NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
25978 | 2kdn | 16118 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 HT1 MET 1 23.957 -8.312 -58.881 2 H2 MET 1 HT2 MET 1 23.296 -6.756 -59.031 3 H3 MET 1 HT3 MET 1 22.279 -8.094 -58.796 4 HA MET 1 HA MET 1 23.140 -8.455 -56.609 5 HB2 MET 1 HB2 MET 1 25.431 -7.643 -57.081 6 HB3 MET 1 HB1 MET 1 24.823 -5.995 -57.158 7 HG2 MET 1 HG2 MET 1 25.907 -6.481 -55.024 8 HG3 MET 1 HG1 MET 1 24.203 -6.078 -54.824 9 HE1 MET 1 HE1 MET 1 26.887 -8.930 -54.836 10 HE2 MET 1 HE2 MET 1 25.764 -9.483 -56.079 11 HE3 MET 1 HE3 MET 1 25.904 -10.369 -54.561 12 H GLY 2 HN GLY 2 22.150 -7.427 -54.817 13 HA2 GLY 2 HA2 GLY 2 21.197 -4.876 -54.587 14 HA3 GLY 2 HA1 GLY 2 19.970 -5.712 -55.530 15 H SER 3 HN SER 3 18.333 -6.286 -54.303 16 HA SER 3 HA SER 3 17.099 -7.222 -52.650 17 HB2 SER 3 HB2 SER 3 19.684 -8.570 -51.833 18 HB3 SER 3 HB1 SER 3 18.052 -9.081 -51.400 19 HG SER 3 HG SER 3 19.465 -9.447 -53.738 20 H SER 4 HN SER 4 18.600 -4.677 -52.189 21 HA SER 4 HA SER 4 19.143 -4.748 -49.329 22 HB2 SER 4 HB2 SER 4 20.671 -3.492 -50.789 23 HB3 SER 4 HB1 SER 4 19.337 -2.464 -51.310 24 HG SER 4 HG SER 4 20.699 -1.596 -49.590 25 H HIS 5 HN HIS 5 17.453 -4.676 -48.030 26 HA HIS 5 HA HIS 5 15.673 -2.383 -48.238 27 HB2 HIS 5 HB2 HIS 5 14.549 -4.390 -49.368 28 HB3 HIS 5 HB1 HIS 5 14.483 -5.121 -47.768 29 HD1 HIS 5 HD1 HIS 5 12.193 -4.855 -46.837 30 HD2 HIS 5 HD2 HIS 5 13.364 -1.529 -49.043 31 HE1 HIS 5 HE1 HIS 5 10.276 -3.237 -46.689 32 HE2 HIS 5 HE2 HIS 5 10.919 -1.331 -48.212 33 H HIS 6 HN HIS 6 16.437 -1.474 -46.420 34 HA HIS 6 HA HIS 6 17.060 -3.169 -44.129 35 HB2 HIS 6 HB2 HIS 6 17.582 -0.232 -44.620 36 HB3 HIS 6 HB1 HIS 6 18.112 -1.126 -43.200 37 HD1 HIS 6 HD1 HIS 6 19.498 0.149 -46.122 38 HD2 HIS 6 HD2 HIS 6 19.661 -3.590 -44.296 39 HE1 HIS 6 HE1 HIS 6 21.557 -0.975 -47.046 40 HE2 HIS 6 HE2 HIS 6 21.587 -3.269 -45.990 41 H HIS 7 HN HIS 7 16.023 -3.145 -42.228 42 HA HIS 7 HA HIS 7 13.536 -1.671 -42.062 43 HB2 HIS 7 HB2 HIS 7 13.251 -2.923 -39.882 44 HB3 HIS 7 HB1 HIS 7 13.334 -3.917 -41.329 45 HD1 HIS 7 HD1 HIS 7 15.495 -5.363 -41.651 46 HD2 HIS 7 HD2 HIS 7 15.238 -3.374 -38.004 47 HE1 HIS 7 HE1 HIS 7 17.225 -6.432 -40.168 48 HE2 HIS 7 HE2 HIS 7 16.897 -5.359 -37.911 49 H HIS 8 HN HIS 8 14.609 0.367 -42.084 50 HA HIS 8 HA HIS 8 16.215 1.254 -39.897 51 HB2 HIS 8 HB2 HIS 8 16.307 2.251 -42.159 52 HB3 HIS 8 HB1 HIS 8 14.657 2.821 -41.969 53 HD1 HIS 8 HD1 HIS 8 18.147 3.425 -40.647 54 HD2 HIS 8 HD2 HIS 8 14.400 5.235 -40.699 55 HE1 HIS 8 HE1 HIS 8 18.504 5.761 -39.791 56 HE2 HIS 8 HE2 HIS 8 16.273 6.894 -40.053 57 H HIS 9 HN HIS 9 15.547 1.875 -37.928 58 HA HIS 9 HA HIS 9 12.778 1.603 -37.253 59 HB2 HIS 9 HB2 HIS 9 15.074 2.605 -35.553 60 HB3 HIS 9 HB1 HIS 9 13.481 2.153 -34.960 61 HD1 HIS 9 HD1 HIS 9 16.120 0.825 -33.980 62 HD2 HIS 9 HD2 HIS 9 13.614 -0.724 -36.919 63 HE1 HIS 9 HE1 HIS 9 16.573 -1.649 -34.027 64 HE2 HIS 9 HE2 HIS 9 14.969 -2.585 -35.725 65 H HIS 10 HN HIS 10 15.014 4.310 -36.689 66 HA HIS 10 HA HIS 10 13.244 6.269 -37.753 67 HB2 HIS 10 HB2 HIS 10 12.134 5.695 -35.540 68 HB3 HIS 10 HB1 HIS 10 13.571 6.320 -34.742 69 HD1 HIS 10 HD1 HIS 10 12.409 8.283 -33.620 70 HD2 HIS 10 HD2 HIS 10 11.918 8.222 -37.748 71 HE1 HIS 10 HE1 HIS 10 11.403 10.513 -34.220 72 HE2 HIS 10 HE2 HIS 10 11.349 10.528 -36.735 73 H SER 11 HN SER 11 14.514 7.896 -38.416 74 HA SER 11 HA SER 11 17.257 7.575 -38.412 75 HB2 SER 11 HB2 SER 11 15.805 10.180 -38.892 76 HB3 SER 11 HB1 SER 11 17.358 9.678 -39.565 77 HG SER 11 HG SER 11 15.115 9.376 -40.728 78 H SER 12 HN SER 12 15.402 10.048 -36.626 79 HA SER 12 HA SER 12 15.909 11.312 -34.806 80 HB2 SER 12 HB2 SER 12 17.895 9.138 -34.096 81 HB3 SER 12 HB1 SER 12 17.082 10.249 -32.994 82 HG SER 12 HG SER 12 16.016 8.053 -34.413 83 H GLY 13 HN GLY 13 17.045 12.186 -37.027 84 HA2 GLY 13 HA2 GLY 13 19.432 13.509 -36.176 85 HA3 GLY 13 HA1 GLY 13 19.790 12.247 -37.343 86 H ARG 14 HN ARG 14 17.204 12.675 -38.748 87 HA ARG 14 HA ARG 14 18.057 15.011 -40.307 88 HB2 ARG 14 HB2 ARG 14 15.899 13.031 -41.051 89 HB3 ARG 14 HB1 ARG 14 16.756 14.141 -42.111 90 HG2 ARG 14 HG2 ARG 14 18.830 12.847 -41.715 91 HG3 ARG 14 HG1 ARG 14 17.887 11.697 -40.765 92 HD2 ARG 14 HD2 ARG 14 18.019 10.734 -42.896 93 HD3 ARG 14 HD1 ARG 14 16.412 11.454 -42.829 94 HE ARG 14 HE ARG 14 18.590 12.992 -44.050 95 HH11 ARG 14 HH11 ARG 14 15.578 11.229 -44.421 96 HH12 ARG 14 HH12 ARG 14 15.355 11.712 -46.071 97 HH21 ARG 14 HH21 ARG 14 18.296 13.607 -46.227 98 HH22 ARG 14 HH22 ARG 14 16.882 13.060 -47.094 99 H GLU 15 HN GLU 15 15.525 13.743 -38.341 100 HA GLU 15 HA GLU 15 13.634 15.841 -38.997 101 HB2 GLU 15 HB2 GLU 15 12.176 14.643 -37.361 102 HB3 GLU 15 HB1 GLU 15 12.736 13.629 -38.681 103 HG2 GLU 15 HG2 GLU 15 14.226 13.659 -36.094 104 HG3 GLU 15 HG1 GLU 15 12.734 12.736 -36.237 105 H ASN 16 HN ASN 16 16.259 16.326 -37.583 106 HA ASN 16 HA ASN 16 15.707 16.894 -34.844 107 HB2 ASN 16 HB2 ASN 16 17.917 17.857 -34.760 108 HB3 ASN 16 HB1 ASN 16 17.991 16.402 -35.747 109 HD21 ASN 16 HD21 ASN 16 18.501 16.565 -37.902 110 HD22 ASN 16 HD22 ASN 16 19.000 18.043 -38.651 111 H LEU 17 HN LEU 17 14.596 18.413 -37.516 112 HA LEU 17 HA LEU 17 14.986 21.148 -36.692 113 HB2 LEU 17 HB2 LEU 17 13.424 19.878 -38.926 114 HB3 LEU 17 HB1 LEU 17 13.336 21.594 -38.590 115 HG LEU 17 HG LEU 17 15.846 21.674 -38.924 116 HD11 LEU 17 HD11 LEU 17 15.370 18.939 -40.094 117 HD12 LEU 17 HD12 LEU 17 16.328 19.302 -38.659 118 HD13 LEU 17 HD13 LEU 17 16.852 19.884 -40.239 119 HD21 LEU 17 HD21 LEU 17 14.108 20.855 -41.244 120 HD22 LEU 17 HD22 LEU 17 15.655 21.694 -41.364 121 HD23 LEU 17 HD23 LEU 17 14.281 22.484 -40.590 122 H TYR 18 HN TYR 18 12.650 18.675 -36.120 123 HA TYR 18 HA TYR 18 10.631 20.651 -35.392 124 HB2 TYR 18 HB2 TYR 18 10.481 17.660 -35.720 125 HB3 TYR 18 HB1 TYR 18 9.149 18.631 -35.088 126 HD1 TYR 18 HD1 TYR 18 8.866 20.901 -36.634 127 HD2 TYR 18 HD2 TYR 18 10.192 17.078 -37.943 128 HE1 TYR 18 HE1 TYR 18 8.155 21.448 -38.920 129 HE2 TYR 18 HE2 TYR 18 9.489 17.616 -40.236 130 HH TYR 18 HH TYR 18 7.404 19.913 -41.030 131 H PHE 19 HN PHE 19 10.057 21.145 -33.432 132 HA PHE 19 HA PHE 19 11.566 20.028 -31.196 133 HB2 PHE 19 HB2 PHE 19 10.818 22.024 -29.993 134 HB3 PHE 19 HB1 PHE 19 11.545 22.466 -31.532 135 HD1 PHE 19 HD1 PHE 19 10.053 23.094 -33.448 136 HD2 PHE 19 HD2 PHE 19 8.603 22.623 -29.472 137 HE1 PHE 19 HE1 PHE 19 8.038 24.375 -34.033 138 HE2 PHE 19 HE2 PHE 19 6.585 23.900 -30.054 139 HZ PHE 19 HZ PHE 19 6.297 24.777 -32.339 140 H GLN 20 HN GLN 20 9.029 18.958 -32.598 141 HA GLN 20 HA GLN 20 7.012 19.108 -30.544 