -6.176 -21.286 16.147 411 HE2 HIS 120 HE2 HIS 120 -7.274 -18.978 15.830 Start of MODEL 13 1 H1 SER 66 H1 SER 66 23.777 2.364 -11.941 2 H2 SER 66 H2 SER 66 22.808 1.941 -13.189 3 H3 SER 66 H3 SER 66 22.171 2.662 -11.858 4 HA SER 66 HA SER 66 23.418 -0.010 -11.960 5 HB2 SER 66 HB2 SER 66 22.151 1.386 -9.568 6 HB3 SER 66 HB3 SER 66 22.842 -0.250 -9.595 7 HG SER 66 HG SER 66 24.348 1.292 -8.810 8 H GLY 67 H GLY 67 22.000 -1.820 -11.678 9 HA2 GLY 67 HA2 GLY 67 19.225 -1.389 -12.667 10 HA3 GLY 67 HA3 GLY 67 20.124 -2.898 -12.594 11 H SER 68 H SER 68 20.815 -2.271 -9.648 12 HA SER 68 HA SER 68 18.932 -4.054 -8.566 13 HB2 SER 68 HB2 SER 68 20.027 -3.518 -6.396 14 HB3 SER 68 HB3 SER 68 21.164 -3.873 -7.706 15 HG SER 68 HG SER 68 21.770 -1.998 -6.491 16 H GLY 69 H GLY 69 18.778 -0.532 -8.581 17 HA2 GLY 69 HA2 GLY 69 16.648 -0.279 -6.624 18 HA3 GLY 69 HA3 GLY 69 17.180 0.943 -7.775 19 H ARG 70 H ARG 70 16.574 -1.432 -9.849 20 HA ARG 70 HA ARG 70 13.641 -0.806 -10.193 21 HB2 ARG 70 HB2 ARG 70 15.896 -0.825 -12.247 22 HB3 ARG 70 HB3 ARG 70 14.184 -0.772 -12.669 23 HG2 ARG 70 HG2 ARG 70 13.865 1.338 -11.508 24 HG3 ARG 70 HG3 ARG 70 15.529 1.338 -10.914 25 HD2 ARG 70 HD2 ARG 70 14.775 1.345 -13.858 26 HD3 ARG 70 HD3 ARG 70 15.099 2.811 -12.916 27 HE ARG 70 HE ARG 70 17.350 1.342 -12.439 28 HH11 ARG 70 HH11 ARG 70 15.858 2.351 -15.443 29 HH12 ARG 70 HH12 ARG 70 17.378 2.379 -16.295 30 HH21 ARG 70 HH21 ARG 70 19.245 1.404 -13.560 31 HH22 ARG 70 HH22 ARG 70 19.253 1.853 -15.246 32 H GLY 71 H GLY 71 16.164 -3.259 -10.708 33 HA2 GLY 71 HA2 GLY 71 14.475 -5.224 -11.939 34 HA3 GLY 71 HA3 GLY 71 16.006 -5.523 -11.123 35 H ARG 72 H ARG 72 13.143 -6.726 -11.141 36 HA ARG 72 HA ARG 72 12.838 -7.207 -8.205 37 HB2 ARG 72 HB2 ARG 72 10.767 -6.270 -10.222 38 HB3 ARG 72 HB3 ARG 72 10.273 -7.182 -8.798 39 HG2 ARG 72 HG2 ARG 72 10.861 -5.520 -7.292 40 HG3 ARG 72 HG3 ARG 72 12.027 -4.756 -8.376 41 HD2 ARG 72 HD2 ARG 72 9.041 -4.748 -8.928 42 HD3 ARG 72 HD3 ARG 72 9.870 -3.487 -7.991 43 HE ARG 72 HE ARG 72 11.411 -3.585 -10.246 44 HH11 ARG 72 HH21 ARG 72 7.953 -3.091 -9.901 45 HH12 ARG 72 HH22 ARG 72 7.863 -2.150 -11.369 46 HH21 ARG 72 HH11 ARG 72 11.256 -2.425 -12.020 47 HH22 ARG 72 HH12 ARG 72 9.723 -1.774 -12.563 48 H GLY 73 H GLY 73 11.854 -9.159 -7.630 49 HA2 GLY 73 HA2 GLY 73 12.620 -11.400 -9.306 50 HA3 GLY 73 HA3 GLY 73 11.893 -11.480 -7.708 51 H ALA 74 H ALA 74 11.240 -13.315 -9.525 52 HA ALA 74 HA ALA 74 8.333 -12.940 -9.853 53 HB1 ALA 74 HB1 ALA 74 9.283 -12.323 -12.055 54 HB2 ALA 74 HB2 ALA 74 10.163 -13.868 -12.118 55 HB3 ALA 74 HB3 ALA 74 8.386 -13.847 -12.154 56 H ILE 75 H ILE 75 7.201 -15.035 -10.150 57 HA ILE 75 HA ILE 75 8.298 -17.034 -8.342 58 HB ILE 75 HB ILE 75 5.760 -17.067 -10.001 59 HG12 ILE 75 HG12 ILE 75 6.232 -16.473 -7.038 60 HG13 ILE 75 HG13 ILE 75 5.877 -15.259 -8.266 61 HG21 ILE 75 HG21 ILE 75 5.020 -18.938 -8.559 62 HG22 ILE 75 HG22 ILE 75 6.443 -19.405 -9.438 63 HG23 ILE 75 HG23 ILE 75 6.590 -18.932 -7.730 64 HD11 ILE 75 HD11 ILE 75 3.662 -16.378 -8.691 65 HD12 ILE 75 HD12 ILE 75 3.983 -17.408 -7.272 66 HD13 ILE 75 HD13 ILE 75 3.858 -15.661 -7.077 67 H ASP 76 H ASP 76 9.461 -18.745 -8.788 68 HA ASP 76 HA ASP 76 9.733 -19.775 -11.569 69 HB2 ASP 76 HB2 ASP 76 11.786 -19.457 -10.313 70 HB3 ASP 76 HB3 ASP 76 11.195 -20.470 -8.999 71 H ARG 77 H ARG 77 9.293 -21.343 -8.381 72 HA ARG 77 HA ARG 77 6.888 -22.858 -9.358 73 HB2 ARG 77 HB2 ARG 77 9.466 -23.893 -8.152 74 HB3 ARG 77 HB3 ARG 77 7.981 -24.818 -7.985 75 HG2 ARG 77 HG2 ARG 77 7.719 -25.143 -10.317 76 HG3 ARG 77 HG3 ARG 77 8.961 -23.960 -10.732 77 HD2 ARG 77 HD2 ARG 77 9.568 -26.486 -9.156 78 HD3 ARG 77 HD3 ARG 77 9.675 -26.370 -10.928 79 HE ARG 77 HE ARG 77 11.147 -24.194 -9.996 80 HH11 ARG 77 HH11 ARG 77 11.565 -27.675 -9.693 81 HH12 ARG 77 HH12 ARG 77 13.296 -27.504 -9.526 82 HH21 ARG 77 HH21 ARG 77 13.145 -24.039 -9.825 83 HH22 ARG 77 HH22 ARG 77 14.227 -25.421 -9.614 84 H GLU 78 H GLU 78 7.874 -20.741 -6.993 85 HA GLU 78 HA GLU 78 7.318 -21.944 -4.563 86 HB2 GLU 78 HB2 GLU 78 6.843 -19.050 -5.364 87 HB3 GLU 78 HB3 GLU 78 6.822 -19.644 -3.703 88 HG2 GLU 78 HG2 GLU 78 9.159 -20.449 -3.959 89 HG3 GLU 78 HG3 GLU 78 9.200 -19.802 -5.599 90 H GLN 79 H GLN 79 4.746 -20.195 -6.465 91 HA GLN 79 HA GLN 79 2.730 -20.825 -4.513 92 HB2 GLN 79 HB2 GLN 79 1.123 -19.991 -6.021 93 HB3 GLN 79 HB3 GLN 79 2.557 -18.976 -6.136 94 HG2 GLN 79 HG2 GLN 79 3.161 -20.237 -8.267 95 HG3 GLN 79 HG3 GLN 79 1.624 -21.088 -8.135 96 HE21 GLN 79 HE22 GLN 79 1.915 -19.812 -10.468 97 HE22 GLN 79 HE21 GLN 79 0.988 -18.322 -10.483 98 H SER 80 H SER 80 3.788 -22.531 -7.433 99 HA SER 80 HA SER 80 1.815 -24.609 -7.419 100 HB2 SER 80 HB2 SER 80 4.657 -24.456 -8.504 101 HB3 SER 80 HB3 SER 80 3.538 -25.816 -8.816 102 HG SER 80 HG SER 80 3.445 -24.210 -10.475 103 H ALA 81 H ALA 81 5.107 -24.481 -5.943 104 HA ALA 81 HA ALA 81 5.002 -26.975 -4.676 105 HB1 ALA 81 HB1 ALA 81 6.474 -24.430 -3.866 106 HB2 ALA 81 HB2 ALA 81 6.853 -26.070 -3.306 107 HB3 ALA 81 HB3 ALA 81 7.054 -25.653 -5.018 108 H ALA 82 H ALA 82 3.853 -23.769 -3.484 109 HA ALA 82 HA ALA 82 3.005 -24.675 -0.916 110 HB1 ALA 82 HB1 ALA 82 1.697 -22.610 -0.872 111 HB2 ALA 82 HB2 ALA 82 3.317 -22.305 -1.533 112 HB3 ALA 82 HB3 ALA 82 1.909 -22.397 -2.620 113 H ILE 83 H ILE 83 1.202 -24.580 -4.042 114 HA ILE 83 HA ILE 83 -1.250 -25.660 -2.973 115 HB ILE 83 HB ILE 83 -0.127 -25.631 -5.797 116 HG12 ILE 83 HG12 ILE 83 -2.372 -23.981 -4.564 117 HG13 ILE 83 HG13 ILE 83 -0.721 -23.411 -4.604 118 HG21 ILE 83 HG21 ILE 83 -2.925 -26.406 -4.829 119 HG22 ILE 83 HG22 ILE 83 -2.488 -26.127 -6.522 120 HG23 ILE 83 HG23 ILE 83 -1.764 -27.471 -5.648 121 HD11 ILE 83 HD11 ILE 83 -0.773 -23.643 -7.129 122 HD12 ILE 83 HD12 ILE 83 -2.527 -23.935 -6.981 123 HD13 ILE 83 HD13 ILE 83 -1.840 -22.401 -6.437 124 H ARG 84 H ARG 84 1.622 -27.266 -4.428 125 HA ARG 84 HA ARG 84 0.663 -29.962 -4.205 126 HB2 ARG 84 HB2 ARG 84 2.627 -29.200 -5.558 127 HB3 ARG 84 HB3 ARG 84 3.519 -28.896 -4.068 128 HG2 ARG 84 HG2 ARG 84 3.250 -31.392 -3.519 129 HG3 ARG 84 HG3 ARG 84 2.511 -31.582 -5.113 130 HD2 ARG 84 HD2 ARG 84 4.828 -32.217 -5.261 131 HD3 ARG 84 HD3 ARG 84 4.614 -30.701 -6.153 132 HE ARG 84 HE ARG 84 5.403 -30.230 -3.389 133 HH11 ARG 84 HH11 ARG 84 6.898 -31.367 -6.363 134 HH12 ARG 84 HH12 ARG 84 8.412 -30.594 -5.980 135 HH21 ARG 84 HH21 ARG 84 7.391 -29.347 -2.947 136 HH22 ARG 84 HH22 ARG 84 8.693 -29.539 -4.075 137 H GLU 85 H GLU 85 2.645 -28.063 -1.855 138 HA GLU 85 HA GLU 85 2.669 -30.043 0.114 139 HB2 GLU 85 HB2 GLU 85 4.106 -27.976 0.006 140 HB3 GLU 85 HB3 GLU 85 2.725 -27.056 0.638 141 HG2 GLU 85 HG2 GLU 85 2.684 -28.685 2.599 142 HG3 GLU 85 HG3 GLU 85 4.171 -29.395 1.973 143 H TRP 86 H TRP 86 0.331 -27.286 -0.249 144 HA TRP 86 HA TRP 86 -1.354 -27.894 1.860 145 HB2 TRP 86 HB2 TRP 86 -1.570 -25.863 0.566 146 HB3 TRP 86 HB3 TRP 86 -1.967 -26.768 -0.891 147 HD1 TRP 86 HD1 TRP 86 -3.505 -25.438 2.298 148 HE1 TRP 86 HE1 TRP 86 -6.043 -25.824 2.302 149 HE3 TRP 86 HE3 TRP 86 -3.920 -28.232 -1.986 150 HZ2 TRP 86 HZ2 TRP 86 -7.939 -27.463 0.858 151 HZ3 TRP 86 HZ3 TRP 86 -6.083 -29.280 -2.590 152 HH2 TRP 86 HH2 TRP 86 -8.083 -28.953 -1.126 153 H ALA 87 H ALA 87 -1.468 -29.248 -1.481 154 HA ALA 87 HA ALA 87 -3.741 -30.901 -1.022 155 HB1 ALA 87 HB1 ALA 87 -2.943 -30.269 -3.246 156 HB2 ALA 87 HB2 ALA 87 -1.427 -31.146 -3.001 157 HB3 ALA 87 HB3 ALA 87 -2.962 -32.039 -3.114 158 H ARG 88 H ARG 88 -0.238 -31.626 -0.637 159 HA ARG 88 HA ARG 88 -0.543 -34.338 0.265 160 HB2 ARG 88 HB2 ARG 88 1.585 -33.280 -0.469 161 HB3 ARG 88 HB3 ARG 88 1.600 -32.289 0.992 162 HG2 ARG 88 HG2 ARG 88 1.736 -34.321 2.400 163 HG3 ARG 88 HG3 ARG 88 1.678 -35.344 0.958 164 HD2 ARG 88 HD2 ARG 88 3.836 -33.268 1.529 165 HD3 ARG 88 HD3 ARG 88 3.965 -34.985 1.945 166 HE ARG 88 HE ARG 88 3.342 -34.952 -0.776 167 HH11 ARG 88 HH11 ARG 88 6.030 -33.853 1.174 168 HH12 ARG 88 HH12 ARG 88 7.184 -34.070 -0.114 169 HH21 ARG 88 HH21 ARG 88 4.862 -35.215 -2.382 170 HH22 ARG 88 HH22 ARG 88 6.530 -34.833 -2.076 171 H ARG 89 H ARG 89 -0.505 -31.289 2.157 172 HA ARG 89 HA ARG 89 -0.908 -32.472 4.751 173 HB2 ARG 89 HB2 ARG 89 -1.602 -29.726 3.626 174 HB3 ARG 89 HB3 ARG 89 -1.835 -30.163 5.319 175 HG2 ARG 89 HG2 ARG 89 0.549 -30.588 5.620 176 HG3 ARG 89 HG3 ARG 89 0.869 -30.275 3.910 177 HD2 ARG 89 HD2 ARG 89 0.013 -27.958 4.167 178 HD3 ARG 89 HD3 ARG 89 -0.290 -28.242 5.878 179 HE ARG 89 HE ARG 89 2.281 -27.701 4.566 180 HH11 ARG 89 HH11 ARG 89 0.949 -28.990 7.572 181 HH12 ARG 89 HH12 ARG 89 2.429 -28.665 8.423 182 HH21 ARG 89 HH21 ARG 89 3.992 -27.332 5.624 183 HH22 ARG 89 HH22 ARG 89 4.171 -27.714 7.340 184 H ASN 90 H ASN 90 -3.250 -31.669 2.242 185 HA ASN 90 HA ASN 90 -5.529 -32.432 3.979 186 HB2 ASN 90 HB2 ASN 90 -5.315 -31.171 1.217 187 HB3 ASN 90 HB3 ASN 90 -6.841 -31.714 1.908 188 HD21 ASN 90 HD22 ASN 90 -4.231 -29.366 2.283 189 HD22 ASN 90 HD21 ASN 90 -5.135 -28.325 3.384 190 H GLY 91 H GLY 91 -3.405 -34.242 2.139 191 HA2 GLY 91 HA2 GLY 91 -3.458 -36.422 1.428 192 HA3 GLY 91 HA3 GLY 91 -5.062 -36.601 2.149 193 H HIS 92 H HIS 92 -4.513 -34.132 -0.293 194 HA HIS 92 HA HIS 92 -6.500 -35.449 -2.066 195 HB2 HIS 92 HB2 HIS 92 -6.617 -33.000 -1.258 196 HB3 HIS 92 HB3 HIS 92 -5.321 -32.662 -2.396 197 HD1 HIS 92 HD1 HIS 92 -9.045 -33.462 -2.234 198 HD2 HIS 92 HD2 HIS 92 -5.993 -32.792 -5.076 199 HE1 HIS 92 HE1 HIS 92 -10.224 -33.049 -4.488 200 HE2 HIS 92 HE2 HIS 92 -8.384 -32.634 -6.224 201 H ASN 93 H ASN 93 -6.124 -35.897 -4.273 202 HA ASN 93 HA ASN 93 -3.519 -36.910 -4.894 203 HB2 ASN 93 HB2 ASN 93 -5.700 -37.835 -5.695 204 HB3 ASN 93 HB3 ASN 93 -5.904 -36.419 -6.731 205 HD21 ASN 93 HD22 ASN 93 -6.090 -38.286 -8.338 206 HD22 ASN 93 HD21 ASN 93 -4.583 -38.827 -9.068 207 H VAL 94 H VAL 94 -1.788 -36.016 -5.907 208 HA VAL 94 HA VAL 94 -1.995 -33.781 -7.747 209 HB VAL 94 HB VAL 94 -2.028 -32.674 -5.487 210 HG11 VAL 94 HG11 VAL 94 -0.520 -34.178 -4.240 211 HG12 VAL 94 HG12 VAL 94 0.854 -33.635 -5.235 212 HG13 VAL 94 HG13 VAL 94 0.025 -32.497 -4.168 213 HG21 VAL 94 HG21 VAL 94 -1.214 -31.524 -7.541 214 HG22 VAL 94 HG22 VAL 94 -0.533 -30.908 -6.030 215 HG23 VAL 94 HG23 VAL 94 0.452 -31.950 -7.072 216 H SER 95 H SER 95 -0.058 -33.475 -9.002 217 HA SER 95 HA SER 95 1.666 -35.791 -9.216 218 HB2 SER 95 HB2 SER 95 1.042 -34.361 -11.161 219 HB3 SER 95 HB3 SER 95 2.016 -33.044 -10.472 220 HG SER 95 HG SER 95 2.845 -35.517 -11.571 221 H THR 96 H THR 96 3.933 -35.923 -8.845 222 HA THR 96 HA THR 96 4.939 -34.492 -6.498 223 HB THR 96 HB THR 96 7.014 -35.823 -6.940 224 HG1 THR 96 HG1 THR 96 6.808 -37.448 -8.569 225 HG21 THR 96 HG21 THR 96 6.060 -38.002 -6.399 226 HG22 THR 96 HG22 THR 96 5.167 -36.745 -5.531 227 HG23 THR 96 HG23 THR 96 4.457 -37.489 -6.977 228 H ARG 97 H ARG 97 5.679 -34.501 -9.975 229 HA ARG 97 HA ARG 97 7.124 -31.885 -9.700 230 HB2 ARG 97 HB2 ARG 97 8.950 -32.701 -11.062 231 HB3 ARG 97 HB3 ARG 97 8.749 -33.716 -9.638 232 HG2 ARG 97 HG2 ARG 97 7.590 -35.446 -11.030 233 HG3 ARG 97 HG3 ARG 97 7.749 -34.399 -12.444 234 HD2 ARG 97 HD2 ARG 97 9.468 -36.042 -12.567 235 HD3 ARG 97 HD3 ARG 97 10.226 -34.484 -12.208 236 HE ARG 97 HE ARG 97 9.646 -35.982 -9.790 237 HH11 ARG 97 HH12 ARG 97 11.987 -35.912 -12.399 238 HH12 ARG 97 HH11 ARG 97 13.230 -36.649 -11.425 239 HH21 ARG 97 HH21 ARG 97 11.288 -36.911 -8.597 240 HH22 ARG 97 HH22 ARG 97 12.836 -37.203 -9.334 241 H GLY 98 H GLY 98 4.738 -33.533 -11.470 242 HA2 GLY 98 HA2 GLY 98 5.113 -32.133 -14.025 243 HA3 GLY 98 HA3 GLY 98 3.784 -33.193 -13.561 244 H ARG 99 H ARG 99 2.915 -31.203 -14.897 245 HA ARG 99 HA ARG 99 2.304 -28.743 -13.533 246 HB2 ARG 99 HB2 ARG 99 2.198 -29.091 -15.991 247 HB3 ARG 99 HB3 ARG 99 0.799 -30.151 -15.788 248 HG2 ARG 99 HG2 ARG 99 -0.508 -28.258 -14.864 249 HG3 ARG 99 HG3 ARG 99 0.915 -27.200 -14.990 250 HD2 ARG 99 HD2 ARG 99 0.937 -27.528 -17.439 251 HD3 ARG 99 HD3 ARG 99 -0.479 -28.595 -17.314 252 HE ARG 99 HE ARG 99 -1.152 -26.137 -16.069 253 HH11 ARG 99 HH11 ARG 99 -0.464 -27.234 -19.331 254 HH12 ARG 99 HH12 ARG 99 -1.443 -25.990 -20.055 255 HH21 ARG 99 HH21 ARG 99 -2.382 -24.567 -17.061 256 HH22 ARG 99 HH22 ARG 99 -2.509 -24.532 -18.795 257 H ILE 100 H ILE 100 0.683 -28.155 -12.185 258 HA ILE 100 HA ILE 100 -0.714 -30.270 -10.761 259 HB ILE 100 HB ILE 100 -0.670 -27.279 -10.339 260 HG12 ILE 100 HG12 ILE 100 0.678 -29.682 -8.994 261 HG13 ILE 100 HG13 ILE 100 1.468 -28.415 -9.928 262 HG21 ILE 100 HG21 ILE 100 -1.795 -27.707 -8.196 263 HG22 ILE 100 HG22 ILE 100 -2.825 -28.228 -9.504 264 HG23 ILE 100 HG23 ILE 100 -1.919 -29.439 -8.566 265 HD11 ILE 100 HD11 ILE 100 0.736 -26.757 -8.156 266 HD12 ILE 100 HD12 ILE 100 0.217 -28.160 -7.178 267 HD13 ILE 100 HD13 ILE 100 1.911 -27.992 -7.644 268 HA PRO 101 HA PRO 101 -4.465 -29.945 -13.253 269 HB2 PRO 101 HB2 PRO 101 -5.891 -31.250 -10.979 270 HB3 PRO 101 HB3 PRO 101 -5.759 -31.771 -12.680 271 HG2 PRO 101 HG2 PRO 101 -4.389 -33.002 -10.635 272 HG3 PRO 101 HG3 PRO 101 -3.709 -32.844 -12.291 273 HD2 PRO 101 HD2 PRO 101 -3.104 -31.205 -9.833 274 HD3 PRO 101 HD3 PRO 101 -2.013 -31.825 -11.108 275 H ALA 102 H ALA 102 -6.192 -28.534 -13.409 276 HA ALA 102 HA ALA 102 -6.435 -26.362 -11.675 277 HB1 ALA 102 HB1 ALA 102 -8.385 -25.788 -12.966 278 HB2 ALA 102 HB2 ALA 102 -7.106 -26.405 -14.037 279 HB3 ALA 102 HB3 ALA 102 -8.494 -27.446 -13.615 280 H ASP 103 H ASP 103 -8.119 -29.472 -11.520 281 HA ASP 103 HA ASP 103 -10.103 -28.980 -9.678 282 HB2 ASP 103 HB2 ASP 103 -9.798 -31.144 -10.729 283 HB3 ASP 103 HB3 ASP 103 -8.201 -31.329 -10.010 284 H VAL 104 H VAL 104 -6.613 -29.496 -9.071 285 HA VAL 104 HA VAL 104 -6.903 -29.387 -6.211 286 HB VAL 104 HB VAL 104 -4.278 -29.133 -7.620 287 HG11 VAL 104 HG11 VAL 104 -5.102 -30.425 -4.987 288 HG12 VAL 104 HG12 VAL 104 -3.450 -30.399 -5.657 289 HG13 VAL 104 HG13 VAL 104 -4.236 -28.886 -5.184 290 HG21 VAL 104 HG21 VAL 104 -4.080 -31.638 -7.559 291 HG22 VAL 104 HG22 VAL 104 -5.813 -31.725 -7.177 292 HG23 VAL 104 HG23 VAL 104 -5.267 -31.066 -8.728 293 H ILE 105 H ILE 105 -5.856 -27.135 -8.751 294 HA ILE 105 HA ILE 105 -5.057 -24.973 -7.013 295 HB ILE 105 HB ILE 105 -6.125 -25.069 -9.869 296 HG12 ILE 105 HG12 ILE 105 -3.293 -24.316 -9.101 297 HG13 ILE 105 HG13 ILE 105 -3.718 -26.013 -8.957 298 HG21 ILE 105 HG21 ILE 105 -6.575 -22.818 -9.070 299 HG22 ILE 105 HG22 ILE 105 -4.956 -22.703 -8.330 300 HG23 ILE 105 HG23 ILE 105 -5.145 -22.758 -10.096 301 HD11 ILE 105 HD11 ILE 105 -4.076 -24.413 -11.519 302 HD12 ILE 105 HD12 ILE 105 -2.696 -25.472 -11.134 303 HD13 ILE 105 HD13 ILE 105 -4.321 -26.161 -11.273 304 H ASP 106 H ASP 106 -8.271 -25.728 -8.514 305 HA ASP 106 HA ASP 106 -9.697 -23.726 -7.187 306 HB2 ASP 106 HB2 ASP 106 -10.543 -24.991 -9.104 307 HB3 ASP 106 HB3 ASP 106 -10.617 -26.462 -8.130 308 H ALA 107 H ALA 107 -9.124 -27.158 -6.146 309 HA ALA 107 HA ALA 107 -10.440 -27.112 -3.743 310 HB1 ALA 107 HB1 ALA 107 -8.966 -28.986 -3.144 311 HB2 ALA 107 HB2 ALA 107 -9.428 -29.096 -4.840 312 HB3 ALA 107 HB3 ALA 107 -7.805 -28.520 -4.408 313 H TYR 108 H TYR 108 -7.048 -26.091 -4.334 314 HA TYR 108 HA TYR 108 -6.363 -25.283 -1.705 315 HB2 TYR 108 HB2 TYR 108 -4.698 -25.615 -3.381 316 HB3 TYR 108 HB3 TYR 108 -5.441 -24.468 -4.477 317 HD1 TYR 108 HD1 TYR 108 -3.443 -24.818 -1.391 318 HD2 TYR 108 HD2 TYR 108 -5.033 -22.087 -4.321 319 HE1 TYR 108 HE1 TYR 108 -1.865 -23.055 -0.598 320 HE2 TYR 108 HE2 TYR 108 -3.468 -20.322 -3.522 321 HH TYR 108 HH TYR 108 -1.783 -19.777 -2.040 322 H HIS 109 H HIS 109 -7.847 -23.338 -4.384 323 HA HIS 109 HA HIS 109 -8.071 -20.944 -2.766 324 HB2 HIS 109 HB2 HIS 109 -9.434 -21.835 -5.333 325 HB3 HIS 109 HB3 HIS 109 -9.823 -20.312 -4.531 326 HD1 HIS 109 HD1 HIS 109 -7.427 -18.732 -4.012 327 HD2 HIS 109 HD2 HIS 109 -7.568 -21.569 -7.128 328 HE1 HIS 109 HE1 HIS 109 -5.536 -18.107 -5.648 329 HE2 HIS 109 HE2 HIS 109 -5.638 -19.830 -7.558 330 H ALA 110 H ALA 110 -10.404 -23.634 -3.286 331 HA ALA 110 HA ALA 110 -12.635 -22.497 -2.052 332 HB1 ALA 110 HB1 ALA 110 -13.365 -24.814 -1.694 333 HB2 ALA 110 HB2 ALA 110 -12.602 -24.645 -3.285 334 HB3 ALA 110 HB3 ALA 110 -11.707 -25.403 -1.943 335 H ALA 111 H ALA 111 -9.868 -24.099 -0.428 336 HA ALA 111 HA ALA 111 -10.796 -24.316 2.138 337 HB1 ALA 111 HB1 ALA 111 -8.004 -23.532 1.216 338 HB2 ALA 111 HB2 ALA 111 -8.407 -24.336 2.743 339 HB3 ALA 111 HB3 ALA 111 -8.651 -25.194 1.208 340 H THR 112 H THR 112 -9.611 -21.395 0.552 341 HA THR 112 HA THR 112 -10.039 -19.764 3.035 342 HB THR 112 HB THR 112 -8.734 -18.010 1.898 343 HG1 THR 112 HG1 THR 112 -7.607 -18.560 0.022 344 HG21 THR 112 HG21 THR 112 -7.254 -20.675 2.009 345 HG22 THR 112 HG22 THR 112 -6.545 -19.050 2.128 346 HG23 THR 112 HG23 THR 112 -7.611 -19.637 3.411 347 H LEU 113 H LEU 113 -11.341 -20.203 -0.209 348 HA LEU 113 HA LEU 113 -12.730 -17.671 -0.236 349 HB2 LEU 113 HB2 LEU 113 -11.746 -18.710 -2.215 350 HB3 LEU 113 HB3 LEU 113 -12.761 -20.141 -1.999 351 HG LEU 113 HG LEU 113 -14.765 -18.820 -2.446 352 HD11 LEU 113 HD11 LEU 113 -14.551 -16.538 -3.451 353 HD12 LEU 113 HD12 LEU 113 -14.045 -16.559 -1.764 354 HD13 LEU 113 HD13 LEU 113 -12.820 -16.542 -3.050 355 HD21 LEU 113 HD21 LEU 113 -12.608 -18.563 -4.582 356 HD22 LEU 113 HD22 LEU 113 -13.606 -20.003 -4.266 357 HD23 LEU 113 HD23 LEU 113 -14.363 -18.518 -4.863 358 H GLU 114 H GLU 114 -13.686 -21.009 0.564 359 HA GLU 114 HA GLU 114 -16.525 -20.387 0.443 360 HB2 GLU 114 HB2 GLU 114 -14.926 -22.803 0.789 361 HB3 GLU 114 HB3 GLU 114 -16.259 -22.785 1.922 362 HG2 GLU 114 HG2 GLU 114 -16.646 -22.213 -1.043 363 HG3 GLU 114 HG3 GLU 114 -16.642 -23.843 -0.379 364 H HIS 115 H HIS 115 -18.049 -20.807 2.139 365 HA HIS 115 HA HIS 115 -17.679 -18.940 4.303 366 HB2 HIS 115 HB2 HIS 115 -19.931 -20.924 3.742 367 HB3 HIS 115 HB3 HIS 115 -20.018 -19.587 4.886 368 HD1 HIS 115 HD1 HIS 115 -19.835 -20.190 1.067 369 HD2 HIS 115 HD2 HIS 115 -20.575 -17.170 3.944 370 HE1 HIS 115 HE1 HIS 115 -20.811 -18.166 -0.217 371 HE2 HIS 115 HE2 HIS 115 -21.246 -16.336 1.543 372 H HIS 116 H HIS 116 -17.741 -19.249 6.522 373 HA HIS 116 HA HIS 116 -17.059 -20.116 8.516 374 HB2 HIS 116 HB2 HIS 116 -18.719 -22.510 7.666 375 HB3 HIS 116 HB3 HIS 116 -18.397 -21.967 9.310 376 HD1 HIS 116 HD1 HIS 116 -21.172 -21.911 7.077 377 HD2 HIS 116 HD2 HIS 116 -19.224 -19.051 9.502 378 HE1 HIS 116 HE1 HIS 116 -22.864 -20.009 7.461 379 HE2 HIS 116 HE2 HIS 116 -21.674 -18.276 8.950 380 H HIS 117 H HIS 117 -15.033 -20.544 6.569 381 HA HIS 117 HA HIS 117 -14.011 -23.265 6.839 382 HB2 HIS 117 HB2 HIS 117 -12.206 -22.546 5.423 383 HB3 HIS 117 HB3 HIS 117 -13.733 -21.977 4.778 384 HD1 HIS 117 HD1 HIS 117 -13.846 -19.415 4.250 385 HD2 HIS 117 HD2 HIS 117 -10.593 -20.608 6.670 386 HE1 HIS 117 HE1 HIS 117 -12.348 -17.331 4.548 387 HE2 HIS 117 HE2 HIS 117 -10.370 -18.069 6.031 388 H HIS 118 H HIS 118 -13.565 -20.458 8.791 389 HA HIS 118 HA HIS 118 -11.022 -21.398 9.979 390 HB2 HIS 118 HB2 HIS 118 -11.227 -19.261 11.335 391 HB3 HIS 118 HB3 HIS 118 -11.001 -19.097 9.607 392 HD1 HIS 118 HD1 HIS 118 -13.589 -18.330 12.325 393 HD2 HIS 118 HD2 HIS 118 -12.935 -17.950 8.160 394 HE1 HIS 118 HE1 HIS 118 -15.405 -16.743 11.443 395 HE2 HIS 118 HE2 HIS 118 -15.001 -16.502 8.906 396 H HIS 119 H HIS 119 -10.729 -21.956 12.130 397 HA HIS 119 HA HIS 119 -12.747 -23.781 13.046 398 HB2 HIS 119 HB2 HIS 119 -10.294 -24.177 13.093 399 HB3 HIS 119 HB3 HIS 119 -10.117 -22.942 14.342 400 HD1 HIS 119 HD1 HIS 119 -10.111 -23.947 16.758 401 HD2 HIS 119 HD2 HIS 119 -12.133 -26.291 13.875 402 HE1 HIS 119 HE1 HIS 119 -10.882 -26.089 17.964 403 HE2 HIS 119 HE2 HIS 119 -12.111 -27.512 16.203 404 H HIS 120 H HIS 120 -11.920 -20.568 14.179 405 HA HIS 120 HA HIS 120 -14.072 -20.706 16.250 406 HB2 HIS 120 HB2 HIS 120 -11.696 -20.644 17.161 407 HB3 HIS 120 HB3 HIS 120 -11.537 -19.042 16.450 408 HD1 HIS 120 HD1 HIS 120 -14.630 -18.211 17.407 409 HD2 HIS 120 HD2 HIS 120 -11.411 -19.747 19.660 410 HE1 HIS 120 HE1 HIS 