142 HB2 GLN 20 HB2 GLN 20 7.153 17.752 -33.225 143 HB3 GLN 20 HB1 GLN 20 5.774 17.582 -32.152 144 HG2 GLN 20 HG2 GLN 20 5.118 19.770 -32.401 145 HG3 GLN 20 HG1 GLN 20 6.728 20.315 -32.863 146 HE21 GLN 20 HE21 GLN 20 7.242 18.431 -34.887 147 HE22 GLN 20 HE22 GLN 20 6.169 18.737 -36.202 148 H GLY 21 HN GLY 21 9.549 17.792 -29.883 149 HA2 GLY 21 HA2 GLY 21 8.889 14.984 -29.619 150 HA3 GLY 21 HA1 GLY 21 10.325 15.786 -29.001 151 H HIS 22 HN HIS 22 7.824 17.671 -28.076 152 HA HIS 22 HA HIS 22 7.888 16.698 -25.365 153 HB2 HIS 22 HB2 HIS 22 7.835 19.137 -25.942 154 HB3 HIS 22 HB1 HIS 22 6.188 18.919 -26.523 155 HD1 HIS 22 HD1 HIS 22 8.220 18.849 -23.347 156 HD2 HIS 22 HD2 HIS 22 4.238 18.893 -24.555 157 HE1 HIS 22 HE1 HIS 22 6.877 19.227 -21.253 158 HE2 HIS 22 HE2 HIS 22 4.477 19.346 -22.016 159 H MET 23 HN MET 23 6.383 15.514 -24.343 160 HA MET 23 HA MET 23 4.680 13.922 -25.911 161 HB2 MET 23 HB2 MET 23 4.832 14.300 -22.925 162 HB3 MET 23 HB1 MET 23 3.805 13.098 -23.704 163 HG2 MET 23 HG2 MET 23 6.803 13.278 -23.895 164 HG3 MET 23 HG1 MET 23 5.880 12.096 -22.967 165 HE1 MET 23 HE1 MET 23 8.189 11.655 -25.295 166 HE2 MET 23 HE2 MET 23 7.553 10.215 -26.088 167 HE3 MET 23 HE3 MET 23 7.546 10.327 -24.328 168 H CYS 24 HN CYS 24 2.786 14.229 -26.679 169 HA CYS 24 HA CYS 24 0.695 15.649 -25.334 170 HB2 CYS 24 HB2 CYS 24 1.986 17.526 -26.332 171 HB3 CYS 24 HB1 CYS 24 1.836 16.774 -27.914 172 HG CYS 24 HG CYS 24 -0.575 18.337 -26.071 173 H ILE 25 HN ILE 25 -1.310 15.618 -26.794 174 HA ILE 25 HA ILE 25 -1.794 13.037 -27.725 175 HB ILE 25 HB ILE 25 -3.588 14.568 -27.056 176 HG12 ILE 25 HG12 ILE 25 -5.180 14.083 -28.924 177 HG13 ILE 25 HG11 ILE 25 -3.811 13.543 -29.892 178 HG21 ILE 25 HG21 ILE 25 -4.383 16.323 -28.569 179 HG22 ILE 25 HG22 ILE 25 -3.007 16.023 -29.629 180 HG23 ILE 25 HG23 ILE 25 -2.744 16.636 -27.997 181 HD11 ILE 25 HD11 ILE 25 -4.997 11.668 -28.907 182 HD12 ILE 25 HD12 ILE 25 -4.722 12.327 -27.294 183 HD13 ILE 25 HD13 ILE 25 -3.357 11.782 -28.269 184 H GLN 26 HN GLN 26 -0.695 15.898 -29.456 185 HA GLN 26 HA GLN 26 -0.938 14.862 -32.076 186 HB2 GLN 26 HB2 GLN 26 -0.644 17.264 -31.584 187 HB3 GLN 26 HB1 GLN 26 0.989 16.942 -31.020 188 HG2 GLN 26 HG2 GLN 26 1.618 16.196 -33.258 189 HG3 GLN 26 HG1 GLN 26 -0.021 16.518 -33.823 190 HE21 GLN 26 HE21 GLN 26 2.525 17.648 -34.692 191 HE22 GLN 26 HE22 GLN 26 2.375 19.358 -34.507 192 H LYS 27 HN LYS 27 1.636 14.771 -29.681 193 HA LYS 27 HA LYS 27 3.698 13.731 -31.276 194 HB2 LYS 27 HB2 LYS 27 3.404 14.510 -28.638 195 HB3 LYS 27 HB1 LYS 27 3.685 12.785 -28.505 196 HG2 LYS 27 HG2 LYS 27 5.490 14.764 -29.883 197 HG3 LYS 27 HG1 LYS 27 5.746 14.063 -28.288 198 HD2 LYS 27 HD2 LYS 27 7.071 12.672 -29.514 199 HD3 LYS 27 HD1 LYS 27 5.544 11.803 -29.666 200 HE2 LYS 27 HE2 LYS 27 5.137 12.917 -31.816 201 HE3 LYS 27 HE1 LYS 27 6.678 13.758 -31.665 202 HZ1 LYS 27 HZ1 LYS 27 6.360 10.811 -31.802 203 HZ2 LYS 27 HZ2 LYS 27 7.820 11.653 -31.757 204 HZ3 LYS 27 HZ3 LYS 27 6.800 11.797 -33.108 205 H VAL 28 HN VAL 28 1.159 12.172 -29.390 206 HA VAL 28 HA VAL 28 2.087 9.524 -29.615 207 HB VAL 28 HB VAL 28 -0.772 10.463 -29.298 208 HG11 VAL 28 HG11 VAL 28 0.524 7.820 -28.640 209 HG12 VAL 28 HG12 VAL 28 -0.623 8.122 -29.944 210 HG13 VAL 28 HG13 VAL 28 -1.140 8.271 -28.264 211 HG21 VAL 28 HG21 VAL 28 0.655 11.407 -27.571 212 HG22 VAL 28 HG22 VAL 28 1.309 9.808 -27.213 213 HG23 VAL 28 HG23 VAL 28 -0.389 10.159 -26.889 214 H ILE 29 HN ILE 29 -0.476 11.210 -31.433 215 HA ILE 29 HA ILE 29 -1.031 9.150 -33.240 216 HB ILE 29 HB ILE 29 -1.471 12.111 -33.290 217 HG12 ILE 29 HG12 ILE 29 -3.844 11.400 -33.459 218 HG13 ILE 29 HG11 ILE 29 -3.320 9.720 -33.467 219 HG21 ILE 29 HG21 ILE 29 -0.877 11.632 -35.591 220 HG22 ILE 29 HG22 ILE 29 -2.606 11.954 -35.461 221 HG23 ILE 29 HG23 ILE 29 -2.029 10.297 -35.632 222 HD11 ILE 29 HD11 ILE 29 -2.986 11.691 -31.219 223 HD12 ILE 29 HD12 ILE 29 -2.385 10.032 -31.217 224 HD13 ILE 29 HD13 ILE 29 -4.120 10.342 -31.284 225 H GLU 30 HN GLU 30 1.201 11.895 -33.545 226 HA GLU 30 HA GLU 30 2.073 11.446 -36.146 227 HB2 GLU 30 HB2 GLU 30 2.593 13.484 -34.944 228 HB3 GLU 30 HB1 GLU 30 3.555 12.592 -33.774 229 HG2 GLU 30 HG2 GLU 30 4.526 12.099 -36.426 230 HG3 GLU 30 HG1 GLU 30 4.425 13.833 -36.122 231 H ASP 31 HN ASP 31 3.471 10.233 -33.101 232 HA ASP 31 HA ASP 31 5.613 8.874 -34.358 233 HB2 ASP 31 HB2 ASP 31 5.693 9.558 -32.007 234 HB3 ASP 31 HB1 ASP 31 4.394 8.435 -31.626 235 H LYS 32 HN LYS 32 2.347 7.918 -33.503 236 HA LYS 32 HA LYS 32 2.709 5.133 -33.694 237 HB2 LYS 32 HB2 LYS 32 0.298 6.905 -33.934 238 HB3 LYS 32 HB1 LYS 32 0.178 5.170 -34.183 239 HG2 LYS 32 HG2 LYS 32 1.017 4.770 -31.936 240 HG3 LYS 32 HG1 LYS 32 1.190 6.508 -31.684 241 HD2 LYS 32 HD2 LYS 32 -0.843 5.765 -30.631 242 HD3 LYS 32 HD1 LYS 32 -1.255 6.753 -32.030 243 HE2 LYS 32 HE2 LYS 32 -1.162 3.746 -32.117 244 HE3 LYS 32 HE1 LYS 32 -2.617 4.648 -31.700 245 HZ1 LYS 32 HZ1 LYS 32 -1.131 4.799 -34.263 246 HZ2 LYS 32 HZ2 LYS 32 -2.461 5.764 -33.870 247 HZ3 LYS 32 HZ3 LYS 32 -2.643 4.076 -34.021 248 H LEU 33 HN LEU 33 1.306 7.377 -36.121 249 HA LEU 33 HA LEU 33 1.280 5.362 -38.124 250 HB2 LEU 33 HB2 LEU 33 0.828 7.258 -39.693 251 HB3 LEU 33 HB1 LEU 33 -0.295 7.100 -38.361 252 HG LEU 33 HG LEU 33 1.211 8.926 -37.236 253 HD11 LEU 33 HD11 LEU 33 1.788 9.372 -40.161 254 HD12 LEU 33 HD12 LEU 33 2.964 8.939 -38.920 255 HD13 LEU 33 HD13 LEU 33 2.150 10.503 -38.855 256 HD21 LEU 33 HD21 LEU 33 -1.135 9.203 -37.828 257 HD22 LEU 33 HD22 LEU 33 -0.682 9.541 -39.498 258 HD23 LEU 33 HD23 LEU 33 -0.212 10.655 -38.216 259 H SER 34 HN SER 34 3.666 7.674 -37.087 260 HA SER 34 HA SER 34 5.329 7.596 -39.365 261 HB2 SER 34 HB2 SER 34 5.487 9.272 -37.507 262 HB3 SER 34 HB1 SER 34 6.186 8.013 -36.491 263 HG SER 34 HG SER 34 7.561 9.572 -37.878 264 H SER 35 HN SER 35 5.141 5.565 -36.483 265 HA SER 35 HA SER 35 7.488 4.069 -37.003 266 HB2 SER 35 HB2 SER 35 5.036 3.296 -35.403 267 HB3 SER 35 HB1 SER 35 6.608 2.498 -35.328 268 HG SER 35 HG SER 35 6.087 5.223 -34.678 269 H ALA 36 HN ALA 36 4.250 3.880 -38.228 270 HA ALA 36 HA ALA 36 4.529 1.113 -39.060 271 HB1 ALA 36 HB1 ALA 36 2.402 1.872 -38.146 272 HB2 ALA 36 HB2 ALA 36 2.217 1.323 -39.814 273 HB3 ALA 36 HB3 ALA 36 2.253 3.049 -39.451 274 H LEU 37 HN LEU 37 3.899 4.236 -40.680 275 HA LEU 37 HA LEU 37 4.318 2.971 -43.263 276 HB2 LEU 37 HB2 LEU 37 3.656 5.840 -42.600 277 HB3 LEU 37 HB1 LEU 37 3.617 5.116 -44.195 278 HG LEU 37 HG LEU 37 1.840 4.274 -41.906 279 HD11 LEU 37 HD11 LEU 37 1.313 6.541 -42.593 280 HD12 LEU 37 HD12 LEU 37 0.056 5.424 -43.127 281 HD13 LEU 37 HD13 LEU 37 