120 -15.051 -17.497 19.878 411 HE2 HIS 120 HE2 HIS 120 -13.072 -18.442 21.230 Start of MODEL 14 1 H1 SER 66 H1 SER 66 14.687 1.893 -0.950 2 H2 SER 66 H2 SER 66 14.346 3.376 -0.349 3 H3 SER 66 H3 SER 66 13.820 2.963 -1.845 4 HA SER 66 HA SER 66 15.717 4.445 -1.996 5 HB2 SER 66 HB2 SER 66 17.943 3.586 -1.234 6 HB3 SER 66 HB3 SER 66 16.819 3.908 0.091 7 HG SER 66 HG SER 66 17.891 1.875 0.317 8 H GLY 67 H GLY 67 17.481 4.168 -3.609 9 HA2 GLY 67 HA2 GLY 67 18.363 3.300 -5.565 10 HA3 GLY 67 HA3 GLY 67 17.713 1.719 -5.160 11 H SER 68 H SER 68 17.455 1.784 -7.564 12 HA SER 68 HA SER 68 14.701 2.546 -8.320 13 HB2 SER 68 HB2 SER 68 15.435 3.629 -10.396 14 HB3 SER 68 HB3 SER 68 16.011 4.499 -8.970 15 HG SER 68 HG SER 68 17.664 4.266 -10.553 16 H GLY 69 H GLY 69 14.031 1.613 -10.407 17 HA2 GLY 69 HA2 GLY 69 15.500 -0.420 -11.779 18 HA3 GLY 69 HA3 GLY 69 14.439 -1.173 -10.583 19 H ARG 70 H ARG 70 13.983 -1.887 -13.058 20 HA ARG 70 HA ARG 70 11.453 -0.537 -13.923 21 HB2 ARG 70 HB2 ARG 70 13.702 -1.549 -15.730 22 HB3 ARG 70 HB3 ARG 70 12.131 -1.023 -16.302 23 HG2 ARG 70 HG2 ARG 70 14.200 0.732 -14.911 24 HG3 ARG 70 HG3 ARG 70 13.871 0.693 -16.635 25 HD2 ARG 70 HD2 ARG 70 11.893 1.574 -14.491 26 HD3 ARG 70 HD3 ARG 70 12.860 2.642 -15.510 27 HE ARG 70 HE ARG 70 11.505 1.051 -17.334 28 HH11 ARG 70 HH11 ARG 70 10.493 3.289 -14.832 29 HH12 ARG 70 HH12 ARG 70 9.009 3.684 -15.657 30 HH21 ARG 70 HH21 ARG 70 9.589 1.582 -18.324 31 HH22 ARG 70 HH22 ARG 70 8.521 2.742 -17.592 32 H GLY 71 H GLY 71 10.003 -1.788 -15.126 33 HA2 GLY 71 HA2 GLY 71 8.706 -3.682 -15.480 34 HA3 GLY 71 HA3 GLY 71 10.139 -4.676 -15.234 35 H ARG 72 H ARG 72 9.173 -6.184 -14.005 36 HA ARG 72 HA ARG 72 8.664 -5.640 -11.160 37 HB2 ARG 72 HB2 ARG 72 6.467 -6.706 -11.104 38 HB3 ARG 72 HB3 ARG 72 6.420 -5.271 -12.116 39 HG2 ARG 72 HG2 ARG 72 6.330 -6.548 -14.142 40 HG3 ARG 72 HG3 ARG 72 6.797 -8.044 -13.328 41 HD2 ARG 72 HD2 ARG 72 4.684 -8.039 -12.041 42 HD3 ARG 72 HD3 ARG 72 4.206 -6.536 -12.832 43 HE ARG 72 HE ARG 72 3.637 -7.689 -14.747 44 HH11 ARG 72 HH11 ARG 72 5.498 -9.984 -12.784 45 HH12 ARG 72 HH12 ARG 72 4.978 -11.321 -13.772 46 HH21 ARG 72 HH21 ARG 72 3.095 -9.451 -15.947 47 HH22 ARG 72 HH22 ARG 72 3.700 -11.024 -15.529 48 H GLY 73 H GLY 73 8.229 -7.656 -9.924 49 HA2 GLY 73 HA2 GLY 73 9.972 -9.888 -10.685 50 HA3 GLY 73 HA3 GLY 73 9.004 -9.748 -9.222 51 H ALA 74 H ALA 74 9.075 -12.149 -10.307 52 HA ALA 74 HA ALA 74 6.304 -12.661 -11.162 53 HB1 ALA 74 HB1 ALA 74 8.715 -13.655 -12.754 54 HB2 ALA 74 HB2 ALA 74 7.018 -14.094 -13.050 55 HB3 ALA 74 HB3 ALA 74 7.555 -12.423 -13.297 56 H ILE 75 H ILE 75 5.714 -14.947 -10.976 57 HA ILE 75 HA ILE 75 6.878 -16.215 -8.612 58 HB ILE 75 HB ILE 75 4.684 -17.138 -10.498 59 HG12 ILE 75 HG12 ILE 75 4.358 -16.071 -7.660 60 HG13 ILE 75 HG13 ILE 75 4.286 -15.010 -9.059 61 HG21 ILE 75 HG21 ILE 75 5.671 -19.098 -9.365 62 HG22 ILE 75 HG22 ILE 75 5.529 -18.287 -7.788 63 HG23 ILE 75 HG23 ILE 75 4.089 -18.781 -8.703 64 HD11 ILE 75 HD11 ILE 75 2.043 -15.616 -8.390 65 HD12 ILE 75 HD12 ILE 75 2.395 -16.274 -9.999 66 HD13 ILE 75 HD13 ILE 75 2.394 -17.340 -8.580 67 H ASP 76 H ASP 76 8.373 -17.799 -8.556 68 HA ASP 76 HA ASP 76 9.296 -19.096 -11.080 69 HB2 ASP 76 HB2 ASP 76 11.028 -18.260 -9.607 70 HB3 ASP 76 HB3 ASP 76 10.398 -19.198 -8.257 71 H ARG 77 H ARG 77 8.714 -20.414 -7.815 72 HA ARG 77 HA ARG 77 6.628 -22.278 -8.842 73 HB2 ARG 77 HB2 ARG 77 7.837 -24.193 -8.068 74 HB3 ARG 77 HB3 ARG 77 8.921 -23.218 -9.064 75 HG2 ARG 77 HG2 ARG 77 9.861 -22.233 -6.881 76 HG3 ARG 77 HG3 ARG 77 8.956 -23.503 -6.034 77 HD2 ARG 77 HD2 ARG 77 10.146 -25.221 -7.373 78 HD3 ARG 77 HD3 ARG 77 11.045 -23.962 -8.212 79 HE ARG 77 HE ARG 77 11.468 -24.958 -5.486 80 HH11 ARG 77 HH11 ARG 77 12.240 -22.260 -7.644 81 HH12 ARG 77 HH12 ARG 77 13.688 -21.884 -6.746 82 HH21 ARG 77 HH21 ARG 77 13.289 -24.355 -4.388 83 HH22 ARG 77 HH22 ARG 77 14.240 -23.006 -4.936 84 H GLU 78 H GLU 78 7.122 -20.036 -6.537 85 HA GLU 78 HA GLU 78 6.736 -21.356 -4.067 86 HB2 GLU 78 HB2 GLU 78 6.106 -18.522 -4.967 87 HB3 GLU 78 HB3 GLU 78 5.957 -19.063 -3.290 88 HG2 GLU 78 HG2 GLU 78 8.352 -19.740 -3.293 89 HG3 GLU 78 HG3 GLU 78 8.520 -19.128 -4.940 90 H GLN 79 H GLN 79 4.174 -19.939 -6.181 91 HA GLN 79 HA GLN 79 2.049 -20.686 -4.340 92 HB2 GLN 79 HB2 GLN 79 1.914 -20.009 -7.307 93 HB3 GLN 79 HB3 GLN 79 0.532 -20.146 -6.221 94 HG2 GLN 79 HG2 GLN 79 2.774 -18.084 -6.014 95 HG3 GLN 79 HG3 GLN 79 1.133 -17.797 -6.583 96 HE21 GLN 79 HE22 GLN 79 -0.686 -18.054 -4.977 97 HE22 GLN 79 HE21 GLN 79 -0.311 -17.759 -3.285 98 H SER 80 H SER 80 3.437 -22.262 -7.234 99 HA SER 80 HA SER 80 1.705 -24.516 -7.321 100 HB2 SER 80 HB2 SER 80 4.633 -24.207 -8.122 101 HB3 SER 80 HB3 SER 80 3.594 -25.583 -8.570 102 HG SER 80 HG SER 80 3.636 -23.928 -10.204 103 H ALA 81 H ALA 81 4.818 -24.079 -5.539 104 HA ALA 81 HA ALA 81 4.814 -26.588 -4.259 105 HB1 ALA 81 HB1 ALA 81 6.775 -25.111 -4.449 106 HB2 ALA 81 HB2 ALA 81 6.007 -23.932 -3.366 107 HB3 ALA 81 HB3 ALA 81 6.456 -25.536 -2.753 108 H ALA 82 H ALA 82 3.334 -23.463 -3.201 109 HA ALA 82 HA ALA 82 2.366 -24.411 -0.696 110 HB1 ALA 82 HB1 ALA 82 2.503 -22.023 -1.339 111 HB2 ALA 82 HB2 ALA 82 1.188 -22.265 -2.512 112 HB3 ALA 82 HB3 ALA 82 0.881 -22.477 -0.781 113 H ILE 83 H ILE 83 0.770 -24.467 -3.933 114 HA ILE 83 HA ILE 83 -1.642 -25.733 -3.038 115 HB ILE 83 HB ILE 83 -0.305 -25.727 -5.767 116 HG12 ILE 83 HG12 ILE 83 -2.784 -24.178 -4.957 117 HG13 ILE 83 HG13 ILE 83 -1.196 -23.504 -4.645 118 HG21 ILE 83 HG21 ILE 83 -2.647 -26.333 -6.599 119 HG22 ILE 83 HG22 ILE 83 -1.829 -27.630 -5.733 120 HG23 ILE 83 HG23 ILE 83 -3.090 -26.671 -4.923 121 HD11 ILE 83 HD11 ILE 83 -2.290 -24.261 -7.380 122 HD12 ILE 83 HD12 ILE 83 -2.047 -22.631 -6.739 123 HD13 ILE 83 HD13 ILE 83 -0.646 -23.667 -7.071 124 H ARG 84 H ARG 84 1.407 -27.163 -4.310 125 HA ARG 84 HA ARG 84 0.574 -29.917 -4.063 126 HB2 ARG 84 HB2 ARG 84 3.279 -28.519 -4.224 127 HB3 ARG 84 HB3 ARG 84 3.175 -30.266 -3.937 128 HG2 ARG 84 HG2 ARG 84 1.902 -30.615 -5.953 129 HG3 ARG 84 HG3 ARG 84 1.794 -28.880 -6.276 130 HD2 ARG 84 HD2 ARG 84 4.154 -28.736 -6.734 131 HD3 ARG 84 HD3 ARG 84 4.433 -30.392 -6.154 132 HE ARG 84 HE ARG 84 2.946 -31.196 -7.999 133 HH11 ARG 84 HH11 ARG 84 5.063 -28.469 -8.578 134 HH12 ARG 84 HH12 ARG 84 4.871 -28.597 -10.302 135 HH21 ARG 84 HH21 ARG 84 2.585 -31.169 -10.170 136 HH22 ARG 84 HH22 ARG 84 3.543 -30.120 -11.175 137 H GLU 85 H GLU 85 2.435 -27.914 -1.702 138 HA GLU 85 HA GLU 85 2.477 -29.922 0.253 139 HB2 GLU 85 HB2 GLU 85 3.924 -27.864 0.136 140 HB3 GLU 85 HB3 GLU 85 2.562 -26.976 0.840 141 HG2 GLU 85 HG2 GLU 85 4.030 -27.666 2.638 142 HG3 GLU 85 HG3 GLU 85 2.556 -28.640 2.710 143 H TRP 86 H TRP 86 0.029 -27.303 -0.177 144 HA TRP 86 HA TRP 86 -1.658 -28.027 1.899 145 HB2 TRP 86 HB2 TRP 86 -1.994 -26.026 0.580 146 HB3 TRP 86 HB3 TRP 86 -2.298 -26.977 -0.874 147 HD1 TRP 86 HD1 TRP 86 -3.947 -25.773 2.313 148 HE1 TRP 86 HE1 TRP 86 -6.436 -26.384 2.339 149 HE3 TRP 86 HE3 TRP 86 -4.147 -28.572 -1.981 150 HZ2 TRP 86 HZ2 TRP 86 -8.206 -28.156 0.888 151 HZ3 TRP 86 HZ3 TRP 86 -6.223 -29.806 -2.568 152 HH2 TRP 86 HH2 TRP 86 -8.231 -29.649 -1.106 153 H ALA 87 H ALA 87 -1.604 -29.388 -1.452 154 HA ALA 87 HA ALA 87 -3.746 -31.212 -1.011 155 HB1 ALA 87 HB1 ALA 87 -1.415 -31.341 -2.981 156 HB2 ALA 87 HB2 ALA 87 -2.934 -32.248 -3.117 157 HB3 ALA 87 HB3 ALA 87 -2.944 -30.476 -3.230 158 H ARG 88 H ARG 88 -0.218 -31.657 -0.593 159 HA ARG 88 HA ARG 88 -0.231 -34.425 0.199 160 HB2 ARG 88 HB2 ARG 88 1.597 -32.049 0.672 161 HB3 ARG 88 HB3 ARG 88 1.946 -33.601 1.427 162 HG2 ARG 88 HG2 ARG 88 2.375 -34.688 -0.577 163 HG3 ARG 88 HG3 ARG 88 1.427 -33.556 -1.545 164 HD2 ARG 88 HD2 ARG 88 3.927 -33.418 -1.871 165 HD3 ARG 88 HD3 ARG 88 3.093 -31.912 -1.544 166 HE ARG 88 HE ARG 88 3.929 -31.894 0.738 167 HH11 ARG 88 HH11 ARG 88 5.544 -34.425 -1.088 168 HH12 ARG 88 HH12 ARG 88 7.017 -34.219 -0.180 169 HH21 ARG 88 HH21 ARG 88 5.812 -31.510 1.607 170 HH22 ARG 88 HH22 ARG 88 7.146 -32.638 1.406 171 H ARG 89 H ARG 89 -0.580 -31.448 2.153 172 HA ARG 89 HA ARG 89 -0.926 -32.836 4.686 173 HB2 ARG 89 HB2 ARG 89 -1.209 -30.021 3.651 174 HB3 ARG 89 HB3 ARG 89 -2.113 -30.425 5.095 175 HG2 ARG 89 HG2 ARG 89 0.034 -29.486 5.697 176 HG3 ARG 89 HG3 ARG 89 -0.143 -31.145 6.272 177 HD2 ARG 89 HD2 ARG 89 1.290 -31.904 4.332 178 HD3 ARG 89 HD3 ARG 89 1.572 -30.200 3.944 179 HE ARG 89 HE ARG 89 2.162 -30.428 6.658 180 HH11 ARG 89 HH11 ARG 89 3.659 -31.692 3.742 181 HH12 ARG 89 HH12 ARG 89 4.983 -32.390 4.642 182 HH21 ARG 89 HH21 ARG 89 3.972 -31.150 7.683 183 HH22 ARG 89 HH22 ARG 89 5.220 -31.966 6.789 184 H ASN 90 H ASN 90 -3.232 -31.983 2.174 185 HA ASN 90 HA ASN 90 -5.511 -32.892 3.846 186 HB2 ASN 90 HB2 ASN 90 -5.302 -31.527 1.143 187 HB3 ASN 90 HB3 ASN 90 -6.820 -32.177 1.764 188 HD21 ASN 90 HD22 ASN 90 -4.331 -29.731 2.337 189 HD22 ASN 90 HD21 ASN 90 -5.315 -28.786 3.453 190 H GLY 91 H GLY 91 -3.295 -34.543 1.947 191 HA2 GLY 91 HA2 GLY 91 -3.246 -36.717 1.221 192 HA3 GLY 91 HA3 GLY 91 -4.843 -36.986 1.931 193 H HIS 92 H HIS 92 -4.390 -34.441 -0.461 194 HA HIS 92 HA HIS 92 -6.309 -35.822 -2.268 195 HB2 HIS 92 HB2 HIS 92 -6.703 -33.474 -1.410 196 HB3 HIS 92 HB3 HIS 92 -5.342 -32.937 -2.383 197 HD1 HIS 92 HD1 HIS 92 -8.961 -34.149 -2.707 198 HD2 HIS 92 HD2 HIS 92 -5.735 -32.819 -5.087 199 HE1 HIS 92 HE1 HIS 92 -9.928 -33.674 -5.050 200 HE2 HIS 92 HE2 HIS 92 -7.977 -32.865 -6.509 201 H ASN 93 H ASN 93 -5.921 -36.187 -4.475 202 HA ASN 93 HA ASN 93 -3.246 -36.970 -5.147 203 HB2 ASN 93 HB2 ASN 93 -5.355 -38.057 -5.942 204 HB3 ASN 93 HB3 ASN 93 -5.695 -36.639 -6.939 205 HD21 ASN 93 HD22 ASN 93 -5.743 -38.478 -8.603 206 HD22 ASN 93 HD21 ASN 93 -4.204 -38.866 -9.356 207 H VAL 94 H VAL 94 -1.625 -35.943 -6.264 208 HA VAL 94 HA VAL 94 -2.134 -33.620 -7.947 209 HB VAL 94 HB VAL 94 -1.967 -32.670 -5.634 210 HG11 VAL 94 HG11 VAL 94 0.187 -32.448 -4.531 211 HG12 VAL 94 HG12 VAL 94 -0.220 -34.159 -4.694 212 HG13 VAL 94 HG13 VAL 94 0.983 -33.419 -5.778 213 HG21 VAL 94 HG21 VAL 94 -0.605 -30.790 -6.239 214 HG22 VAL 94 HG22 VAL 94 0.238 -31.721 -7.496 215 HG23 VAL 94 HG23 VAL 94 -1.496 -31.337 -7.662 216 H SER 95 H SER 95 -0.409 -33.126 -9.395 217 HA SER 95 HA SER 95 1.321 -35.355 -10.072 218 HB2 SER 95 HB2 SER 95 2.051 -33.836 -11.889 219 HB3 SER 95 HB3 SER 95 0.283 -33.962 -11.780 220 HG SER 95 HG SER 95 0.821 -31.807 -11.963 221 H THR 96 H THR 96 3.669 -35.277 -10.197 222 HA THR 96 HA THR 96 4.874 -33.861 -7.899 223 HB THR 96 HB THR 96 6.833 -35.334 -8.421 224 HG1 THR 96 HG1 THR 96 6.392 -37.046 -9.900 225 HG21 THR 96 HG21 THR 96 5.077 -36.020 -6.785 226 HG22 THR 96 HG22 THR 96 4.173 -36.807 -8.099 227 HG23 THR 96 HG23 THR 96 5.785 -37.404 -7.635 228 H ARG 97 H ARG 97 5.780 -34.288 -11.333 229 HA ARG 97 HA ARG 97 7.455 -31.793 -11.184 230 HB2 ARG 97 HB2 ARG 97 7.670 -34.236 -12.991 231 HB3 ARG 97 HB3 ARG 97 8.764 -32.860 -13.002 232 HG2 ARG 97 HG2 ARG 97 8.378 -34.837 -10.716 233 HG3 ARG 97 HG3 ARG 97 9.744 -34.767 -11.818 234 HD2 ARG 97 HD2 ARG 97 8.982 -32.622 -9.791 235 HD3 ARG 97 HD3 ARG 97 10.281 -33.812 -9.623 236 HE ARG 97 HE ARG 97 10.831 -32.504 -12.024 237 HH11 ARG 97 HH11 ARG 97 10.644 -31.516 -8.661 238 HH12 ARG 97 HH12 ARG 97 11.769 -30.207 -8.891 239 HH21 ARG 97 HH21 ARG 97 12.246 -30.806 -12.244 240 HH22 ARG 97 HH22 ARG 97 12.662 -29.827 -10.867 241 H GLY 98 H GLY 98 4.759 -33.085 -12.962 242 HA2 GLY 98 HA2 GLY 98 5.012 -31.316 -15.278 243 HA3 GLY 98 HA3 GLY 98 3.653 -32.360 -14.867 244 H ARG 99 H ARG 99 2.480 -30.455 -15.731 245 HA ARG 99 HA ARG 99 2.108 -28.082 -14.076 246 HB2 ARG 99 HB2 ARG 99 1.645 -28.212 -16.526 247 HB3 ARG 99 HB3 ARG 99 0.299 -29.308 -16.210 248 HG2 ARG 99 HG2 ARG 99 -0.864 -27.521 -14.941 249 HG3 ARG 99 HG3 ARG 99 0.532 -26.439 -15.175 250 HD2 ARG 99 HD2 ARG 99 0.188 -26.555 -17.627 251 HD3 ARG 99 HD3 ARG 99 -1.197 -27.644 -17.380 252 HE ARG 99 HE ARG 99 -1.646 -25.291 -15.853 253 HH11 ARG 99 HH11 ARG 99 -1.521 -26.154 -19.247 254 HH12 ARG 99 HH12 ARG 99 -2.599 -24.868 -19.715 255 HH21 ARG 99 HH21 ARG 99 -3.011 -23.657 -16.518 256 HH22 ARG 99 HH22 ARG 99 -3.426 -23.503 -18.201 257 H ILE 100 H ILE 100 0.479 -27.653 -12.557 258 HA ILE 100 HA ILE 100 -0.469 -29.934 -11.027 259 HB ILE 100 HB ILE 100 -0.875 -26.962 -10.686 260 HG12 ILE 100 HG12 ILE 100 0.795 -29.087 -9.246 261 HG13 ILE 100 HG13 ILE 100 1.415 -27.848 -10.336 262 HG21 ILE 100 HG21 ILE 100 -2.844 -28.177 -9.708 263 HG22 ILE 100 HG22 ILE 100 -1.716 -29.172 -8.747 264 HG23 ILE 100 HG23 ILE 100 -1.849 -27.422 -8.492 265 HD11 ILE 100 HD11 ILE 100 1.884 -27.160 -8.111 266 HD12 ILE 100 HD12 ILE 100 0.590 -26.097 -8.716 267 HD13 ILE 100 HD13 ILE 100 0.220 -27.426 -7.580 268 HA PRO 101 HA PRO 101 -4.358 -30.349 -13.235 269 HB2 PRO 101 HB2 PRO 101 -5.512 -31.680 -10.849 270 HB3 PRO 101 HB3 PRO 101 -5.279 -32.323 -12.493 271 HG2 PRO 101 HG2 PRO 101 -3.741 -33.108 -10.348 272 HG3 PRO 101 HG3 PRO 101 -3.105 -33.024 -12.022 273 HD2 PRO 101 HD2 PRO 101 -2.775 -31.043 -9.771 274 HD3 PRO 101 HD3 PRO 101 -1.584 -31.627 -10.973 275 H ALA 102 H ALA 102 -6.223 -29.129 -13.430 276 HA ALA 102 HA ALA 102 -6.446 -26.836 -11.880 277 HB1 ALA 102 HB1 ALA 102 -8.554 -28.044 -13.686 278 HB2 ALA 102 HB2 ALA 102 -8.428 -26.345 -13.150 279 HB3 ALA 102 HB3 ALA 102 -7.175 -27.033 -14.206 280 H ASP 103 H ASP 103 -8.208 -29.908 -11.377 281 HA ASP 103 HA ASP 103 -10.082 -28.894 -9.589 282 HB2 ASP 103 HB2 ASP 103 -10.519 -31.098 -8.883 283 HB3 ASP 103 HB3 ASP 103 -10.154 -31.162 -10.601 284 H VAL 104 H VAL 104 -6.652 -29.669 -9.023 285 HA VAL 104 HA VAL 104 -6.864 -29.450 -6.163 286 HB VAL 104 HB VAL 104 -4.271 -29.095 -7.597 287 HG11 VAL 104 HG11 VAL 104 -4.300 -28.873 -5.149 288 HG12 VAL 104 HG12 VAL 104 -5.036 -30.479 -4.993 289 HG13 VAL 104 HG13 VAL 104 -3.385 -30.304 -5.633 290 HG21 VAL 104 HG21 VAL 104 -3.945 -31.593 -7.552 291 HG22 VAL 104 HG22 VAL 104 -5.678 -31.762 -7.207 292 HG23 VAL 104 HG23 VAL 104 -5.129 -31.053 -8.735 293 H ILE 105 H ILE 105 -5.963 -27.291 -8.836 294 HA ILE 105 HA ILE 105 -5.230 -24.994 -7.245 295 HB ILE 105 HB ILE 105 -6.284 -25.376 -10.078 296 HG12 ILE 105 HG12 ILE 105 -3.566 -24.251 -9.379 297 HG13 ILE 105 HG13 ILE 105 -3.810 -25.961 -9.059 298 HG21 ILE 105 HG21 ILE 105 -7.005 -23.139 -9.492 299 HG22 ILE 105 HG22 ILE 105 -5.417 -22.770 -8.758 300 HG23 ILE 105 HG23 ILE 105 -5.578 -23.012 -10.514 301 HD11 ILE 105 HD11 ILE 105 -2.841 -25.529 -11.299 302 HD12 ILE 105 HD12 ILE 105 -4.373 -26.424 -11.334 303 HD13 ILE 105 HD13 ILE 105 -4.341 -24.693 -11.766 304 H ASP 106 H ASP 106 -8.417 -25.955 -8.673 305 HA ASP 106 HA ASP 106 -9.935 -23.965 -7.453 306 HB2 ASP 106 HB2 ASP 106 -10.716 -25.411 -9.277 307 HB3 ASP 106 HB3 ASP 106 -10.714 -26.803 -8.194 308 H ALA 107 H ALA 107 -9.199 -27.288 -6.193 309 HA ALA 107 HA ALA 107 -10.504 -27.147 -3.788 310 HB1 ALA 107 HB1 ALA 107 -9.475 -29.176 -4.741 311 HB2 ALA 107 HB2 ALA 107 -7.848 -28.518 -4.435 312 HB3 ALA 107 HB3 ALA 107 -8.941 -28.911 -3.087 313 H TYR 108 H TYR 108 -7.150 -26.058 -4.474 314 HA TYR 108 HA TYR 108 -6.522 -25.127 -1.856 315 HB2 TYR 108 HB2 TYR 108 -4.875 -25.560 -3.619 316 HB3 TYR 108 HB3 TYR 108 -5.523 -24.248 -4.593 317 HD1 TYR 108 HD1 TYR 108 -3.714 -25.078 -1.462 318 HD2 TYR 108 HD2 TYR 108 -4.903 -21.942 -4.171 319 HE1 TYR 108 HE1 TYR 108 -2.080 -23.528 -0.381 320 HE2 TYR 108 HE2 TYR 108 -3.293 -20.391 -3.080 321 HH TYR 108 HH TYR 108 -1.704 -20.114 -1.423 322 H HIS 109 H HIS 109 -7.873 -23.308 -4.698 323 HA HIS 109 HA HIS 109 -8.209 -20.850 -3.262 324 HB2 HIS 109 HB2 HIS 109 -9.561 -21.975 -5.735 325 HB3 HIS 109 HB3 HIS 109 -10.016 -20.416 -5.046 326 HD1 HIS 109 HD1 HIS 109 -7.711 -18.693 -4.652 327 HD2 HIS 109 HD2 HIS 109 -7.725 -21.734 -7.573 328 HE1 HIS 109 HE1 HIS 109 -5.883 -18.067 -6.358 329 HE2 HIS 109 HE2 HIS 109 -5.898 -19.923 -8.139 330 H ALA 110 H ALA 110 -10.494 -23.635 -3.537 331 HA ALA 110 HA ALA 110 -12.589 -22.430 -2.099 332 HB1 ALA 110 HB1 ALA 110 -11.770 -25.364 -2.222 333 HB2 ALA 110 HB2 ALA 110 -13.356 -24.741 -1.720 334 HB3 ALA 110 HB3 ALA 110 -12.805 -24.512 -3.392 335 H ALA 111 H ALA 111 -9.730 -24.266 -0.851 336 HA ALA 111 HA ALA 111 -10.442 -24.120 1.846 337 HB1 ALA 111 HB1 ALA 111 -8.119 -24.776 2.247 338 HB2 ALA 111 HB2 ALA 111 -8.813 -25.685 0.892 339 HB3 ALA 111 HB3 ALA 111 -7.686 -24.345 0.578 340 H THR 112 H THR 112 -8.453 -21.846 -0.135 341 HA THR 112 HA THR 112 -7.811 -20.173 2.156 342 HB THR 112 HB THR 112 -6.848 -18.613 0.536 343 HG1 THR 112 HG1 THR 112 -6.820 -19.157 -1.629 344 HG21 THR 112 HG21 THR 112 -5.045 -20.049 -0.260 345 HG22 THR 112 HG22 THR 112 -5.502 -20.513 1.390 346 HG23 THR 112 HG23 THR 112 -6.021 -21.501 0.010 347 H LEU 113 H LEU 113 -10.275 -19.855 -0.454 348 HA LEU 113 HA LEU 113 -11.178 -17.276 0.519 349 HB2 LEU 113 HB2 LEU 113 -11.205 -17.939 -1.855 350 HB3 LEU 113 HB3 LEU 113 -12.281 -19.291 -1.478 351 HG LEU 113 HG LEU 113 -14.049 -17.764 -0.817 352 HD11 LEU 113 HD11 LEU 113 -12.157 -15.546 -1.734 353 HD12 LEU 113 HD12 LEU 113 -13.889 -15.332 -1.385 354 HD13 LEU 113 HD13 LEU 113 -12.782 -15.776 -0.087 355 HD21 LEU 113 HD21 LEU 113 -13.914 -18.556 -3.135 356 HD22 LEU 113 HD22 LEU 113 -14.595 -16.925 -3.065 357 HD23 LEU 113 HD23 LEU 113 -12.907 -17.156 -3.569 358 H GLU 114 H GLU 114 -12.162 -20.631 0.982 359 HA GLU 114 HA GLU 114 -13.818 -21.663 2.141 360 HB2 GLU 114 HB2 GLU 114 -12.066 -20.989 3.733 361 HB3 GLU 114 HB3 GLU 114 -13.034 -19.586 4.210 362 HG2 GLU 114 HG2 GLU 114 -14.846 -21.090 4.987 363 HG3 GLU 114 HG3 GLU 114 -13.967 -22.484 4.373 364 H HIS 115 H HIS 115 -15.525 -21.013 0.657 365 HA HIS 115 HA HIS 115 -17.046 -18.714 0.761 366 HB2 HIS 115 HB2 HIS 115 -17.092 -20.445 -1.011 367 HB3 HIS 115 HB3 HIS 115 -17.967 -21.541 0.049 368 HD1 HIS 115 HD1 HIS 115 -18.517 -18.098 -1.683 369 HD2 HIS 115 HD2 HIS 115 -20.596 -21.391 -0.036 370 HE1 HIS 115 HE1 HIS 115 -21.012 -17.730 -2.218 371 HE2 HIS 115 HE2 HIS 115 -22.270 -19.740 -1.208 372 H HIS 116 H HIS 116 -17.395 -21.397 3.003 373 HA HIS 116 HA HIS 116 -19.937 -20.443 4.124 374 HB2 HIS 116 HB2 HIS 116 -19.832 -22.369 5.551 375 HB3 HIS 116 HB3 HIS 116 -19.454 -22.835 3.907 376 HD1 HIS 116 HD1 HIS 116 -17.679 -22.334 7.317 377 HD2 HIS 116 HD2 HIS 116 -17.181 -24.119 3.517 378 HE1 HIS 116 HE1 HIS 116 -15.558 -23.794 7.466 379 HE2 HIS 116 HE2 HIS 116 -15.270 -24.880 5.156 380 H HIS 117 H HIS 117 -16.913 -19.094 4.561 381 HA HIS 117 HA HIS 117 -16.938 -18.818 7.443 382 HB2 HIS 117 HB2 HIS 117 -15.036 -17.529 7.246 383 HB3 HIS 117 HB3 HIS 117 -14.922 -18.638 5.892 384 HD1 HIS 117 HD1 HIS 117 -14.861 -17.506 3.463 385 HD2 HIS 117 HD2 HIS 117 -15.466 -14.895 6.728 386 HE1 HIS 117 HE1 HIS 117 -14.583 -15.112 2.541 387 HE2 HIS 117 HE2 HIS 117 -14.952 -13.526 4.543 388 H HIS 118 H HIS 118 -18.417 -16.892 4.914 389 HA HIS 118 HA HIS 118 -19.259 -14.772 6.828 390 HB2 HIS 118 HB2 HIS 118 -18.277 -14.096 4.658 391 HB3 HIS 118 HB3 HIS 118 -19.551 -14.959 3.798 392 HD1 HIS 118 HD1 HIS 118 -21.713 -13.531 3.305 393 HD2 HIS 118 HD2 HIS 118 -19.202 -11.985 6.338 394 HE1 HIS 118 HE1 HIS 118 -22.723 -11.265 4.000 395 HE2 HIS 118 HE2 HIS 118 -21.173 -10.326 5.841 396 H HIS 119 H HIS 119 -21.406 -14.274 7.259 397 HA HIS 119 HA HIS 119 -23.502 -16.302 6.576 398 HB2 HIS 119 HB2 HIS 119 -22.971 -15.223 9.375 399 HB3 HIS 119 HB3 HIS 119 -24.133 -16.470 8.921 400 HD1 HIS 119 HD1 HIS 119 -20.945 -16.331 10.555 401 HD2 HIS 119 HD2 HIS 119 -22.567 -18.608 7.387 402 HE1 HIS 119 HE1 HIS 119 -19.419 -18.388 10.282 403 HE2 HIS 119 HE2 HIS 119 -20.376 -19.737 8.302 404 H HIS 120 H HIS 120 -25.692 -15.613 7.047 405 HA HIS 120 HA HIS 120 -26.231 -12.868 6.203 406 HB2 HIS 120 HB2 HIS 120 -27.528 -14.931 5.504 407 HB3 HIS 120 HB3 HIS 120 -28.207 -14.989 7.132 408 HD1 HIS 120 HD1 HIS 120 -28.560 -11.633 7.109 409 HD2 HIS 120 HD2 HIS 120 -29.957 -14.577 4.426 410 HE1 HIS 120 HE1 HIS 120 -30.627 -10.611 5.904 411 HE2 HIS 120 HE2 HIS 120 -31.462 -12.423 4.267 Start of MODEL 15 1 H1 SER 66 H1 SER 66 13.946 -5.472 21.335 2 H2 SER 66 H2 SER 66 14.507 -6.713 20.417 3 H3 SER 66 H3 SER 66 15.527 -5.544 20.929 4 HA SER 66 HA SER 66 14.439 -3.866 19.648 5 HB2 SER 66 HB2 SER 66 15.325 -6.209 17.932 6 HB3 SER 66 HB3 SER 66 15.214 -4.505 17.444 7 HG SER 66 HG SER 66 17.340 -5.060 18.091 8 H GLY 67 H GLY 67 13.217 -7.005 18.213 9 HA2 GLY 67 HA2 GLY 67 10.457 -6.395 18.566 10 HA3 GLY 67 HA3 GLY 67 10.962 -5.845 16.965 11 H SER 68 H SER 68 9.050 -7.672 17.001 12 HA SER 68 HA SER 68 10.268 -10.061 15.776 13 HB2 SER 68 HB2 SER 68 10.001 -10.549 18.249 14 HB3 SER 68 HB3 SER 68 8.250 -10.365 18.034 15 HG SER 68 HG SER 68 9.008 -12.570 17.860 16 H GLY 69 H GLY 69 8.629 -11.436 14.723 17 HA2 GLY 69 HA2 GLY 69 6.765 -11.836 13.412 18 HA3 GLY 69 HA3 GLY 69 5.942 -10.498 14.209 19 H ARG 70 H ARG 70 5.073 -10.376 12.003 20 HA ARG 70 HA ARG 70 4.753 -9.427 9.972 21 HB2 ARG 70 HB2 ARG 70 6.647 -7.287 11.009 22 HB3 ARG 70 HB3 ARG 70 5.505 -7.112 9.674 23 HG2 ARG 70 HG2 ARG 70 3.615 -7.575 11.221 24 HG3 ARG 70 HG3 ARG 70 4.745 -7.655 12.577 25 HD2 ARG 70 HD2 ARG 70 4.310 -5.238 10.775 26 HD3 ARG 70 HD3 ARG 70 3.593 -5.441 12.365 27 HE ARG 70 HE ARG 70 6.352 -4.690 11.726 28 HH11 ARG 70 HH11 ARG 70 4.333 -5.920 14.326 29 HH12 ARG 70 HH12 ARG 70 5.474 -5.445 15.554 30 HH21 ARG 70 HH21 ARG 70 7.749 -4.110 13.344 31 HH22 ARG 70 HH22 ARG 70 7.345 -4.425 15.007 32 H GLY 71 H GLY 71 7.173 -11.259 10.188 33 HA2 GLY 71 HA2 GLY 71 8.877 -10.564 7.936 34 HA3 GLY 71 HA3 GLY 71 8.741 -12.146 8.704 35 H ARG 72 H ARG 72 8.764 -11.222 5.833 36 HA ARG 72 HA ARG 72 6.282 -12.569 4.823 37 HB2 ARG 72 HB2 ARG 72 7.510 -9.992 3.750 38 HB3 ARG 72 HB3 ARG 72 6.134 -10.851 3.050 39 HG2 ARG 72 HG2 ARG 72 4.830 -10.477 5.141 40 HG3 ARG 72 HG3 ARG 72 6.195 -9.604 5.832 41 HD2 ARG 72 HD2 ARG 72 4.556 -8.785 3.424 42 HD3 ARG 72 HD3 ARG 72 4.524 -8.038 5.015 43 HE ARG 72 HE ARG 72 6.347 -7.486 2.869 44 HH11 ARG 72 HH11 ARG 72 6.496 -7.626 6.408 45 HH12 ARG 72 HH12 ARG 72 7.669 -6.352 6.458 46 HH21 ARG 72 HH21 ARG 72 7.896 -5.951 3.061 47 HH22 ARG 72 HH22 ARG 72 8.467 -5.454 4.627 48 H GLY 73 H GLY 73 6.483 -13.830 3.043 49 HA2 GLY 73 HA2 GLY 73 9.133 -14.780 2.279 50 HA3 GLY 73 HA3 GLY 73 7.582 -15.341 1.665 51 H ALA 74 H ALA 74 6.813 -12.548 0.814 52 HA ALA 74 HA ALA 74 6.542 -11.677 -1.262 53 HB1 ALA 74 HB1 ALA 74 8.494 -10.385 -0.456 54 HB2 ALA 74 HB2 ALA 74 9.585 -11.545 -1.244 55 HB3 ALA 74 HB3 ALA 74 8.481 -10.553 -2.220 56 H ILE 75 H ILE 75 5.972 -14.165 -1.340 57 HA ILE 75 HA ILE 75 7.603 -15.658 -3.182 58 HB ILE 75 HB ILE 75 4.905 -16.455 -2.022 59 HG12 ILE 75 HG12 ILE 75 6.404 -15.920 -0.151 60 HG13 ILE 75 HG13 ILE 75 6.034 -17.621 -0.233 61 HG21 ILE 75 HG21 ILE 75 7.197 -18.058 -3.215 62 HG22 ILE 75 HG22 ILE 75 5.861 -18.780 -2.292 63 HG23 ILE 75 HG23 ILE 75 5.520 -17.950 -3.818 64 HD11 ILE 75 HD11 ILE 75 8.410 -17.187 0.343 65 HD12 ILE 75 HD12 ILE 75 8.251 -18.148 -1.128 66 HD13 ILE 75 HD13 ILE 75 8.655 -16.421 -1.237 67 H ASP 76 H ASP 76 7.156 -16.353 -5.240 68 HA ASP 76 HA ASP 76 4.585 -15.593 -6.543 69 HB2 ASP 76 HB2 ASP 76 6.106 -13.725 -6.990 70 HB3 ASP 76 HB3 ASP 76 7.307 -14.832 -7.649 71 H ARG 77 H ARG 77 7.762 -17.118 -7.353 72 HA ARG 77 HA ARG 77 6.609 -18.975 -9.230 73 HB2 ARG 77 HB2 ARG 77 9.312 -18.892 -7.823 74 HB3 ARG 77 HB3 ARG 77 8.906 -20.027 -9.115 75 HG2 ARG 77 HG2 ARG 77 8.450 -18.133 -10.658 76 HG3 ARG 77 HG3 ARG 77 8.911 -16.985 -9.387 77 HD2 ARG 77 HD2 ARG 77 11.173 -17.993 -9.301 78 HD3 ARG 77 HD3 ARG 77 10.711 -19.137 -10.576 79 HE ARG 77 HE ARG 77 10.191 -16.505 -11.518 80 HH11 ARG 77 HH11 ARG 77 13.017 -18.439 -10.760 81 HH12 ARG 77 HH12 ARG 77 14.022 -17.582 -11.892 82 HH21 ARG 77 HH21 ARG 77 11.528 -15.452 -12.944 83 HH22 ARG 77 HH22 ARG 77 13.192 -15.925 -13.097 84 H GLU 78 H GLU 78 7.352 -19.299 -5.815 85 HA GLU 78 HA GLU 78 6.936 -22.206 -5.828 86 HB2 GLU 78 HB2 GLU 78 7.625 -20.249 -3.621 87 HB3 GLU 78 HB3 GLU 78 7.475 -22.001 -3.396 88 HG2 GLU 78 HG2 GLU 78 9.248 -22.358 -5.113 89 HG3 GLU 78 HG3 GLU 78 9.447 -20.610 -5.260 90 H GLN 79 H GLN 79 4.639 -19.872 -5.978 91 HA GLN 79 HA GLN 79 2.745 -20.609 -3.955 92 HB2 GLN 79 HB2 GLN 79 2.358 -19.600 -6.805 93 HB3 GLN 79 HB3 GLN 79 1.053 -19.765 -5.622 94 HG2 GLN 79 HG2 GLN 79 2.146 -18.161 -4.115 95 HG3 GLN 79 HG3 GLN 79 3.494 -17.976 -5.238 96 HE21 GLN 79 HE22 GLN 79 2.946 -17.146 -7.482 97 HE22 GLN 79 HE21 GLN 79 1.597 -16.012 -7.608 98 H SER 80 H SER 80 3.413 -22.074 -7.170 99 HA SER 80 HA SER 80 1.371 -24.071 -7.084 100 HB2 SER 80 HB2 SER 80 4.116 -24.159 -8.406 101 HB3 SER 80 HB3 SER 80 2.756 -25.242 -8.759 102 HG SER 80 HG SER 80 2.880 -23.454 -10.235 103 H ALA 81 H ALA 81 4.807 -24.229 -5.946 104 HA ALA 81 HA ALA 81 4.684 -26.851 -4.957 105 HB1 ALA 81 HB1 ALA 81 6.704 -26.226 -3.692 106 HB2 ALA 81 HB2 ALA 81 6.773 -25.613 -5.357 107 HB3 ALA 81 HB3 ALA 81 6.394 -24.509 -4.014 108 H ALA 82 H ALA 82 3.834 -23.751 -3.336 109 HA ALA 82 HA ALA 82 3.175 -24.881 -0.800 110 HB1 ALA 82 HB1 ALA 82 1.975 -22.788 -0.423 111 HB2 ALA 82 HB2 ALA 82 3.528 -22.470 -1.221 112 HB3 ALA 82 HB3 ALA 82 2.015 -22.411 -2.154 113 H ILE 83 H ILE 83 1.126 -24.489 -3.744 114 HA ILE 83 HA ILE 83 -1.266 -25.569 -2.534 115 HB ILE 83 HB ILE 83 -0.393 -25.296 -5.434 116 HG12 ILE 83 HG12 ILE 83 -2.449 -23.815 -3.735 117 HG13 ILE 83 HG13 ILE 83 -0.844 -23.210 -4.070 118 HG21 ILE 83 HG21 ILE 83 -3.106 -26.197 -4.350 119 HG22 ILE 83 HG22 ILE 83 -2.761 -25.793 -6.041 120 HG23 ILE 83 HG23 ILE 83 -1.987 -27.185 -5.317 121 HD11 ILE 83 HD11 ILE 83 -1.402 -23.224 -6.539 122 HD12 ILE 83 HD12 ILE 83 -3.089 -23.577 -6.079 123 HD13 ILE 83 HD13 ILE 83 -2.326 -22.078 -5.547 124 H ARG 84 H ARG 84 1.391 -27.137 -4.371 125 HA ARG 84 HA ARG 84 0.288 -29.803 -4.185 126 HB2 ARG 84 HB2 ARG 84 1.961 -29.190 -5.815 127 HB3 ARG 84 HB3 ARG 84 3.156 -28.838 -4.572 128 HG2 ARG 84 HG2 ARG 84 3.694 -31.047 -4.274 129 HG3 ARG 84 HG3 ARG 84 2.023 -31.598 -4.449 130 HD2 ARG 84 HD2 ARG 84 3.443 -32.462 -6.256 131 HD3 ARG 84 HD3 ARG 84 2.106 -31.455 -6.837 132 HE ARG 84 HE ARG 84 4.633 -30.000 -6.517 133 HH11 ARG 84 HH11 ARG 84 2.933 -32.101 -8.784 134 HH12 ARG 84 HH12 ARG 84 3.626 -31.258 -10.168 135 HH21 ARG 84 HH21 ARG 84 5.523 -29.081 -8.400 136 HH22 ARG 84 HH22 ARG 84 5.031 -29.716 -9.955 137 H GLU 85 H GLU 85 2.618 -28.129 -2.002 138 HA GLU 85 HA GLU 85 2.807 -30.176 -0.127 139 HB2 GLU 85 HB2 GLU 85 4.166 -28.028 -0.248 140 HB3 GLU 85 HB3 GLU 85 2.800 -27.211 0.525 141 HG2 GLU 85 HG2 GLU 85 3.049 -29.114 2.342 142 HG3 GLU 85 HG3 GLU 85 4.629 -29.375 1.621 143 H TRP 86 H TRP 86 0.429 -27.421 -0.133 144 HA TRP 86 HA TRP 86 -1.072 -28.148 2.071 145 HB2 TRP 86 HB2 TRP 86 -1.386 -26.036 0.970 146 HB3 TRP 86 HB3 TRP 86 -1.854 -26.815 -0.534 147 HD1 TRP 86 HD1 TRP 86 -3.222 -25.967 2.924 148 HE1 TRP 86 HE1 TRP 86 -5.778 -26.191 2.928 149 HE3 TRP 86 HE3 TRP 86 -3.884 -27.912 -1.780 150 HZ2 TRP 86 HZ2 TRP 86 -7.828 -27.199 1.176 151 HZ3 TRP 86 HZ3 TRP 86 -6.168 -28.441 -2.600 152 HH2 TRP 86 HH2 TRP 86 -8.140 -28.113 -1.126 153 H ALA 87 H ALA 87 -1.528 -29.261 -1.320 154 HA ALA 87 HA ALA 87 -3.770 -30.933 -0.810 155 HB1 ALA 87 HB1 ALA 87 -3.105 -30.175 -3.045 156 HB2 ALA 87 HB2 ALA 87 -1.585 -31.085 -2.940 157 HB3 ALA 87 HB3 ALA 87 -3.133 -31.953 -3.000 158 H ARG 88 H ARG 88 -0.254 -31.743 -0.776 159 HA ARG 88 HA ARG 88 -0.588 -34.521 -0.042 160 HB2 ARG 88 HB2 ARG 88 1.718 -32.545 0.288 161 HB3 ARG 88 HB3 ARG 88 1.824 -34.243 0.769 162 HG2 ARG 88 HG2 ARG 88 1.343 -34.978 -1.536 163 HG3 ARG 88 HG3 ARG 88 1.144 -33.306 -2.055 164 HD2 ARG 88 HD2 ARG 88 3.334 -34.021 -2.718 165 HD3 ARG 88 HD3 ARG 88 3.507 -32.843 -1.402 166 HE ARG 88 HE ARG 88 3.438 -35.606 -0.458 167 HH11 ARG 88 HH11 ARG 88 5.678 -33.278 -1.836 168 HH12 ARG 88 HH12 ARG 88 7.060 -34.064 -1.124 169 HH21 ARG 88 HH21 ARG 88 5.242 -36.525 0.445 170 HH22 ARG 88 HH22 ARG 88 6.816 -35.864 0.121 171 H ARG 89 H ARG 89 -0.151 -31.625 1.996 172 HA ARG 89 HA ARG 89 -0.182 -32.992 4.535 173 HB2 ARG 89 HB2 ARG 89 -0.736 -30.119 3.689 174 HB3 ARG 89 HB3 ARG 89 -0.805 -30.637 5.377 175 HG2 ARG 89 HG2 ARG 89 1.523 -31.337 5.358 176 HG3 ARG 89 HG3 ARG 89 1.646 -31.083 3.619 177 HD2 ARG 89 HD2 ARG 89 2.725 -29.258 4.730 178 HD3 ARG 89 HD3 ARG 89 1.263 -28.656 3.928 179 HE ARG 89 HE ARG 89 0.619 -29.305 6.630 180 HH11 ARG 89 HH11 ARG 89 2.634 -26.927 4.971 181 HH12 ARG 89 HH12 ARG 89 2.374 -25.739 6.224 182 HH21 ARG 89 HH21 ARG 89 0.365 -27.728 8.182 183 HH22 ARG 89 HH22 ARG 89 1.141 -26.185 7.989 184 H ASN 90 H ASN 90 -2.841 -31.911 2.503 185 HA ASN 90 HA ASN 90 -4.817 -32.743 4.573 186 HB2 ASN 90 HB2 ASN 90 -5.090 -31.197 1.971 187 HB3 ASN 90 HB3 ASN 90 -6.460 -31.736 2.940 188 HD21 ASN 90 HD22 ASN 90 -3.717 -29.515 2.890 189 HD22 ASN 90 HD21 ASN 90 -4.288 -28.561 4.259 190 H GLY 91 H GLY 91 -3.099 -34.478 2.401 191 HA2 GLY 91 HA2 GLY 91 -3.345 -36.603 1.599 192 HA3 GLY 91 HA3 GLY 91 -4.848 -36.736 2.517 193 H HIS 92 H HIS 92 -4.519 -34.236 0.057 194 HA HIS 92 HA HIS 92 -6.763 -35.408 -1.490 195 HB2 HIS 92 HB2 HIS 92 -5.268 -32.772 -1.840 196 HB3 HIS 92 HB3 HIS 92 -6.741 -33.240 -2.681 197 HD1 HIS 92 HD1 HIS 92 -8.135 -34.349 0.207 198 HD2 HIS 92 HD2 HIS 92 -6.511 -30.598 -0.856 199 HE1 HIS 92 HE1 HIS 92 -9.299 -32.606 1.696 200 HE2 HIS 92 HE2 HIS 92 -8.308 -30.318 1.040 201 H ASN 93 H ASN 93 -6.716 -35.690 -3.782 202 HA ASN 93 HA ASN 93 -4.376 -37.056 -4.766 203 HB2 ASN 93 HB2 ASN 93 -6.718 -37.629 -5.363 204 HB3 ASN 93 HB3 ASN 93 -6.876 -36.092 -6.227 205 HD21 ASN 93 HD22 ASN 93 -7.494 -37.826 -7.929 206 HD22 ASN 93 HD21 ASN 93 -6.161 -38.408 -8.916 207 H VAL 94 H VAL 94 -2.591 -36.212 -5.642 208 HA VAL 94 HA VAL 94 -2.649 -33.915 -7.449 209 HB VAL 94 HB VAL 94 -2.467 -32.795 -5.275 210 HG11 VAL 94 HG11 VAL 94 -1.317 -34.520 -3.931 211 HG12 VAL 94 HG12 VAL 94 0.171 -34.266 -4.871 212 HG13 VAL 94 HG13 VAL 94 -0.485 -32.963 -3.863 213 HG21 VAL 94 HG21 VAL 94 -1.364 -31.849 -7.287 214 HG22 VAL 94 HG22 VAL 94 -0.600 -31.374 -5.768 215 HG23 VAL 94 HG23 VAL 94 0.158 -32.618 -6.784 216 H SER 95 H SER 95 -1.098 -33.983 -8.969 217 HA SER 95 HA SER 95 0.533 -36.303 -9.346 218 HB2 SER 95 HB2 SER 95 0.663 -33.546 -10.628 219 HB3 SER 95 HB3 SER 95 1.453 -35.018 -11.248 220 HG SER 95 HG SER 95 -0.561 -34.688 -12.284 221 H THR 96 H THR 96 2.515 -36.789 -8.495 222 HA THR 96 HA THR 96 3.809 -34.963 -6.652 223 HB THR 96 HB THR 96 5.473 -36.828 -6.421 224 HG1 THR 96 HG1 THR 96 4.972 -38.759 -7.523 225 HG21 THR 96 HG21 THR 96 2.553 -37.713 -6.265 226 HG22 THR 96 HG22 THR 96 3.928 -38.416 -5.385 227 HG23 THR 96 HG23 THR 96 3.409 -36.758 -5.034 228 H ARG 97 H ARG 97 4.319 -35.671 -10.006 229 HA ARG 97 HA ARG 97 6.696 -33.838 -10.104 230 HB2 ARG 97 HB2 ARG 97 6.188 -36.341 -11.778 231 HB3 ARG 97 HB3 ARG 97 7.486 -35.171 -12.057 232 HG2 ARG 97 HG2 ARG 97 8.417 -35.658 -9.805 233 HG3 ARG 97 HG3 ARG 97 7.155 -36.884 -9.558 234 HD2 ARG 97 HD2 ARG 97 7.959 -38.123 -11.537 235 HD3 ARG 97 HD3 ARG 97 9.231 -36.904 -11.786 236 HE ARG 97 HE ARG 97 9.459 -37.876 -9.124 237 HH11 ARG 97 HH11 ARG 97 9.954 -39.133 -12.360 238 HH12 ARG 97 HH12 ARG 97 11.163 -40.271 -11.834 239 HH21 ARG 97 HH21 ARG 97 11.010 -39.352 -8.516 240 HH22 ARG 97 HH22 ARG 97 11.739 -40.391 -9.706 241 H GLY 98 H GLY 98 6.924 -32.678 -12.134 242 HA2 GLY 98 HA2 GLY 98 6.168 -31.376 -13.891 243 HA3 GLY 98 HA3 GLY 98 4.898 -32.569 -14.142 244 H ARG 99 H ARG 99 3.453 -30.921 -14.716 245 HA ARG 99 HA ARG 99 2.767 -28.658 -13.021 246 HB2 ARG 99 HB2 ARG 99 1.525 -29.936 -15.496 247 HB3 ARG 99 HB3 ARG 99 0.718 -28.643 -14.635 248 HG2 ARG 99 HG2 ARG 99 1.821 -27.687 -16.470 249 HG3 ARG 99 HG3 ARG 99 2.623 -27.114 -15.020 250 HD2 ARG 99 HD2 ARG 99 3.710 -29.452 -16.636 251 HD3 ARG 99 HD3 ARG 99 4.002 -27.779 -17.120 252 HE ARG 99 HE ARG 99 4.757 -27.847 -14.443 253 HH11 ARG 99 HH21 ARG 99 5.880 -29.396 -17.379 254 HH12 ARG 99 HH22 ARG 99 7.520 -29.514 -16.808 255 HH21 ARG 99 HH11 ARG 99 6.880 -28.014 -13.775 256 HH22 ARG 99 HH12 ARG 99 8.063 -28.740 -14.816 257 H ILE 100 H ILE 100 0.641 -28.228 -12.183 258 HA ILE 100 HA ILE 100 -0.342 -30.508 -10.548 259 HB ILE 100 HB ILE 100 -0.605 -27.513 -10.204 260 HG12 ILE 100 HG12 ILE 100 1.001 -29.633 -8.694 261 HG13 ILE 100 HG13 ILE 100 1.665 -28.431 -9.804 262 HG21 ILE 100 HG21 ILE 100 -1.475 -29.639 -8.185 263 HG22 ILE 100 HG22 ILE 100 -1.681 -27.885 -8.073 264 HG23 ILE 100 HG23 ILE 100 -2.610 -28.794 -9.250 265 HD11 ILE 100 HD11 ILE 100 0.788 -26.615 -8.285 266 HD12 ILE 100 HD12 ILE 100 0.405 -27.892 -7.102 267 HD13 ILE 100 HD13 ILE 100 2.082 -27.636 -7.628 268 HA PRO 101 HA PRO 101 -4.253 -30.550 -12.850 269 HB2 PRO 101 HB2 PRO 101 -5.903 -31.665 -10.927 270 HB3 PRO 101 HB3 PRO 101 -4.706 -32.611 -11.874 271 HG2 PRO 101 HG2 PRO 101 -4.354 -31.359 -9.127 272 HG3 PRO 101 HG3 PRO 101 -4.034 -33.065 -9.602 273 HD2 PRO 101 HD2 PRO 101 -2.094 -31.258 -9.448 274 HD3 PRO 101 HD3 PRO 101 -2.112 -32.389 -10.841 275 H ALA 102 H ALA 102 -5.704 -28.903 -13.192 276 HA ALA 102 HA ALA 102 -5.924 -26.706 -11.483 277 HB1 ALA 102 HB1 ALA 102 -7.871 -27.596 -13.624 278 HB2 ALA 102 HB2 ALA 102 -7.687 -25.960 -12.945 279 HB3 ALA 102 HB3 ALA 102 -6.364 -26.675 -13.894 280 H ASP 103 H ASP 103 -7.846 -29.672 -11.428 281 HA ASP 103 HA ASP 103 -9.995 -28.823 -9.901 282 HB2 ASP 103 HB2 ASP 103 -9.833 -30.997 -11.024 283 HB3 ASP 103 HB3 ASP 103 -8.567 -31.502 -9.904 284 H VAL 104 H VAL 104 -6.728 -29.825 -8.791 285 HA VAL 104 HA VAL 104 -7.508 -29.553 -6.016 286 HB VAL 104 HB VAL 104 -5.814 -31.243 -6.941 287 HG11 VAL 104 HG11 VAL 104 -3.499 -30.682 -6.865 288 HG12 VAL 104 HG12 VAL 104 -4.274 -29.514 -7.929 289 HG13 VAL 104 HG13 VAL 104 -3.827 -29.031 -6.280 290 HG21 VAL 104 HG21 VAL 104 -5.212 -29.738 -4.373 291 HG22 VAL 104 HG22 VAL 104 -6.453 -30.998 -4.574 292 HG23 VAL 104 HG23 VAL 104 -4.746 -31.411 -4.775 293 H ILE 105 H ILE 105 -5.922 -27.502 -8.394 294 HA ILE 105 HA ILE 105 -5.196 -25.361 -6.586 295 HB ILE 105 HB ILE 105 -5.860 -25.502 -9.551 296 HG12 ILE 105 HG12 ILE 105 -3.153 -24.787 -8.376 297 HG13 ILE 105 HG13 ILE 105 -3.651 -26.472 -8.298 298 HG21 ILE 105 HG21 ILE 105 -6.388 -23.233 -8.938 299 HG22 ILE 105 HG22 ILE 105 -4.915 -23.091 -7.941 300 HG23 ILE 105 HG23 ILE 105 -4.801 -23.214 -9.708 301 HD11 ILE 105 HD11 ILE 105 -3.626 -24.907 -10.899 302 HD12 ILE 105 HD12 ILE 105 -2.307 -25.939 -10.316 303 HD13 ILE 105 HD13 ILE 105 -3.894 -26.653 -10.647 304 H ASP 106 H ASP 106 -8.221 -25.988 -8.488 305 HA ASP 106 HA ASP 106 -9.681 -23.857 -7.450 306 HB2 ASP 106 HB2 ASP 106 -10.347 -25.180 -9.401 307 HB3 ASP 106 HB3 ASP 106 -10.647 -26.582 -8.370 308 H ALA 107 H ALA 107 -9.452 -27.246 -6.154 309 HA ALA 107 HA ALA 107 -11.021 -26.883 -3.914 310 HB1 ALA 107 HB1 ALA 107 -8.519 -28.602 -4.155 311 HB2 ALA 107 HB2 ALA 107 -9.840 -28.823 -2.991 312 HB3 ALA 107 HB3 ALA 107 -10.142 -29.058 -4.722 313 H TYR 108 H TYR 108 -7.511 -26.125 -4.256 314 HA TYR 108 HA TYR 108 -7.071 -25.199 -1.599 315 HB2 TYR 108 HB2 TYR 108 -5.216 -25.644 -3.037 316 HB3 TYR 108 HB3 TYR 108 -5.780 -24.529 -4.260 317 HD1 TYR 108 HD2 TYR 108 -4.311 -24.744 -0.851 318 HD2 TYR 108 HD1 TYR 108 -5.303 -22.174 -4.174 319 HE1 TYR 108 HE2 TYR 108 -2.911 -22.934 0.133 320 HE2 TYR 108 HE1 TYR 108 -3.897 -20.367 -3.189 321 HH TYR 108 HH TYR 108 -2.127 -20.780 -0.097 322 H HIS 109 H HIS 109 -8.080 -23.321 -4.534 323 HA HIS 109 HA HIS 109 -8.419 -20.863 -3.090 324 HB2 HIS 109 HB2 HIS 109 -9.564 -21.848 -5.721 325 HB3 HIS 109 HB3 HIS 109 -9.905 -20.242 -5.075 326 HD1 HIS 109 HD1 HIS 109 -7.408 -18.851 -4.371 327 HD2 HIS 109 HD2 HIS 109 -7.546 -21.837 -7.347 328 HE1 HIS 109 HE1 HIS 109 -5.331 -18.486 -5.853 329 HE2 HIS 109 HE2 HIS 109 -5.430 -20.294 -7.685 330 H ALA 110 H ALA 110 -10.805 -23.502 -3.667 331 HA ALA 110 HA ALA 110 -12.968 -22.230 -2.421 332 HB1 ALA 110 HB1 ALA 110 -13.878 -24.503 -2.169 333 HB2 ALA 110 HB2 ALA 110 -13.114 -24.315 -3.762 334 HB3 ALA 110 HB3 ALA 110 -12.273 -25.197 -2.464 335 H ALA 111 H ALA 111 -10.312 -24.154 -0.914 336 HA ALA 111 HA ALA 111 -11.286 -23.992 1.702 337 HB1 ALA 111 HB1 ALA 111 -9.054 -24.773 2.327 338 HB2 ALA 111 HB2 ALA 111 -9.657 -25.641 0.903 339 HB3 ALA 111 HB3 ALA 111 -8.435 -24.361 0.718 340 H THR 112 H THR 112 -8.977 -21.824 -0.038 341 HA THR 112 HA THR 112 -8.486 -20.214 2.333 342 HB THR 112 HB THR 112 -7.224 -18.726 0.831 343 HG1 THR 112 HG1 THR 112 -6.982 -19.350 -1.327 344 HG21 THR 112 HG21 THR 112 -6.131 -20.722 1.822 345 HG22 THR 112 HG22 THR 112 -6.566 -21.667 0.382 346 HG23 THR 112 HG23 THR 112 -5.455 -20.292 0.240 347 H LEU 113 H LEU 113 -10.546 -19.707 -0.548 348 HA LEU 113 HA LEU 113 -11.396 -17.044 0.385 349 HB2 LEU 113 HB2 LEU 113 -12.433 -18.739 -1.919 350 HB3 LEU 113 HB3 LEU 113 -12.720 -17.017 -1.674 351 HG LEU 113 HG LEU 113 -10.008 -18.292 -2.207 352 HD11 LEU 113 HD11 LEU 113 -10.188 -17.249 -4.433 353 HD12 LEU 113 HD12 LEU 113 -11.511 -18.393 -4.154 354 HD13 LEU 113 HD13 LEU 113 -11.811 -16.641 -4.032 355 HD21 LEU 113 HD21 LEU 113 -10.818 -15.358 -2.059 356 HD22 LEU 113 HD22 LEU 113 -9.732 -16.213 -0.936 357 HD23 LEU 113 HD23 LEU 113 -9.237 -15.954 -2.610 358 H GLU 114 H GLU 114 -12.487 -20.260 0.749 359 HA GLU 114 HA GLU 114 -14.374 -21.264 1.527 360 HB2 GLU 114 HB2 GLU 114 -14.739 -20.826 3.825 361 HB3 GLU 114 HB3 GLU 114 -13.028 -20.683 3.400 362 HG2 GLU 114 HG2 GLU 114 -13.202 -18.213 3.493 363 HG3 GLU 114 HG3 GLU 114 -14.918 -18.352 3.895 364 H HIS 115 H HIS 115 -15.261 -19.875 -0.546 365 HA HIS 115 HA HIS 115 -17.303 -18.009 -0.206 366 HB2 HIS 115 HB2 HIS 115 -16.250 -18.681 -2.354 367 HB3 HIS 115 HB3 HIS 115 -17.139 -20.199 -2.337 368 HD1 HIS 115 HD1 HIS 115 -19.555 -20.068 -3.436 369 HD2 HIS 115 HD2 HIS 115 -17.769 -16.344 -2.536 370 HE1 HIS 115 HE1 HIS 115 -21.072 -18.264 -4.465 371 HE2 HIS 115 HE2 HIS 115 -19.967 -15.995 -3.929 372 H HIS 116 H HIS 116 -17.671 -21.531 0.081 373 HA HIS 116 HA HIS 116 -20.499 -21.652 0.416 374 HB2 HIS 116 HB2 HIS 116 -20.111 -23.833 1.419 375 HB3 HIS 116 HB3 HIS 116 -19.099 -23.614 0.007 376 HD1 HIS 116 HD1 HIS 116 -18.839 -23.986 3.823 377 HD2 HIS 116 HD2 HIS 116 -16.438 -23.739 0.349 378 HE1 HIS 116 HE1 HIS 116 -16.450 -24.603 4.544 379 HE2 HIS 116 HE2 HIS 116 -14.993 -24.463 2.425 380 H HIS 117 H HIS 117 -18.068 -20.617 2.744 381 HA HIS 117 HA HIS 117 -20.077 -20.422 4.940 382 HB2 HIS 117 HB2 HIS 117 -17.860 -21.368 5.427 383 HB3 HIS 117 HB3 HIS 117 -17.075 -19.894 4.861 384 HD1 HIS 117 HD1 HIS 117 -16.069 -18.966 7.058 385 HD2 HIS 117 HD2 HIS 117 -20.107 -20.194 7.367 386 HE1 HIS 117 HE1 HIS 117 -16.880 -18.259 9.411 387 HE2 HIS 117 HE2 HIS 117 -19.336 -19.014 9.585 388 H HIS 118 H HIS 118 -18.039 -18.223 2.929 389 HA HIS 118 HA HIS 118 -19.057 -15.819 4.165 390 HB2 HIS 118 HB2 HIS 118 -17.620 -16.326 1.529 391 HB3 HIS 118 HB3 HIS 118 -18.107 -14.720 2.054 392 HD1 HIS 118 HD1 HIS 118 -15.000 -16.331 1.945 393 HD2 HIS 118 HD2 HIS 118 -17.283 -14.514 5.019 394 HE1 HIS 118 HE1 HIS 118 -13.338 -15.545 3.740 395 HE2 HIS 118 HE2 HIS 118 -14.732 -14.476 5.621 396 H HIS 119 H HIS 119 -20.312 -17.635 1.372 397 HA HIS 119 HA HIS 119 -22.279 -15.541 0.718 398 HB2 HIS 119 HB2 HIS 119 -21.159 -16.927 -1.020 399 HB3 HIS 119 HB3 HIS 119 -21.929 -18.370 -0.363 400 HD1 HIS 119 HD1 HIS 119 -22.963 -15.035 -2.085 401 HD2 HIS 119 HD2 HIS 119 -24.347 -18.941 -1.231 402 HE1 HIS 119 HE1 HIS 119 -25.207 -15.308 -3.324 403 HE2 HIS 119 HE2 HIS 119 -26.044 -17.685 -2.798 404 H HIS 120 H HIS 120 -24.557 -15.818 0.773 405 HA HIS 120 HA HIS 120 -25.762 -17.972 2.394 406 HB2 HIS 120 HB2 HIS 120 -25.231 -16.166 4.015 407 HB3 HIS 120 HB3 HIS 120 -26.125 -15.011 3.034 408 HD1 HIS 120 HD1 HIS 120 -26.755 -18.075 5.299 409 HD2 HIS 120 HD2 HIS 120 -28.779 -14.985 3.254 410 HE1 HIS 120 HE1 HIS 120 -29.193 -18.133 6.132 411 HE2 HIS 120 HE2 HIS 120 -30.423 -16.238 4.884 Start of