1.246 6.030 -44.279 282 HD21 LEU 37 HD21 LEU 37 1.776 3.592 -44.844 283 HD22 LEU 37 HD22 LEU 37 0.595 3.082 -43.637 284 HD23 LEU 37 HD23 LEU 37 2.260 2.506 -43.541 285 H LYS 38 HN LYS 38 6.090 4.707 -40.974 286 HA LYS 38 HA LYS 38 8.134 5.652 -40.890 287 HB2 LYS 38 HB2 LYS 38 8.625 3.496 -42.938 288 HB3 LYS 38 HB1 LYS 38 9.905 4.431 -42.171 289 HG2 LYS 38 HG2 LYS 38 9.184 3.613 -39.980 290 HG3 LYS 38 HG1 LYS 38 7.921 2.659 -40.760 291 HD2 LYS 38 HD2 LYS 38 9.620 1.393 -41.974 292 HD3 LYS 38 HD1 LYS 38 10.887 2.361 -41.216 293 HE2 LYS 38 HE2 LYS 38 10.623 0.199 -40.107 294 HE3 LYS 38 HE1 LYS 38 10.234 1.535 -39.026 295 HZ1 LYS 38 HZ1 LYS 38 7.956 1.089 -39.186 296 HZ2 LYS 38 HZ2 LYS 38 8.674 -0.441 -39.023 297 HZ3 LYS 38 HZ3 LYS 38 8.146 0.092 -40.544 298 HA PRO 39 HA PRO 39 7.986 8.356 -44.548 299 HB2 PRO 39 HB2 PRO 39 7.096 10.593 -43.297 300 HB3 PRO 39 HB1 PRO 39 6.014 9.372 -43.965 301 HG2 PRO 39 HG2 PRO 39 6.604 10.002 -41.167 302 HG3 PRO 39 HG1 PRO 39 5.239 9.108 -41.853 303 HD2 PRO 39 HD2 PRO 39 7.623 8.071 -40.603 304 HD3 PRO 39 HD1 PRO 39 6.219 7.176 -41.214 305 H THR 40 HN THR 40 9.915 9.163 -45.059 306 HA THR 40 HA THR 40 11.951 9.748 -43.210 307 HB THR 40 HB THR 40 13.003 10.932 -45.247 308 HG1 THR 40 HG1 THR 40 10.554 10.711 -46.157 309 HG21 THR 40 HG21 THR 40 13.520 8.782 -46.316 310 HG22 THR 40 HG22 THR 40 12.192 8.027 -45.433 311 HG23 THR 40 HG23 THR 40 13.585 8.662 -44.557 312 H PHE 41 HN PHE 41 9.394 11.650 -44.550 313 HA PHE 41 HA PHE 41 10.118 13.823 -42.750 314 HB2 PHE 41 HB2 PHE 41 10.980 14.512 -44.952 315 HB3 PHE 41 HB1 PHE 41 9.393 14.238 -45.664 316 HD1 PHE 41 HD1 PHE 41 11.217 16.295 -43.192 317 HD2 PHE 41 HD2 PHE 41 7.762 15.913 -45.644 318 HE1 PHE 41 HE1 PHE 41 10.597 18.618 -42.676 319 HE2 PHE 41 HE2 PHE 41 7.134 18.234 -45.132 320 HZ PHE 41 HZ PHE 41 8.554 19.591 -43.647 321 H LEU 42 HN LEU 42 8.356 14.808 -41.831 322 HA LEU 42 HA LEU 42 5.701 14.185 -42.863 323 HB2 LEU 42 HB2 LEU 42 6.261 12.465 -41.162 324 HB3 LEU 42 HB1 LEU 42 6.509 13.739 -39.985 325 HG LEU 42 HG LEU 42 4.128 14.377 -40.205 326 HD11 LEU 42 HD11 LEU 42 3.745 13.594 -42.483 327 HD12 LEU 42 HD12 LEU 42 2.587 12.877 -41.362 328 HD13 LEU 42 HD13 LEU 42 3.949 11.924 -41.950 329 HD21 LEU 42 HD21 LEU 42 3.224 12.430 -39.024 330 HD22 LEU 42 HD22 LEU 42 4.831 12.861 -38.437 331 HD23 LEU 42 HD23 LEU 42 4.627 11.483 -39.519 332 H GLU 43 HN GLU 43 4.713 16.074 -43.105 333 HA GLU 43 HA GLU 43 5.431 18.299 -41.312 334 HB2 GLU 43 HB2 GLU 43 5.762 18.645 -43.755 335 HB3 GLU 43 HB1 GLU 43 4.041 18.387 -44.000 336 HG2 GLU 43 HG2 GLU 43 4.451 20.728 -44.022 337 HG3 GLU 43 HG1 GLU 43 3.600 20.339 -42.526 338 H LEU 44 HN LEU 44 3.933 19.106 -39.942 339 HA LEU 44 HA LEU 44 1.169 18.143 -40.281 340 HB2 LEU 44 HB2 LEU 44 2.675 18.607 -37.707 341 HB3 LEU 44 HB1 LEU 44 0.952 18.314 -37.793 342 HG LEU 44 HG LEU 44 1.675 16.120 -39.036 343 HD11 LEU 44 HD11 LEU 44 3.785 15.218 -38.201 344 HD12 LEU 44 HD12 LEU 44 4.142 16.765 -37.431 345 HD13 LEU 44 HD13 LEU 44 4.040 16.657 -39.189 346 HD21 LEU 44 HD21 LEU 44 1.973 16.500 -36.059 347 HD22 LEU 44 HD22 LEU 44 1.727 14.959 -36.879 348 HD23 LEU 44 HD23 LEU 44 0.468 16.193 -36.927 349 H VAL 45 HN VAL 45 -0.147 19.698 -40.823 350 HA VAL 45 HA VAL 45 0.264 22.389 -39.679 351 HB VAL 45 HB VAL 45 -0.926 21.750 -42.391 352 HG11 VAL 45 HG11 VAL 45 -0.208 24.386 -41.117 353 HG12 VAL 45 HG12 VAL 45 -1.838 23.786 -41.426 354 HG13 VAL 45 HG13 VAL 45 -0.765 24.168 -42.775 355 HG21 VAL 45 HG21 VAL 45 1.117 22.726 -43.342 356 HG22 VAL 45 HG22 VAL 45 1.476 21.290 -42.382 357 HG23 VAL 45 HG23 VAL 45 1.785 22.895 -41.719 358 H ASP 46 HN ASP 46 -1.551 23.446 -38.901 359 HA ASP 46 HA ASP 46 -3.831 21.854 -38.257 360 HB2 ASP 46 HB2 ASP 46 -3.241 23.536 -36.668 361 HB3 ASP 46 HB1 ASP 46 -3.254 24.797 -37.897 362 H LYS 47 HN LYS 47 -5.319 21.328 -39.661 363 HA LYS 47 HA LYS 47 -6.431 23.453 -41.353 364 HB2 LYS 47 HB2 LYS 47 -4.980 21.696 -42.608 365 HB3 LYS 47 HB1 LYS 47 -6.308 20.590 -42.296 366 HG2 LYS 47 HG2 LYS 47 -6.714 23.219 -43.693 367 HG3 LYS 47 HG1 LYS 47 -6.257 21.752 -44.556 368 HD2 LYS 47 HD2 LYS 47 -8.624 21.715 -42.732 369 HD3 LYS 47 HD1 LYS 47 -8.773 22.444 -44.330 370 HE2 LYS 47 HE2 LYS 47 -9.474 20.097 -44.333 371 HE3 LYS 47 HE1 LYS 47 -8.076 20.360 -45.372 372 HZ1 LYS 47 HZ1 LYS 47 -8.062 18.332 -43.861 373 HZ2 LYS 47 HZ2 LYS 47 -7.765 19.413 -42.589 374 HZ3 LYS 47 HZ3 LYS 47 -6.669 19.296 -43.881 375 H SER 48 HN SER 48 -7.872 23.696 -39.613 376 HA SER 48 HA SER 48 -9.323 21.551 -38.479 377 HB2 SER 48 HB2 SER 48 -9.939 24.515 -38.481 378 HB3 SER 48 HB1 SER 48 -10.668 23.316 -37.415 379 HG SER 48 HG SER 48 -7.869 23.467 -37.488 380 H CYS 49 HN CYS 49 -11.108 20.557 -39.095 381 HA CYS 49 HA CYS 49 -12.273 21.006 -41.640 382 HB2 CYS 49 HB2 CYS 49 -12.182 18.795 -40.528 383 HB3 CYS 49 HB1 CYS 49 -13.317 19.371 -39.313 384 HG CYS 49 HG CYS 49 -15.087 18.012 -40.682 385 H GLY 50 HN GLY 50 -12.890 22.278 -38.509 386 HA2 GLY 50 HA2 GLY 50 -14.281 24.428 -38.862 387 HA3 GLY 50 HA1 GLY 50 -15.530 23.276 -39.321 388 H CYS 51 HN CYS 51 -14.889 21.272 -37.456 389 HA CYS 51 HA CYS 51 -15.682 22.592 -34.956 390 HB2 CYS 51 HB2 CYS 51 -17.346 21.022 -35.856 391 HB3 CYS 51 HB1 CYS 51 -16.143 19.739 -35.859 392 HG CYS 51 HG CYS 51 -18.104 20.780 -33.410 393 H GLY 52 HN GLY 52 -13.747 23.002 -34.006 394 HA2 GLY 52 HA2 GLY 52 -12.077 22.443 -32.509 395 HA3 GLY 52 HA1 GLY 52 -12.431 20.747 -32.798 396 H THR 53 HN THR 53 -9.920 21.142 -32.542 397 HA THR 53 HA THR 53 -8.475 22.044 -34.793 398 HB THR 53 HB THR 53 -7.632 20.166 -32.575 399 HG1 THR 53 HG1 THR 53 -7.367 22.991 -32.925 400 HG21 THR 53 HG21 THR 53 -6.133 19.999 -34.514 401 HG22 THR 53 HG22 THR 53 -5.337 20.796 -33.157 402 HG23 THR 53 HG23 THR 53 -5.936 21.752 -34.514 403 H SER 54 HN SER 54 -7.700 21.008 -36.545 404 HA SER 54 HA SER 54 -8.028 18.103 -36.755 405 HB2 SER 54 HB2 SER 54 -8.737 20.017 -38.995 406 HB3 SER 54 HB1 SER 54 -8.945 18.266 -38.983 407 HG SER 54 HG SER 54 -10.187 19.429 -36.868 408 H PHE 55 HN PHE 55 -6.451 17.123 -38.149 409 HA PHE 55 HA PHE 55 -4.125 18.893 -38.482 410 HB2 PHE 55 HB2 PHE 55 -4.199 15.935 -37.858 411 HB3 PHE 55 HB1 PHE 55 -2.735 16.864 -38.156 412 HD1 PHE 55 HD1 PHE 55 -2.101 18.684 -36.571 413 HD2 PHE 55 HD2 PHE 55 -5.230 15.924 -35.734 414 HE1 PHE 55 HE1 PHE 55 -1.969 19.267 -34.183 415 HE2 PHE 55 HE2 PHE 55 -5.106 16.503 -33.344 416 HZ PHE 55 HZ PHE 55 -3.475 18.177 -32.567 417 H ASP 56 HN ASP 56 -3.208 19.062 -40.389 418 HA ASP 56 HA ASP 56 -3.953 17.136 -42.494 419 HB2 ASP 56 HB2 ASP 56 -4.619 19.693 -42.613 