MODEL 16 1 H1 SER 66 H1 SER 66 17.962 -19.512 -27.777 2 H2 SER 66 H2 SER 66 17.970 -20.497 -29.078 3 H3 SER 66 H3 SER 66 18.421 -18.931 -29.237 4 HA SER 66 HA SER 66 16.236 -19.219 -30.157 5 HB2 SER 66 HB2 SER 66 15.446 -20.205 -27.384 6 HB3 SER 66 HB3 SER 66 14.370 -19.984 -28.776 7 HG SER 66 HG SER 66 15.087 -22.166 -28.576 8 H GLY 67 H GLY 67 14.491 -17.634 -29.927 9 HA2 GLY 67 HA2 GLY 67 13.520 -15.662 -29.324 10 HA3 GLY 67 HA3 GLY 67 14.060 -16.002 -27.679 11 H SER 68 H SER 68 16.434 -15.486 -30.232 12 HA SER 68 HA SER 68 18.247 -14.144 -30.285 13 HB2 SER 68 HB2 SER 68 16.298 -11.910 -29.656 14 HB3 SER 68 HB3 SER 68 17.902 -11.743 -30.390 15 HG SER 68 HG SER 68 16.256 -11.783 -31.986 16 H GLY 69 H GLY 69 17.649 -15.357 -27.627 17 HA2 GLY 69 HA2 GLY 69 18.706 -15.450 -25.597 18 HA3 GLY 69 HA3 GLY 69 19.782 -14.160 -26.124 19 H ARG 70 H ARG 70 16.392 -13.368 -26.183 20 HA ARG 70 HA ARG 70 16.815 -11.225 -24.259 21 HB2 ARG 70 HB2 ARG 70 14.341 -12.143 -25.775 22 HB3 ARG 70 HB3 ARG 70 14.420 -10.680 -24.785 23 HG2 ARG 70 HG2 ARG 70 16.163 -9.716 -26.187 24 HG3 ARG 70 HG3 ARG 70 16.258 -11.172 -27.182 25 HD2 ARG 70 HD2 ARG 70 13.779 -9.438 -26.902 26 HD3 ARG 70 HD3 ARG 70 14.961 -9.318 -28.222 27 HE ARG 70 HE ARG 70 14.169 -12.019 -28.123 28 HH11 ARG 70 HH11 ARG 70 12.610 -8.955 -28.858 29 HH12 ARG 70 HH12 ARG 70 11.415 -9.698 -29.883 30 HH21 ARG 70 HH21 ARG 70 12.580 -12.905 -29.415 31 HH22 ARG 70 HH22 ARG 70 11.414 -11.885 -30.206 32 H GLY 71 H GLY 71 15.937 -10.804 -22.335 33 HA2 GLY 71 HA2 GLY 71 15.414 -13.016 -20.554 34 HA3 GLY 71 HA3 GLY 71 15.334 -11.305 -20.152 35 H ARG 72 H ARG 72 13.596 -13.779 -19.749 36 HA ARG 72 HA ARG 72 10.943 -12.459 -20.211 37 HB2 ARG 72 HB2 ARG 72 11.571 -15.418 -20.587 38 HB3 ARG 72 HB3 ARG 72 9.951 -14.716 -20.577 39 HG2 ARG 72 HG2 ARG 72 10.556 -13.298 -22.544 40 HG3 ARG 72 HG3 ARG 72 12.137 -14.092 -22.617 41 HD2 ARG 72 HD2 ARG 72 9.451 -15.497 -22.857 42 HD3 ARG 72 HD3 ARG 72 10.477 -15.026 -24.223 43 HE ARG 72 HE ARG 72 12.148 -16.559 -22.624 44 HH11 ARG 72 HH11 ARG 72 9.124 -17.215 -24.277 45 HH12 ARG 72 HH12 ARG 72 9.468 -18.913 -24.429 46 HH21 ARG 72 HH21 ARG 72 12.509 -18.747 -22.820 47 HH22 ARG 72 HH22 ARG 72 11.348 -19.753 -23.630 48 H GLY 73 H GLY 73 9.369 -12.825 -18.659 49 HA2 GLY 73 HA2 GLY 73 10.317 -13.158 -15.933 50 HA3 GLY 73 HA3 GLY 73 8.657 -12.855 -16.441 51 H ALA 74 H ALA 74 9.675 -14.683 -14.394 52 HA ALA 74 HA ALA 74 8.144 -17.087 -15.133 53 HB1 ALA 74 HB1 ALA 74 10.457 -17.655 -15.829 54 HB2 ALA 74 HB2 ALA 74 11.050 -17.241 -14.204 55 HB3 ALA 74 HB3 ALA 74 9.960 -18.620 -14.426 56 H ILE 75 H ILE 75 7.533 -18.380 -13.344 57 HA ILE 75 HA ILE 75 7.311 -16.889 -10.783 58 HB ILE 75 HB ILE 75 5.839 -19.283 -11.912 59 HG12 ILE 75 HG12 ILE 75 3.817 -17.884 -11.484 60 HG13 ILE 75 HG13 ILE 75 4.840 -16.548 -10.970 61 HG21 ILE 75 HG21 ILE 75 4.483 -19.318 -9.838 62 HG22 ILE 75 HG22 ILE 75 6.144 -19.783 -9.540 63 HG23 ILE 75 HG23 ILE 75 5.596 -18.148 -9.093 64 HD11 ILE 75 HD11 ILE 75 3.881 -16.380 -13.288 65 HD12 ILE 75 HD12 ILE 75 5.638 -16.229 -13.241 66 HD13 ILE 75 HD13 ILE 75 4.889 -17.756 -13.769 67 H ASP 76 H ASP 76 8.284 -17.553 -8.923 68 HA ASP 76 HA ASP 76 10.540 -19.391 -9.239 69 HB2 ASP 76 HB2 ASP 76 10.720 -17.089 -8.310 70 HB3 ASP 76 HB3 ASP 76 9.798 -17.610 -6.898 71 H ARG 77 H ARG 77 8.246 -20.806 -9.326 72 HA ARG 77 HA ARG 77 6.784 -22.306 -8.493 73 HB2 ARG 77 HB2 ARG 77 7.746 -24.327 -7.703 74 HB3 ARG 77 HB3 ARG 77 8.770 -23.614 -8.938 75 HG2 ARG 77 HG2 ARG 77 10.397 -22.897 -7.247 76 HG3 ARG 77 HG3 ARG 77 9.307 -23.382 -5.942 77 HD2 ARG 77 HD2 ARG 77 10.991 -25.064 -6.168 78 HD3 ARG 77 HD3 ARG 77 9.452 -25.738 -6.728 79 HE ARG 77 HE ARG 77 10.901 -24.634 -8.955 80 HH11 ARG 77 HH21 ARG 77 11.108 -27.405 -6.824 81 HH12 ARG 77 HH22 ARG 77 11.942 -28.375 -8.011 82 HH21 ARG 77 HH11 ARG 77 11.961 -25.922 -10.423 83 HH22 ARG 77 HH12 ARG 77 12.422 -27.541 -9.992 84 H GLU 78 H GLU 78 7.092 -19.970 -6.588 85 HA GLU 78 HA GLU 78 6.738 -20.931 -3.942 86 HB2 GLU 78 HB2 GLU 78 6.038 -18.336 -5.331 87 HB3 GLU 78 HB3 GLU 78 5.600 -18.597 -3.641 88 HG2 GLU 78 HG2 GLU 78 8.445 -18.958 -4.637 89 HG3 GLU 78 HG3 GLU 78 7.816 -17.402 -4.107 90 H GLN 79 H GLN 79 4.160 -19.828 -6.215 91 HA GLN 79 HA GLN 79 2.055 -20.595 -4.414 92 HB2 GLN 79 HB2 GLN 79 0.528 -20.132 -6.221 93 HB3 GLN 79 HB3 GLN 79 1.733 -18.857 -6.056 94 HG2 GLN 79 HG2 GLN 79 2.947 -19.786 -8.046 95 HG3 GLN 79 HG3 GLN 79 1.697 -21.026 -8.205 96 HE21 GLN 79 HE22 GLN 79 2.190 -17.435 -8.273 97 HE22 GLN 79 HE21 GLN 79 0.807 -17.164 -9.321 98 H SER 80 H SER 80 3.574 -22.357 -7.138 99 HA SER 80 HA SER 80 1.711 -24.549 -7.101 100 HB2 SER 80 HB2 SER 80 3.503 -25.744 -8.386 101 HB3 SER 80 HB3 SER 80 2.970 -24.197 -9.074 102 HG SER 80 HG SER 80 5.280 -24.443 -9.034 103 H ALA 81 H ALA 81 4.952 -24.155 -5.495 104 HA ALA 81 HA ALA 81 4.876 -26.596 -4.126 105 HB1 ALA 81 HB1 ALA 81 6.512 -25.553 -2.600 106 HB2 ALA 81 HB2 ALA 81 6.879 -25.187 -4.296 107 HB3 ALA 81 HB3 ALA 81 6.113 -23.952 -3.258 108 H ALA 82 H ALA 82 3.432 -23.436 -3.127 109 HA ALA 82 HA ALA 82 2.494 -24.326 -0.585 110 HB1 ALA 82 HB1 ALA 82 1.362 -22.182 -2.435 111 HB2 ALA 82 HB2 ALA 82 1.018 -22.361 -0.706 112 HB3 ALA 82 HB3 ALA 82 2.657 -21.955 -1.239 113 H ILE 83 H ILE 83 0.817 -24.325 -3.774 114 HA ILE 83 HA ILE 83 -1.612 -25.543 -2.860 115 HB ILE 83 HB ILE 83 -0.295 -25.560 -5.597 116 HG12 ILE 83 HG12 ILE 83 -2.703 -23.928 -4.735 117 HG13 ILE 83 HG13 ILE 83 -1.087 -23.309 -4.458 118 HG21 ILE 83 HG21 ILE 83 -1.953 -27.415 -5.448 119 HG22 ILE 83 HG22 ILE 83 -3.162 -26.291 -4.806 120 HG23 ILE 83 HG23 ILE 83 -2.576 -26.126 -6.470 121 HD11 ILE 83 HD11 ILE 83 -0.630 -23.510 -6.925 122 HD12 ILE 83 HD12 ILE 83 -2.332 -23.969 -7.156 123 HD13 ILE 83 HD13 ILE 83 -1.931 -22.375 -6.508 124 H ARG 84 H ARG 84 1.374 -27.032 -4.233 125 HA ARG 84 HA ARG 84 0.529 -29.754 -4.078 126 HB2 ARG 84 HB2 ARG 84 2.596 -28.872 -5.279 127 HB3 ARG 84 HB3 ARG 84 3.351 -28.625 -3.714 128 HG2 ARG 84 HG2 ARG 84 2.652 -31.302 -3.506 129 HG3 ARG 84 HG3 ARG 84 2.831 -31.136 -5.251 130 HD2 ARG 84 HD2 ARG 84 4.946 -31.821 -4.414 131 HD3 ARG 84 HD3 ARG 84 5.113 -30.109 -4.831 132 HE ARG 84 HE ARG 84 4.384 -30.650 -2.011 133 HH11 ARG 84 HH11 ARG 84 7.141 -30.267 -4.144 134 HH12 ARG 84 HH12 ARG 84 8.221 -29.926 -2.826 135 HH21 ARG 84 HH21 ARG 84 5.822 -30.244 -0.360 136 HH22 ARG 84 HH22 ARG 84 7.488 -29.905 -0.751 137 H GLU 85 H GLU 85 2.429 -27.865 -1.640 138 HA GLU 85 HA GLU 85 2.488 -29.971 0.203 139 HB2 GLU 85 HB2 GLU 85 4.010 -27.970 0.083 140 HB3 GLU 85 HB3 GLU 85 2.719 -27.055 0.886 141 HG2 GLU 85 HG2 GLU 85 4.187 -27.809 2.601 142 HG3 GLU 85 HG3 GLU 85 2.739 -28.818 2.691 143 H TRP 86 H TRP 86 0.099 -27.269 0.019 144 HA TRP 86 HA TRP 86 -1.476 -28.053 2.176 145 HB2 TRP 86 HB2 TRP 86 -1.887 -25.974 1.058 146 HB3 TRP 86 HB3 TRP 86 -2.187 -26.780 -0.481 147 HD1 TRP 86 HD1 TRP 86 -3.827 -26.169 2.926 148 HE1 TRP 86 HE1 TRP 86 -6.341 -26.674 2.788 149 HE3 TRP 86 HE3 TRP 86 -4.039 -27.947 -1.881 150 HZ2 TRP 86 HZ2 TRP 86 -8.169 -27.875 0.909 151 HZ3 TRP 86 HZ3 TRP 86 -6.196 -28.721 -2.832 152 HH2 TRP 86 HH2 TRP 86 -8.254 -28.722 -1.435 153 H ALA 87 H ALA 87 -1.710 -29.163 -1.256 154 HA ALA 87 HA ALA 87 -3.838 -30.994 -0.842 155 HB1 ALA 87 HB1 ALA 87 -3.194 -30.158 -3.034 156 HB2 ALA 87 HB2 ALA 87 -1.592 -30.896 -2.912 157 HB3 ALA 87 HB3 ALA 87 -3.030 -31.926 -3.048 158 H ARG 88 H ARG 88 -0.305 -31.546 -0.731 159 HA ARG 88 HA ARG 88 -0.341 -34.346 -0.247 160 HB2 ARG 88 HB2 ARG 88 1.581 -32.875 -1.008 161 HB3 ARG 88 HB3 ARG 88 1.768 -32.324 0.660 162 HG2 ARG 88 HG2 ARG 88 2.222 -34.708 1.340 163 HG3 ARG 88 HG3 ARG 88 2.008 -35.195 -0.353 164 HD2 ARG 88 HD2 ARG 88 4.340 -35.020 -0.130 165 HD3 ARG 88 HD3 ARG 88 3.888 -33.524 -0.921 166 HE ARG 88 HE ARG 88 4.460 -32.288 1.013 167 HH11 ARG 88 HH11 ARG 88 4.825 -35.722 1.718 168 HH12 ARG 88 HH12 ARG 88 5.732 -35.406 3.170 169 HH21 ARG 88 HH21 ARG 88 5.475 -31.974 2.923 170 HH22 ARG 88 HH22 ARG 88 6.125 -33.333 3.817 171 H ARG 89 H ARG 89 -0.278 -31.643 2.113 172 HA ARG 89 HA ARG 89 -0.313 -33.420 4.435 173 HB2 ARG 89 HB2 ARG 89 -0.760 -30.418 4.151 174 HB3 ARG 89 HB3 ARG 89 -0.707 -31.280 5.696 175 HG2 ARG 89 HG2 ARG 89 1.583 -32.117 5.161 176 HG3 ARG 89 HG3 ARG 89 1.559 -31.181 3.662 177 HD2 ARG 89 HD2 ARG 89 1.200 -29.097 5.047 178 HD3 ARG 89 HD3 ARG 89 1.432 -30.101 6.498 179 HE ARG 89 HE ARG 89 3.582 -30.301 4.481 180 HH11 ARG 89 HH11 ARG 89 2.678 -28.508 7.376 181 HH12 ARG 89 HH12 ARG 89 4.313 -27.952 7.600 182 HH21 ARG 89 HH21 ARG 89 5.475 -29.540 4.745 183 HH22 ARG 89 HH22 ARG 89 5.920 -28.555 6.138 184 H ASN 90 H ASN 90 -2.864 -32.098 2.458 185 HA ASN 90 HA ASN 90 -4.937 -33.095 4.345 186 HB2 ASN 90 HB2 ASN 90 -5.074 -31.504 1.757 187 HB3 ASN 90 HB3 ASN 90 -6.493 -32.188 2.540 188 HD21 ASN 90 HD22 ASN 90 -3.974 -29.748 2.874 189 HD22 ASN 90 HD21 ASN 90 -4.760 -28.913 4.219 190 H GLY 91 H GLY 91 -2.940 -34.699 2.313 191 HA2 GLY 91 HA2 GLY 91 -2.987 -36.866 1.582 192 HA3 GLY 91 HA3 GLY 91 -4.594 -37.048 2.286 193 H HIS 92 H HIS 92 -4.213 -34.526 -0.108 194 HA HIS 92 HA HIS 92 -6.028 -35.948 -1.970 195 HB2 HIS 92 HB2 HIS 92 -4.845 -33.147 -2.134 196 HB3 HIS 92 HB3 HIS 92 -6.154 -33.786 -3.123 197 HD1 HIS 92 HD1 HIS 92 -7.682 -35.050 -0.348 198 HD2 HIS 92 HD2 HIS 92 -6.439 -31.126 -1.317 199 HE1 HIS 92 HE1 HIS 92 -9.138 -33.461 1.051 200 HE2 HIS 92 HE2 HIS 92 -8.386 -31.073 0.448 201 H ASN 93 H ASN 93 -5.559 -36.302 -4.192 202 HA ASN 93 HA ASN 93 -2.908 -37.314 -4.683 203 HB2 ASN 93 HB2 ASN 93 -4.993 -38.314 -5.558 204 HB3 ASN 93 HB3 ASN 93 -5.252 -36.901 -6.584 205 HD21 ASN 93 HD22 ASN 93 -5.310 -38.860 -8.157 206 HD22 ASN 93 HD21 ASN 93 -3.765 -39.261 -8.892 207 H VAL 94 H VAL 94 -1.148 -36.174 -5.236 208 HA VAL 94 HA VAL 94 -1.238 -34.206 -7.388 209 HB VAL 94 HB VAL 94 -1.689 -32.842 -5.356 210 HG11 VAL 94 HG11 VAL 94 0.074 -32.353 -3.740 211 HG12 VAL 94 HG12 VAL 94 -0.345 -34.071 -3.684 212 HG13 VAL 94 HG13 VAL 94 1.145 -33.541 -4.491 213 HG21 VAL 94 HG21 VAL 94 -0.183 -31.059 -5.892 214 HG22 VAL 94 HG22 VAL 94 0.994 -32.174 -6.616 215 HG23 VAL 94 HG23 VAL 94 -0.592 -31.910 -7.386 216 H SER 95 H SER 95 0.760 -33.983 -8.472 217 HA SER 95 HA SER 95 2.619 -36.198 -8.121 218 HB2 SER 95 HB2 SER 95 1.986 -35.314 -10.351 219 HB3 SER 95 HB3 SER 95 2.816 -33.797 -9.961 220 HG SER 95 HG SER 95 3.887 -36.374 -10.439 221 H THR 96 H THR 96 4.855 -36.090 -7.739 222 HA THR 96 HA THR 96 5.839 -33.955 -5.944 223 HB THR 96 HB THR 96 7.882 -35.389 -5.854 224 HG1 THR 96 HG1 THR 96 7.728 -37.456 -6.802 225 HG21 THR 96 HG21 THR 96 5.298 -36.907 -5.274 226 HG22 THR 96 HG22 THR 96 6.897 -37.206 -4.552 227 HG23 THR 96 HG23 THR 96 6.044 -35.694 -4.210 228 H ARG 97 H ARG 97 5.917 -34.655 -9.327 229 HA ARG 97 HA ARG 97 7.986 -32.535 -9.787 230 HB2 ARG 97 HB2 ARG 97 9.218 -33.940 -11.339 231 HB3 ARG 97 HB3 ARG 97 9.186 -34.654 -9.731 232 HG2 ARG 97 HG2 ARG 97 7.389 -36.236 -10.473 233 HG3 ARG 97 HG3 ARG 97 7.459 -35.523 -12.099 234 HD2 ARG 97 HD2 ARG 97 9.840 -36.176 -12.286 235 HD3 ARG 97 HD3 ARG 97 9.769 -36.884 -10.656 236 HE ARG 97 HE ARG 97 7.698 -38.056 -12.213 237 HH11 ARG 97 HH11 ARG 97 11.203 -38.127 -12.139 238 HH12 ARG 97 HH12 ARG 97 11.279 -39.718 -12.854 239 HH21 ARG 97 HH21 ARG 97 7.862 -40.083 -13.100 240 HH22 ARG 97 HH22 ARG 97 9.424 -40.800 -13.370 241 H GLY 98 H GLY 98 5.168 -34.192 -11.053 242 HA2 GLY 98 HA2 GLY 98 5.169 -32.794 -13.636 243 HA3 GLY 98 HA3 GLY 98 3.923 -33.846 -12.979 244 H ARG 99 H ARG 99 2.790 -31.948 -14.152 245 HA ARG 99 HA ARG 99 2.403 -29.464 -12.650 246 HB2 ARG 99 HB2 ARG 99 0.844 -30.715 -14.954 247 HB3 ARG 99 HB3 ARG 99 0.526 -29.113 -14.281 248 HG2 ARG 99 HG2 ARG 99 2.844 -28.401 -14.842 249 HG3 ARG 99 HG3 ARG 99 3.144 -29.973 -15.596 250 HD2 ARG 99 HD2 ARG 99 0.992 -27.986 -16.446 251 HD3 ARG 99 HD3 ARG 99 2.551 -28.156 -17.233 252 HE ARG 99 HE ARG 99 0.226 -29.935 -17.448 253 HH11 ARG 99 HH11 ARG 99 3.670 -29.738 -18.107 254 HH12 ARG 99 HH12 ARG 99 3.604 -31.016 -19.289 255 HH21 ARG 99 HH21 ARG 99 0.219 -31.556 -18.956 256 HH22 ARG 99 HH22 ARG 99 1.694 -32.014 -19.758 257 H ILE 100 H ILE 100 0.453 -28.760 -11.682 258 HA ILE 100 HA ILE 100 -0.817 -30.828 -10.011 259 HB ILE 100 HB ILE 100 -1.047 -27.815 -9.884 260 HG12 ILE 100 HG12 ILE 100 0.653 -29.860 -8.379 261 HG13 ILE 100 HG13 ILE 100 1.220 -28.545 -9.406 262 HG21 ILE 100 HG21 ILE 100 -2.097 -28.189 -7.693 263 HG22 ILE 100 HG22 ILE 100 -3.050 -28.970 -8.925 264 HG23 ILE 100 HG23 ILE 100 -1.976 -29.944 -7.889 265 HD11 ILE 100 HD11 ILE 100 1.604 -27.868 -7.185 266 HD12 ILE 100 HD12 ILE 100 0.222 -26.913 -7.756 267 HD13 ILE 100 HD13 ILE 100 -0.034 -28.310 -6.669 268 HA PRO 101 HA PRO 101 -4.471 -30.893 -12.667 269 HB2 PRO 101 HB2 PRO 101 -5.990 -31.788 -10.249 270 HB3 PRO 101 HB3 PRO 101 -5.854 -32.567 -11.849 271 HG2 PRO 101 HG2 PRO 101 -4.539 -33.547 -9.662 272 HG3 PRO 101 HG3 PRO 101 -3.779 -33.557 -11.292 273 HD2 PRO 101 HD2 PRO 101 -3.346 -31.597 -9.027 274 HD3 PRO 101 HD3 PRO 101 -2.150 -32.393 -10.094 275 H ALA 102 H ALA 102 -6.034 -29.374 -13.184 276 HA ALA 102 HA ALA 102 -6.240 -27.002 -11.735 277 HB1 ALA 102 HB1 ALA 102 -6.664 -27.242 -14.140 278 HB2 ALA 102 HB2 ALA 102 -8.189 -28.098 -13.778 279 HB3 ALA 102 HB3 ALA 102 -7.972 -26.397 -13.288 280 H ASP 103 H ASP 103 -8.325 -29.881 -11.521 281 HA ASP 103 HA ASP 103 -10.341 -28.855 -9.928 282 HB2 ASP 103 HB2 ASP 103 -10.319 -31.088 -10.974 283 HB3 ASP 103 HB3 ASP 103 -9.062 -31.611 -9.851 284 H VAL 104 H VAL 104 -7.059 -29.899 -8.981 285 HA VAL 104 HA VAL 104 -7.535 -29.605 -6.146 286 HB VAL 104 HB VAL 104 -4.931 -29.961 -7.600 287 HG11 VAL 104 HG11 VAL 104 -4.064 -30.803 -5.439 288 HG12 VAL 104 HG12 VAL 104 -4.542 -29.108 -5.338 289 HG13 VAL 104 HG13 VAL 104 -5.604 -30.370 -4.666 290 HG21 VAL 104 HG21 VAL 104 -6.680 -32.056 -6.237 291 HG22 VAL 104 HG22 VAL 104 -6.433 -31.911 -7.985 292 HG23 VAL 104 HG23 VAL 104 -5.076 -32.344 -6.951 293 H ILE 105 H ILE 105 -6.030 -27.633 -8.737 294 HA ILE 105 HA ILE 105 -5.211 -25.441 -7.059 295 HB ILE 105 HB ILE 105 -6.074 -25.644 -9.968 296 HG12 ILE 105 HG12 ILE 105 -3.292 -24.931 -8.996 297 HG13 ILE 105 HG13 ILE 105 -3.793 -26.602 -8.814 298 HG21 ILE 105 HG21 ILE 105 -4.964 -23.206 -8.504 299 HG22 ILE 105 HG22 ILE 105 -5.026 -23.381 -10.274 300 HG23 ILE 105 HG23 ILE 105 -6.527 -23.342 -9.343 301 HD11 ILE 105 HD11 ILE 105 -2.565 -26.181 -10.920 302 HD12 ILE 105 HD12 ILE 105 -4.183 -26.866 -11.144 303 HD13 ILE 105 HD13 ILE 105 -3.889 -25.137 -11.471 304 H ASP 106 H ASP 106 -8.371 -26.031 -8.734 305 HA ASP 106 HA ASP 106 -9.727 -23.875 -7.612 306 HB2 ASP 106 HB2 ASP 106 -10.536 -25.211 -9.506 307 HB3 ASP 106 HB3 ASP 106 -10.808 -26.586 -8.437 308 H ALA 107 H ALA 107 -9.442 -27.249 -6.323 309 HA ALA 107 HA ALA 107 -10.881 -26.952 -4.005 310 HB1 ALA 107 HB1 ALA 107 -9.622 -28.892 -3.208 311 HB2 ALA 107 HB2 ALA 107 -9.945 -29.080 -4.931 312 HB3 ALA 107 HB3 ALA 107 -8.329 -28.594 -4.389 313 H TYR 108 H TYR 108 -7.412 -26.156 -4.493 314 HA TYR 108 HA TYR 108 -6.885 -25.186 -1.850 315 HB2 TYR 108 HB2 TYR 108 -5.139 -25.822 -3.408 316 HB3 TYR 108 HB3 TYR 108 -5.608 -24.572 -4.543 317 HD1 TYR 108 HD1 TYR 108 -3.891 -25.280 -1.368 318 HD2 TYR 108 HD2 TYR 108 -5.052 -22.206 -4.153 319 HE1 TYR 108 HE1 TYR 108 -2.206 -23.741 -0.368 320 HE2 TYR 108 HE2 TYR 108 -3.389 -20.659 -3.144 321 HH TYR 108 HH TYR 108 -1.745 -20.389 -1.547 322 H HIS 109 H HIS 109 -7.938 -23.396 -4.834 323 HA HIS 109 HA HIS 109 -8.117 -20.819 -3.575 324 HB2 HIS 109 HB2 HIS 109 -9.718 -21.976 -5.901 325 HB3 HIS 109 HB3 HIS 109 -9.712 -20.285 -5.424 326 HD1 HIS 109 HD1 HIS 109 -8.735 -21.225 -8.308 327 HD2 HIS 109 HD2 HIS 109 -6.355 -20.244 -4.959 328 HE1 HIS 109 HE1 HIS 109 -6.438 -20.494 -9.229 329 HE2 HIS 109 HE2 HIS 109 -4.999 -19.908 -7.176 330 H ALA 110 H ALA 110 -10.588 -23.449 -3.713 331 HA ALA 110 HA ALA 110 -12.563 -21.975 -2.271 332 HB1 ALA 110 HB1 ALA 110 -13.569 -24.177 -1.847 333 HB2 ALA 110 HB2 ALA 110 -13.052 -24.029 -3.539 334 HB3 ALA 110 HB3 ALA 110 -12.085 -24.985 -2.396 335 H ALA 111 H ALA 111 -10.119 -24.358 -1.001 336 HA ALA 111 HA ALA 111 -10.828 -24.106 1.649 337 HB1 ALA 111 HB1 ALA 111 -8.106 -24.721 0.429 338 HB2 ALA 111 HB2 ALA 111 -8.620 -25.150 2.078 339 HB3 ALA 111 HB3 ALA 111 -9.432 -25.883 0.677 340 H THR 112 H THR 112 -8.564 -22.115 -0.183 341 HA THR 112 HA THR 112 -7.627 -20.626 2.166 342 HB THR 112 HB THR 112 -6.325 -19.283 0.534 343 HG1 THR 112 HG1 THR 112 -7.154 -21.194 -1.360 344 HG21 THR 112 HG21 THR 112 -5.363 -21.296 1.563 345 HG22 THR 112 HG22 THR 112 -6.002 -22.306 0.253 346 HG23 THR 112 HG23 THR 112 -4.776 -21.060 -0.086 347 H LEU 113 H LEU 113 -10.376 -20.176 0.166 348 HA LEU 113 HA LEU 113 -10.603 -17.303 1.048 349 HB2 LEU 113 HB2 LEU 113 -11.753 -18.612 -1.443 350 HB3 LEU 113 HB3 LEU 113 -11.924 -16.924 -0.988 351 HG LEU 113 HG LEU 113 -9.279 -18.275 -1.660 352 HD11 LEU 113 HD11 LEU 113 -10.790 -18.103 -3.611 353 HD12 LEU 113 HD12 LEU 113 -10.992 -16.364 -3.309 354 HD13 LEU 113 HD13 LEU 113 -9.399 -17.016 -3.765 355 HD21 LEU 113 HD21 LEU 113 -8.402 -15.959 -1.809 356 HD22 LEU 113 HD22 LEU 113 -9.963 -15.324 -1.258 357 HD23 LEU 113 HD23 LEU 113 -8.964 -16.321 -0.177 358 H GLU 114 H GLU 114 -12.460 -20.255 0.433 359 HA GLU 114 HA GLU 114 -14.888 -19.054 1.584 360 HB2 GLU 114 HB2 GLU 114 -14.387 -21.670 0.142 361 HB3 GLU 114 HB3 GLU 114 -15.950 -21.239 0.805 362 HG2 GLU 114 HG2 GLU 114 -14.536 -19.412 -1.166 363 HG3 GLU 114 HG3 GLU 114 -15.511 -20.776 -1.678 364 H HIS 115 H HIS 115 -12.378 -20.382 3.111 365 HA HIS 115 HA HIS 115 -13.395 -22.176 5.018 366 HB2 HIS 115 HB2 HIS 115 -11.610 -21.157 6.532 367 HB3 HIS 115 HB3 HIS 115 -11.084 -21.772 4.982 368 HD1 HIS 115 HD1 HIS 115 -12.547 -18.192 5.351 369 HD2 HIS 115 HD2 HIS 115 -8.947 -20.300 4.688 370 HE1 HIS 115 HE1 HIS 115 -10.792 -16.432 4.652 371 HE2 HIS 115 HE2 HIS 115 -8.605 -17.731 4.233 372 H HIS 116 H HIS 116 -14.648 -22.093 6.773 373 HA HIS 116 HA HIS 116 -16.254 -21.460 8.227 374 HB2 HIS 116 HB2 HIS 116 -14.707 -18.868 8.552 375 HB3 HIS 116 HB3 HIS 116 -15.733 -19.661 9.738 376 HD1 HIS 116 HD1 HIS 116 -14.704 -22.329 10.383 377 HD2 HIS 116 HD2 HIS 116 -12.179 -19.273 8.910 378 HE1 HIS 116 HE1 HIS 116 -12.302 -23.005 11.008 379 HE2 HIS 116 HE2 HIS 116 -10.770 -21.139 10.114 380 H HIS 117 H HIS 117 -16.825 -20.617 5.375 381 HA HIS 117 HA HIS 117 -18.872 -18.480 5.883 382 HB2 HIS 117 HB2 HIS 117 -17.829 -19.661 3.285 383 HB3 HIS 117 HB3 HIS 117 -19.048 -18.406 3.408 384 HD1 HIS 117 HD1 HIS 117 -16.677 -17.612 1.746 385 HD2 HIS 117 HD2 HIS 117 -16.909 -17.088 5.942 386 HE1 HIS 117 HE1 HIS 117 -15.010 -15.742 2.351 387 HE2 HIS 117 HE2 HIS 117 -15.173 -15.424 4.905 388 H HIS 118 H HIS 118 -18.924 -21.777 6.167 389 HA HIS 118 HA HIS 118 -21.219 -22.463 4.572 390 HB2 HIS 118 HB2 HIS 118 -19.421 -24.030 5.255 391 HB3 HIS 118 HB3 HIS 118 -19.963 -23.933 6.931 392 HD1 HIS 118 HD1 HIS 118 -21.312 -25.139 3.488 393 HD2 HIS 118 HD2 HIS 118 -21.826 -25.649 7.653 394 HE1 HIS 118 HE1 HIS 118 -22.980 -27.079 3.787 395 HE2 HIS 118 HE2 HIS 118 -23.280 -27.387 6.328 396 H HIS 119 H HIS 119 -21.025 -21.206 7.841 397 HA HIS 119 HA HIS 119 -23.653 -22.028 8.728 398 HB2 HIS 119 HB2 HIS 119 -23.262 -20.532 10.621 399 HB3 HIS 119 HB3 HIS 119 -21.845 -21.515 10.304 400 HD1 HIS 119 HD1 HIS 119 -23.056 -17.841 9.830 401 HD2 HIS 119 HD2 HIS 119 -19.566 -20.247 9.855 402 HE1 HIS 119 HE1 HIS 119 -21.052 -16.232 9.688 403 HE2 HIS 119 HE2 HIS 119 -18.929 -17.710 9.664 404 H HIS 120 H HIS 120 -25.395 -20.573 9.348 405 HA HIS 120 HA HIS 120 -26.341 -18.808 7.254 406 HB2 HIS 120 HB2 HIS 120 -27.718 -20.240 8.857 407 HB3 HIS 120 HB3 HIS 120 -27.351 -19.061 10.114 408 HD1 HIS 120 HD1 HIS 120 -27.807 -16.515 8.008 409 HD2 HIS 120 HD2 HIS 120 -30.343 -19.759 8.933 410 HE1 HIS 120 HE1 HIS 120 -30.233 -15.734 7.461 411 HE2 