420 HB3 ASP 56 HB1 ASP 56 -2.941 19.888 -43.108 421 H ALA 57 HN ALA 57 -2.284 15.800 -42.805 422 HA ALA 57 HA ALA 57 0.409 16.830 -42.208 423 HB1 ALA 57 HB1 ALA 57 1.024 14.564 -41.582 424 HB2 ALA 57 HB2 ALA 57 -0.594 13.996 -41.999 425 HB3 ALA 57 HB3 ALA 57 -0.372 15.115 -40.655 426 H VAL 58 HN VAL 58 1.780 16.976 -43.793 427 HA VAL 58 HA VAL 58 1.321 15.571 -46.303 428 HB VAL 58 HB VAL 58 3.505 17.532 -45.555 429 HG11 VAL 58 HG11 VAL 58 2.698 16.443 -48.251 430 HG12 VAL 58 HG12 VAL 58 4.177 16.054 -47.372 431 HG13 VAL 58 HG13 VAL 58 3.907 17.693 -47.966 432 HG21 VAL 58 HG21 VAL 58 2.240 19.150 -46.898 433 HG22 VAL 58 HG22 VAL 58 1.310 18.584 -45.510 434 HG23 VAL 58 HG23 VAL 58 0.962 17.956 -47.122 435 H ILE 59 HN ILE 59 2.163 13.606 -46.601 436 HA ILE 59 HA ILE 59 4.316 12.771 -44.807 437 HB ILE 59 HB ILE 59 3.707 10.549 -45.103 438 HG12 ILE 59 HG12 ILE 59 1.877 11.101 -47.418 439 HG13 ILE 59 HG11 ILE 59 3.602 10.895 -47.695 440 HG21 ILE 59 HG21 ILE 59 1.125 12.073 -45.402 441 HG22 ILE 59 HG22 ILE 59 1.984 11.787 -43.887 442 HG23 ILE 59 HG23 ILE 59 1.291 10.432 -44.779 443 HD11 ILE 59 HD11 ILE 59 3.501 8.690 -46.664 444 HD12 ILE 59 HD12 ILE 59 2.413 8.823 -48.046 445 HD13 ILE 59 HD13 ILE 59 1.767 8.892 -46.407 446 H VAL 60 HN VAL 60 6.215 11.953 -45.520 447 HA VAL 60 HA VAL 60 6.682 11.839 -48.419 448 HB VAL 60 HB VAL 60 8.541 13.003 -46.330 449 HG11 VAL 60 HG11 VAL 60 9.013 12.559 -49.276 450 HG12 VAL 60 HG12 VAL 60 9.816 11.714 -47.952 451 HG13 VAL 60 HG13 VAL 60 10.083 13.442 -48.186 452 HG21 VAL 60 HG21 VAL 60 6.786 14.542 -47.009 453 HG22 VAL 60 HG22 VAL 60 7.184 14.273 -48.706 454 HG23 VAL 60 HG23 VAL 60 8.347 15.066 -47.643 455 H SER 61 HN SER 61 6.683 9.628 -48.606 456 HA SER 61 HA SER 61 8.691 8.169 -47.066 457 HB2 SER 61 HB2 SER 61 6.693 7.937 -45.706 458 HB3 SER 61 HB1 SER 61 5.760 7.418 -47.110 459 HG SER 61 HG SER 61 6.977 5.854 -45.467 460 H ASN 62 HN ASN 62 9.627 6.550 -48.111 461 HA ASN 62 HA ASN 62 9.181 6.096 -50.879 462 HB2 ASN 62 HB2 ASN 62 10.963 4.958 -48.793 463 HB3 ASN 62 HB1 ASN 62 10.688 3.985 -50.236 464 HD21 ASN 62 HD21 ASN 62 11.917 7.026 -49.032 465 HD22 ASN 62 HD22 ASN 62 12.895 7.398 -50.412 466 H ASN 63 HN ASN 63 7.709 4.815 -48.078 467 HA ASN 63 HA ASN 63 7.081 2.206 -48.928 468 HB2 ASN 63 HB2 ASN 63 6.835 3.064 -46.591 469 HB3 ASN 63 HB1 ASN 63 5.446 4.002 -47.115 470 HD21 ASN 63 HD21 ASN 63 3.502 2.996 -47.441 471 HD22 ASN 63 HD22 ASN 63 3.203 1.341 -47.035 472 H PHE 64 HN PHE 64 5.900 5.259 -49.914 473 HA PHE 64 HA PHE 64 3.427 4.105 -50.977 474 HB2 PHE 64 HB2 PHE 64 4.255 6.961 -50.453 475 HB3 PHE 64 HB1 PHE 64 2.774 6.525 -51.299 476 HD1 PHE 64 HD2 PHE 64 4.566 5.700 -48.122 477 HD2 PHE 64 HD1 PHE 64 0.847 6.383 -50.070 478 HE1 PHE 64 HE2 PHE 64 3.400 5.457 -45.971 479 HE2 PHE 64 HE1 PHE 64 -0.327 6.143 -47.922 480 HZ PHE 64 HZ PHE 64 0.949 5.678 -45.869 481 H GLU 65 HN GLU 65 6.519 4.747 -52.051 482 HA GLU 65 HA GLU 65 5.784 5.905 -54.597 483 HB2 GLU 65 HB2 GLU 65 8.123 5.894 -55.140 484 HB3 GLU 65 HB1 GLU 65 7.939 6.465 -53.491 485 HG2 GLU 65 HG2 GLU 65 9.690 5.075 -53.191 486 HG3 GLU 65 HG1 GLU 65 8.385 3.917 -52.947 487 H ASP 66 HN ASP 66 5.758 2.846 -53.296 488 HA ASP 66 HA ASP 66 6.453 1.340 -55.632 489 HB2 ASP 66 HB2 ASP 66 6.488 0.568 -53.163 490 HB3 ASP 66 HB1 ASP 66 4.755 0.327 -53.356 491 H LYS 67 HN LYS 67 3.842 3.204 -54.741 492 HA LYS 67 HA LYS 67 1.909 3.753 -55.763 493 HB2 LYS 67 HB2 LYS 67 2.856 1.861 -57.920 494 HB3 LYS 67 HB1 LYS 67 1.461 2.924 -58.061 495 HG2 LYS 67 HG2 LYS 67 4.312 3.803 -57.650 496 HG3 LYS 67 HG1 LYS 67 3.415 3.867 -59.165 497 HD2 LYS 67 HD2 LYS 67 2.292 5.227 -56.759 498 HD3 LYS 67 HD1 LYS 67 3.628 5.986 -57.622 499 HE2 LYS 67 HE2 LYS 67 1.487 6.826 -58.420 500 HE3 LYS 67 HE1 LYS 67 2.332 5.943 -59.689 501 HZ1 LYS 67 HZ1 LYS 67 -0.061 5.448 -59.568 502 HZ2 LYS 67 HZ2 LYS 67 0.151 4.806 -58.014 503 HZ3 LYS 67 HZ3 LYS 67 0.898 4.068 -59.349 504 H LYS 68 HN LYS 68 2.290 1.216 -54.084 505 HA LYS 68 HA LYS 68 0.133 -0.501 -54.770 506 HB2 LYS 68 HB2 LYS 68 1.399 0.030 -52.073 507 HB3 LYS 68 HB1 LYS 68 0.307 -1.296 -52.437 508 HG2 LYS 68 HG2 LYS 68 2.946 -0.903 -53.816 509 HG3 LYS 68 HG1 LYS 68 2.735 -1.879 -52.362 510 HD2 LYS 68 HD2 LYS 68 1.254 -2.329 -54.951 511 HD3 LYS 68 HD1 LYS 68 2.712 -3.198 -54.467 512 HE2 LYS 68 HE2 LYS 68 1.524 -4.003 -52.458 513 HE3 LYS 68 HE1 LYS 68 0.062 -3.191 -53.018 514 HZ1 LYS 68 HZ1 LYS 68 -0.042 -5.487 -53.635 515 HZ2 LYS 68 HZ2 LYS 68 1.486 -5.417 -54.368 516 HZ3 LYS 68 HZ3 LYS 68 0.184 -4.569 -55.046 517 H LEU 69 HN LEU 69 -1.680 0.776 -55.222 518 HA LEU 69 HA LEU 69 -2.543 2.921 -53.614 519 HB2 LEU 69 HB2 LEU 69 -3.154 2.366 -56.040 520 HB3 LEU 69 HB1 LEU 69 -4.337 1.261 -55.376 521 HG LEU 69 HG LEU 69 -5.221 3.510 -56.083 522 HD11 LEU 69 HD11 LEU 69 -6.670 3.803 -54.145 523 HD12 LEU 69 HD12 LEU 69 -5.604 2.779 -53.184 524 HD13 LEU 69 HD13 LEU 69 -6.483 2.098 -54.554 525 HD21 LEU 69 HD21 LEU 69 -4.862 5.401 -54.587 526 HD22 LEU 69 HD22 LEU 69 -3.349 4.866 -55.322 527 HD23 LEU 69 HD23 LEU 69 -3.715 4.447 -53.648 528 H LEU 70 HN LEU 70 -3.957 -0.338 -53.942 529 HA LEU 70 HA LEU 70 -5.728 0.057 -51.784 530 HB2 LEU 70 HB2 LEU 70 -6.363 -2.240 -52.012 531 HB3 LEU 70 HB1 LEU 70 -6.201 -1.527 -53.594 532 HG LEU 70 HG LEU 70 -5.394 -3.709 -53.811 533 HD11 LEU 70 HD11 LEU 70 -3.922 -2.163 -54.915 534 HD12 LEU 70 HD12 LEU 70 -3.008 -3.537 -54.292 535 HD13 LEU 70 HD13 LEU 70 -2.957 -1.989 -53.450 536 HD21 LEU 70 HD21 LEU 70 -5.216 -4.302 -51.474 537 HD22 LEU 70 HD22 LEU 70 -3.752 -3.332 -51.316 538 HD23 LEU 70 HD23 LEU 70 -3.753 -4.765 -52.344 539 H ASP 71 HN ASP 71 -2.464 -1.103 -51.951 540 HA ASP 71 HA ASP 71 -2.525 -2.452 -49.433 541 HB2 ASP 71 HB2 ASP 71 -0.923 -3.002 -51.274 542 HB3 ASP 71 HB1 ASP 71 -0.089 -1.489 -50.933 543 H ARG 72 HN ARG 72 -1.313 0.719 -50.525 544 HA ARG 72 HA ARG 72 -0.457 1.473 -47.923 545 HB2 ARG 72 HB2 ARG 72 -0.085 3.645 -48.791 546 HB3 ARG 72 HB1 ARG 72 0.301 2.535 -50.093 547 HG2 ARG 72 HG2 ARG 72 -1.970 2.982 -51.039 548 HG3 ARG 72 HG1 ARG 72 -2.162 4.239 -49.813 549 HD2 ARG 72 HD2 ARG 72 0.051 5.175 -50.691 550 HD3 ARG 72 HD1 ARG 72 -0.188 4.111 -52.074 551 HE ARG 72 HE ARG 72 -2.531 5.532 -51.841 552 HH11 ARG 72 HH11 ARG 72 0.855 6.306 -52.297 553 HH12 ARG 72 HH12 ARG 72 0.549 7.799 -53.132 554 HH21 ARG 72 HH21 ARG 72 -2.955 7.474 -52.955 555 HH22 ARG 72 HH22 ARG 72 -1.638 8.460 -53.509 556 H HIS 73 HN HIS 73 -3.486 1.655 -49.650 557 HA HIS 73 HA HIS 73 -4.860 3.388 -47.892 558 HB2 HIS 73 HB2 HIS 73 -5.682 2.883 -50.138 559 HB3 HIS 73 HB1 HIS 73 -5.898 1.194 -49.706 560 HD1 HIS 73 HD1 HIS 73 -7.310 4.613 -48.739 561 HD2 HIS 73 HD2 HIS 73 -8.383 0.587 -48.811 562 HE1 HIS 73 HE1 HIS 73 -9.757 4.549 -48.164 563 HE2 HIS 73 HE2 HIS 73 -10.378 2.103 -48.155 564 H ARG 74 HN ARG 74 -4.696 -0.177 -48.036 565 HA ARG 74 HA ARG 74 -6.358 -0.614 -45.803 566 HB2 ARG 74 HB2 ARG 74 -5.553 -2.906 -45.836 567 HB3 ARG 74 HB1 ARG 74 -5.838 -2.359 -47.481 568 HG2 ARG 74 HG2 ARG 74 -3.341 -1.831 -47.543 569 HG3 ARG 74 HG1 ARG 74 -3.231 -2.813 -46.084 570 HD2 ARG 74 HD2 ARG 74 -4.413 -3.759 -48.688 571 HD3 ARG 74 HD1 ARG 74 -2.743 -4.034 -48.201 572 HE ARG 74 HE ARG 74 -5.011 -5.050 -46.614 573 HH11 ARG 74 HH11 ARG 74 -1.913 -5.496 -48.191 574 HH12 ARG 74 HH12 ARG 74 -1.803 -7.184 -47.780 575 HH21 ARG 74 HH21 ARG 74 -4.854 -7.262 -46.037 576 HH22 ARG 74 HH22 ARG 74 -3.459 -8.180 -46.534 577 H LEU 75 HN LEU 75 -2.837 -0.247 -46.087 578 HA LEU 75 HA LEU 75 -2.231 -0.852 -43.400 579 HB2 LEU 75 HB2 LEU 75 -0.824 0.388 -45.672 580 HB3 LEU 75 HB1 LEU 75 -0.251 0.881 -44.093 581 HG LEU 75 HG LEU 75 1.072 -0.972 -44.945 582 HD11 LEU 75 HD11 LEU 75 0.865 -2.492 -43.046 583 HD12 LEU 75 HD12 LEU 75 -0.708 -1.796 -42.657 584 HD13 LEU 75 HD13 LEU 75 0.749 -0.807 -42.541 585 HD21 LEU 75 HD21 LEU 75 -0.600 -2.011 -46.388 586 HD22 LEU 75 HD22 LEU 75 -1.511 -2.529 -44.970 587 HD23 LEU 75 HD23 LEU 75 0.095 -3.188 -45.273 588 H VAL 76 HN VAL 76 -2.705 2.283 -45.029 589 HA VAL 76 HA VAL 76 -2.353 3.917 -42.804 590 HB VAL 76 HB VAL 76 -4.056 4.319 -45.266 591 HG11 VAL 76 HG11 VAL 76 -4.206 6.689 -44.652 592 HG12 VAL 76 HG12 VAL 76 -3.426 6.338 -43.110 593 HG13 VAL 76 HG13 VAL 76 -5.015 5.662 -43.467 594 HG21 VAL 76 HG21 VAL 76 -2.264 5.895 -45.869 595 HG22 VAL 76 HG22 VAL 76 -1.670 4.247 -45.665 596 HG23 VAL 76 HG23 VAL 76 -1.396 5.445 -44.400 597 H ASN 77 HN ASN 77 -5.335 2.392 -44.013 598 HA ASN 77 HA ASN 77 -7.010 3.609 -42.081 599 HB2 ASN 77 HB2 ASN 77 -7.440 1.094 -43.700 600 HB3 ASN 77 HB1 ASN 77 -8.676 1.876 -42.725 601 HD21 ASN 77 HD21 ASN 77 -7.605 4.565 -43.484 602 HD22 ASN 77 HD22 ASN 77 -8.197 4.831 -45.079 603 H THR 78 HN THR 78 -5.042 0.726 -41.996 604 HA THR 78 HA THR 78 -6.328 -0.507 -39.793 605 HB THR 78 HB THR 78 -3.467 -0.810 -40.737 606 HG1 THR 78 HG1 THR 78 -4.907 -1.433 -42.356 607 HG21 THR 78 HG21 THR 78 -3.772 -1.626 -38.444 608 HG22 THR 78 HG22 THR 78 -3.520 -2.963 -39.566 609 HG23 THR 78 HG23 THR 78 -5.142 -2.604 -38.972 610 H ILE 79 HN ILE 79 -3.531 1.691 -40.011 611 HA ILE 79 HA ILE 79 -3.199 1.683 -37.140 612 HB ILE 79 HB ILE 79 -1.819 3.197 -39.350 613 HG12 ILE 79 HG12 ILE 79 0.185 2.025 -38.310 614 HG13 ILE 79 HG11 ILE 79 -0.960 1.111 -37.341 615 HG21 ILE 79 HG21 ILE 79 -2.045 4.753 -37.488 616 HG22 ILE 79 HG22 ILE 79 -0.369 4.240 -37.678 617 HG23 ILE 79 HG23 ILE 79 -1.361 3.554 -36.391 618 HD11 ILE 79 HD11 ILE 79 -1.943 0.183 -39.363 619 HD12 ILE 79 HD12 ILE 79 -0.211 -0.147 -39.281 620 HD13 ILE 79 HD13 ILE 79 -0.819 1.120 -40.346 621 H LEU 80 HN LEU 80 -4.439 3.922 -39.590 622 HA LEU 80 HA LEU 80 -5.034 5.953 -37.677 623 HB2 LEU 80 HB2 LEU 80 -5.646 5.574 -40.572 624 HB3 LEU 80 HB1 LEU 80 -6.526 6.788 -39.663 625 HG LEU 80 HG LEU 80 -4.312 7.799 -39.020 626 HD11 LEU 80 HD11 LEU 80 -2.353 7.234 -40.352 627 HD12 LEU 80 HD12 LEU 80 -3.243 5.915 -41.114 628 HD13 LEU 80 HD13 LEU 80 -2.891 5.860 -39.386 629 HD21 LEU 80 HD21 LEU 80 -4.955 7.641 -41.960 630 HD22 LEU 80 HD22 LEU 80 -3.966 8.880 -41.187 631 HD23 LEU 80 HD23 LEU 80 -5.677 8.745 -40.789 632 H LYS 81 HN LYS 81 -6.461 3.020 -38.288 633 HA LYS 81 HA LYS 81 -9.146 3.381 -37.793 634 HB2 LYS 81 HB2 LYS 81 -8.428 1.163 -38.114 635 HB3 LYS 81 HB1 LYS 81 -7.165 1.298 -36.905 636 HG2 LYS 81 HG2 LYS 81 -8.863 -0.138 -36.062 637 HG3 LYS 81 HG1 LYS 81 -8.925 1.372 -35.155 638 HD2 LYS 81 HD2 LYS 81 -10.817 2.109 -36.532 639 HD3 LYS 81 HD1 LYS 81 -10.754 0.581 -37.420 640 HE2 LYS 81 HE2 LYS 81 -11.132 -0.626 -35.296 641 HE3 LYS 81 HE1 LYS 81 -11.292 0.924 -34.471 642 HZ1 LYS 81 HZ1 LYS 81 -13.442 -0.025 -35.009 643 HZ2 LYS 81 HZ2 LYS 81 -13.046 -0.061 -36.658 644 HZ3 LYS 81 HZ3 LYS 81 -13.206 1.426 -35.854 645 H GLU 82 HN GLU 82 -6.677 2.841 -35.266 646 HA GLU 82 HA GLU 82 -8.405 3.863 -33.216 647 HB2 GLU 82 HB2 GLU 82 -5.413 3.493 -33.020 648 HB3 GLU 82 HB1 GLU 82 -6.587 3.474 -31.712 649 HG2 GLU 82 HG2 GLU 82 -7.501 1.382 -32.542 650 HG3 GLU 82 HG1 GLU 82 -6.357 1.407 -33.886 651 H GLU 83 HN GLU 83 -5.857 5.103 -35.228 652 HA GLU 83 HA GLU 83 -4.974 7.337 -33.856 653 HB2 GLU 83 HB2 GLU 83 -4.449 6.224 -36.209 654 HB3 GLU 83 HB1 GLU 83 -5.482 7.528 -36.774 655 HG2 GLU 83 HG2 GLU 83 -3.412 8.409 -36.934 656 HG3 GLU 83 HG1 GLU 83 -3.952 9.035 -35.380 657 H LEU 84 HN LEU 84 -7.389 7.274 -36.404 658 HA LEU 84 HA LEU 84 -8.395 9.804 -36.294 659 HB2 LEU 84 HB2 LEU 84 -9.918 7.262 -36.826 660 HB3 LEU 84 HB1 LEU 84 -10.556 8.866 -37.127 661 HG LEU 84 HG LEU 84 -8.205 7.563 -38.495 662 HD11 LEU 84 HD11 LEU 84 -9.588 7.789 -40.494 663 HD12 LEU 84 HD12 LEU 84 -10.890 8.471 -39.521 664 HD13 LEU 84 HD13 LEU 84 -10.380 6.802 -39.267 665 HD21 LEU 84 HD21 LEU 84 -8.031 9.598 -39.833 666 HD22 LEU 84 HD22 LEU 84 -7.750 9.944 -38.127 667 HD23 LEU 84 HD23 LEU 84 -9.296 10.356 -38.866 668 H GLN 85 HN GLN 85 -9.081 7.252 -33.965 669 HA GLN 85 HA GLN 85 -11.457 8.217 -32.870 670 HB2 GLN 85 HB2 GLN 85 -9.168 6.849 -31.457 671 HB3 GLN 85 HB1 GLN 85 -10.731 7.152 -30.723 672 HG2 GLN 85 HG2 GLN 85 -9.895 5.088 -32.628 673 HG3 GLN 85 HG1 GLN 85 -11.130 5.047 -31.375 674 HE21 GLN 85 HE21 GLN 85 -10.444 5.491 -34.675 675 HE22 GLN 85 HE22 GLN 85 -12.065 5.718 -35.217 676 H ASN 86 HN ASN 86 -8.271 9.529 -32.669 677 HA ASN 86 HA ASN 86 -9.023 11.201 -30.376 678 HB2 ASN 86 HB2 ASN 86 -6.316 10.663 -31.612 679 HB3 ASN 86 HB1 ASN 86 -6.597 11.745 -30.255 680 HD21 ASN 86 HD21 ASN 86 -6.450 8.448 -31.308 681 HD22 ASN 86 HD22 ASN 86 -6.498 7.725 -29.736 682 H ILE 87 HN ILE 87 -9.246 11.397 -33.618 683 HA ILE 87 HA ILE 87 -8.659 14.290 -33.640 684 HB ILE 87 HB ILE 87 -8.386 12.572 -36.101 685 HG12 ILE 87 HG12 ILE 87 -6.193 13.321 -34.149 686 HG13 ILE 87 HG11 ILE 87 -6.818 11.700 -34.437 687 HG21 ILE 87 HG21 ILE 87 -7.031 14.454 -36.890 688 HG22 ILE 87 HG22 ILE 87 -7.292 15.284 -35.356 689 HG23 ILE 87 HG23 ILE 87 -8.654 14.972 -36.432 690 HD11 ILE 87 HD11 ILE 87 -5.366 13.409 -36.437 691 HD12 ILE 87 HD12 ILE 87 -5.992 11.785 -36.723 692 HD13 ILE 87 HD13 ILE 87 -4.697 12.039 -35.552 693 H HIS 88 HN HIS 88 -10.230 15.586 -34.513 694 HA HIS 88 HA HIS 88 -12.791 14.466 -35.048 695 HB2 HIS 88 HB2 HIS 88 -12.409 16.782 -34.153 696 HB3 HIS 88 HB1 HIS 88 -11.839 17.251 -35.751 