HIS 120 HE2 HIS 120 -31.761 -17.731 8.037 Start of MODEL 17 1 H1 SER 66 H1 SER 66 10.508 -6.988 -30.160 2 H2 SER 66 H2 SER 66 9.728 -5.661 -30.730 3 H3 SER 66 H3 SER 66 11.141 -6.135 -31.409 4 HA SER 66 HA SER 66 12.352 -5.686 -29.388 5 HB2 SER 66 HB2 SER 66 10.762 -3.272 -30.362 6 HB3 SER 66 HB3 SER 66 12.320 -3.250 -29.514 7 HG SER 66 HG SER 66 12.588 -3.099 -31.797 8 H GLY 67 H GLY 67 12.408 -4.781 -27.259 9 HA2 GLY 67 HA2 GLY 67 11.623 -4.244 -25.157 10 HA3 GLY 67 HA3 GLY 67 10.012 -4.004 -25.812 11 H SER 68 H SER 68 9.639 -4.982 -23.605 12 HA SER 68 HA SER 68 9.324 -7.952 -23.739 13 HB2 SER 68 HB2 SER 68 10.374 -6.363 -21.361 14 HB3 SER 68 HB3 SER 68 9.975 -8.090 -21.354 15 HG SER 68 HG SER 68 12.234 -7.700 -21.685 16 H GLY 69 H GLY 69 7.680 -8.829 -22.366 17 HA2 GLY 69 HA2 GLY 69 5.275 -7.249 -22.096 18 HA3 GLY 69 HA3 GLY 69 5.524 -8.899 -21.530 19 H ARG 70 H ARG 70 4.018 -7.105 -20.088 20 HA ARG 70 HA ARG 70 5.555 -5.806 -17.987 21 HB2 ARG 70 HB2 ARG 70 3.437 -5.178 -17.025 22 HB3 ARG 70 HB3 ARG 70 3.407 -4.896 -18.761 23 HG2 ARG 70 HG2 ARG 70 2.107 -7.024 -19.066 24 HG3 ARG 70 HG3 ARG 70 2.102 -7.251 -17.306 25 HD2 ARG 70 HD2 ARG 70 0.915 -5.101 -17.029 26 HD3 ARG 70 HD3 ARG 70 0.917 -4.875 -18.791 27 HE ARG 70 HE ARG 70 -0.251 -7.406 -18.214 28 HH11 ARG 70 HH11 ARG 70 -1.096 -4.024 -17.801 29 HH12 ARG 70 HH12 ARG 70 -2.805 -4.352 -17.861 30 HH21 ARG 70 HH21 ARG 70 -2.448 -7.752 -18.277 31 HH22 ARG 70 HH22 ARG 70 -3.544 -6.410 -18.130 32 H GLY 71 H GLY 71 5.695 -6.166 -15.847 33 HA2 GLY 71 HA2 GLY 71 6.168 -7.432 -13.971 34 HA3 GLY 71 HA3 GLY 71 4.826 -8.476 -14.432 35 H ARG 72 H ARG 72 5.786 -10.361 -13.928 36 HA ARG 72 HA ARG 72 8.415 -11.223 -15.032 37 HB2 ARG 72 HB2 ARG 72 6.333 -12.597 -13.276 38 HB3 ARG 72 HB3 ARG 72 7.801 -13.379 -13.869 39 HG2 ARG 72 HG2 ARG 72 9.212 -11.803 -12.661 40 HG3 ARG 72 HG3 ARG 72 7.795 -10.883 -12.122 41 HD2 ARG 72 HD2 ARG 72 8.638 -12.427 -10.346 42 HD3 ARG 72 HD3 ARG 72 6.979 -12.753 -10.822 43 HE ARG 72 HE ARG 72 7.590 -14.762 -11.857 44 HH11 ARG 72 HH11 ARG 72 10.515 -13.228 -10.655 45 HH12 ARG 72 HH12 ARG 72 11.473 -14.659 -10.911 46 HH21 ARG 72 HH21 ARG 72 8.885 -16.509 -12.234 47 HH22 ARG 72 HH22 ARG 72 10.571 -16.463 -11.807 48 H GLY 73 H GLY 73 4.998 -11.897 -15.614 49 HA2 GLY 73 HA2 GLY 73 3.941 -12.985 -17.374 50 HA3 GLY 73 HA3 GLY 73 5.500 -13.328 -18.123 51 H ALA 74 H ALA 74 5.915 -14.458 -15.048 52 HA ALA 74 HA ALA 74 4.403 -16.957 -15.160 53 HB1 ALA 74 HB1 ALA 74 7.456 -16.927 -15.361 54 HB2 ALA 74 HB2 ALA 74 6.455 -18.375 -15.113 55 HB3 ALA 74 HB3 ALA 74 6.334 -17.463 -16.628 56 H ILE 75 H ILE 75 4.401 -18.086 -13.170 57 HA ILE 75 HA ILE 75 4.705 -16.434 -10.822 58 HB ILE 75 HB ILE 75 3.994 -19.373 -11.162 59 HG12 ILE 75 HG12 ILE 75 2.259 -16.918 -10.578 60 HG13 ILE 75 HG13 ILE 75 2.407 -17.695 -12.150 61 HG21 ILE 75 HG21 ILE 75 4.877 -19.044 -8.871 62 HG22 ILE 75 HG22 ILE 75 3.772 -17.669 -8.631 63 HG23 ILE 75 HG23 ILE 75 3.154 -19.323 -8.837 64 HD11 ILE 75 HD11 ILE 75 0.366 -18.443 -11.213 65 HD12 ILE 75 HD12 ILE 75 1.487 -19.815 -11.147 66 HD13 ILE 75 HD13 ILE 75 1.123 -18.882 -9.672 67 H ASP 76 H ASP 76 6.167 -16.525 -9.136 68 HA ASP 76 HA ASP 76 8.821 -17.603 -9.730 69 HB2 ASP 76 HB2 ASP 76 8.389 -15.301 -8.856 70 HB3 ASP 76 HB3 ASP 76 7.845 -16.010 -7.340 71 H ARG 77 H ARG 77 7.380 -19.722 -9.617 72 HA ARG 77 HA ARG 77 6.698 -21.662 -8.755 73 HB2 ARG 77 HB2 ARG 77 8.435 -23.060 -7.929 74 HB3 ARG 77 HB3 ARG 77 9.067 -21.984 -9.166 75 HG2 ARG 77 HG2 ARG 77 10.154 -20.585 -7.487 76 HG3 ARG 77 HG3 ARG 77 9.420 -21.512 -6.170 77 HD2 ARG 77 HD2 ARG 77 11.346 -22.632 -8.251 78 HD3 ARG 77 HD3 ARG 77 11.835 -22.069 -6.662 79 HE ARG 77 HE ARG 77 10.471 -24.573 -7.326 80 HH11 ARG 77 HH11 ARG 77 11.271 -22.446 -4.648 81 HH12 ARG 77 HH12 ARG 77 11.068 -23.707 -3.466 82 HH21 ARG 77 HH21 ARG 77 10.216 -26.126 -5.765 83 HH22 ARG 77 HH22 ARG 77 10.478 -25.742 -4.090 84 H GLU 78 H GLU 78 6.685 -19.361 -6.407 85 HA GLU 78 HA GLU 78 6.290 -20.543 -3.986 86 HB2 GLU 78 HB2 GLU 78 6.191 -18.128 -4.453 87 HB3 GLU 78 HB3 GLU 78 4.642 -18.326 -5.261 88 HG2 GLU 78 HG2 GLU 78 3.740 -19.204 -3.000 89 HG3 GLU 78 HG3 GLU 78 5.259 -18.646 -2.298 90 H GLN 79 H GLN 79 3.553 -20.088 -6.314 91 HA GLN 79 HA GLN 79 1.714 -21.574 -4.647 92 HB2 GLN 79 HB2 GLN 79 1.510 -20.745 -7.568 93 HB3 GLN 79 HB3 GLN 79 0.182 -21.378 -6.598 94 HG2 GLN 79 HG2 GLN 79 1.715 -18.788 -6.034 95 HG3 GLN 79 HG3 GLN 79 0.127 -18.901 -6.765 96 HE21 GLN 79 HE22 GLN 79 1.427 -17.956 -3.903 97 HE22 GLN 79 HE21 GLN 79 0.170 -18.566 -2.837 98 H SER 80 H SER 80 3.721 -22.500 -7.427 99 HA SER 80 HA SER 80 2.761 -25.137 -7.806 100 HB2 SER 80 HB2 SER 80 5.604 -24.147 -8.246 101 HB3 SER 80 HB3 SER 80 4.782 -25.488 -9.070 102 HG SER 80 HG SER 80 4.719 -23.628 -10.386 103 H ALA 81 H ALA 81 4.699 -23.916 -5.190 104 HA ALA 81 HA ALA 81 5.224 -26.634 -4.229 105 HB1 ALA 81 HB1 ALA 81 6.297 -23.945 -3.285 106 HB2 ALA 81 HB2 ALA 81 6.770 -25.532 -2.643 107 HB3 ALA 81 HB3 ALA 81 7.151 -25.102 -4.326 108 H ALA 82 H ALA 82 3.712 -23.546 -3.119 109 HA ALA 82 HA ALA 82 2.851 -24.520 -0.623 110 HB1 ALA 82 HB1 ALA 82 1.655 -22.312 -2.355 111 HB2 ALA 82 HB2 ALA 82 1.416 -22.522 -0.607 112 HB3 ALA 82 HB3 ALA 82 3.029 -22.145 -1.237 113 H ILE 83 H ILE 83 1.009 -24.508 -3.736 114 HA ILE 83 HA ILE 83 -1.395 -25.635 -2.551 115 HB ILE 83 HB ILE 83 -0.493 -25.555 -5.454 116 HG12 ILE 83 HG12 ILE 83 -2.304 -23.693 -3.858 117 HG13 ILE 83 HG13 ILE 83 -0.693 -23.300 -4.426 118 HG21 ILE 83 HG21 ILE 83 -2.887 -25.943 -5.996 119 HG22 ILE 83 HG22 ILE 83 -2.245 -27.287 -5.078 120 HG23 ILE 83 HG23 ILE 83 -3.256 -26.075 -4.264 121 HD11 ILE 83 HD11 ILE 83 -2.225 -22.244 -5.902 122 HD12 ILE 83 HD12 ILE 83 -1.491 -23.595 -6.800 123 HD13 ILE 83 HD13 ILE 83 -3.149 -23.728 -6.153 124 H ARG 84 H ARG 84 1.495 -27.036 -4.063 125 HA ARG 84 HA ARG 84 0.571 -29.791 -4.037 126 HB2 ARG 84 HB2 ARG 84 2.231 -29.220 -5.570 127 HB3 ARG 84 HB3 ARG 84 3.259 -28.420 -4.381 128 HG2 ARG 84 HG2 ARG 84 4.179 -30.387 -3.604 129 HG3 ARG 84 HG3 ARG 84 2.761 -31.365 -4.001 130 HD2 ARG 84 HD2 ARG 84 4.844 -31.769 -5.427 131 HD3 ARG 84 HD3 ARG 84 3.290 -31.543 -6.235 132 HE ARG 84 HE ARG 84 4.912 -29.091 -5.976 133 HH11 ARG 84 HH11 ARG 84 4.278 -31.826 -8.081 134 HH12 ARG 84 HH12 ARG 84 4.534 -30.876 -9.534 135 HH21 ARG 84 HH21 ARG 84 5.123 -27.941 -7.830 136 HH22 ARG 84 HH22 ARG 84 5.196 -28.768 -9.376 137 H GLU 85 H GLU 85 2.629 -27.960 -1.696 138 HA GLU 85 HA GLU 85 2.778 -30.029 0.160 139 HB2 GLU 85 HB2 GLU 85 4.081 -27.864 0.152 140 HB3 GLU 85 HB3 GLU 85 2.658 -27.076 0.863 141 HG2 GLU 85 HG2 GLU 85 2.752 -28.809 2.718 142 HG3 GLU 85 HG3 GLU 85 4.254 -29.413 2.028 143 H TRP 86 H TRP 86 0.299 -27.387 -0.004 144 HA TRP 86 HA TRP 86 -1.355 -28.146 2.063 145 HB2 TRP 86 HB2 TRP 86 -1.590 -26.089 0.819 146 HB3 TRP 86 HB3 TRP 86 -1.981 -26.955 -0.652 147 HD1 TRP 86 HD1 TRP 86 -3.510 -25.787 2.613 148 HE1 TRP 86 HE1 TRP 86 -6.069 -25.958 2.489 149 HE3 TRP 86 HE3 TRP 86 -3.948 -28.295 -1.843 150 HZ2 TRP 86 HZ2 TRP 86 -8.043 -27.137 0.743 151 HZ3 TRP 86 HZ3 TRP 86 -6.192 -28.962 -2.687 152 HH2 TRP 86 HH2 TRP 86 -8.233 -28.410 -1.387 153 H ALA 87 H ALA 87 -1.506 -29.332 -1.329 154 HA ALA 87 HA ALA 87 -3.626 -31.187 -0.952 155 HB1 ALA 87 HB1 ALA 87 -2.878 -30.335 -3.136 156 HB2 ALA 87 HB2 ALA 87 -1.319 -31.160 -2.955 157 HB3 ALA 87 HB3 ALA 87 -2.803 -32.113 -3.119 158 H ARG 88 H ARG 88 -0.066 -31.677 -0.683 159 HA ARG 88 HA ARG 88 -0.194 -34.494 -0.118 160 HB2 ARG 88 HB2 ARG 88 1.799 -33.208 -0.929 161 HB3 ARG 88 HB3 ARG 88 1.946 -32.460 0.668 162 HG2 ARG 88 HG2 ARG 88 2.337 -34.690 1.683 163 HG3 ARG 88 HG3 ARG 88 2.091 -35.463 0.106 164 HD2 ARG 88 HD2 ARG 88 4.035 -34.223 -0.800 165 HD3 ARG 88 HD3 ARG 88 4.312 -33.470 0.773 166 HE ARG 88 HE ARG 88 4.851 -36.261 -0.033 167 HH11 ARG 88 HH11 ARG 88 4.731 -34.095 2.733 168 HH12 ARG 88 HH12 ARG 88 5.691 -35.166 3.713 169 HH21 ARG 88 HH21 ARG 88 6.066 -37.567 1.285 170 HH22 ARG 88 HH22 ARG 88 6.430 -37.073 2.910 171 H ARG 89 H ARG 89 -0.267 -31.676 2.050 172 HA ARG 89 HA ARG 89 -0.309 -33.132 4.551 173 HB2 ARG 89 HB2 ARG 89 -1.279 -30.362 3.734 174 HB3 ARG 89 HB3 ARG 89 -1.407 -30.967 5.385 175 HG2 ARG 89 HG2 ARG 89 1.016 -31.234 5.555 176 HG3 ARG 89 HG3 ARG 89 1.235 -30.733 3.873 177 HD2 ARG 89 HD2 ARG 89 0.209 -28.529 4.393 178 HD3 ARG 89 HD3 ARG 89 -0.008 -29.007 6.073 179 HE ARG 89 HE ARG 89 2.458 -28.111 4.756 180 HH11 ARG 89 HH11 ARG 89 1.365 -29.835 7.637 181 HH12 ARG 89 HH12 ARG 89 2.843 -29.450 8.476 182 HH21 ARG 89 HH21 ARG 89 4.169 -27.697 5.801 183 HH22 ARG 89 HH22 ARG 89 4.445 -28.250 7.454 184 H ASN 90 H ASN 90 -2.973 -32.051 2.423 185 HA ASN 90 HA ASN 90 -4.915 -33.257 4.295 186 HB2 ASN 90 HB2 ASN 90 -6.539 -31.867 3.359 187 HB3 ASN 90 HB3 ASN 90 -5.086 -30.894 3.551 188 HD21 ASN 90 HD22 ASN 90 -6.215 -29.446 2.068 189 HD22 ASN 90 HD21 ASN 90 -6.069 -29.736 0.351 190 H GLY 91 H GLY 91 -3.357 -34.464 1.599 191 HA2 GLY 91 HA2 GLY 91 -3.575 -36.687 0.937 192 HA3 GLY 91 HA3 GLY 91 -5.207 -36.758 1.587 193 H HIS 92 H HIS 92 -4.563 -34.097 -0.599 194 HA HIS 92 HA HIS 92 -6.220 -35.357 -2.726 195 HB2 HIS 92 HB2 HIS 92 -5.044 -32.586 -2.389 196 HB3 HIS 92 HB3 HIS 92 -5.670 -33.138 -3.939 197 HD1 HIS 92 HD1 HIS 92 -6.920 -32.430 -0.378 198 HD2 HIS 92 HD2 HIS 92 -8.307 -33.262 -4.278 199 HE1 HIS 92 HE1 HIS 92 -9.488 -32.048 -0.340 200 HE2 HIS 92 HE2 HIS 92 -10.311 -32.554 -2.730 201 H ASN 93 H ASN 93 -5.523 -35.989 -4.741 202 HA ASN 93 HA ASN 93 -2.835 -37.017 -4.911 203 HB2 ASN 93 HB2 ASN 93 -4.870 -38.105 -5.860 204 HB3 ASN 93 HB3 ASN 93 -5.005 -36.801 -7.040 205 HD21 ASN 93 HD22 ASN 93 -4.938 -38.827 -8.469 206 HD22 ASN 93 HD21 ASN 93 -3.342 -39.350 -8.977 207 H VAL 94 H VAL 94 -1.021 -36.133 -5.754 208 HA VAL 94 HA VAL 94 -1.085 -34.087 -7.830 209 HB VAL 94 HB VAL 94 -1.370 -32.772 -5.734 210 HG11 VAL 94 HG11 VAL 94 1.448 -33.647 -4.984 211 HG12 VAL 94 HG12 VAL 94 0.428 -32.465 -4.144 212 HG13 VAL 94 HG13 VAL 94 -0.041 -34.169 -4.170 213 HG21 VAL 94 HG21 VAL 94 0.289 -31.088 -6.219 214 HG22 VAL 94 HG22 VAL 94 1.288 -32.251 -7.111 215 HG23 VAL 94 HG23 VAL 94 -0.313 -31.787 -7.727 216 H SER 95 H SER 95 0.843 -33.986 -9.030 217 HA SER 95 HA SER 95 2.592 -36.290 -8.845 218 HB2 SER 95 HB2 SER 95 2.019 -35.257 -11.014 219 HB3 SER 95 HB3 SER 95 2.840 -33.765 -10.520 220 HG SER 95 HG SER 95 3.936 -36.273 -11.208 221 H THR 96 H THR 96 4.774 -36.426 -8.312 222 HA THR 96 HA THR 96 5.879 -34.494 -6.408 223 HB THR 96 HB THR 96 7.835 -36.062 -6.431 224 HG1 THR 96 HG1 THR 96 7.555 -38.017 -7.559 225 HG21 THR 96 HG21 THR 96 5.953 -36.374 -4.836 226 HG22 THR 96 HG22 THR 96 5.135 -37.431 -6.014 227 HG23 THR 96 HG23 THR 96 6.694 -37.914 -5.307 228 H ARG 97 H ARG 97 5.995 -34.808 -9.840 229 HA ARG 97 HA ARG 97 8.234 -32.818 -9.987 230 HB2 ARG 97 HB2 ARG 97 9.007 -35.210 -10.303 231 HB3 ARG 97 HB3 ARG 97 7.957 -35.329 -11.703 232 HG2 ARG 97 HG2 ARG 97 10.274 -34.955 -12.357 233 HG3 ARG 97 HG3 ARG 97 9.262 -33.621 -12.886 234 HD2 ARG 97 HD2 ARG 97 11.419 -32.808 -12.018 235 HD3 ARG 97 HD3 ARG 97 10.087 -32.206 -11.053 236 HE ARG 97 HE ARG 97 10.794 -33.451 -9.218 237 HH11 ARG 97 HH11 ARG 97 12.741 -34.460 -11.960 238 HH12 ARG 97 HH12 ARG 97 13.859 -35.342 -10.954 239 HH21 ARG 97 HH21 ARG 97 12.259 -34.586 -8.005 240 HH22 ARG 97 HH22 ARG 97 13.588 -35.407 -8.772 241 H GLY 98 H GLY 98 5.347 -34.102 -11.557 242 HA2 GLY 98 HA2 GLY 98 5.407 -32.268 -13.825 243 HA3 GLY 98 HA3 GLY 98 4.102 -33.345 -13.346 244 H ARG 99 H ARG 99 2.925 -31.382 -14.136 245 HA ARG 99 HA ARG 99 2.727 -29.030 -12.393 246 HB2 ARG 99 HB2 ARG 99 1.019 -30.005 -14.729 247 HB3 ARG 99 HB3 ARG 99 0.784 -28.467 -13.895 248 HG2 ARG 99 HG2 ARG 99 3.094 -27.775 -14.486 249 HG3 ARG 99 HG3 ARG 99 3.318 -29.273 -15.399 250 HD2 ARG 99 HD2 ARG 99 1.171 -27.188 -15.964 251 HD3 ARG 99 HD3 ARG 99 2.731 -27.287 -16.799 252 HE ARG 99 HE ARG 99 1.581 -29.827 -17.077 253 HH11 ARG 99 HH11 ARG 99 0.749 -26.591 -18.140 254 HH12 ARG 99 HH12 ARG 99 -0.131 -27.172 -19.528 255 HH21 ARG 99 HH21 ARG 99 0.435 -30.502 -18.862 256 HH22 ARG 99 HH22 ARG 99 -0.290 -29.329 -19.923 257 H ILE 100 H ILE 100 0.724 -28.335 -11.413 258 HA ILE 100 HA ILE 100 -0.501 -30.449 -9.761 259 HB ILE 100 HB ILE 100 -0.839 -27.451 -9.642 260 HG12 ILE 100 HG12 ILE 100 0.926 -29.390 -8.084 261 HG13 ILE 100 HG13 ILE 100 1.462 -28.095 -9.151 262 HG21 ILE 100 HG21 ILE 100 -2.799 -28.705 -8.677 263 HG22 ILE 100 HG22 ILE 100 -1.675 -29.601 -7.622 264 HG23 ILE 100 HG23 ILE 100 -1.896 -27.847 -7.462 265 HD11 ILE 100 HD11 ILE 100 0.377 -26.441 -7.589 266 HD12 ILE 100 HD12 ILE 100 0.135 -27.802 -6.454 267 HD13 ILE 100 HD13 ILE 100 1.772 -27.328 -6.939 268 HA PRO 101 HA PRO 101 -4.113 -30.576 -12.479 269 HB2 PRO 101 HB2 PRO 101 -5.674 -31.561 -10.130 270 HB3 PRO 101 HB3 PRO 101 -5.441 -32.320 -11.730 271 HG2 PRO 101 HG2 PRO 101 -4.182 -33.273 -9.504 272 HG3 PRO 101 HG3 PRO 101 -3.367 -33.245 -11.105 273 HD2 PRO 101 HD2 PRO 101 -3.092 -31.274 -8.815 274 HD3 PRO 101 HD3 PRO 101 -1.822 -32.031 -9.829 275 H ALA 102 H ALA 102 -5.671 -29.059 -13.012 276 HA ALA 102 HA ALA 102 -5.964 -26.730 -11.511 277 HB1 ALA 102 HB1 ALA 102 -6.302 -26.909 -13.928 278 HB2 ALA 102 HB2 ALA 102 -7.829 -27.796 -13.639 279 HB3 ALA 102 HB3 ALA 102 -7.655 -26.106 -13.096 280 H ASP 103 H ASP 103 -8.063 -29.622 -11.473 281 HA ASP 103 HA ASP 103 -10.138 -28.647 -9.934 282 HB2 ASP 103 HB2 ASP 103 -10.089 -30.846 -11.036 283 HB3 ASP 103 HB3 ASP 103 -8.858 -31.404 -9.898 284 H VAL 104 H VAL 104 -6.903 -29.692 -8.876 285 HA VAL 104 HA VAL 104 -7.515 -29.504 -6.060 286 HB VAL 104 HB VAL 104 -4.839 -29.804 -7.389 287 HG11 VAL 104 HG11 VAL 104 -4.582 -29.062 -5.061 288 HG12 VAL 104 HG12 VAL 104 -5.665 -30.367 -4.520 289 HG13 VAL 104 HG13 VAL 104 -4.081 -30.743 -5.242 290 HG21 VAL 104 HG21 VAL 104 -5.026 -32.214 -6.854 291 HG22 VAL 104 HG22 VAL 104 -6.667 -31.949 -6.216 292 HG23 VAL 104 HG23 VAL 104 -6.326 -31.731 -7.938 293 H ILE 105 H ILE 105 -5.921 -27.440 -8.514 294 HA ILE 105 HA ILE 105 -5.177 -25.302 -6.728 295 HB ILE 105 HB ILE 105 -5.890 -25.444 -9.682 296 HG12 ILE 105 HG12 ILE 105 -3.171 -24.711 -8.540 297 HG13 ILE 105 HG13 ILE 105 -3.661 -26.396 -8.447 298 HG21 ILE 105 HG21 ILE 105 -4.849 -23.153 -9.878 299 HG22 ILE 105 HG22 ILE 105 -6.416 -23.174 -9.075 300 HG23 ILE 105 HG23 ILE 105 -4.925 -23.017 -8.108 301 HD11 ILE 105 HD11 ILE 105 -3.691 -24.839 -11.056 302 HD12 ILE 105 HD12 ILE 105 -2.349 -25.854 -10.496 303 HD13 ILE 105 HD13 ILE 105 -3.936 -26.588 -10.794 304 H ASP 106 H ASP 106 -8.246 -25.864 -8.567 305 HA ASP 106 HA ASP 106 -9.666 -23.744 -7.432 306 HB2 ASP 106 HB2 ASP 106 -10.588 -26.423 -8.513 307 HB3 ASP 106 HB3 ASP 106 -11.703 -25.172 -7.968 308 H ALA 107 H ALA 107 -9.421 -27.156 -6.231 309 HA ALA 107 HA ALA 107 -10.970 -26.908 -3.975 310 HB1 ALA 107 HB1 ALA 107 -8.391 -28.528 -4.309 311 HB2 ALA 107 HB2 ALA 107 -9.696 -28.859 -3.153 312 HB3 ALA 107 HB3 ALA 107 -10.001 -29.014 -4.885 313 H TYR 108 H TYR 108 -7.484 -26.124 -4.280 314 HA TYR 108 HA TYR 108 -7.039 -25.215 -1.611 315 HB2 TYR 108 HB2 TYR 108 -5.192 -25.711 -2.999 316 HB3 TYR 108 HB3 TYR 108 -5.732 -24.647 -4.285 317 HD1 TYR 108 HD1 TYR 108 -4.253 -24.730 -0.872 318 HD2 TYR 108 HD2 TYR 108 -5.229 -22.290 -4.298 319 HE1 TYR 108 HE1 TYR 108 -2.840 -22.886 0.035 320 HE2 TYR 108 HE2 TYR 108 -3.807 -20.460 -3.398 321 HH TYR 108 HH TYR 108 -2.425 -19.766 -1.694 322 H HIS 109 H HIS 109 -7.951 -23.295 -4.563 323 HA HIS 109 HA HIS 109 -8.209 -20.838 -3.120 324 HB2 HIS 109 HB2 HIS 109 -9.436 -21.752 -5.740 325 HB3 HIS 109 HB3 HIS 109 -9.722 -20.155 -5.049 326 HD1 HIS 109 HD1 HIS 109 -7.227 -18.790 -4.408 327 HD2 HIS 109 HD2 HIS 109 -7.433 -21.759 -7.399 328 HE1 HIS 109 HE1 HIS 109 -5.173 -18.433 -5.921 329 HE2 HIS 109 HE2 HIS 109 -5.308 -20.228 -7.759 330 H ALA 110 H ALA 110 -10.691 -23.406 -3.642 331 HA ALA 110 HA ALA 110 -12.819 -21.979 -2.450 332 HB1 ALA 110 HB1 ALA 110 -12.267 -24.976 -2.450 333 HB2 ALA 110 HB2 ALA 110 -13.824 -24.201 -2.102 334 HB3 ALA 110 HB3 ALA 110 -13.112 -24.065 -3.723 335 H ALA 111 H ALA 111 -10.343 -24.124 -0.895 336 HA ALA 111 HA ALA 111 -11.288 -23.856 1.707 337 HB1 ALA 111 HB1 ALA 111 -9.761 -25.605 0.911 338 HB2 ALA 111 HB2 ALA 111 -8.467 -24.396 0.707 339 HB3 ALA 111 HB3 ALA 111 -9.093 -24.773 2.328 340 H THR 112 H THR 112 -8.901 -21.821 -0.060 341 HA THR 112 HA THR 112 -8.347 -20.171 2.284 342 HB THR 112 HB THR 112 -7.103 -18.707 0.784 343 HG1 THR 112 HG1 THR 112 -6.902 -19.246 -1.374 344 HG21 THR 112 HG21 THR 112 -6.005 -20.705 1.740 345 HG22 THR 112 HG22 THR 112 -6.457 -21.646 0.302 346 HG23 THR 112 HG23 THR 112 -5.347 -20.268 0.159 347 H LEU 113 H LEU 113 -10.641 -19.805 -0.452 348 HA LEU 113 HA LEU 113 -11.275 -17.079 0.312 349 HB2 LEU 113 HB2 LEU 113 -11.168 -17.798 -2.027 350 HB3 LEU 113 HB3 LEU 113 -12.415 -19.014 -1.734 351 HG LEU 113 HG LEU 113 -14.065 -17.293 -1.280 352 HD11 LEU 113 HD11 LEU 113 -13.583 -14.906 -1.876 353 HD12 LEU 113 HD12 LEU 113 -12.670 -15.434 -0.459 354 HD13 LEU 113 HD13 LEU 113 -11.862 -15.316 -2.038 355 HD21 LEU 113 HD21 LEU 113 -13.778 -18.167 -3.559 356 HD22 LEU 113 HD22 LEU 113 -14.301 -16.477 -3.589 357 HD23 LEU 113 HD23 LEU 113 -12.596 -16.882 -3.913 358 H GLU 114 H GLU 114 -13.052 -20.197 0.469 359 HA GLU 114 HA GLU 114 -15.372 -18.827 1.647 360 HB2 GLU 114 HB2 GLU 114 -14.925 -21.715 0.850 361 HB3 GLU 114 HB3 GLU 114 -16.375 -21.159 1.659 362 HG2 GLU 114 HG2 GLU 114 -15.348 -20.125 -1.019 363 HG3 GLU 114 HG3 GLU 114 -16.664 -21.277 -0.799 364 H HIS 115 H HIS 115 -15.867 -18.569 3.641 365 HA HIS 115 HA HIS 115 -14.999 -20.463 5.762 366 HB2 HIS 115 HB2 HIS 115 -14.674 -17.427 5.952 367 HB3 HIS 115 HB3 HIS 115 -14.313 -18.590 7.226 368 HD1 HIS 115 HD1 HIS 115 -12.174 -20.346 6.589 369 HD2 HIS 115 HD2 HIS 115 -12.791 -16.919 4.194 370 HE1 HIS 115 HE1 HIS 115 -10.037 -20.045 5.176 371 HE2 HIS 115 HE2 HIS 115 -10.431 -17.963 3.707 372 H HIS 116 H HIS 116 -16.322 -20.443 7.616 373 HA HIS 116 HA HIS 116 -18.372 -20.677 8.576 374 HB2 HIS 116 HB2 HIS 116 -19.196 -18.612 9.530 375 HB3 HIS 116 HB3 HIS 116 -17.448 -18.691 9.559 376 HD1 HIS 116 HD1 HIS 116 -20.185 -16.978 7.397 377 HD2 HIS 116 HD2 HIS 116 -16.191 -16.573 8.700 378 HE1 HIS 116 HE1 HIS 116 -19.372 -14.666 6.557 379 HE2 HIS 116 HE2 HIS 116 -16.934 -14.437 7.357 380 H HIS 117 H HIS 117 -18.764 -21.386 5.989 381 HA HIS 117 HA HIS 117 -21.660 -20.743 5.606 382 HB2 HIS 117 HB2 HIS 117 -19.560 -21.062 3.412 383 HB3 HIS 117 HB3 HIS 117 -21.296 -21.025 3.124 384 HD1 HIS 117 HD1 HIS 117 -19.000 -18.818 2.113 385 HD2 HIS 117 HD2 HIS 117 -22.065 -18.488 5.017 386 HE1 HIS 117 HE1 HIS 117 -19.536 -16.323 2.332 387 HE2 HIS 117 HE2 HIS 117 -21.421 -16.126 4.081 388 H HIS 118 H HIS 118 -22.936 -22.436 4.747 389 HA HIS 118 HA HIS 118 -21.859 -25.177 5.351 390 HB2 HIS 118 HB2 HIS 118 -24.587 -24.036 6.058 391 HB3 HIS 118 HB3 HIS 118 -23.976 -25.632 6.484 392 HD1 HIS 118 HD1 HIS 118 -21.648 -25.523 8.154 393 HD2 HIS 118 HD2 HIS 118 -24.207 -22.174 7.853 394 HE1 HIS 118 HE1 HIS 118 -21.137 -24.036 10.195 395 HE2 HIS 118 HE2 HIS 118 -22.706 -21.996 10.007 396 H HIS 119 H HIS 119 -22.519 -23.719 2.667 397 HA HIS 119 HA HIS 119 -23.779 -26.084 1.382 398 HB2 HIS 119 HB2 HIS 119 -25.536 -24.293 1.959 399 HB3 HIS 119 HB3 HIS 119 -24.752 -23.254 0.783 400 HD1 HIS 119 HD1 HIS 119 -24.974 -24.134 -1.881 401 HD2 HIS 119 HD2 HIS 119 -27.125 -26.217 1.123 402 HE1 HIS 119 HE1 HIS 119 -26.805 -25.489 -3.085 403 HE2 HIS 119 HE2 HIS 119 -28.089 -26.776 -1.253 404 H HIS 120 H HIS 120 -23.319 -26.274 -0.865 405 HA HIS 120 HA HIS 120 -20.818 -25.084 -1.802 406 HB2 HIS 120 HB2 HIS 120 -21.139 -26.459 -3.773 407 HB3 HIS 120 HB3 HIS 120 -21.357 -27.406 -2.316 408 HD1 HIS 120 HD1 HIS 120 -23.488 -25.819 -5.139 409 HD2 HIS 120 HD2 HIS 120 -23.610 -28.760 -2.113 410 HE1 HIS 120 HE1 HIS 120 -25.642 -27.182 -5.538 411 HE2 HIS 120 HE2 HIS 120 -25.719 -28.962 -3.670 Start of MODEL 18 1 H1 SER 66 H1 SER 66 2.465 -19.743 19.866 2 H2 SER 66 H2 SER 66 1.030 -19.852 20.639 3 H3 SER 66 H3 SER 66 2.041 -21.134 20.619 4 HA SER 66 HA SER 66 0.215 -21.507 19.141 5 HB2 SER 66 HB2 SER 66 1.132 -19.013 17.657 6 HB3 SER 66 HB3 SER 66 -0.173 -20.123 17.187 7 HG SER 66 HG SER 66 -0.959 -18.296 18.351 8 H GLY 67 H GLY 67 3.122 -20.109 17.398 9 HA2 GLY 67 HA2 GLY 67 4.441 -22.612 17.092 10 HA3 GLY 67 HA3 GLY 67 3.437 -22.332 15.666 11 H SER 68 H SER 68 6.126 -22.581 15.379 12 HA SER 68 HA SER 68 7.717 -20.262 15.565 13 HB2 SER 68 HB2 SER 68 7.964 -22.553 13.581 14 HB3 SER 68 HB3 SER 68 9.238 -21.398 14.014 15 HG SER 68 HG SER 68 9.410 -23.365 15.205 16 H GLY 69 H GLY 69 8.336 -18.636 14.155 17 HA2 GLY 69 HA2 GLY 69 8.149 -17.072 12.490 18 HA3 GLY 69 HA3 GLY 69 7.736 -18.405 11.408 19 H ARG 70 H ARG 70 5.699 -17.581 14.158 20 HA ARG 70 HA ARG 70 3.454 -17.284 14.293 21 HB2 ARG 70 HB2 ARG 70 4.492 -14.964 13.767 22 HB3 ARG 70 HB3 ARG 70 3.704 -15.115 12.197 23 HG2 ARG 70 HG2 ARG 70 1.488 -15.391 13.422 24 HG3 ARG 70 HG3 ARG 70 2.365 -15.221 14.948 25 HD2 ARG 70 HD2 ARG 70 1.374 -13.102 14.435 26 HD3 ARG 70 HD3 ARG 70 3.128 -12.955 14.234 27 HE ARG 70 HE ARG 70 1.868 -13.642 11.733 28 HH11 ARG 70 HH11 ARG 70 2.264 -10.851 13.820 29 HH12 ARG 70 HH12 ARG 70 2.082 -9.725 12.503 30 HH21 ARG 70 HH21 ARG 70 1.643 -12.156 10.096 31 HH22 ARG 70 HH22 ARG 70 1.740 -10.455 10.448 32 H GLY 71 H GLY 71 4.240 -19.340 12.464 33 HA2 GLY 71 HA2 GLY 71 3.102 -20.927 11.244 34 HA3 GLY 71 HA3 GLY 71 1.667 -19.901 11.240 35 H ARG 72 H ARG 72 4.371 -18.194 9.940 36 HA ARG 72 HA ARG 72 3.269 -18.170 7.275 37 HB2 ARG 72 HB2 ARG 72 4.483 -16.247 8.221 38 HB3 ARG 72 HB3 ARG 72 5.947 -17.225 8.377 39 HG2 ARG 72 HG2 ARG 72 6.194 -15.750 6.499 40 HG3 ARG 72 HG3 ARG 72 6.125 -17.399 5.932 41 HD2 ARG 72 HD2 ARG 72 3.574 -16.912 5.491 42 HD3 ARG 72 HD3 ARG 72 4.034 -15.214 5.711 43 HE ARG 72 HE ARG 72 5.676 -16.758 3.797 44 HH11 ARG 72 HH11 ARG 72 2.891 -14.629 4.044 45 HH12 ARG 72 HH12 ARG 72 2.909 -14.266 2.341 46 HH21 ARG 72 HH21 ARG 72 5.585 -16.334 1.653 47 HH22 ARG 72 HH22 ARG 72 4.425 -15.192 1.015 48 H GLY 73 H GLY 73 3.782 -19.291 5.459 49 HA2 GLY 73 HA2 GLY 73 5.182 -21.789 5.549 50 HA3 GLY 73 HA3 GLY 73 4.604 -20.963 4.096 51 H ALA 74 H ALA 74 7.048 -22.448 4.391 52 HA ALA 74 HA ALA 74 9.312 -20.604 4.322 53 HB1 ALA 74 HB1 ALA 74 10.552 -22.671 3.814 54 HB2 ALA 74 HB2 ALA 74 9.430 -22.951 5.157 55 HB3 ALA 74 HB3 ALA 74 9.017 -23.523 3.516 56 H ILE 75 H ILE 75 7.401 -19.698 2.618 57 HA ILE 75 HA ILE 75 8.518 -19.966 -0.108 58 HB ILE 75 HB ILE 75 5.787 -20.739 0.894 59 HG12 ILE 75 HG12 ILE 75 7.614 -21.917 -1.243 60 HG13 ILE 75 HG13 ILE 75 7.498 -22.451 0.431 61 HG21 ILE 75 HG21 ILE 75 5.214 -18.989 -0.717 62 HG22 ILE 75 HG22 ILE 75 6.309 -19.709 -1.921 63 HG23 ILE 75 HG23 ILE 75 4.825 -20.545 -1.406 64 HD11 ILE 75 HD11 ILE 75 5.089 -23.041 0.063 65 HD12 ILE 75 HD12 ILE 75 5.332 -22.697 -1.666 66 HD13 ILE 75 HD13 ILE 75 6.252 -23.987 -0.888 67 H ASP 76 H ASP 76 8.277 -18.170 -1.367 68 HA ASP 76 HA ASP 76 7.332 -15.648 -0.037 69 HB2 ASP 76 HB2 ASP 76 9.711 -15.677 -0.525 70 HB3 ASP 76 HB3 ASP 76 9.408 -16.169 -2.190 71 H ARG 77 H ARG 77 7.461 -17.385 -3.127 72 HA ARG 77 HA ARG 77 4.904 -16.161 -4.112 73 HB2 ARG 77 HB2 ARG 77 7.695 -15.971 -5.295 74 HB3 ARG 77 HB3 ARG 77 6.289 -15.937 -6.360 75 HG2 ARG 77 HG2 ARG 77 5.390 -13.964 -5.328 76 HG3 ARG 77 HG3 ARG 77 6.605 -13.986 -4.046 77 HD2 ARG 77 HD2 ARG 77 8.398 -13.546 -5.637 78 HD3 ARG 77 HD3 ARG 77 7.284 -13.716 -6.995 79 HE ARG 77 HE ARG 77 6.489 -11.583 -6.671 80 HH11 ARG 77 HH11 ARG 77 8.357 -12.375 -3.768 81 HH12 ARG 77 HH12 ARG 77 8.308 -10.723 -3.217 82 HH21 ARG 77 HH21 ARG 77 6.479 -9.521 -5.868 83 HH22 ARG 77 HH22 ARG 77 7.275 -9.160 -4.366 84 H GLU 78 H GLU 78 6.813 -18.920 -3.788 85 HA GLU 78 HA GLU 78 6.158 -20.346 -6.162 86 HB2 GLU 78 HB2 GLU 78 7.064 -21.509 -3.500 87 HB3 GLU 78 HB3 GLU 78 7.200 -22.227 -5.103 88 HG2 GLU 78 HG2 GLU 78 9.309 -21.468 -4.972 89 HG3 GLU 78 HG3 GLU 78 8.610 -19.978 -5.584 90 H GLN 79 H GLN 79 3.724 -19.675 -5.900 91 HA GLN 79 HA GLN 79 2.033 -21.080 -4.124 92 HB2 GLN 79 HB2 GLN 79 1.567 -19.840 -6.859 93 HB3 GLN 79 HB3 GLN 79 0.260 -20.586 -5.944 94 HG2 GLN 79 HG2 GLN 79 1.980 -18.292 -4.902 95 HG3 GLN 79 HG3 GLN 79 0.375 -18.129 -5.618 96 HE21 GLN 79 HE22 GLN 79 -1.455 -19.375 -4.487 97 HE22 GLN 79 HE21 GLN 79 -1.320 -19.600 -2.748 98 H SER 80 H SER 80 3.447 -22.298 -7.143 99 HA SER 80 HA SER 80 1.828 -24.658 -7.421 100 HB2 SER 80 HB2 SER 80 3.859 -25.541 -8.606 101 HB3 SER 80 HB3 SER 80 3.274 -23.977 -9.204 102 HG SER 80 HG SER 80 5.566 -23.973 -8.916 103 H ALA 81 H ALA 81 4.974 -24.191 -5.716 104 HA ALA 81 HA ALA 81 5.018 -26.707 -4.472 105 HB1 ALA 81 HB1 ALA 81 6.982 -25.255 -4.760 106 HB2 ALA 81 HB2 ALA 81 6.309 -24.092 -3.598 107 HB3 ALA 81 HB3 ALA 81 6.777 -25.716 -3.061 108 H ALA 82 H ALA 82 3.583 -23.615 -3.337 109 HA ALA 82 HA ALA 82 2.817 -24.523 -0.747 110 HB1 ALA 82 HB1 ALA 82 2.841 -22.142 -1.500 111 HB2 ALA 82 HB2 ALA 82 1.399 -22.476 -2.495 112 HB3 ALA 82 HB3 ALA 82 1.317 -22.622 -0.730 113 H ILE 83 H ILE 83 0.976 -24.656 -3.859 114 HA ILE 83 HA ILE 83 -1.308 -25.996 -2.700 115 HB ILE 83 HB ILE 83 -0.403 -25.704 -5.582 116 HG12 ILE 83 HG12 ILE 83 -2.644 -24.350 -4.013 117 HG13 ILE 83 HG13 ILE 83 -1.080 -23.609 -4.245 118 HG21 ILE 83 HG21 ILE 83 -2.717 -26.407 -6.194 119 HG22 ILE 83 HG22 ILE 83 -1.886 -27.709 -5.362 120 HG23 ILE 83 HG23 ILE 83 -3.078 -26.725 -4.486 121 HD11 ILE 83 HD11 ILE 83 -1.451 -23.718 -6.746 122 HD12 ILE 83 HD12 ILE 83 -3.133 -24.201 -6.393 123 HD13 ILE 83 HD13 ILE 83 -2.530 -22.635 -5.842 124 H ARG 84 H ARG 84 1.638 -27.247 -4.327 125 HA ARG 84 HA ARG 84 1.020 -30.047 -4.244 126 HB2 ARG 84 HB2 ARG 84 3.035 -28.814 -5.324 127 HB3 ARG 84 HB3 ARG 84 3.731 -28.698 -3.729 128 HG2 ARG 84 HG2 ARG 84 4.825 -30.567 -4.410 129 HG3 ARG 84 HG3 ARG 84 3.414 -31.360 -3.726 130 HD2 ARG 84 HD2 ARG 84 3.888 -32.346 -5.854 131 HD3 ARG 84 HD3 ARG 84 2.397 -31.396 -6.038 132 HE ARG 84 HE ARG 84 4.691 -29.786 -6.734 133 HH11 ARG 84 HH11 ARG 84 3.102 -32.599 -8.070 134 HH12 ARG 84 HH12 ARG 84 3.325 -32.018 -9.726 135 HH21 ARG 84 HH21 ARG 84 5.043 -29.225 -8.905 136 HH22 ARG 84 HH22 ARG 84 4.441 -30.296 -10.151 137 H GLU 85 H GLU 85 2.716 -28.060 -1.725 138 HA GLU 85 HA GLU 85 2.836 -30.130 0.142 139 HB2 GLU 85 HB2 GLU 85 4.161 -27.986 0.136 140 HB3 GLU 85 HB3 GLU 85 2.738 -27.177 0.822 141 HG2 GLU 85 HG2 GLU 85 2.791 -28.899 2.695 142 HG3 GLU 85 HG3 GLU 85 4.296 -29.518 2.019 143 H TRP 86 H TRP 86 0.359 -27.489 -0.114 144 HA TRP 86 HA TRP 86 -1.290 -28.270 1.968 145 HB2 TRP 86 HB2 TRP 86 -1.536 -26.176 0.758 146 HB3 TRP 86 HB3 TRP 86 -1.961 -27.030 -0.718 147 HD1 TRP 86 HD1 TRP 86 -3.391 -26.113 2.710 148 HE1 TRP 86 HE1 TRP 86 -5.946 -26.307 2.661 149 HE3 TRP 86 HE3 TRP 86 -3.966 -28.099 -1.987 150 HZ2 TRP 86 HZ2 TRP 86 -7.967 -27.335 0.886 151 HZ3 TRP 86 HZ3 TRP 86 -6.238 -28.603 -2.854 152 HH2 TRP 86 HH2 TRP 86 -8.239 -28.259 -1.414 153 H ALA 87 H ALA 87 -1.326 -29.461 -1.414 154 HA ALA 87 HA ALA 87 -3.487 -31.295 -1.132 155 HB1 ALA 87 HB1 ALA 87 -1.060 -31.259 -3.013 156 HB2 ALA 87 HB2 ALA 87 -2.486 -32.297 -3.200 157 HB3 ALA 87 HB3 ALA 87 -2.650 -30.534 -3.294 158 H ARG 88 H ARG 88 0.049 -31.797 -0.633 159 HA ARG 88 HA ARG 88 -0.115 -34.564 0.100 160 HB2 ARG 88 HB2 ARG 88 1.942 -33.259 -0.571 161 HB3 ARG 88 HB3 ARG 88 1.936 -32.501 1.025 162 HG2 ARG 88 HG2 ARG 88 2.147 -34.805 2.057 163 HG3 ARG 88 HG3 ARG 88 2.185 -35.484 0.422 164 HD2 ARG 88 HD2 ARG 88 4.444 -35.338 1.173 165 HD3 ARG 88 HD3 ARG 88 4.218 -34.076 -0.052 166 HE ARG 88 HE ARG 88 3.750 -33.129 2.679 167 HH11 ARG 88 HH11 ARG 88 6.381 -33.808 0.463 168 HH12 ARG 88 HH12 ARG 88 7.468 -32.718 1.274 169 HH21 ARG 88 HH21 ARG 88 5.207 -31.774 3.687 170 HH22 ARG 88 HH22 ARG 88 6.815 -31.599 3.050 171 H ARG 89 H ARG 89 -0.234 -31.628 2.129 172 HA ARG 89 HA ARG 89 -0.494 -32.909 4.691 173 HB2 ARG 89 HB2 ARG 89 -1.393 -30.190 3.647 174 HB3 ARG 89 HB3 ARG 89 -1.582 -30.681 5.328 175 HG2 ARG 89 HG2 ARG 89 0.826 -30.946 5.607 176 HG3 ARG 89 HG3 ARG 89 1.115 -30.570 3.904 177 HD2 ARG 89 HD2 ARG 89 0.114 -28.325 4.215 178 HD3 ARG 89 HD3 ARG 89 -0.198 -28.672 5.914 179 HE ARG 89 HE ARG 89 2.358 -27.934 4.656 180 HH11 ARG 89 HH11 ARG 89 1.059 -29.350 7.620 181 HH12 ARG 89 HH12 ARG 89 2.496 -28.918 8.500 182 HH21 ARG 89 HH21 ARG 89 4.015 -27.464 5.746 183 HH22 ARG 89 HH22 ARG 89 4.182 -27.847 7.464 184 H ASN 90 H ASN 90 -2.964 -32.088 2.289 185 HA ASN 90 HA ASN 90 -5.120 -33.096 4.075 186 HB2 ASN 90 HB2 ASN 90 -5.147 -31.516 1.478 187 HB3 ASN 90 HB3 ASN 90 -6.599 -32.133 2.271 188 HD21 ASN 90 HD22 ASN 90 -4.026 -29.738 2.511 189 HD22 ASN 90 HD21 ASN 90 -4.789 -28.847 3.825 190 H GLY 91 H GLY 91 -3.084 -34.666 2.021 191 HA2 GLY 91 HA2 GLY 91 -3.138 -36.802 1.197 192 HA3 GLY 91 HA3 GLY 91 -4.721 -37.026 1.941 193 H HIS 92 H HIS 92 -4.217 -34.470 -0.440 194 HA HIS 92 HA HIS 92 -6.249 -35.672 -2.226 195 HB2 HIS 92 HB2 HIS 92 -4.729 -33.034 -2.454 196 HB3 HIS 92 HB3 HIS 92 -6.105 -33.520 -3.435 197 HD1 HIS 92 HD1 HIS 92 -7.875 -34.583 -0.800 198 HD2 HIS 92 HD2 HIS 92 -5.992 -30.873 -1.530 199 HE1 HIS 92 HE1 HIS 92 -9.158 -32.834 0.586 200 HE2 HIS 92 HE2 HIS 92 -8.011 -30.570 0.130 201 H ASN 93 H ASN 93 -5.938 -35.926 -4.523 202 HA ASN 93 HA ASN 93 -3.512 -37.395 -5.112 203 HB2 ASN 93 HB2 ASN 93 -5.775 -38.081 -5.855 204 HB3 ASN 93 HB3 ASN 93 -5.882 -36.642 -6.880 205 HD21 ASN 93 HD22 ASN 93 -6.317 -38.539 -8.459 206 HD22 ASN 93 HD21 ASN 93 -4.891 -39.176 -9.260 207 H VAL 94 H VAL 94 -1.664 -36.295 -5.404 208 HA VAL 94 HA VAL 94 -1.455 -34.399 -7.679 209 HB VAL 94 HB VAL 94 0.257 -33.070 -6.383 210 HG11 VAL 94 HG11 VAL 94 -2.603 -32.859 -5.431 211 HG12 VAL 94 HG12 VAL 94 -1.373 -31.566 -5.487 212 HG13 VAL 94 HG13 VAL 94 -1.986 -32.264 -6.983 213 HG21 VAL 94 HG21 VAL 94 0.588 -34.600 -4.455 214 HG22 VAL 94 HG22 VAL 94 0.179 -32.952 -3.990 215 HG23 VAL 94 HG23 VAL 94 -1.057 -34.227 -3.908 216 H SER 95 H SER 95 0.379 -34.590 -8.895 217 HA SER 95 HA SER 95 2.017 -36.971 -8.640 218 HB2 SER 95 HB2 SER 95 1.554 -35.956 -10.833 219 HB3 SER 95 HB3 SER 95 2.365 -34.465 -10.332 220 HG SER 95 HG SER 95 3.472 -36.980 -10.968 221 H THR 96 H THR 96 4.301 -37.070 -8.221 222 HA THR 96 HA THR 96 5.338 -35.251 -6.159 223 HB THR 96 HB THR 96 7.377 -36.691 -6.352 224 HG1 THR 96 HG1 THR 96 7.198 -38.546 -7.668 225 HG21 THR 96 HG21 THR 96 6.389 -38.715 -5.415 226 HG22 THR 96 HG22 THR 96 5.533 -37.292 -4.795 227 HG23 THR 96 HG23 THR 96 4.792 -38.288 -6.066 228 H ARG 97 H ARG 97 5.536 -35.446 -9.640 229 HA ARG 97 HA ARG 97 7.504 -33.191 -9.701 230 HB2 ARG 97 HB2 ARG 97 8.954 -34.347 -11.271 231 HB3 ARG 97 HB3 ARG 97 8.826 -35.231 -9.754 232 HG2 ARG 97 HG2 ARG 97 7.199 -36.808 -10.814 233 HG3 ARG 97 HG3 ARG 97 7.383 -35.943 -12.351 234 HD2 ARG 97 HD2 ARG 97 9.828 -36.470 -12.327 235 HD3 ARG 97 HD3 ARG 97 9.617 -37.320 -10.800 236 HE ARG 97 HE ARG 97 8.569 -39.107 -11.866 237 HH11 ARG 97 HH11 ARG 97 9.139 -36.625 -14.290 238 HH12 ARG 97 HH12 ARG 97 8.792 -37.715 -15.605 239 HH21 ARG 97 HH21 ARG 97 8.145 -40.426 -13.591 240 HH22 ARG 97 HH22 ARG 97 8.241 -39.806 -15.211 241 H GLY 98 H GLY 98 4.860 -34.800 -11.337 242 HA2 GLY 98 HA2 GLY 98 5.014 -33.244 -13.803 243 HA3 GLY 98 HA3 GLY 98 3.702 -34.287 -13.267 244 H ARG 99 H ARG 99 2.559 -32.378 -14.332 245 HA ARG 99 HA ARG 99 2.266 -29.874 -12.882 246 HB2 ARG 99 HB2 ARG 99 0.489 -31.230 -14.963 247 HB3 ARG 99 HB3 ARG 99 0.233 -29.596 -14.339 248 HG2 ARG 99 HG2 ARG 99 2.460 -28.898 -15.179 249 HG3 ARG 99 HG3 ARG 99 2.720 -30.525 -15.840 250 HD2 ARG 99 HD2 ARG 99 0.721 -30.269 -17.276 251 HD3 ARG 99 HD3 ARG 99 0.460 -28.635 -16.627 252 HE ARG 99 HE ARG 99 3.108 -28.735 -17.619 253 HH11 ARG 99 HH21 ARG 99 -0.118 -28.876 -18.985 254 HH12 ARG 99 HH22 ARG 99 0.398 -28.218 -20.513 255 HH21 ARG 99 HH11 ARG 99 3.703 -27.900 -19.586 256 HH22 ARG 99 HH12 ARG 99 2.518 -27.691 -20.843 257 H ILE 100 H ILE 100 0.420 -29.111 -11.776 258 HA ILE 100 HA ILE 100 -0.844 -31.099 -9.973 259 HB ILE 100 HB ILE 100 -0.805 -28.076 -9.889 260 HG12 ILE 100 HG12 ILE 100 0.607 -30.267 -8.285 261 HG13 ILE 100 HG13 ILE 100 1.362 -29.112 -9.389 262 HG21 ILE 100 HG21 ILE 100 -2.933 -28.985 -8.914 263 HG22 ILE 100 HG22 ILE 100 -1.967 -30.018 -7.833 264 HG23 ILE 100 HG23 ILE 100 -1.900 -28.249 -7.713 265 HD11 ILE 100 HD11 ILE 100 0.144 -28.531 -6.680 266 HD12 ILE 100 HD12 ILE 100 1.826 -28.363 -7.204 267 HD13 ILE 100 HD13 ILE 100 0.599 -27.255 -7.844 268 HA PRO 101 HA PRO 101 -4.547 -30.951 -12.543 269 HB2 PRO 101 HB2 PRO 101 -6.090 -31.793 -10.129 270 HB3 PRO 101 HB3 PRO 101 -5.983 -32.577 -11.728 271 HG2 PRO 101 HG2 PRO 101 -4.714 -33.601 -9.532 272 HG3 PRO 101 HG3 PRO 101 -3.963 -33.661 -11.165 273 HD2 PRO 101 HD2 PRO 101 -3.427 -31.706 -8.918 274 HD3 PRO 101 HD3 PRO 101 -2.278 -32.569 -9.987 275 H ALA 102 H ALA 102 -5.976 -29.325 -13.051 276 HA ALA 102 HA ALA 102 -6.128 -26.983 -11.544 277 HB1 ALA 102 HB1 ALA 102 -6.524 -27.147 -13.960 278 HB2 ALA 102 HB2 ALA 102 -8.075 -27.977 -13.643 279 HB3 ALA 102 HB3 ALA 102 -7.830 -26.288 -13.112 280 H ASP 103 H ASP 103 -8.280 -29.808 -11.407 281 HA ASP 103 HA ASP 103 -10.318 -28.763 -9.854 282 HB2 ASP 103 HB2 ASP 103 -10.304 -30.987 -10.917 283 HB3 ASP 103 HB3 ASP 103 -9.076 -31.537 -9.774 284 H VAL 104 H VAL 104 -7.078 -29.857 -8.832 285 HA VAL 104 HA VAL 104 -7.640 -29.593 -6.008 286 HB VAL 104 HB VAL 104 -4.980 -29.986 -7.348 287 HG11 VAL 104 HG11 VAL 104 -5.840 -30.445 -4.466 288 HG12 VAL 104 HG12 VAL 104 -4.276 -30.926 -5.162 289 HG13 VAL 104 HG13 VAL 104 -4.691 -29.217 -5.044 290 HG21 VAL 104 HG21 VAL 104 -5.217 -32.385 -6.770 291 HG22 VAL 104 HG22 VAL 104 -6.852 -32.075 -6.145 292 HG23 VAL 104 HG23 VAL 104 -6.494 -31.895 -7.873 293 H ILE 105 H ILE 105 -6.027 -27.645 -8.534 294 HA ILE 105 HA ILE 105 -5.183 -25.487 -6.817 295 HB ILE 105 HB ILE 105 -5.943 -25.670 -9.754 296 HG12 ILE 105 HG12 ILE 105 -3.174 -25.043 -8.686 297 HG13 ILE 105 HG13 ILE 105 -3.741 -26.697 -8.512 298 HG21 ILE 105 HG21 ILE 105 -6.350 -23.359 -9.193 299 HG22 ILE 105 HG22 ILE 105 -4.833 -23.252 -8.262 300 HG23 ILE 105 HG23 ILE 105 -4.800 -23.443 -10.029 301 HD11 ILE 105 HD11 ILE 105 -2.426 -26.344 -10.579 302 HD12 ILE 105 HD12 ILE 105 -4.065 -26.955 -10.863 303 HD13 ILE 105 HD13 ILE 105 -3.686 -25.240 -11.175 304 H ASP 106 H ASP 106 -8.292 -25.976 -8.605 305 HA ASP 106 HA ASP 106 -9.621 -23.782 -7.522 306 HB2 ASP 106 HB2 ASP 106 -10.420 -25.080 -9.441 307 HB3 ASP 106 HB3 ASP 106 -10.734 -26.465 -8.394 308 H ALA 107 H ALA 107 -9.473 -27.171 -6.239 309 HA ALA 107 HA ALA 107 -10.978 -26.838 -3.966 310 HB1 ALA 107 HB1 ALA 107 -10.082 -28.996 -4.823 311 HB2 ALA 107 HB2 ALA 107 -8.455 -28.534 -4.285 312 HB3 ALA 107 HB3 ALA 107 -9.752 -28.786 -3.101 313 H TYR 108 H TYR 108 -7.472 -26.106 -4.341 314 HA TYR 108 HA TYR 108 -6.982 -25.193 -1.680 315 HB2 TYR 108 HB2 TYR 108 -5.144 -25.709 -3.097 316 HB3 TYR 108 HB3 TYR 108 -5.696 -24.630 -4.360 317 HD1 TYR 108 HD2 TYR 108 -4.196 -24.734 -0.955 318 HD2 TYR 108 HD1 TYR 108 -5.188 -22.282 -4.367 319 HE1 TYR 108 HE2 TYR 108 -2.734 -22.920 -0.077 320 HE2 TYR 108 HE1 TYR 108 -3.738 -20.464 -3.476 321 HH TYR 108 HH TYR 108 -1.908 -20.788 -0.408 322 H HIS 109 H HIS 109 -7.921 -23.305 -4.635 323 HA HIS 109 HA HIS 109 -8.127 -20.822 -3.225 324 HB2 HIS 109 HB2 HIS 109 -9.371 -21.769 -5.829 325 HB3 HIS 109 HB3 HIS 109 -9.630 -20.153 -5.180 326 HD1 HIS 109 HD1 HIS 109 -7.146 -18.794 -4.581 327 HD2 HIS 109 HD2 HIS 109 -7.327 -21.873 -7.458 328 HE1 HIS 109 HE1 HIS 109 -5.084 -18.494 -6.089 329 HE2 HIS 109 HE2 HIS 109 -5.200 -20.367 -7.855 330 H ALA 110 H ALA 110 -10.645 -23.342 -3.712 331 HA ALA 110 HA ALA 110 -12.735 -21.916 -2.465 332 HB1 ALA 110 HB1 ALA 110 -12.212 -24.920 -2.556 333 HB2 ALA 110 HB2 ALA 110 -13.763 -24.145 -2.188 334 HB3 ALA 110 HB3 ALA 110 -13.047 -23.964 -3.800 335 H ALA 111 H ALA 111 -10.201 -24.035 -0.993 336 HA ALA 111 HA ALA 111 -11.119 -23.832 1.635 337 HB1 ALA 111 HB1 ALA 111 -9.589 -25.560 0.814 338 HB2 ALA 111 HB2 ALA 111 -8.311 -24.338 0.592 339 HB3 ALA 111 HB3 ALA 111 -8.904 -24.716 2.220 340 H THR 112 H THR 112 -8.750 -21.762 -0.142 341 HA THR 112 HA THR 112 -8.155 -20.165 2.210 342 HB THR 112 HB THR 112 -6.911 -18.699 0.691 343 HG1 THR 112 HG1 THR 112 -6.751 -19.242 -1.470 344 HG21 THR 112 HG21 THR 112 -6.317 -21.650 0.203 345 HG22 THR 112 HG22 THR 112 -5.187 -20.291 0.040 346 HG23 THR 112 HG23 THR 112 -5.828 -20.716 1.633 347 H LEU 113 H LEU 113 -10.302 -19.558 -0.634 348 HA LEU 113 HA LEU 113 -11.006 -16.917 0.335 349 HB2 LEU 113 HB2 LEU 113 -10.763 -17.511 -2.045 350 HB3 LEU 113 HB3 LEU 113 -12.069 -18.690 -1.899 351 HG LEU 113 HG LEU 113 -13.678 -16.953 -1.458 352 HD11 LEU 113 HD11 LEU 113 -12.313 -15.196 -0.382 353 HD12 LEU 113 HD12 LEU 113 -11.375 -14.989 -1.881 354 HD13 LEU 113 HD13 LEU 113 -13.095 -14.539 -1.820 355 HD21 LEU 113 HD21 LEU 113 -13.716 -15.954 -3.702 356 HD22 LEU 113 HD22 LEU 113 -11.994 -16.338 -3.919 357 HD23 LEU 113 HD23 LEU 113 -13.183 -17.648 -3.782 358 H GLU 114 H GLU 114 -12.383 -20.135 0.619 359 HA GLU 114 HA GLU 114 -14.169 -21.006 1.683 360 HB2 GLU 114 HB2 GLU 114 -12.486 -20.289 3.367 361 HB3 GLU 114 HB3 GLU 114 -13.491 -18.888 3.744 362 HG2 GLU 114 HG2 GLU 114 -15.355 -20.418 4.393 363 HG3 GLU 114 HG3 GLU 114 -14.376 -21.807 3.935 364 H HIS 115 H HIS 115 -15.600 -20.211 -0.069 365 HA HIS 115 HA HIS 115 -17.251 -17.982 -0.001 366 HB2 HIS 115 HB2 HIS 115 -17.952 -20.794 -0.963 367 HB3 HIS 115 HB3 HIS 115 -18.822 -19.335 -1.402 368 HD1 HIS 115 HD1 HIS 115 -17.254 -17.429 -2.799 369 HD2 HIS 115 HD2 HIS 115 -16.089 -21.488 -2.663 370 HE1 HIS 115 HE1 HIS 115 -15.679 -17.801 -4.803 371 HE2 HIS 115 HE2 HIS 115 -14.970 -20.274 -4.706 372 H HIS 116 H HIS 116 -17.649 -20.779 2.074 373 HA HIS 116 HA HIS 116 -20.375 -20.159 2.922 374 HB2 HIS 116 HB2 HIS 116 -18.327 -21.985 4.239 375 HB3 HIS 116 HB3 HIS 116 -20.072 -22.005 4.482 376 HD1 HIS 116 HD1 HIS 116 -17.800 -24.173 2.932 377 HD2 HIS 116 HD2 HIS 116 -21.264 -22.145 1.610 378 HE1 HIS 116 HE1 HIS 116 -18.660 -25.467 0.877 379 HE2 HIS 116 HE2 HIS 116 -20.770 -24.219 0.076 380 H HIS 117 H HIS 117 -17.534 -18.519 3.694 381 HA HIS 117 HA HIS 117 -17.952 -18.110 6.536 382 HB2 HIS 117 HB2 HIS 117 -15.772 -18.097 5.182 383 HB3 HIS 117 HB3 HIS 117 -16.167 -16.460 4.705 384 HD1 HIS 117 HD1 HIS 117 -14.471 -18.401 7.321 385 HD2 HIS 117 HD2 HIS 117 -16.467 -14.689 7.006 386 HE1 HIS 117 HE1 HIS 117 -13.749 -16.993 9.378 387 HE2 HIS 117 HE2 HIS 117 -15.017 -14.741 9.195 388 H HIS 118 H HIS 118 -20.330 -17.551 6.105 389 HA HIS 118 HA HIS 118 -20.924 -14.798 5.267 390 HB2 HIS 118 HB2 HIS 118 -22.727 -16.840 6.616 391 HB3 HIS 118 HB3 HIS 118 -23.237 -15.387 5.765 392 HD1 HIS 118 HD1 HIS 118 -21.888 -15.562 3.002 393 HD2 HIS 118 HD2 HIS 118 -23.388 -18.868 5.156 394 HE1 HIS 118 HE1 HIS 118 -22.347 -17.405 1.266 395 HE2 HIS 118 HE2 HIS 118 -23.301 -19.409 2.584 396 H HIS 119 H HIS 119 -20.334 -16.354 8.348 397 HA HIS 119 HA HIS 119 -21.120 -14.048 10.004 398 HB2 HIS 119 HB2 HIS 119 -20.161 -15.392 11.845 399 HB3 HIS 119 HB3 HIS 119 -21.324 -16.296 10.903 400 HD1 HIS 119 HD1 HIS 119 -17.453 -16.072 11.362 401 HD2 HIS 119 HD2 HIS 119 -20.540 -18.609 9.931 402 HE1 HIS 119 HE1 HIS 119 -16.362 -18.343 10.832 403 HE2 HIS 119 HE2 HIS 119 -18.240 -19.877 9.965 404 H HIS 120 H HIS 120 -19.394 -13.175 11.566 405 HA HIS 120 HA HIS 120 -17.177 -11.922 10.225 406 HB2 HIS 120 HB2 HIS 120 -18.281 -11.053 12.284 407 HB3 HIS 120 HB3 HIS 120 -17.641 -12.418 13.197 408 HD1 HIS 120 HD1 HIS 120 -16.438 -9.188 11.466 409 HD2 HIS 120 HD2 HIS 120 -15.086 -12.309 13.969 410 HE1 HIS 120 HE1 HIS 120 -14.120 -8.467 12.334 411 HE2 HIS 120 HE2 HIS 120 -13.305 -10.372 13.870 Start of