697 HD1 HIS 88 HD1 HIS 88 -14.963 16.262 -33.902 698 HD2 HIS 88 HD2 HIS 88 -13.834 17.704 -37.643 699 HE1 HIS 88 HE1 HIS 88 -17.103 16.921 -35.053 700 HE2 HIS 88 HE2 HIS 88 -16.388 17.924 -37.256 701 H ALA 89 HN ALA 89 -10.207 15.764 -37.086 702 HA ALA 89 HA ALA 89 -11.051 14.085 -39.270 703 HB1 ALA 89 HB1 ALA 89 -12.488 16.041 -39.602 704 HB2 ALA 89 HB2 ALA 89 -11.304 15.882 -40.898 705 HB3 ALA 89 HB3 ALA 89 -11.065 17.083 -39.627 706 H PHE 90 HN PHE 90 -9.147 13.158 -39.702 707 HA PHE 90 HA PHE 90 -6.748 14.843 -39.812 708 HB2 PHE 90 HB2 PHE 90 -6.623 12.821 -38.397 709 HB3 PHE 90 HB1 PHE 90 -6.985 11.823 -39.801 710 HD1 PHE 90 HD1 PHE 90 -4.488 14.111 -38.328 711 HD2 PHE 90 HD2 PHE 90 -5.290 11.179 -41.305 712 HE1 PHE 90 HE1 PHE 90 -2.083 13.969 -38.831 713 HE2 PHE 90 HE2 PHE 90 -2.888 11.031 -41.814 714 HZ PHE 90 HZ PHE 90 -1.281 12.426 -40.577 715 H SER 91 HN SER 91 -6.058 15.506 -41.702 716 HA SER 91 HA SER 91 -6.782 13.984 -44.119 717 HB2 SER 91 HB2 SER 91 -5.929 16.885 -43.977 718 HB3 SER 91 HB1 SER 91 -6.638 16.042 -45.354 719 HG SER 91 HG SER 91 -8.561 15.796 -44.090 720 H MET 92 HN MET 92 -5.123 13.568 -45.663 721 HA MET 92 HA MET 92 -2.403 14.199 -44.777 722 HB2 MET 92 HB2 MET 92 -1.624 11.958 -45.075 723 HB3 MET 92 HB1 MET 92 -3.027 11.891 -44.023 724 HG2 MET 92 HG2 MET 92 -3.066 11.294 -46.974 725 HG3 MET 92 HG1 MET 92 -2.946 10.083 -45.703 726 HE1 MET 92 HE1 MET 92 -4.885 9.465 -44.041 727 HE2 MET 92 HE2 MET 92 -6.407 10.351 -43.932 728 HE3 MET 92 HE3 MET 92 -4.896 11.135 -43.474 729 H LYS 93 HN LYS 93 -0.947 14.588 -46.354 730 HA LYS 93 HA LYS 93 -1.850 14.299 -49.144 731 HB2 LYS 93 HB2 LYS 93 -0.079 16.298 -47.792 732 HB3 LYS 93 HB1 LYS 93 0.234 15.903 -49.475 733 HG2 LYS 93 HG2 LYS 93 -1.163 17.902 -49.212 734 HG3 LYS 93 HG1 LYS 93 -1.984 16.619 -50.102 735 HD2 LYS 93 HD2 LYS 93 -3.276 16.028 -48.176 736 HD3 LYS 93 HD1 LYS 93 -2.342 17.119 -47.155 737 HE2 LYS 93 HE2 LYS 93 -3.185 19.027 -48.465 738 HE3 LYS 93 HE1 LYS 93 -4.150 17.914 -49.436 739 HZ1 LYS 93 HZ1 LYS 93 -5.491 18.917 -47.711 740 HZ2 LYS 93 HZ2 LYS 93 -4.419 18.375 -46.512 741 HZ3 LYS 93 HZ3 LYS 93 -5.320 17.259 -47.412 742 H CYS 94 HN CYS 94 -1.037 12.601 -50.100 743 HA CYS 94 HA CYS 94 1.249 11.240 -48.976 744 HB2 CYS 94 HB2 CYS 94 0.705 9.566 -50.820 745 HB3 CYS 94 HB1 CYS 94 -0.529 9.812 -49.590 746 HG CYS 94 HG CYS 94 -0.545 11.003 -52.798 747 H HIS 95 HN HIS 95 3.248 11.781 -49.529 748 HA HIS 95 HA HIS 95 3.859 12.038 -52.370 749 HB2 HIS 95 HB2 HIS 95 4.194 14.195 -50.372 750 HB3 HIS 95 HB1 HIS 95 5.555 13.929 -51.457 751 HD1 HIS 95 HD1 HIS 95 3.225 16.324 -51.342 752 HD2 HIS 95 HD2 HIS 95 3.896 13.389 -54.217 753 HE1 HIS 95 HE1 HIS 95 2.221 17.209 -53.468 754 HE2 HIS 95 HE2 HIS 95 2.833 15.516 -55.233 755 H THR 96 HN THR 96 6.245 12.025 -52.757 756 HA THR 96 HA THR 96 7.533 10.148 -50.892 757 HB THR 96 HB THR 96 8.861 9.476 -52.951 758 HG1 THR 96 HG1 THR 96 7.849 10.036 -54.968 759 HG21 THR 96 HG21 THR 96 7.106 8.050 -52.108 760 HG22 THR 96 HG22 THR 96 7.021 8.083 -53.871 761 HG23 THR 96 HG23 THR 96 5.876 9.025 -52.915 762 HA PRO 97 HA PRO 97 11.026 12.844 -50.328 763 HB2 PRO 97 HB2 PRO 97 12.813 10.645 -51.205 764 HB3 PRO 97 HB1 PRO 97 12.793 11.537 -49.679 765 HG2 PRO 97 HG2 PRO 97 11.911 9.028 -49.793 766 HG3 PRO 97 HG1 PRO 97 11.088 10.238 -48.789 767 HD2 PRO 97 HD2 PRO 97 10.318 9.161 -51.477 768 HD3 PRO 97 HD1 PRO 97 9.291 9.511 -50.069 769 H LEU 98 HN LEU 98 10.734 11.030 -53.284 770 HA LEU 98 HA LEU 98 12.698 12.386 -54.798 771 HB2 LEU 98 HB2 LEU 98 10.191 10.939 -55.665 772 HB3 LEU 98 HB1 LEU 98 11.379 11.574 -56.782 773 HG LEU 98 HG LEU 98 11.802 9.260 -56.613 774 HD11 LEU 98 HD11 LEU 98 13.810 10.605 -56.593 775 HD12 LEU 98 HD12 LEU 98 14.040 9.143 -55.631 776 HD13 LEU 98 HD13 LEU 98 13.762 10.692 -54.833 777 HD21 LEU 98 HD21 LEU 98 11.794 9.545 -53.612 778 HD22 LEU 98 HD22 LEU 98 12.127 8.068 -54.516 779 HD23 LEU 98 HD23 LEU 98 10.525 8.800 -54.584 780 H GLU 99 HN GLU 99 9.187 12.840 -54.493 781 HA GLU 99 HA GLU 99 9.208 15.200 -56.114 782 HB2 GLU 99 HB2 GLU 99 7.045 14.074 -54.331 783 HB3 GLU 99 HB1 GLU 99 6.833 15.408 -55.458 784 HG2 GLU 99 HG2 GLU 99 7.567 13.809 -57.277 785 HG3 GLU 99 HG1 GLU 99 7.397 12.526 -56.082 786 H TYR 100 HN TYR 100 9.376 14.487 -52.699 787 HA TYR 100 HA TYR 100 8.908 17.112 -51.758 788 HB2 TYR 100 HB2 TYR 100 8.751 15.280 -50.218 789 HB3 TYR 100 HB1 TYR 100 10.413 14.795 -50.537 790 HD1 TYR 100 HD1 TYR 100 8.552 17.835 -49.392 791 HD2 TYR 100 HD2 TYR 100 11.978 15.354 -48.949 792 HE1 TYR 100 HE1 TYR 100 9.323 19.243 -47.529 793 HE2 TYR 100 HE2 TYR 100 12.758 16.753 -47.085 794 HH TYR 100 HH TYR 100 10.776 19.157 -45.628 795 H ASP 101 HN ASP 101 11.872 15.396 -52.672 796 HA ASP 101 HA ASP 101 13.739 17.332 -51.942 797 HB2 ASP 101 HB2 ASP 101 14.512 15.177 -52.639 798 HB3 ASP 101 HB1 ASP 101 13.753 15.353 -54.219 799 H LYS 102 HN LYS 102 11.749 17.057 -54.814 800 HA LYS 102 HA LYS 102 12.899 19.059 -56.368 801 HB2 LYS 102 HB2 LYS 102 10.163 17.876 -56.198 802 HB3 LYS 102 HB1 LYS 102 10.446 19.275 -57.227 803 HG2 LYS 102 HG2 LYS 102 11.707 18.109 -58.709 804 HG3 LYS 102 HG1 LYS 102 12.307 16.986 -57.487 805 HD2 LYS 102 HD2 LYS 102 10.763 15.954 -59.130 806 HD3 LYS 102 HD1 LYS 102 10.234 15.815 -57.456 807 HE2 LYS 102 HE2 LYS 102 8.330 16.375 -58.783 808 HE3 LYS 102 HE1 LYS 102 8.760 17.790 -57.828 809 HZ1 LYS 102 HZ1 LYS 102 8.249 18.441 -60.067 810 HZ2 LYS 102 HZ2 LYS 102 9.376 17.344 -60.696 811 HZ3 LYS 102 HZ3 LYS 102 9.910 18.681 -59.797 812 H LEU 103 HN LEU 103 10.321 19.212 -53.960 813 HA LEU 103 HA LEU 103 9.719 21.949 -54.331 814 HB2 LEU 103 HB2 LEU 103 9.256 20.283 -51.857 815 HB3 LEU 103 HB1 LEU 103 8.404 21.745 -52.314 816 HG LEU 103 HG LEU 103 8.263 19.087 -53.745 817 HD11 LEU 103 HD11 LEU 103 5.963 19.035 -52.954 818 HD12 LEU 103 HD12 LEU 103 6.213 20.554 -52.093 819 HD13 LEU 103 HD13 LEU 103 7.095 19.108 -51.602 820 HD21 LEU 103 HD21 LEU 103 8.071 20.943 -55.308 821 HD22 LEU 103 HD22 LEU 103 6.828 21.682 -54.300 822 HD23 LEU 103 HD23 LEU 103 6.515 20.140 -55.097 823 H LYS 104 HN LYS 104 11.862 20.252 -52.095 824 HA LYS 104 HA LYS 104 12.321 22.637 -50.540 825 HB2 LYS 104 HB2 LYS 104 13.761 21.227 -49.163 826 HB3 LYS 104 HB1 LYS 104 12.202 20.464 -49.435 827 HG2 LYS 104 HG2 LYS 104 13.103 18.905 -50.941 828 HG3 LYS 104 HG1 LYS 104 14.603 19.815 -51.114 829 HD2 LYS 104 HD2 LYS 104 14.671 19.374 -48.478 830 HD3 LYS 104 HD1 LYS 104 13.728 17.966 -48.976 831 HE2 LYS 104 HE2 LYS 104 16.040 17.346 -48.979 832 HE3 LYS 104 HE1 LYS 104 15.498 17.465 -50.657 833 HZ1 LYS 104 HZ1 LYS 104 16.829 19.726 -49.285 834 HZ2 LYS 104 HZ2 LYS 104 16.621 19.474 -50.952 835 HZ3 LYS 104 HZ3 LYS 104 17.715 18.521 -50.080 836 H SER 105 HN SER 105 14.150 20.742 -52.913 837 HA SER 105 HA SER 105 16.584 22.168 -52.312 838 HB2 SER 105 HB2 SER 105 16.037 20.177 -54.521 839 HB3 SER 105 HB1 SER 105 17.620 20.704 -53.947 840 HG SER 105 HG SER 105 16.533 18.623 -53.107 841 H LYS 106 HN LYS 106 14.396 21.949 -55.125 842 HA LYS 106 HA LYS 106 15.772 24.339 -56.156 843 HB2 LYS 106 HB2 LYS 106 15.007 23.518 -58.459 844 HB3 LYS 106 HB1 LYS 106 16.366 22.711 -57.698 845 HG2 LYS 106 HG2 LYS 106 13.668 21.553 -57.279 846 HG3 LYS 106 HG1 LYS 106 14.401 21.386 -58.874 847 HD2 LYS 106 HD2 LYS 106 16.466 20.517 -57.644 848 HD3 LYS 106 HD1 LYS 106 15.423 20.386 -56.227 849 HE2 LYS 106 HE2 LYS 106 13.968 18.853 -57.370 850 HE3 LYS 106 HE1 LYS 106 14.833 19.095 -58.886 851 HZ1 LYS 106 HZ1 LYS 106 16.841 18.202 -57.632 852 HZ2 LYS 106 HZ2 LYS 106 15.641 17.091 -58.060 853 HZ3 LYS 106 HZ3 LYS 106 15.738 17.653 -56.464 854 H GLY 107 HN GLY 107 12.635 22.655 -56.289 855 HA2 GLY 107 HA2 GLY 107 10.783 24.296 -55.625 856 HA3 GLY 107 HA1 GLY 107 11.404 25.240 -56.975 857 H SER 108 HN SER 108 11.950 23.183 -58.780 858 HA SER 108 HA SER 108 9.444 21.729 -59.119 859 HB2 SER 108 HB2 SER 108 10.625 23.553 -61.231 860 HB3 SER 108 HB1 SER 108 9.258 22.466 -61.473 861 HG SER 108 HG SER 108 8.571 23.820 -59.396 Start of MODEL 2 1 H1 MET 1 HT1 MET 1 1.849 -1.971 1.261 2 H2 MET 1 HT2 MET 1 1.043 -0.481 1.248 3 H3 MET 1 HT3 MET 1 2.731 -0.531 1.408 4 HA MET 1 HA MET 1 1.201 -1.429 -0.958 5 HB2 MET 1 HB2 MET 1 2.170 0.540 -2.090 6 HB3 MET 1 HB1 MET 1 1.111 0.991 -0.764 7 HG2 MET 1 HG2 MET 1 2.874 2.446 -0.516 8 HG3 MET 1 HG1 MET 1 3.292 1.161 0.612 9 HE1 MET 1 HE1 MET 1 5.238 1.753 -3.536 10 HE2 MET 1 HE2 MET 1 4.024 2.833 -2.848 11 HE3 MET 1 HE3 MET 1 3.577 1.198 -3.333 12 H GLY 2 HN GLY 2 2.458 -2.186 -2.683 13 HA2 GLY 2 HA2 GLY 2 5.146 -3.067 -1.822 14 HA3 GLY 2 HA1 GLY 2 4.094 -3.994 -2.882 15 H SER 3 HN SER 3 6.176 -3.979 -4.119 16 HA SER 3 HA SER 3 6.754 -1.525 -5.547 17 HB2 SER 3 HB2 SER 3 7.868 -4.319 -5.907 18 HB3 SER 3 HB1 SER 3 8.505 -2.851 -6.648 19 HG SER 3 HG SER 3 8.593 -2.121 -4.304 20 H SER 4 HN SER 4 4.514 -3.980 -5.813 21 HA SER 4 HA SER 4 4.348 -4.097 -8.676 22 HB2 SER 4 HB2 SER 4 2.325 -4.926 -6.580 23 HB3 SER 4 HB1 SER 4 2.316 -5.395 -8.282 24 HG SER 4 HG SER 4 3.321 -6.848 -6.551 25 H HIS 5 HN HIS 5 3.645 -2.460 -9.854 26 HA HIS 5 HA HIS 5 1.923 -0.441 -8.623 27 HB2 HIS 5 HB2 HIS 5 3.597 -0.414 -11.136 28 HB3 HIS 5 HB1 HIS 5 2.495 0.886 -10.700 29 HD1 HIS 5 HD1 HIS 5 5.793 -0.614 -9.825 30 HD2 HIS 5 HD2 HIS 5 3.339 2.500 -8.566 31 HE1 HIS 5 HE1 HIS 5 7.228 0.825 -8.339 32 HE2 HIS 5 HE2 HIS 5 5.776 2.799 -7.743 33 H HIS 6 HN HIS 6 0.275 0.575 -10.039 34 HA HIS 6 HA HIS 6 -1.320 -1.510 -11.330 35 HB2 HIS 6 HB2 HIS 6 -1.996 1.337 -10.547 36 HB3 HIS 6 HB1 HIS 6 -3.122 0.218 -11.309 37 HD1 HIS 6 HD1 HIS 6 -2.242 1.464 -8.106 38 HD2 HIS 6 HD2 HIS 6 -3.353 -2.266 -9.580 39 HE1 HIS 6 HE1 HIS 6 -3.056 0.159 -6.114 40 HE2 HIS 6 HE2 HIS 6 -3.949 -1.990 -7.079 41 H HIS 7 HN HIS 7 -2.452 -0.922 -13.380 42 HA HIS 7 HA HIS 7 -0.673 0.706 -15.079 43 HB2 HIS 7 HB2 HIS 7 -1.976 -1.947 -15.696 44 HB3 HIS 7 HB1 HIS 7 -1.314 -0.897 -16.943 45 HD1 HIS 7 HD1 HIS 7 0.944 -1.579 -17.625 46 HD2 HIS 7 HD2 HIS 7 0.230 -2.443 -13.618 47 HE1 HIS 7 HE1 HIS 7 3.039 -2.685 -16.782 48 HE2 HIS 7 HE2 HIS 7 2.654 -3.042 -14.319 49 H HIS 8 HN HIS 8 -1.885 2.535 -15.145 50 HA HIS 8 HA HIS 8 -4.689 2.398 -15.901 51 HB2 HIS 8 HB2 HIS 8 -2.820 4.696 -15.324 52 HB3 HIS 8 HB1 HIS 8 -4.454 4.940 -15.931 53 HD1 HIS 8 HD1 HIS 8 -6.421 4.200 -14.322 54 HD2 HIS 8 HD2 HIS 8 -2.622 4.199 -12.629 55 HE1 HIS 8 HE1 HIS 8 -6.788 4.173 -11.834 56 HE2 HIS 8 HE2 HIS 8 -4.483 4.419 -10.847 57 H HIS 9 HN HIS 9 -5.167 1.996 -17.955 58 HA HIS 9 HA HIS 9 -3.276 2.769 -20.045 59 HB2 HIS 9 HB2 HIS 9 -5.702 0.969 -20.068 60 HB3 HIS 9 HB1 HIS 9 -4.810 1.400 -21.524 61 HD1 HIS 9 HD1 HIS 9 -2.806 0.006 -22.074 62 HD2 HIS 9 HD2 HIS 9 -4.085 -0.538 -18.151 63 HE1 HIS 9 HE1 HIS 9 -1.418 -1.880 -21.162 64 HE2 HIS 9 HE2 HIS 9 -2.313 -2.295 -18.844 65 H HIS 10 HN HIS 10 -4.068 3.739 -22.032 66 HA HIS 10 HA HIS 10 -4.969 5.505 -23.130 67 HB2 HIS 10 HB2 HIS 10 -7.092 4.137 -22.765 68 HB3 HIS 10 HB1 HIS 10 -7.437 5.203 -21.409 69 HD1 HIS 10 HD1 HIS 10 -8.200 4.793 -24.852 70 HD2 HIS 10 HD2 HIS 10 -7.481 8.082 -22.406 71 HE1 HIS 10 HE1 HIS 10 -9.212 6.763 -26.045 72 HE2 HIS 10 HE2 HIS 10 -8.974 8.685 -24.437 73 H SER 11 HN SER 11 -3.277 6.632 -21.906 74 HA SER 11 HA SER 11 -4.392 8.960 -20.613 75 HB2 SER 11 HB2 SER 11 -4.045 7.414 -18.712 76 HB3 SER 11 HB1 SER 11 -2.356 7.230 -19.175 77 HG SER 11 HG SER 11 -3.550 9.721 -18.507 78 H SER 12 HN SER 12 -3.493 10.528 -21.786 79 HA SER 12 HA SER 12 -0.867 10.071 -22.966 80 HB2 SER 12 HB2 SER 12 -1.544 12.300 -24.168 81 HB3 SER 12 HB1 SER 12 -2.300 10.779 -24.645 82 HG SER 12 HG SER 12 -3.366 12.800 -22.952 83 H GLY 13 HN GLY 13 0.426 10.389 -21.147 84 HA2 GLY 13 HA2 GLY 13 2.033 12.258 -20.736 85 HA3 GLY 13 HA1 GLY 13 0.620 13.219 -20.330 86 H ARG 14 HN ARG 14 2.038 10.068 -19.383 87 HA ARG 14 HA ARG 14 1.210 10.614 -16.638 88 HB2 ARG 14 HB2 ARG 14 2.602 8.157 -17.714 89 HB3 ARG 14 HB1 ARG 14 1.864 8.337 -16.130 90 HG2 ARG 14 HG2 ARG 14 -0.317 8.755 -17.397 91 HG3 ARG 14 HG1 ARG 14 0.532 8.104 -18.801 92 HD2 ARG 14 HD2 ARG 14 -0.061 6.731 -16.190 93 HD3 ARG 14 HD1 ARG 14 -0.648 6.302 -17.796 94 HE ARG 14 HE ARG 14 2.224 6.218 -17.528 95 HH11 ARG 14 HH11 ARG 14 -0.767 4.420 -17.280 96 HH12 ARG 14 HH12 ARG 14 0.009 2.869 -17.343 97 HH21 ARG 14 HH21 ARG 14 3.257 4.186 -17.554 98 HH22 ARG 14 HH22 ARG 14 2.308 2.734 -17.487 99 H GLU 15 HN GLU 15 4.140 9.944 -18.516 100 HA GLU 15 HA GLU 15 5.820 10.837 -16.315 101 HB2 GLU 15 HB2 GLU 15 7.693 10.391 -17.906 102 HB3 GLU 15 HB1 GLU 15 6.681 8.991 -17.589 103 HG2 GLU 15 HG2 GLU 15 6.098 10.682 -19.969 104 HG3 GLU 15 HG1 GLU 15 7.465 9.570 -20.013 105 H ASN 16 HN ASN 16 3.983 12.730 -17.272 106 HA ASN 16 HA ASN 16 4.984 14.496 -19.221 107 HB2 ASN 16 HB2 ASN 16 3.355 16.114 -18.315 108 HB3 ASN 16 HB1 ASN 16 2.638 14.523 -18.540 109 HD21 ASN 16 HD21 ASN 16 1.947 13.370 -16.782 110 HD22 ASN 16 HD22 ASN 16 1.886 14.024 -15.181 111 H LEU 17 HN LEU 17 6.152 13.855 -16.160 112 HA LEU 17 HA LEU 17 7.069 16.444 -15.417 113 HB2 LEU 17 HB2 LEU 17 7.994 13.694 -14.576 114 HB3 LEU 17 HB1 LEU 17 8.580 15.184 -13.869 115 HG LEU 17 HG LEU 17 6.983 14.350 -12.359 116 HD11 LEU 17 HD11 LEU 17 6.776 16.731 -12.740 117 