MODEL 19 1 H1 SER 66 H1 SER 66 15.757 -7.603 9.617 2 H2 SER 66 H2 SER 66 16.689 -6.325 9.194 3 H3 SER 66 H3 SER 66 15.945 -7.214 8.032 4 HA SER 66 HA SER 66 18.268 -7.751 8.074 5 HB2 SER 66 HB2 SER 66 17.817 -8.535 10.981 6 HB3 SER 66 HB3 SER 66 19.323 -8.696 10.058 7 HG SER 66 HG SER 66 19.291 -6.764 11.302 8 H GLY 67 H GLY 67 19.041 -9.871 7.562 9 HA2 GLY 67 HA2 GLY 67 18.903 -12.105 7.057 10 HA3 GLY 67 HA3 GLY 67 17.596 -12.284 8.231 11 H SER 68 H SER 68 17.117 -9.960 5.671 12 HA SER 68 HA SER 68 14.643 -11.044 4.950 13 HB2 SER 68 HB2 SER 68 16.308 -9.096 3.319 14 HB3 SER 68 HB3 SER 68 14.542 -9.270 3.312 15 HG SER 68 HG SER 68 15.200 -7.524 4.643 16 H GLY 69 H GLY 69 17.741 -11.885 3.584 17 HA2 GLY 69 HA2 GLY 69 16.831 -12.901 1.031 18 HA3 GLY 69 HA3 GLY 69 18.370 -13.226 1.820 19 H ARG 70 H ARG 70 16.380 -14.191 4.190 20 HA ARG 70 HA ARG 70 16.474 -17.036 3.526 21 HB2 ARG 70 HB2 ARG 70 15.190 -15.519 5.842 22 HB3 ARG 70 HB3 ARG 70 15.243 -17.275 5.705 23 HG2 ARG 70 HG2 ARG 70 17.724 -17.241 5.712 24 HG3 ARG 70 HG3 ARG 70 17.708 -15.479 5.799 25 HD2 ARG 70 HD2 ARG 70 18.105 -16.291 8.005 26 HD3 ARG 70 HD3 ARG 70 16.471 -15.604 7.958 27 HE ARG 70 HE ARG 70 16.476 -18.467 7.432 28 HH11 ARG 70 HH11 ARG 70 16.707 -16.237 10.127 29 HH12 ARG 70 HH12 ARG 70 16.053 -17.393 11.256 30 HH21 ARG 70 HH21 ARG 70 15.630 -19.884 8.917 31 HH22 ARG 70 HH22 ARG 70 15.495 -19.418 10.587 32 H GLY 71 H GLY 71 14.698 -18.474 3.445 33 HA2 GLY 71 HA2 GLY 71 12.686 -17.770 1.555 34 HA3 GLY 71 HA3 GLY 71 12.748 -19.267 2.484 35 H ARG 72 H ARG 72 10.715 -16.965 1.744 36 HA ARG 72 HA ARG 72 9.211 -16.934 4.333 37 HB2 ARG 72 HB2 ARG 72 9.898 -14.571 2.531 38 HB3 ARG 72 HB3 ARG 72 8.606 -14.512 3.735 39 HG2 ARG 72 HG2 ARG 72 10.151 -14.894 5.560 40 HG3 ARG 72 HG3 ARG 72 11.502 -15.140 4.453 41 HD2 ARG 72 HD2 ARG 72 9.950 -12.538 4.707 42 HD3 ARG 72 HD3 ARG 72 11.461 -12.896 5.535 43 HE ARG 72 HE ARG 72 12.625 -13.046 3.407 44 HH11 ARG 72 HH21 ARG 72 9.451 -11.576 3.069 45 HH12 ARG 72 HH22 ARG 72 9.889 -10.782 1.587 46 HH21 ARG 72 HH11 ARG 72 13.155 -11.893 1.655 47 HH22 ARG 72 HH12 ARG 72 11.938 -11.009 0.762 48 H GLY 73 H GLY 73 6.962 -16.593 4.134 49 HA2 GLY 73 HA2 GLY 73 5.784 -17.965 1.827 50 HA3 GLY 73 HA3 GLY 73 4.979 -17.508 3.330 51 H ALA 74 H ALA 74 6.532 -14.799 1.912 52 HA ALA 74 HA ALA 74 4.033 -13.639 0.909 53 HB1 ALA 74 HB1 ALA 74 6.894 -12.587 0.937 54 HB2 ALA 74 HB2 ALA 74 5.438 -11.652 0.530 55 HB3 ALA 74 HB3 ALA 74 5.654 -12.280 2.175 56 H ILE 75 H ILE 75 3.808 -15.545 -0.486 57 HA ILE 75 HA ILE 75 5.213 -15.316 -3.102 58 HB ILE 75 HB ILE 75 4.233 -17.745 -1.560 59 HG12 ILE 75 HG12 ILE 75 6.338 -16.893 -0.659 60 HG13 ILE 75 HG13 ILE 75 6.537 -18.459 -1.407 61 HG21 ILE 75 HG21 ILE 75 5.331 -19.100 -3.367 62 HG22 ILE 75 HG22 ILE 75 3.851 -18.278 -3.853 63 HG23 ILE 75 HG23 ILE 75 5.424 -17.613 -4.346 64 HD11 ILE 75 HD11 ILE 75 8.435 -17.003 -1.904 65 HD12 ILE 75 HD12 ILE 75 7.586 -17.422 -3.398 66 HD13 ILE 75 HD13 ILE 75 7.371 -15.810 -2.669 67 H ASP 76 H ASP 76 4.045 -15.370 -4.954 68 HA ASP 76 HA ASP 76 1.090 -15.750 -4.810 69 HB2 ASP 76 HB2 ASP 76 0.645 -13.789 -6.004 70 HB3 ASP 76 HB3 ASP 76 1.628 -13.359 -4.613 71 H ARG 77 H ARG 77 3.686 -15.219 -7.250 72 HA ARG 77 HA ARG 77 2.352 -16.765 -9.300 73 HB2 ARG 77 HB2 ARG 77 3.939 -14.870 -9.645 74 HB3 ARG 77 HB3 ARG 77 5.263 -15.881 -9.048 75 HG2 ARG 77 HG2 ARG 77 4.961 -17.436 -10.943 76 HG3 ARG 77 HG3 ARG 77 3.545 -16.511 -11.500 77 HD2 ARG 77 HD2 ARG 77 4.986 -14.534 -11.856 78 HD3 ARG 77 HD3 ARG 77 6.396 -15.459 -11.288 79 HE ARG 77 HE ARG 77 5.150 -16.895 -13.418 80 HH11 ARG 77 HH11 ARG 77 7.012 -13.950 -13.029 81 HH12 ARG 77 HH12 ARG 77 7.638 -14.014 -14.652 82 HH21 ARG 77 HH21 ARG 77 5.972 -16.914 -15.488 83 HH22 ARG 77 HH22 ARG 77 7.052 -15.652 -16.010 84 H GLU 78 H GLU 78 4.724 -17.595 -6.875 85 HA GLU 78 HA GLU 78 5.197 -20.290 -8.019 86 HB2 GLU 78 HB2 GLU 78 6.650 -18.706 -5.879 87 HB3 GLU 78 HB3 GLU 78 7.099 -20.337 -6.399 88 HG2 GLU 78 HG2 GLU 78 7.368 -19.497 -8.736 89 HG3 GLU 78 HG3 GLU 78 7.040 -17.859 -8.163 90 H GLN 79 H GLN 79 2.654 -19.563 -6.538 91 HA GLN 79 HA GLN 79 2.617 -20.998 -4.030 92 HB2 GLN 79 HB2 GLN 79 0.430 -20.103 -5.946 93 HB3 GLN 79 HB3 GLN 79 0.092 -20.970 -4.442 94 HG2 GLN 79 HG2 GLN 79 1.246 -19.222 -3.132 95 HG3 GLN 79 HG3 GLN 79 1.554 -18.313 -4.613 96 HE21 GLN 79 HE22 GLN 79 -0.364 -17.500 -5.843 97 HE22 GLN 79 HE21 GLN 79 -1.865 -17.216 -4.955 98 H SER 80 H SER 80 2.925 -22.377 -7.158 99 HA SER 80 HA SER 80 1.444 -24.731 -7.051 100 HB2 SER 80 HB2 SER 80 4.349 -24.454 -7.925 101 HB3 SER 80 HB3 SER 80 3.214 -25.731 -8.413 102 HG SER 80 HG SER 80 3.339 -24.039 -9.981 103 H ALA 81 H ALA 81 4.593 -24.155 -5.336 104 HA ALA 81 HA ALA 81 4.715 -26.731 -4.184 105 HB1 ALA 81 HB1 ALA 81 6.644 -25.208 -4.393 106 HB2 ALA 81 HB2 ALA 81 5.897 -24.082 -3.239 107 HB3 ALA 81 HB3 ALA 81 6.411 -25.694 -2.704 108 H ALA 82 H ALA 82 3.190 -23.717 -3.001 109 HA ALA 82 HA ALA 82 2.391 -24.738 -0.428 110 HB1 ALA 82 HB1 ALA 82 1.250 -22.465 -2.115 111 HB2 ALA 82 HB2 ALA 82 0.923 -22.759 -0.394 112 HB3 ALA 82 HB3 ALA 82 2.561 -22.333 -0.927 113 H ILE 83 H ILE 83 0.764 -24.660 -3.614 114 HA ILE 83 HA ILE 83 -1.704 -25.884 -2.813 115 HB ILE 83 HB ILE 83 -0.250 -25.783 -5.488 116 HG12 ILE 83 HG12 ILE 83 -2.730 -24.256 -4.661 117 HG13 ILE 83 HG13 ILE 83 -1.141 -23.609 -4.294 118 HG21 ILE 83 HG21 ILE 83 -2.468 -26.350 -6.517 119 HG22 ILE 83 HG22 ILE 83 -1.830 -27.675 -5.551 120 HG23 ILE 83 HG23 ILE 83 -3.120 -26.649 -4.895 121 HD11 ILE 83 HD11 ILE 83 -0.601 -23.659 -6.748 122 HD12 ILE 83 HD12 ILE 83 -2.285 -24.148 -7.043 123 HD13 ILE 83 HD13 ILE 83 -1.944 -22.583 -6.303 124 H ARG 84 H ARG 84 1.337 -27.321 -4.094 125 HA ARG 84 HA ARG 84 0.459 -30.050 -3.984 126 HB2 ARG 84 HB2 ARG 84 2.461 -29.034 -5.220 127 HB3 ARG 84 HB3 ARG 84 3.319 -29.010 -3.681 128 HG2 ARG 84 HG2 ARG 84 2.933 -31.535 -3.548 129 HG3 ARG 84 HG3 ARG 84 2.251 -31.451 -5.180 130 HD2 ARG 84 HD2 ARG 84 5.087 -30.723 -4.333 131 HD3 ARG 84 HD3 ARG 84 4.608 -32.151 -5.227 132 HE ARG 84 HE ARG 84 3.971 -30.734 -7.141 133 HH11 ARG 84 HH11 ARG 84 6.127 -29.197 -4.828 134 HH12 ARG 84 HH12 ARG 84 6.670 -28.025 -5.989 135 HH21 ARG 84 HH21 ARG 84 4.787 -29.307 -8.572 136 HH22 ARG 84 HH22 ARG 84 5.873 -28.034 -8.051 137 H GLU 85 H GLU 85 2.323 -28.161 -1.535 138 HA GLU 85 HA GLU 85 2.383 -30.211 0.365 139 HB2 GLU 85 HB2 GLU 85 3.732 -28.077 0.365 140 HB3 GLU 85 HB3 GLU 85 2.307 -27.243 1.011 141 HG2 GLU 85 HG2 GLU 85 2.302 -28.940 2.906 142 HG3 GLU 85 HG3 GLU 85 3.802 -29.596 2.265 143 H TRP 86 H TRP 86 -0.062 -27.542 0.013 144 HA TRP 86 HA TRP 86 -1.788 -28.262 2.047 145 HB2 TRP 86 HB2 TRP 86 -2.055 -26.223 0.786 146 HB3 TRP 86 HB3 TRP 86 -2.351 -27.116 -0.702 147 HD1 TRP 86 HD1 TRP 86 -4.054 -25.944 2.466 148 HE1 TRP 86 HE1 TRP 86 -6.563 -26.476 2.403 149 HE3 TRP 86 HE3 TRP 86 -4.205 -28.643 -1.892 150 HZ2 TRP 86 HZ2 TRP 86 -8.338 -28.150 0.849 151 HZ3 TRP 86 HZ3 TRP 86 -6.293 -29.785 -2.582 152 HH2 TRP 86 HH2 TRP 86 -8.351 -29.591 -1.183 153 H ALA 87 H ALA 87 -1.731 -29.559 -1.317 154 HA ALA 87 HA ALA 87 -3.942 -31.311 -0.980 155 HB1 ALA 87 HB1 ALA 87 -2.999 -30.591 -3.146 156 HB2 ALA 87 HB2 ALA 87 -1.520 -31.523 -2.843 157 HB3 ALA 87 HB3 ALA 87 -3.078 -32.365 -3.048 158 H ARG 88 H ARG 88 -0.432 -31.919 -0.476 159 HA ARG 88 HA ARG 88 -0.695 -34.664 0.324 160 HB2 ARG 88 HB2 ARG 88 1.405 -33.520 -0.404 161 HB3 ARG 88 HB3 ARG 88 1.431 -32.614 1.115 162 HG2 ARG 88 HG2 ARG 88 1.630 -34.743 2.384 163 HG3 ARG 88 HG3 ARG 88 1.549 -35.657 0.861 164 HD2 ARG 88 HD2 ARG 88 3.625 -34.554 0.093 165 HD3 ARG 88 HD3 ARG 88 3.697 -33.631 1.615 166 HE ARG 88 HE ARG 88 3.518 -36.407 2.242 167 HH11 ARG 88 HH11 ARG 88 5.904 -34.215 0.895 168 HH12 ARG 88 HH12 ARG 88 7.238 -35.181 1.459 169 HH21 ARG 88 HH21 ARG 88 5.269 -37.589 2.926 170 HH22 ARG 88 HH22 ARG 88 6.881 -37.037 2.582 171 H ARG 89 H ARG 89 -0.773 -31.672 2.284 172 HA ARG 89 HA ARG 89 -1.118 -32.919 4.861 173 HB2 ARG 89 HB2 ARG 89 -1.903 -30.185 3.771 174 HB3 ARG 89 HB3 ARG 89 -2.161 -30.656 5.448 175 HG2 ARG 89 HG2 ARG 89 0.228 -31.005 5.801 176 HG3 ARG 89 HG3 ARG 89 0.576 -30.642 4.109 177 HD2 ARG 89 HD2 ARG 89 -0.367 -28.363 4.392 178 HD3 ARG 89 HD3 ARG 89 -0.716 -28.702 6.087 179 HE ARG 89 HE ARG 89 1.883 -28.046 4.872 180 HH11 ARG 89 HH11 ARG 89 0.498 -29.445 7.802 181 HH12 ARG 89 HH12 ARG 89 1.937 -29.075 8.711 182 HH21 ARG 89 HH21 ARG 89 3.534 -27.622 5.995 183 HH22 ARG 89 HH22 ARG 89 3.670 -28.038 7.706 184 H ASN 90 H ASN 90 -3.501 -32.059 2.383 185 HA ASN 90 HA ASN 90 -5.751 -32.955 4.090 186 HB2 ASN 90 HB2 ASN 90 -5.570 -31.689 1.329 187 HB3 ASN 90 HB3 ASN 90 -7.076 -32.293 1.999 188 HD21 ASN 90 HD22 ASN 90 -4.574 -29.840 2.390 189 HD22 ASN 90 HD21 ASN 90 -5.511 -28.842 3.500 190 H GLY 91 H GLY 91 -3.581 -34.639 2.126 191 HA2 GLY 91 HA2 GLY 91 -3.569 -36.800 1.336 192 HA3 GLY 91 HA3 GLY 91 -5.129 -37.085 2.122 193 H HIS 92 H HIS 92 -4.769 -34.469 -0.211 194 HA HIS 92 HA HIS 92 -6.853 -35.691 -1.908 195 HB2 HIS 92 HB2 HIS 92 -6.890 -33.279 -1.099 196 HB3 HIS 92 HB3 HIS 92 -5.551 -32.950 -2.196 197 HD1 HIS 92 HD1 HIS 92 -9.301 -33.830 -2.227 198 HD2 HIS 92 HD2 HIS 92 -6.161 -32.738 -4.833 199 HE1 HIS 92 HE1 HIS 92 -10.394 -33.267 -4.494 200 HE2 HIS 92 HE2 HIS 92 -8.490 -32.607 -6.086 201 H ASN 93 H ASN 93 -6.664 -36.024 -4.166 202 HA ASN 93 HA ASN 93 -4.225 -37.230 -5.034 203 HB2 ASN 93 HB2 ASN 93 -6.537 -37.818 -5.803 204 HB3 ASN 93 HB3 ASN 93 -6.620 -36.280 -6.673 205 HD21 ASN 93 HD22 ASN 93 -7.102 -37.923 -8.461 206 HD22 ASN 93 HD21 ASN 93 -5.707 -38.546 -9.324 207 H VAL 94 H VAL 94 -2.471 -36.460 -6.143 208 HA VAL 94 HA VAL 94 -2.485 -33.870 -7.494 209 HB VAL 94 HB VAL 94 -2.196 -33.306 -5.083 210 HG11 VAL 94 HG11 VAL 94 0.526 -34.659 -5.282 211 HG12 VAL 94 HG12 VAL 94 -0.098 -33.698 -3.929 212 HG13 VAL 94 HG13 VAL 94 -0.857 -35.241 -4.337 213 HG21 VAL 94 HG21 VAL 94 -1.353 -31.820 -6.885 214 HG22 VAL 94 HG22 VAL 94 -0.484 -31.686 -5.355 215 HG23 VAL 94 HG23 VAL 94 0.265 -32.552 -6.699 216 H SER 95 H SER 95 -0.486 -33.439 -8.700 217 HA SER 95 HA SER 95 0.276 -35.780 -10.137 218 HB2 SER 95 HB2 SER 95 1.629 -34.140 -11.444 219 HB3 SER 95 HB3 SER 95 -0.026 -33.570 -11.160 220 HG SER 95 HG SER 95 1.668 -31.997 -10.689 221 H THR 96 H THR 96 1.822 -34.245 -7.458 222 HA THR 96 HA THR 96 3.866 -34.169 -6.536 223 HB THR 96 HB THR 96 5.143 -36.166 -6.180 224 HG1 THR 96 HG1 THR 96 4.538 -38.118 -7.123 225 HG21 THR 96 HG21 THR 96 2.163 -36.768 -6.082 226 HG22 THR 96 HG22 THR 96 3.439 -37.515 -5.095 227 HG23 THR 96 HG23 THR 96 3.059 -35.801 -4.889 228 H ARG 97 H ARG 97 3.652 -33.209 -9.254 229 HA ARG 97 HA ARG 97 6.543 -33.098 -10.046 230 HB2 ARG 97 HB2 ARG 97 4.109 -33.924 -11.653 231 HB3 ARG 97 HB3 ARG 97 5.422 -33.101 -12.489 232 HG2 ARG 97 HG2 ARG 97 7.022 -34.751 -11.980 233 HG3 ARG 97 HG3 ARG 97 6.020 -35.504 -10.735 234 HD2 ARG 97 HD2 ARG 97 5.203 -35.443 -13.665 235 HD3 ARG 97 HD3 ARG 97 6.187 -36.738 -12.951 236 HE ARG 97 HE ARG 97 3.923 -36.383 -11.281 237 HH11 ARG 97 HH11 ARG 97 4.511 -37.626 -14.511 238 HH12 ARG 97 HH12 ARG 97 3.176 -38.741 -14.408 239 HH21 ARG 97 HH21 ARG 97 2.310 -37.782 -11.198 240 HH22 ARG 97 HH22 ARG 97 1.923 -38.822 -12.553 241 H GLY 98 H GLY 98 6.746 -31.376 -11.867 242 HA2 GLY 98 HA2 GLY 98 6.524 -28.850 -10.653 243 HA3 GLY 98 HA3 GLY 98 6.857 -29.140 -12.363 244 H ARG 99 H ARG 99 4.535 -30.185 -13.303 245 HA ARG 99 HA ARG 99 2.584 -27.947 -13.201 246 HB2 ARG 99 HB2 ARG 99 2.673 -30.490 -14.884 247 HB3 ARG 99 HB3 ARG 99 1.414 -29.250 -14.994 248 HG2 ARG 99 HG2 ARG 99 3.130 -27.551 -15.584 249 HG3 ARG 99 HG3 ARG 99 4.388 -28.803 -15.531 250 HD2 ARG 99 HD2 ARG 99 3.196 -30.052 -17.322 251 HD3 ARG 99 HD3 ARG 99 1.962 -28.775 -17.382 252 HE ARG 99 HE ARG 99 4.531 -27.585 -17.730 253 HH11 ARG 99 HH11 ARG 99 2.355 -29.636 -19.561 254 HH12 ARG 99 HH12 ARG 99 2.971 -29.085 -21.094 255 HH21 ARG 99 HH21 ARG 99 5.265 -26.914 -19.718 256 HH22 ARG 99 HH22 ARG 99 4.576 -27.574 -21.173 257 H ILE 100 H ILE 100 0.494 -28.093 -12.478 258 HA ILE 100 HA ILE 100 -0.234 -30.428 -10.763 259 HB ILE 100 HB ILE 100 -0.375 -27.482 -10.092 260 HG12 ILE 100 HG12 ILE 100 1.127 -29.867 -8.902 261 HG13 ILE 100 HG13 ILE 100 1.822 -28.479 -9.747 262 HG21 ILE 100 HG21 ILE 100 -1.459 -28.078 -7.988 263 HG22 ILE 100 HG22 ILE 100 -2.472 -28.614 -9.307 264 HG23 ILE 100 HG23 ILE 100 -1.466 -29.798 -8.425 265 HD11 ILE 100 HD11 ILE 100 0.951 -27.011 -7.878 266 HD12 ILE 100 HD12 ILE 100 0.573 -28.509 -6.989 267 HD13 ILE 100 HD13 ILE 100 2.246 -28.149 -7.451 268 HA PRO 101 HA PRO 101 -4.014 -30.190 -13.145 269 HB2 PRO 101 HB2 PRO 101 -5.484 -31.484 -10.900 270 HB3 PRO 101 HB3 PRO 101 -5.244 -32.051 -12.574 271 HG2 PRO 101 HG2 PRO 101 -3.945 -33.171 -10.418 272 HG3 PRO 101 HG3 PRO 101 -3.200 -33.058 -12.047 273 HD2 PRO 101 HD2 PRO 101 -2.756 -31.294 -9.644 274 HD3 PRO 101 HD3 PRO 101 -1.582 -31.945 -10.821 275 H ALA 102 H ALA 102 -5.732 -28.805 -13.380 276 HA ALA 102 HA ALA 102 -6.011 -26.583 -11.726 277 HB1 ALA 102 HB1 ALA 102 -7.923 -26.028 -13.084 278 HB2 ALA 102 HB2 ALA 102 -6.618 -26.680 -14.099 279 HB3 ALA 102 HB3 ALA 102 -8.020 -27.707 -13.690 280 H ASP 103 H ASP 103 -7.757 -29.666 -11.523 281 HA ASP 103 HA ASP 103 -9.795 -29.055 -9.777 282 HB2 ASP 103 HB2 ASP 103 -9.495 -31.263 -10.752 283 HB3 ASP 103 HB3 ASP 103 -7.959 -31.480 -9.906 284 H VAL 104 H VAL 104 -6.348 -29.627 -9.022 285 HA VAL 104 HA VAL 104 -6.739 -29.451 -6.177 286 HB VAL 104 HB VAL 104 -4.063 -29.250 -7.487 287 HG11 VAL 104 HG11 VAL 104 -4.150 -28.999 -5.042 288 HG12 VAL 104 HG12 VAL 104 -4.995 -30.554 -4.904 289 HG13 VAL 104 HG13 VAL 104 -3.318 -30.488 -5.507 290 HG21 VAL 104 HG21 VAL 104 -5.657 -31.815 -7.103 291 HG22 VAL 104 HG22 VAL 104 -5.012 -31.173 -8.634 292 HG23 VAL 104 HG23 VAL 104 -3.905 -31.760 -7.406 293 H ILE 105 H ILE 105 -5.538 -27.289 -8.729 294 HA ILE 105 HA ILE 105 -4.767 -25.081 -7.054 295 HB ILE 105 HB ILE 105 -5.761 -25.273 -9.927 296 HG12 ILE 105 HG12 ILE 105 -2.957 -24.474 -9.131 297 HG13 ILE 105 HG13 ILE 105 -3.373 -26.167 -8.918 298 HG21 ILE 105 HG21 ILE 105 -6.251 -23.004 -9.186 299 HG22 ILE 105 HG22 ILE 105 -4.639 -22.851 -8.444 300 HG23 ILE 105 HG23 ILE 105 -4.818 -22.965 -10.212 301 HD11 ILE 105 HD11 ILE 105 -3.711 -24.683 -11.546 302 HD12 ILE 105 HD12 ILE 105 -2.311 -25.686 -11.099 303 HD13 ILE 105 HD13 ILE 105 -3.916 -26.423 -11.229 304 H ASP 106 H ASP 106 -7.943 -25.848 -8.615 305 HA ASP 106 HA ASP 106 -9.386 -23.780 -7.428 306 HB2 ASP 106 HB2 ASP 106 -10.138 -25.092 -9.356 307 HB3 ASP 106 HB3 ASP 106 -10.301 -26.523 -8.338 308 H ALA 107 H ALA 107 -8.904 -27.174 -6.267 309 HA ALA 107 HA ALA 107 -10.388 -27.057 -3.965 310 HB1 ALA 107 HB1 ALA 107 -9.357 -29.092 -4.946 311 HB2 ALA 107 HB2 ALA 107 -7.746 -28.527 -4.447 312 HB3 ALA 107 HB3 ALA 107 -8.972 -28.942 -3.233 313 H TYR 108 H TYR 108 -6.946 -26.121 -4.340 314 HA TYR 108 HA TYR 108 -6.513 -25.223 -1.654 315 HB2 TYR 108 HB2 TYR 108 -4.676 -25.711 -3.112 316 HB3 TYR 108 HB3 TYR 108 -5.228 -24.562 -4.319 317 HD1 TYR 108 HD2 TYR 108 -3.765 -24.851 -0.894 318 HD2 TYR 108 HD1 TYR 108 -4.615 -22.257 -4.235 319 HE1 TYR 108 HE2 TYR 108 -2.239 -23.130 0.056 320 HE2 TYR 108 HE1 TYR 108 -3.107 -20.526 -3.276 321 HH TYR 108 HH TYR 108 -1.674 -19.983 -1.582 322 H HIS 109 H HIS 109 -7.522 -23.361 -4.623 323 HA HIS 109 HA HIS 109 -7.842 -20.860 -3.274 324 HB2 HIS 109 HB2 HIS 109 -9.352 -21.978 -5.676 325 HB3 HIS 109 HB3 HIS 109 -9.435 -20.310 -5.129 326 HD1 HIS 109 HD1 HIS 109 -8.399 -20.944 -8.031 327 HD2 HIS 109 HD2 HIS 109 -6.041 -20.280 -4.592 328 HE1 HIS 109 HE1 HIS 109 -6.109 -20.121 -8.865 329 HE2 HIS 109 HE2 HIS 109 -4.677 -19.724 -6.762 330 H ALA 110 H ALA 110 -10.234 -23.544 -3.580 331 HA ALA 110 HA ALA 110 -12.329 -22.181 -2.249 332 HB1 ALA 110 HB1 ALA 110 -11.713 -25.168 -2.317 333 HB2 ALA 110 HB2 ALA 110 -13.266 -24.426 -1.898 334 HB3 ALA 110 HB3 ALA 110 -12.621 -24.260 -3.546 335 H ALA 111 H ALA 111 -9.686 -24.255 -0.868 336 HA ALA 111 HA ALA 111 -10.501 -24.068 1.784 337 HB1 ALA 111 HB1 ALA 111 -8.887 -25.701 0.882 338 HB2 ALA 111 HB2 ALA 111 -7.700 -24.396 0.654 339 HB3 ALA 111 HB3 ALA 111 -8.230 -24.829 2.290 340 H THR 112 H THR 112 -8.341 -21.878 -0.085 341 HA THR 112 HA THR 112 -7.725 -20.233 2.242 342 HB THR 112 HB THR 112 -6.588 -18.737 0.677 343 HG1 THR 112 HG1 THR 112 -6.494 -19.253 -1.488 344 HG21 THR 112 HG21 THR 112 -4.834 -20.274 -0.061 345 HG22 THR 112 HG22 THR 112 -5.376 -20.701 1.570 346 HG23 THR 112 HG23 THR 112 -5.903 -21.666 0.177 347 H LEU 113 H LEU 113 -10.195 -19.944 -0.320 348 HA LEU 113 HA LEU 113 -10.880 -17.237 0.579 349 HB2 LEU 113 HB2 LEU 113 -10.584 -17.781 -1.803 350 HB3 LEU 113 HB3 LEU 113 -11.845 -19.016 -1.680 351 HG LEU 113 HG LEU 113 -13.524 -17.328 -1.215 352 HD11 LEU 113 HD11 LEU 113 -13.007 -14.899 -1.573 353 HD12 LEU 113 HD12 LEU 113 -12.198 -15.540 -0.142 354 HD13 LEU 113 HD13 LEU 113 -11.279 -15.300 -1.643 355 HD21 LEU 113 HD21 LEU 113 -13.067 -18.000 -3.538 356 HD22 LEU 113 HD22 LEU 113 -13.582 -16.312 -3.459 357 HD23 LEU 113 HD23 LEU 113 -11.865 -16.700 -3.692 358 H GLU 114 H GLU 114 -12.395 -20.473 0.600 359 HA GLU 114 HA GLU 114 -14.919 -19.329 1.608 360 HB2 GLU 114 HB2 GLU 114 -14.600 -21.095 -0.291 361 HB3 GLU 114 HB3 GLU 114 -14.549 -22.261 1.025 362 HG2 GLU 114 HG2 GLU 114 -16.773 -20.228 0.516 363 HG3 GLU 114 HG3 GLU 114 -16.792 -21.907 -0.016 364 H HIS 115 H HIS 115 -14.354 -18.661 3.657 365 HA HIS 115 HA HIS 115 -12.900 -20.315 5.493 366 HB2 HIS 115 HB2 HIS 115 -14.414 -17.735 6.043 367 HB3 HIS 115 HB3 HIS 115 -13.120 -18.425 7.024 368 HD1 HIS 115 HD1 HIS 115 -13.268 -15.573 5.096 369 HD2 HIS 115 HD2 HIS 115 -10.966 -19.099 4.730 370 HE1 HIS 115 HE1 HIS 115 -11.232 -14.969 3.636 371 HE2 HIS 115 HE2 HIS 115 -9.856 -17.148 3.388 372 H HIS 116 H HIS 116 -16.139 -20.686 4.758 373 HA HIS 116 HA HIS 116 -16.888 -21.561 7.522 374 HB2 HIS 116 HB2 HIS 116 -18.713 -21.049 5.154 375 HB3 HIS 116 HB3 HIS 116 -19.178 -21.288 6.832 376 HD1 HIS 116 HD1 HIS 116 -18.439 -19.187 8.553 377 HD2 HIS 116 HD2 HIS 116 -18.169 -18.603 4.377 378 HE1 HIS 116 HE1 HIS 116 -18.250 -16.642 8.186 379 HE2 HIS 116 HE2 HIS 116 -18.098 -16.293 5.636 380 H HIS 117 H HIS 117 -15.370 -23.080 5.176 381 HA HIS 117 HA HIS 117 -17.172 -25.202 4.476 382 HB2 HIS 117 HB2 HIS 117 -14.958 -24.119 3.317 383 HB3 HIS 117 HB3 HIS 117 -14.243 -25.578 3.994 384 HD1 HIS 117 HD1 HIS 117 -17.177 -24.480 1.745 385 HD2 HIS 117 HD2 HIS 117 -14.705 -27.806 2.581 386 HE1 HIS 117 HE1 HIS 117 -17.736 -26.287 -0.045 387 HE2 HIS 117 HE2 HIS 117 -16.210 -28.303 0.484 388 H HIS 118 H HIS 118 -15.471 -24.900 7.351 389 HA HIS 118 HA HIS 118 -15.791 -27.798 7.981 390 HB2 HIS 118 HB2 HIS 118 -13.627 -27.851 9.118 391 HB3 HIS 118 HB3 HIS 118 -13.415 -27.430 7.433 392 HD1 HIS 118 HD1 HIS 118 -13.147 -25.829 10.943 393 HD2 HIS 118 HD2 HIS 118 -12.369 -25.026 6.856 394 HE1 HIS 118 HE1 HIS 118 -11.753 -23.670 10.877 395 HE2 HIS 118 HE2 HIS 118 -11.268 -23.191 8.386 396 H HIS 119 H HIS 119 -15.873 -28.256 10.291 397 HA HIS 119 HA HIS 119 -17.393 -26.319 11.879 398 HB2 HIS 119 HB2 HIS 119 -16.100 -28.960 12.709 399 HB3 HIS 119 HB3 HIS 119 -17.308 -28.063 13.624 400 HD1 HIS 119 HD1 HIS 119 -17.253 -31.001 11.600 401 HD2 HIS 119 HD2 HIS 119 -19.673 -27.539 11.802 402 HE1 HIS 119 HE1 HIS 119 -19.500 -31.620 10.505 403 HE2 HIS 119 HE2 HIS 119 -20.965 -29.499 10.622 404 H HIS 120 H HIS 120 -16.716 -25.507 13.975 405 HA HIS 120 HA HIS 120 -15.430 -24.018 15.115 406 HB2 HIS 120 HB2 HIS 120 -14.696 -26.217 16.022 407 HB3 HIS 120 HB3 HIS 120 -13.311 -26.179 14.935 408 HD1 HIS 120 HD1 HIS 120 -11.885 -23.662 15.304 409 HD2 HIS 120 HD2 HIS 120 -14.138 -25.379 18.424 410 HE1 HIS 120 HE1 HIS 120 -10.948 -22.662 17.526 411 HE2 HIS 120 HE2 HIS 120 -12.348 -23.721 19.413 Start of MODEL 20 1 H1 SER 66 H1 SER 66 20.887 -5.896 1.469 2 H2 SER 66 H2 SER 66 19.504 -6.665 1.038 3 H3 SER 66 H3 SER 66 20.961 -7.318 0.662 4 HA SER 66 HA SER 66 19.865 -4.800 -0.409 5 HB2 SER 66 HB2 SER 66 22.505 -6.152 -1.107 6 HB3 SER 66 HB3 SER 66 21.846 -4.675 -1.831 7 HG SER 66 HG SER 66 23.343 -4.210 -0.141 8 H GLY 67 H GLY 67 19.300 -4.831 -2.670 9 HA2 GLY 67 HA2 GLY 67 19.362 -7.131 -4.355 10 HA3 GLY 67 HA3 GLY 67 17.794 -7.069 -3.540 11 H SER 68 H SER 68 17.596 -6.961 -6.131 12 HA SER 68 HA SER 68 17.954 -4.393 -7.377 13 HB2 SER 68 HB2 SER 68 16.260 -6.751 -8.276 14 HB3 SER 68 HB3 SER 68 16.831 -5.416 -9.293 15 HG SER 68 HG SER 68 18.191 -7.278 -9.465 16 H GLY 69 H GLY 69 15.352 -5.520 -5.389 17 HA2 GLY 69 HA2 GLY 69 13.366 -4.509 -4.749 18 HA3 GLY 69 HA3 GLY 69 13.848 -3.074 -5.643 19 H ARG 70 H ARG 70 11.676 -2.811 -6.283 20 HA ARG 70 HA ARG 70 9.803 -2.980 -7.601 21 HB2 ARG 70 HB2 ARG 70 11.835 -3.941 -9.646 22 HB3 ARG 70 HB3 ARG 70 10.237 -3.265 -9.997 23 HG2 ARG 70 HG2 ARG 70 10.901 -1.124 -8.918 24 HG3 ARG 70 HG3 ARG 70 12.531 -1.776 -8.648 25 HD2 ARG 70 HD2 ARG 70 12.809 -2.103 -11.083 26 HD3 ARG 70 HD3 ARG 70 11.186 -1.436 -11.358 27 HE ARG 70 HE ARG 70 12.699 0.444 -9.840 28 HH11 ARG 70 HH21 ARG 70 12.669 -0.809 -13.109 29 HH12 ARG 70 HH22 ARG 70 13.375 0.642 -13.776 30 HH21 ARG 70 HH11 ARG 70 13.585 2.269 -10.742 31 HH22 ARG 70 HH12 ARG 70 13.897 2.334 -12.453 32 H GLY 71 H GLY 71 9.944 -5.128 -5.908 33 HA2 GLY 71 HA2 GLY 71 9.334 -7.650 -7.139 34 HA3 GLY 71 HA3 GLY 71 8.935 -7.175 -5.491 35 H ARG 72 H ARG 72 7.472 -8.554 -7.785 36 HA ARG 72 HA ARG 72 4.810 -7.278 -7.392 37 HB2 ARG 72 HB2 ARG 72 5.997 -8.034 -10.113 38 HB3 ARG 72 HB3 ARG 72 4.304 -7.631 -9.849 39 HG2 ARG 72 HG2 ARG 72 6.635 -5.718 -9.423 40 HG3 ARG 72 HG3 ARG 72 5.577 -5.774 -10.827 41 HD2 ARG 72 HD2 ARG 72 3.620 -5.237 -9.435 42 HD3 ARG 72 HD3 ARG 72 4.621 -5.176 -7.992 43 HE ARG 72 HE ARG 72 4.504 -3.211 -10.202 44 HH11 ARG 72 HH11 ARG 72 6.222 -4.067 -7.243 45 HH12 ARG 72 HH12 ARG 72 6.721 -2.412 -6.977 46 HH21 ARG 72 HH21 ARG 72 5.252 -1.174 -9.832 47 HH22 ARG 72 HH22 ARG 72 6.244 -0.839 -8.446 48 H GLY 73 H GLY 73 3.027 -8.683 -8.010 49 HA2 GLY 73 HA2 GLY 73 3.369 -11.349 -6.919 50 HA3 GLY 73 HA3 GLY 73 1.860 -10.588 -7.432 51 H ALA 74 H ALA 74 4.312 -10.695 -9.890 52 HA ALA 74 HA ALA 74 2.982 -12.815 -11.416 53 HB1 ALA 74 HB1 ALA 74 3.861 -10.794 -12.527 54 HB2 ALA 74 HB2 ALA 74 5.502 -11.188 -11.961 55 HB3 ALA 74 HB3 ALA 74 4.674 -12.254 -13.117 56 H ILE 75 H ILE 75 3.238 -14.195 -9.504 57 HA ILE 75 HA ILE 75 5.838 -15.637 -9.380 58 HB ILE 75 HB ILE 75 3.811 -14.958 -7.210 59 HG12 ILE 75 HG12 ILE 75 5.202 -13.028 -7.751 60 HG13 ILE 75 HG13 ILE 75 5.526 -13.628 -6.143 61 HG21 ILE 75 HG21 ILE 75 6.344 -16.618 -6.939 62 HG22 ILE 75 HG22 ILE 75 5.403 -15.946 -5.587 63 HG23 ILE 75 HG23 ILE 75 4.660 -17.133 -6.660 64 HD11 ILE 75 HD11 ILE 75 7.640 -14.666 -6.926 65 HD12 ILE 75 HD12 ILE 75 7.302 -14.099 -8.583 66 HD13 ILE 75 HD13 ILE 75 7.582 -12.934 -7.280 67 H ASP 76 H ASP 76 5.810 -17.870 -9.251 68 HA ASP 76 HA ASP 76 3.202 -19.308 -9.599 69 HB2 ASP 76 HB2 ASP 76 3.913 -18.492 -11.818 70 HB3 ASP 76 HB3 ASP 76 5.465 -19.304 -11.631 71 H ARG 77 H ARG 77 6.794 -19.751 -9.533 72 HA ARG 77 HA ARG 77 6.768 -22.470 -8.879 73 HB2 ARG 77 HB2 ARG 77 8.779 -21.221 -9.594 74 HB3 ARG 77 HB3 ARG 77 8.753 -20.280 -8.110 75 HG2 ARG 77 HG2 ARG 77 10.502 -21.840 -7.909 76 HG3 ARG 77 HG3 ARG 77 9.258 -22.383 -6.806 77 HD2 ARG 77 HD2 ARG 77 9.785 -23.507 -9.585 78 HD3 ARG 77 HD3 ARG 77 10.399 -24.204 -8.077 79 HE ARG 77 HE ARG 77 7.652 -24.131 -7.679 80 HH11 ARG 77 HH11 ARG 77 9.815 -25.779 -9.921 81 HH12 ARG 77 HH12 ARG 77 8.590 -26.976 -10.315 82 HH21 ARG 77 HH21 ARG 77 6.095 -25.562 -8.517 83 HH22 ARG 77 HH22 ARG 77 6.660 -26.904 -9.504 84 H GLU 78 H GLU 78 6.571 -19.729 -6.685 85 HA GLU 78 HA GLU 78 6.568 -21.257 -4.230 86 HB2 GLU 78 HB2 GLU 78 7.169 -18.843 -4.486 87 HB3 GLU 78 HB3 GLU 78 5.471 -18.482 -4.815 88 HG2 GLU 78 HG2 GLU 78 4.851 -19.289 -2.557 89 HG3 GLU 78 HG3 GLU 78 6.525 -19.760 -2.251 90 H GLN 79 H GLN 79 3.946 -20.091 -6.385 91 HA GLN 79 HA GLN 79 1.795 -20.810 -4.579 92 HB2 GLN 79 HB2 GLN 79 1.685 -20.407 -7.605 93 HB3 GLN 79 HB3 GLN 79 0.319 -20.480 -6.485 94 HG2 GLN 79 HG2 GLN 79 1.531 -18.475 -5.269 95 HG3 GLN 79 HG3 GLN 79 2.401 -18.308 -6.800 96 HE21 GLN 79 HE22 GLN 79 1.264 -17.254 -8.558 97 HE22 GLN 79 HE21 GLN 79 -0.431 -16.804 -8.411 98 H SER 80 H SER 80 3.247 -22.472 -7.419 99 HA SER 80 HA SER 80 1.607 -24.824 -7.239 100 HB2 SER 80 HB2 SER 80 3.415 -25.910 -8.570 101 HB3 SER 80 HB3 SER 80 2.840 -24.379 -9.253 102 HG SER 80 HG SER 80 4.676 -23.397 -8.715 103 H ALA 81 H ALA 81 4.851 -24.151 -5.769 104 HA ALA 81 HA ALA 81 5.069 -26.565 -4.385 105 HB1 ALA 81 HB1 ALA 81 6.914 -24.976 -4.694 106 HB2 ALA 81 HB2 ALA 81 6.107 -23.797 -3.640 107 HB3 ALA 81 HB3 ALA 81 6.692 -25.336 -2.969 108 H ALA 82 H ALA 82 3.482 -23.516 -3.252 109 HA ALA 82 HA ALA 82 2.739 -24.490 -0.679 110 HB1 ALA 82 HB1 ALA 82 1.155 -22.600 -0.698 111 HB2 ALA 82 HB2 ALA 82 2.748 -22.109 -1.304 112 HB3 ALA 82 HB3 ALA 82 1.411 -22.384 -2.442 113 H ILE 83 H ILE 83 0.935 -24.607 -3.796 114 HA ILE 83 HA ILE 83 -1.378 -25.930 -2.695 115 HB ILE 83 HB ILE 83 -0.345 -25.704 -5.544 116 HG12 ILE 83 HG12 ILE 83 -2.646 -24.340 -4.084 117 HG13 ILE 83 HG13 ILE 83 -1.080 -23.599 -4.292 118 HG21 ILE 83 HG21 ILE 83 -1.813 -27.721 -5.354 119 HG22 ILE 83 HG22 ILE 83 -3.062 -26.735 -4.566 120 HG23 ILE 83 HG23 ILE 83 -2.611 -26.443 -6.261 121 HD11 ILE 83 HD11 ILE 83 -2.486 -22.658 -5.947 122 HD12 ILE 83 HD12 ILE 83 -1.397 -23.771 -6.805 123 HD13 ILE 83 HD13 ILE 83 -3.091 -24.233 -6.465 124 H ARG 84 H ARG 84 1.632 -27.231 -4.178 125 HA ARG 84 HA ARG 84 0.936 -30.001 -3.966 126 HB2 ARG 84 HB2 ARG 84 2.984 -28.973 -5.152 127 HB3 ARG 84 HB3 ARG 84 3.710 -28.784 -3.562 128 HG2 ARG 84 HG2 ARG 84 3.081 -31.440 -3.433 129 HG3 ARG 84 HG3 ARG 84 3.210 -31.269 -5.179 130 HD2 ARG 84 HD2 ARG 84 5.318 -30.602 -3.083 131 HD3 ARG 84 HD3 ARG 84 5.329 -31.987 -4.165 132 HE ARG 84 HE ARG 84 5.573 -30.414 -6.090 133 HH11 ARG 84 HH21 ARG 84 6.648 -29.190 -2.959 134 HH12 ARG 84 HH22 ARG 84 7.864 -28.192 -3.696 135 HH21 ARG 84 HH11 ARG 84 7.162 -29.240 -6.902 136 HH22 ARG 84 HH12 ARG 84 8.112 -28.154 -5.901 137 H GLU 85 H GLU 85 2.651 -27.906 -1.567 138 HA GLU 85 HA GLU 85 2.855 -29.837 0.423 139 HB2 GLU 85 HB2 GLU 85 3.962 -27.541 0.326 140 HB3 GLU 85 HB3 GLU 85 2.439 -26.874 0.930 141 HG2 GLU 85 HG2 GLU 85 2.725 -28.708 2.829 142 HG3 GLU 85 HG3 GLU 85 4.395 -28.753 2.294 143 H TRP 86 H TRP 86 0.228 -27.399 -0.000 144 HA TRP 86 HA TRP 86 -1.445 -28.151 2.063 145 HB2 TRP 86 HB2 TRP 86 -1.729 -26.147 0.752 146 HB3 TRP 86 HB3 TRP 86 -2.032 -27.075 -0.707 147 HD1 TRP 86 HD1 TRP 86 -3.710 -25.988 2.535 148 HE1 TRP 86 HE1 TRP 86 -6.255 -26.281 2.335 149 HE3 TRP 86 HE3 TRP 86 -3.891 -28.388 -1.990 150 HZ2 TRP 86 HZ2 TRP 86 -8.117 -27.494 0.491 151 HZ3 TRP 86 HZ3 TRP 86 -6.070 -29.109 -2.937 152 HH2 TRP 86 HH2 TRP 86 -8.181 -28.693 -1.689 153 H ALA 87 H ALA 87 -1.435 -29.463 -1.295 154 HA ALA 87 HA ALA 87 -3.503 -31.377 -0.910 155 HB1 ALA 87 HB1 ALA 87 -1.153 -31.272 -2.867 156 HB2 ALA 87 HB2 ALA 87 -2.541 -32.373 -2.988 157 HB3 ALA 87 HB3 ALA 87 -2.785 -30.619 -3.113 158 H ARG 88 H ARG 88 0.062 -31.728 -0.532 159 HA ARG 88 HA ARG 88 0.040 -34.503 0.192 160 HB2 ARG 88 HB2 ARG 88 2.028 -33.205 -0.543 161 HB3 ARG 88 HB3 ARG 88 2.019 -32.313 0.983 162 HG2 ARG 88 HG2 ARG 88 2.397 -34.443 2.223 163 HG3 ARG 88 HG3 ARG 88 2.362 -35.336 0.687 164 HD2 ARG 88 HD2 ARG 88 4.333 -34.059 -0.096 165 HD3 ARG 88 HD3 ARG 88 4.356 -33.164 1.442 166 HE ARG 88 HE ARG 88 4.414 -35.972 1.980 167 HH11 ARG 88 HH21 ARG 88 6.590 -33.515 0.740 168 HH12 ARG 88 HH22 ARG 88 8.004 -34.378 1.267 169 HH21 ARG 88 HH11 ARG 88 6.263 -37.017 2.625 170 HH22 ARG 88 HH12 ARG 88 7.820 -36.313 2.311 171 H ARG 89 H ARG 89 -0.167 -31.580 2.230 172 HA ARG 89 HA ARG 89 -0.291 -32.935 4.777 173 HB2 ARG 89 HB2 ARG 89 -1.091 -30.154 3.835 174 HB3 ARG 89 HB3 ARG 89 -1.264 -30.674 5.512 175 HG2 ARG 89 HG2 ARG 89 1.119 -31.061 5.749 176 HG3 ARG 89 HG3 ARG 89 1.392 -30.826 4.024 177 HD2 ARG 89 HD2 ARG 89 2.112 -28.858 5.188 178 HD3 ARG 89 HD3 ARG 89 0.686 -28.459 4.215 179 HE ARG 89 HE ARG 89 -0.175 -29.128 6.847 180 HH11 ARG 89 HH11 ARG 89 1.733 -26.562 5.350 181 HH12 ARG 89 HH12 ARG 89 1.221 -25.394 6.543 182 HH21 ARG 89 HH21 ARG 89 -0.766 -27.562 8.320 183 HH22 ARG 89 HH22 ARG 89 -0.134 -25.950 8.180 184 H ASN 90 H ASN 90 -2.889 -32.006 2.519 185 HA ASN 90 HA ASN 90 -4.875 -33.157 4.380 186 HB2 ASN 90 HB2 ASN 90 -6.531 -32.001 3.214 187 HB3 ASN 90 HB3 ASN 90 -5.167 -30.905 3.378 188 HD21 ASN 90 HD22 ASN 90 -6.164 -29.656 1.663 189 HD22 ASN 90 HD21 ASN 90 -6.004 -30.170 0.005 190 H GLY 91 H GLY 91 -2.919 -34.683 2.353 191 HA2 GLY 91 HA2 GLY 91 -2.940 -36.936 1.923 192 HA3 GLY 91 HA3 GLY 91 -4.627 -37.021 2.419 193 H HIS 92 H HIS 92 -3.864 -34.798 -0.199 194 HA HIS 92 HA HIS 92 -5.140 -36.679 -2.157 195 HB2 HIS 92 HB2 HIS 92 -4.860 -33.655 -2.187 196 HB3 HIS 92 HB3 HIS 92 -5.397 -34.604 -3.575 197 HD1 HIS 92 HD1 HIS 92 -6.596 -33.522 -0.119 198 HD2 HIS 92 HD2 HIS 92 -7.852 -35.737 -3.487 199 HE1 HIS 92 HE1 HIS 92 -9.134 -33.968 0.201 200 HE2 HIS 92 HE2 HIS 92 -9.882 -35.315 -1.870 201 H ASN 93 H ASN 93 -4.131 -37.377 -3.956 202 HA ASN 93 HA ASN 93 -1.238 -37.185 -4.105 203 HB2 ASN 93 HB2 ASN 93 -1.431 -38.721 -5.954 204 HB3 ASN 93 HB3 ASN 93 -2.457 -39.261 -4.641 205 HD21 ASN 93 HD22 ASN 93 -2.383 -38.680 -8.000 206 HD22 ASN 93 HD21 ASN 93 -4.117 -38.665 -8.249 207 H VAL 94 H VAL 94 0.035 -36.011 -5.430 208 HA VAL 94 HA VAL 94 -1.049 -34.250 -7.545 209 HB VAL 94 HB VAL 94 0.257 -32.296 -6.461 210 HG11 VAL 94 HG11 VAL 94 -1.659 -31.471 -5.343 211 HG12 VAL 94 HG12 VAL 94 -2.190 -32.389 -6.756 212 HG13 VAL 94 HG13 VAL 94 -2.325 -33.115 -5.143 213 HG21 VAL 94 HG21 VAL 94 0.490 -32.209 -4.095 214 HG22 VAL 94 HG22 VAL 94 -0.258 -33.798 -3.876 215 HG23 VAL 94 HG23 VAL 94 1.338 -33.651 -4.647 216 H SER 95 H SER 95 0.407 -33.513 -9.007 217 HA SER 95 HA SER 95 2.800 -34.990 -9.476 218 HB2 SER 95 HB2 SER 95 1.805 -32.362 -10.619 219 HB3 SER 95 HB3 SER 95 3.120 -33.350 -11.309 220 HG SER 95 HG SER 95 1.044 -33.760 -12.293 221 H THR 96 H THR 96 4.997 -34.396 -9.378 222 HA THR 96 HA THR 96 5.615 -32.863 -6.985 223 HB THR 96 HB THR 96 7.942 -33.738 -7.406 224 HG1 THR 96 HG1 THR 96 8.088 -35.358 -9.013 225 HG21 THR 96 HG21 THR 96 6.310 -34.946 -5.970 226 HG22 THR 96 HG22 THR 96 5.716 -35.829 -7.391 227 HG23 THR 96 HG23 THR 96 7.388 -36.056 -6.835 228 H ARG 97 H ARG 97 7.094 -32.726 -10.257 229 HA ARG 97 HA ARG 97 8.515 -30.298 -9.653 230 HB2 ARG 97 HB2 ARG 97 9.224 -32.115 -11.215 231 HB3 ARG 97 HB3 ARG 97 7.983 -31.602 -12.362 232 HG2 ARG 97 HG2 ARG 97 9.084 -29.392 -12.583 233 HG3 ARG 97 HG3 ARG 97 10.286 -29.861 -11.363 234 HD2 ARG 97 HD2 ARG 97 11.050 -31.706 -12.831 235 HD3 ARG 97 HD3 ARG 97 9.847 -31.236 -14.051 236 HE ARG 97 HE ARG 97 11.431 -28.953 -13.446 237 HH11 ARG 97 HH11 ARG 97 11.851 -32.031 -15.074 238 HH12 ARG 97 HH12 ARG 97 13.126 -31.424 -16.094 239 HH21 ARG 97 HH21 ARG 97 13.050 -28.236 -14.786 240 HH22 ARG 97 HH22 ARG 97 13.781 -29.317 -15.933 241 H GLY 98 H GLY 98 5.481 -30.820 -11.348 242 HA2 GLY 98 HA2 GLY 98 4.418 -28.198 -10.973 243 HA3 GLY 98 HA3 GLY 98 5.158 -28.284 -12.583 244 H ARG 99 H ARG 99 2.930 -27.892 -13.296 245 HA ARG 99 HA ARG 99 0.898 -28.478 -14.149 246 HB2 ARG 99 HB2 ARG 99 2.697 -29.694 -15.493 247 HB3 ARG 99 HB3 ARG 99 2.162 -31.178 -14.695 248 HG2 ARG 99 HG2 ARG 99 -0.147 -30.787 -15.633 249 HG3 ARG 99 HG3 ARG 99 0.443 -29.308 -16.402 250 HD2 ARG 99 HD2 ARG 99 2.089 -30.637 -17.698 251 HD3 ARG 99 HD3 ARG 99 1.513 -32.120 -16.946 252 HE ARG 99 HE ARG 99 0.200 -30.514 -19.040 253 HH11 ARG 99 HH11 ARG 99 -0.342 -33.124 -16.753 254 HH12 ARG 99 HH12 ARG 99 -1.723 -33.722 -17.631 255 HH21 ARG 99 HH21 ARG 99 -1.552 -31.341 -20.113 256 HH22 ARG 99 HH22 ARG 99 -2.389 -32.731 -19.488 257 H ILE 100 H ILE 100 0.601 -28.490 -11.564 258 HA ILE 100 HA ILE 100 -0.714 -30.827 -10.453 259 HB ILE 100 HB ILE 100 -0.809 -27.887 -9.713 260 HG12 ILE 100 HG12 ILE 100 0.626 -30.325 -8.541 261 HG13 ILE 100 HG13 ILE 100 1.381 -28.999 -9.416 262 HG21 ILE 100 HG21 ILE 100 -1.925 -30.219 -8.084 263 HG22 ILE 100 HG22 ILE 100 -1.900 -28.507 -7.625 264 HG23 ILE 100 HG23 ILE 100 -2.920 -29.013 -8.944 265 HD11 ILE 100 HD11 ILE 100 1.835 -28.641 -7.131 266 HD12 ILE 100 HD12 ILE 100 0.608 -27.435 -7.577 267 HD13 ILE 100 HD13 ILE 100 0.150 -28.893 -6.652 268 HA PRO 101 HA PRO 101 -4.449 -30.503 -12.866 269 HB2 PRO 101 HB2 PRO 101 -6.032 -31.572 -10.574 270 HB3 PRO 101 HB3 PRO 101 -5.851 -32.218 -12.226 271 HG2 PRO 101 HG2 PRO 101 -4.621 -33.374 -10.064 272 HG3 PRO 101 HG3 PRO 101 -3.832 -33.307 -11.682 273 HD2 PRO 101 HD2 PRO 101 -3.399 -31.520 -9.289 274 HD3 PRO 101 HD3 PRO 101 -2.198 -32.262 -10.389 275 H ALA 102 H ALA 102 -5.945 -28.913 -13.271 276 HA ALA 102 HA ALA 102 -6.112 -26.658 -11.654 277 HB1 ALA 102 HB1 ALA 102 -8.051 -27.543 -13.802 278 HB2 ALA 102 HB2 ALA 102 -7.807 -25.889 -13.180 279 HB3 ALA 102 HB3 ALA 102 -6.498 -26.703 -14.067 280 H ASP 103 H ASP 103 -8.256 -29.492 -11.647 281 HA ASP 103 HA ASP 103 -10.294 -28.529 -10.040 282 HB2 ASP 103 HB2 ASP 103 -10.303 -30.693 -11.196 283 HB3 ASP 103 HB3 ASP 103 -9.047 -31.296 -10.111 284 H VAL 104 H VAL 104 -7.057 -29.703 -9.079 285 HA VAL 104 HA VAL 104 -7.603 -29.561 -6.248 286 HB VAL 104 HB VAL 104 -4.923 -29.820 -7.584 287 HG11 VAL 104 HG11 VAL 104 -5.840 -30.579 -4.784 288 HG12 VAL 104 HG12 VAL 104 -4.235 -30.914 -5.467 289 HG13 VAL 104 HG13 VAL 104 -4.733 -29.245 -5.207 290 HG21 VAL 104 HG21 VAL 104 -6.349 -31.716 -8.320 291 HG22 VAL 104 HG22 VAL 104 -5.102 -32.264 -7.207 292 HG23 VAL 104 HG23 VAL 104 -6.776 -32.052 -6.630 293 H ILE 105 H ILE 105 -5.966 -27.503 -8.673 294 HA ILE 105 HA ILE 105 -5.104 -25.436 -6.866 295 HB ILE 105 HB ILE 105 -5.870 -25.481 -9.810 296 HG12 ILE 105 HG12 ILE 105 -3.089 -24.977 -8.709 297 HG13 ILE 105 HG13 ILE 105 -3.693 -26.626 -8.655 298 HG21 ILE 105 HG21 ILE 105 -6.217 -23.189 -9.146 299 HG22 ILE 105 HG22 ILE 105 -4.695 -23.161 -8.217 300 HG23 ILE 105 HG23 ILE 105 -4.672 -23.270 -9.989 301 HD11 ILE 105 HD11 ILE 105 -3.583 -24.979 -11.203 302 HD12 ILE 105 HD12 ILE 105 -2.375 -26.177 -10.687 303 HD13 ILE 105 HD13 ILE 105 -4.037 -26.692 -11.016 304 H ASP 106 H ASP 106 -8.225 -25.782 -8.678 305 HA ASP 106 HA ASP 106 -9.512 -23.611 -7.502 306 HB2 ASP 106 HB2 ASP 106 -10.326 -24.810 -9.481 307 HB3 ASP 106 HB3 ASP 106 -10.680 -26.232 -8.496 308 H ALA 107 H ALA 107 -9.437 -27.060 -6.379 309 HA ALA 107 HA ALA 107 -10.961 -26.813 -4.118 310 HB1 ALA 107 HB1 ALA 107 -8.463 -28.538 -4.511 311 HB2 ALA 107 HB2 ALA 107 -9.770 -28.823 -3.340 312 HB3 ALA 107 HB3 ALA 107 -10.096 -28.940 -5.068 313 H TYR 108 H TYR 108 -7.429 -26.162 -4.382 314 HA TYR 108 HA TYR 108 -6.973 -25.332 -1.695 315 HB2 TYR 108 HB2 TYR 108 -5.117 -25.802 -3.096 316 HB3 TYR 108 HB3 TYR 108 -5.645 -24.688 -4.342 317 HD1 TYR 108 HD1 TYR 108 -4.251 -24.876 -0.893 318 HD2 TYR 108 HD2 TYR 108 -5.072 -22.358 -4.296 319 HE1 TYR 108 HE1 TYR 108 -2.809 -23.087 0.079 320 HE2 TYR 108 HE2 TYR 108 -3.645 -20.572 -3.321 321 HH TYR 108 HH TYR 108 -2.282 -19.943 -1.561 322 H HIS 109 H HIS 109 -7.824 -23.309 -4.591 323 HA HIS 109 HA HIS 109 -7.986 -20.890 -3.068 324 HB2 HIS 109 HB2 HIS 109 -9.133 -21.680 -5.763 325 HB3 HIS 109 HB3 HIS 109 -9.385 -20.081 -5.056 326 HD1 HIS 109 HD1 HIS 109 -6.867 -18.864 -4.243 327 HD2 HIS 109 HD2 HIS 109 -7.049 -21.742 -7.318 328 HE1 HIS 109 HE1 HIS 109 -4.717 -18.567 -5.639 329 HE2 HIS 109 HE2 HIS 109 -4.848 -20.306 -7.530 330 H ALA 110 H ALA 110 -10.542 -23.341 -3.660 331 HA ALA 110 HA ALA 110 -12.624 -21.830 -2.391 332 HB1 ALA 110 HB1 ALA 110 -13.754 -24.016 -2.219 333 HB2 ALA 110 HB2 ALA 110 -13.031 -23.799 -3.824 334 HB3 ALA 110 HB3 ALA 110 -12.238 -24.848 -2.629 335 H ALA 111 H ALA 111 -10.257 -24.219 -1.031 336 HA ALA 111 HA ALA 111 -11.181 -24.170 1.582 337 HB1 ALA 111 HB1 ALA 111 -9.652 -25.834 0.617 338 HB2 ALA 111 HB2 ALA 111 -8.360 -24.605 0.538 339 HB3 ALA 111 HB3 ALA 111 -8.987 -25.145 2.111 340 H THR 112 H THR 112 -8.886 -21.948 -0.018 341 HA THR 112 HA THR 112 -8.333 -20.503 2.473 342 HB THR 112 HB THR 112 -7.037 -18.957 1.086 343 HG1 THR 112 HG1 THR 112 -6.795 -19.374 -1.093 344 HG21 THR 112 HG21 THR 112 -5.288 -20.520 0.390 345 HG22 THR 112 HG22 THR 112 -5.970 -21.023 1.945 346 HG23 THR 112 HG23 THR 112 -6.429 -21.877 0.456 347 H LEU 113 H LEU 113 -10.380 -19.753 -0.421 348 HA LEU 113 HA LEU 113 -10.980 -17.130 0.717 349 HB2 LEU 113 HB2 LEU 113 -10.133 -17.477 -1.579 350 HB3 LEU 113 HB3 LEU 113 -11.565 -18.438 -1.954 351 HG LEU 113 HG LEU 113 -12.999 -16.510 -1.644 352 HD11 LEU 113 HD11 LEU 113 -10.414 -14.933 -1.237 353 HD12 LEU 113 HD12 LEU 113 -12.011 -14.211 -1.525 354 HD13 LEU 113 HD13 LEU 113 -11.723 -15.131 -0.048 355 HD21 LEU 113 HD21 LEU 113 -10.687 -15.985 -3.553 356 HD22 LEU 113 HD22 LEU 113 -12.093 -17.029 -3.869 357 HD23 LEU 113 HD23 LEU 113 -12.318 -15.283 -3.668 358 H GLU 114 H GLU 114 -12.811 -20.143 0.197 359 HA GLU 114 HA GLU 114 -15.356 -18.793 0.055 360 HB2 GLU 114 HB2 GLU 114 -14.581 -21.173 -0.789 361 HB3 GLU 114 HB3 GLU 114 -15.160 -21.709 0.785 362 HG2 GLU 114 HG2 GLU 114 -16.699 -20.271 -1.420 363 HG3 GLU 114 HG3 GLU 114 -16.854 -21.965 -0.967 364 H HIS 115 H HIS 115 -16.908 -18.368 1.584 365 HA HIS 115 HA HIS 115 -16.023 -17.659 4.133 366 HB2 HIS 115 HB2 HIS 115 -18.904 -18.052 3.217 367 HB3 HIS 115 HB3 HIS 115 -18.360 -17.008 4.526 368 HD1 HIS 115 HD1 HIS 115 -16.645 -14.901 3.635 369 HD2 HIS 115 HD2 HIS 115 -19.123 -16.920 0.866 370 HE1 HIS 115 HE1 HIS 115 -16.783 -13.395 1.537 371 HE2 HIS 115 HE2 HIS 115 -18.304 -14.632 -0.132 372 H HIS 116 H HIS 116 -17.338 -20.795 3.268 373 HA HIS 116 HA HIS 116 -18.023 -21.447 6.081 374 HB2 HIS 116 HB2 HIS 116 -18.333 -23.122 3.565 375 HB3 HIS 116 HB3 HIS 116 -19.016 -23.474 5.151 376 HD1 HIS 116 HD1 HIS 116 -19.527 -21.191 2.161 377 HD2 HIS 116 HD2 HIS 116 -21.177 -22.027 5.954 378 HE1 HIS 116 HE1 HIS 116 -21.856 -20.024 2.227 379 HE2 HIS 116 HE2 HIS 116 -22.840 -20.538 4.551 380 H HIS 117 H HIS 117 -15.086 -21.503 4.555 381 HA HIS 117 HA HIS 117 -14.199 -24.162 5.007 382 HB2 HIS 117 HB2 HIS 117 -12.056 -23.432 4.384 383 HB3 HIS 117 HB3 HIS 117 -13.172 -22.443 3.460 384 HD1 HIS 117 HD1 HIS 117 -13.049 -19.804 3.912 385 HD2 HIS 117 HD2 HIS 117 -10.576 -22.235 6.327 386 HE1 HIS 117 HE1 HIS 117 -11.388 -18.213 5.106 387 HE2 HIS 117 HE2 HIS 117 -9.902 -19.711 6.593 388 H HIS 118 H HIS 118 -14.500 -21.674 7.393 389 HA HIS 118 HA HIS 118 -12.439 -22.500 9.206 390 HB2 HIS 118 HB2 HIS 118 -13.732 -21.077 10.843 391 HB3 HIS 118 HB3 HIS 118 -13.267 -20.300 9.345 392 HD1 HIS 118 HD1 HIS 118 -16.510 -22.420 9.797 393 HD2 HIS 118 HD2 HIS 118 -15.119 -18.485 9.116 394 HE1 HIS 118 HE1 HIS 118 -18.601 -20.972 9.319 395 HE2 HIS 118 HE2 HIS 118 -17.731 -18.580 8.884 396 H HIS 119 H HIS 119 -12.369 -23.796 10.969 397 HA HIS 119 HA HIS 119 -14.774 -25.308 11.873 398 HB2 HIS 119 HB2 HIS 119 -12.092 -26.587 11.174 399 HB3 HIS 119 HB3 HIS 119 -13.437 -27.414 11.941 400 HD1 HIS 119 HD1 HIS 119 -15.823 -27.352 10.283 401 HD2 HIS 119 HD2 HIS 119 -11.989 -26.841 8.583 402 HE1 HIS 119 HE1 HIS 119 -16.072 -27.847 7.769 403 HE2 HIS 119 HE2 HIS 119 -13.726 -27.549 6.743 404 H HIS 120 H HIS 120 -14.492 -26.316 13.987 405 HA HIS 120 HA HIS 120 -13.033 -24.631 15.885 406 HB2 HIS 120 HB2 HIS 120 -14.062 -26.072 17.591 407 HB3 HIS 120 HB3 HIS 120 -15.227 -25.352 16.496 408 HD1 HIS 120 HD1 HIS 120 -17.018 -27.046 15.669 409 HD2 HIS 120 HD2 HIS 120 -13.357 -28.802 16.833 410 HE1 HIS 120 HE1 HIS 120 -17.335 -29.598 15.462 411 HE2 HIS 120 HE2 HIS 120 -15.097 -30.660 16.175
Contact the webmaster for help, if required. Saturday, May 18, 2024 11:04:27 PM GMT (wattos1)