HD12 LEU 17 HD12 LEU 17 5.204 16.020 -12.374 118 HD13 LEU 17 HD13 LEU 17 5.616 16.440 -14.036 119 HD21 LEU 17 HD21 LEU 17 5.073 13.993 -14.661 120 HD22 LEU 17 HD22 LEU 17 4.725 13.670 -12.963 121 HD23 LEU 17 HD23 LEU 17 5.927 12.703 -13.816 122 H TYR 18 HN TYR 18 8.150 14.006 -17.584 123 HA TYR 18 HA TYR 18 10.868 14.933 -17.796 124 HB2 TYR 18 HB2 TYR 18 9.206 13.125 -19.569 125 HB3 TYR 18 HB1 TYR 18 10.911 13.461 -19.826 126 HD1 TYR 18 HD2 TYR 18 8.713 12.311 -17.013 127 HD2 TYR 18 HD1 TYR 18 12.366 11.833 -19.135 128 HE1 TYR 18 HE2 TYR 18 9.291 10.406 -15.573 129 HE2 TYR 18 HE1 TYR 18 12.953 9.923 -17.702 130 HH TYR 18 HH TYR 18 10.688 8.421 -15.637 131 H PHE 19 HN PHE 19 11.631 16.511 -19.140 132 HA PHE 19 HA PHE 19 9.721 18.182 -20.473 133 HB2 PHE 19 HB2 PHE 19 11.504 19.653 -20.951 134 HB3 PHE 19 HB1 PHE 19 11.923 18.943 -19.398 135 HD1 PHE 19 HD1 PHE 19 13.639 17.107 -19.332 136 HD2 PHE 19 HD2 PHE 19 12.909 19.447 -22.811 137 HE1 PHE 19 HE1 PHE 19 15.819 16.429 -20.245 138 HE2 PHE 19 HE2 PHE 19 15.085 18.768 -23.731 139 HZ PHE 19 HZ PHE 19 16.544 17.256 -22.448 140 H GLN 20 HN GLN 20 11.802 15.577 -21.388 141 HA GLN 20 HA GLN 20 11.396 16.058 -24.233 142 HB2 GLN 20 HB2 GLN 20 12.895 14.068 -24.509 143 HB3 GLN 20 HB1 GLN 20 13.620 15.420 -23.655 144 HG2 GLN 20 HG2 GLN 20 14.330 13.684 -22.363 145 HG3 GLN 20 HG1 GLN 20 12.838 14.103 -21.528 146 HE21 GLN 20 HE21 GLN 20 11.119 12.668 -21.576 147 HE22 GLN 20 HE22 GLN 20 11.253 11.063 -22.194 148 H GLY 21 HN GLY 21 9.531 14.863 -21.936 149 HA2 GLY 21 HA2 GLY 21 8.147 13.070 -23.757 150 HA3 GLY 21 HA1 GLY 21 8.741 12.342 -22.270 151 H HIS 22 HN HIS 22 7.295 15.516 -22.929 152 HA HIS 22 HA HIS 22 5.661 15.399 -20.594 153 HB2 HIS 22 HB2 HIS 22 6.528 17.484 -21.896 154 HB3 HIS 22 HB1 HIS 22 5.120 17.232 -22.922 155 HD1 HIS 22 HD1 HIS 22 6.177 18.641 -19.704 156 HD2 HIS 22 HD2 HIS 22 2.603 17.551 -21.528 157 HE1 HIS 22 HE1 HIS 22 4.364 19.725 -18.340 158 HE2 HIS 22 HE2 HIS 22 2.204 18.998 -19.413 159 H MET 23 HN MET 23 5.355 14.505 -23.895 160 HA MET 23 HA MET 23 4.024 12.985 -24.890 161 HB2 MET 23 HB2 MET 23 4.035 11.991 -22.499 162 HB3 MET 23 HB1 MET 23 2.409 12.647 -22.384 163 HG2 MET 23 HG2 MET 23 2.324 10.328 -23.014 164 HG3 MET 23 HG1 MET 23 1.753 11.335 -24.344 165 HE1 MET 23 HE1 MET 23 3.617 8.165 -25.925 166 HE2 MET 23 HE2 MET 23 2.056 8.969 -25.756 167 HE3 MET 23 HE3 MET 23 2.806 8.193 -24.360 168 H CYS 24 HN CYS 24 3.407 15.077 -25.899 169 HA CYS 24 HA CYS 24 0.758 16.058 -25.413 170 HB2 CYS 24 HB2 CYS 24 2.338 17.562 -26.432 171 HB3 CYS 24 HB1 CYS 24 2.685 16.411 -27.718 172 HG CYS 24 HG CYS 24 0.980 18.839 -28.270 173 H ILE 25 HN ILE 25 -1.123 15.447 -26.371 174 HA ILE 25 HA ILE 25 -1.380 12.811 -27.259 175 HB ILE 25 HB ILE 25 -3.246 14.014 -26.267 176 HG12 ILE 25 HG12 ILE 25 -5.034 13.357 -27.872 177 HG13 ILE 25 HG11 ILE 25 -3.794 13.100 -29.096 178 HG21 ILE 25 HG21 ILE 25 -3.298 15.644 -28.798 179 HG22 ILE 25 HG22 ILE 25 -2.869 16.221 -27.188 180 HG23 ILE 25 HG23 ILE 25 -4.516 15.688 -27.523 181 HD11 ILE 25 HD11 ILE 25 -2.790 11.363 -27.699 182 HD12 ILE 25 HD12 ILE 25 -4.472 11.004 -28.092 183 HD13 ILE 25 HD13 ILE 25 -4.050 11.616 -26.492 184 H GLN 26 HN GLN 26 -1.116 15.812 -29.107 185 HA GLN 26 HA GLN 26 -1.601 14.748 -31.657 186 HB2 GLN 26 HB2 GLN 26 -1.520 17.164 -31.173 187 HB3 GLN 26 HB1 GLN 26 0.210 17.047 -30.882 188 HG2 GLN 26 HG2 GLN 26 0.555 16.383 -33.206 189 HG3 GLN 26 HG1 GLN 26 -1.177 16.513 -33.503 190 HE21 GLN 26 HE21 GLN 26 -0.964 18.097 -35.041 191 HE22 GLN 26 HE22 GLN 26 -0.502 19.720 -34.664 192 H LYS 27 HN LYS 27 1.374 15.051 -29.766 193 HA LYS 27 HA LYS 27 3.077 14.103 -31.844 194 HB2 LYS 27 HB2 LYS 27 3.600 14.221 -28.870 195 HB3 LYS 27 HB1 LYS 27 4.814 13.993 -30.121 196 HG2 LYS 27 HG2 LYS 27 4.160 16.231 -31.037 197 HG3 LYS 27 HG1 LYS 27 3.157 16.450 -29.602 198 HD2 LYS 27 HD2 LYS 27 5.071 17.454 -28.870 199 HD3 LYS 27 HD1 LYS 27 5.413 15.798 -28.376 200 HE2 LYS 27 HE2 LYS 27 6.403 17.191 -30.861 201 HE3 LYS 27 HE1 LYS 27 7.358 16.741 -29.451 202 HZ1 LYS 27 HZ1 LYS 27 7.760 15.141 -31.126 203 HZ2 LYS 27 HZ2 LYS 27 6.109 14.934 -31.441 204 HZ3 LYS 27 HZ3 LYS 27 6.770 14.382 -29.977 205 H VAL 28 HN VAL 28 1.202 12.581 -29.341 206 HA VAL 28 HA VAL 28 2.430 10.052 -29.308 207 HB VAL 28 HB VAL 28 -0.503 10.709 -28.924 208 HG11 VAL 28 HG11 VAL 28 1.071 8.261 -28.129 209 HG12 VAL 28 HG12 VAL 28 -0.169 8.342 -29.381 210 HG13 VAL 28 HG13 VAL 28 -0.605 8.592 -27.690 211 HG21 VAL 28 HG21 VAL 28 0.926 11.914 -27.364 212 HG22 VAL 28 HG22 VAL 28 1.723 10.407 -26.914 213 HG23 VAL 28 HG23 VAL 28 0.019 10.651 -26.531 214 H ILE 29 HN ILE 29 -0.376 11.203 -31.168 215 HA ILE 29 HA ILE 29 -0.671 8.906 -32.758 216 HB ILE 29 HB ILE 29 -1.563 11.756 -33.077 217 HG12 ILE 29 HG12 ILE 29 -3.811 10.647 -33.036 218 HG13 ILE 29 HG11 ILE 29 -2.997 9.110 -32.782 219 HG21 ILE 29 HG21 ILE 29 -2.777 11.160 -35.121 220 HG22 ILE 29 HG22 ILE 29 -1.983 9.586 -35.124 221 HG23 ILE 29 HG23 ILE 29 -1.030 11.053 -35.340 222 HD11 ILE 29 HD11 ILE 29 -2.921 11.476 -30.927 223 HD12 ILE 29 HD12 ILE 29 -2.105 9.935 -30.668 224 HD13 ILE 29 HD13 ILE 29 -3.866 10.004 -30.707 225 H GLU 30 HN GLU 30 1.128 11.911 -33.301 226 HA GLU 30 HA GLU 30 2.088 11.505 -35.850 227 HB2 GLU 30 HB2 GLU 30 3.271 12.837 -33.434 228 HB3 GLU 30 HB1 GLU 30 4.169 12.760 -34.944 229 HG2 GLU 30 HG2 GLU 30 1.405 13.911 -34.714 230 HG3 GLU 30 HG1 GLU 30 2.884 14.862 -34.572 231 H ASP 31 HN ASP 31 3.610 10.438 -32.807 232 HA ASP 31 HA ASP 31 5.805 9.170 -34.114 233 HB2 ASP 31 HB2 ASP 31 5.934 9.968 -31.789 234 HB3 ASP 31 HB1 ASP 31 4.728 8.777 -31.310 235 H LYS 32 HN LYS 32 2.635 8.191 -33.167 236 HA LYS 32 HA LYS 32 3.066 5.396 -33.142 237 HB2 LYS 32 HB2 LYS 32 1.223 6.656 -32.011 238 HB3 LYS 32 HB1 LYS 32 0.488 6.897 -33.587 239 HG2 LYS 32 HG2 LYS 32 -0.155 4.704 -33.777 240 HG3 LYS 32 HG1 LYS 32 1.099 4.129 -32.670 241 HD2 LYS 32 HD2 LYS 32 -0.071 4.868 -30.778 242 HD3 LYS 32 HD1 LYS 32 -1.115 5.925 -31.729 243 HE2 LYS 32 HE2 LYS 32 -1.133 2.920 -31.901 244 HE3 LYS 32 HE1 LYS 32 -2.230 3.863 -30.892 245 HZ1 LYS 32 HZ1 LYS 32 -3.360 3.413 -32.892 246 HZ2 LYS 32 HZ2 LYS 32 -2.031 3.867 -33.844 247 HZ3 LYS 32 HZ3 LYS 32 -2.890 5.047 -32.984 248 H LEU 33 HN LEU 33 1.425 7.481 -35.583 249 HA LEU 33 HA LEU 33 1.415 5.379 -37.512 250 HB2 LEU 33 HB2 LEU 33 0.777 7.168 -39.130 251 HB3 LEU 33 HB1 LEU 33 -0.270 7.024 -37.736 252 HG LEU 33 HG LEU 33 1.147 8.986 -36.771 253 HD11 LEU 33 HD11 LEU 33 1.674 9.312 -39.723 254 HD12 LEU 33 HD12 LEU 33 2.883 8.995 -38.478 255 HD13 LEU 33 HD13 LEU 33 1.994 10.518 -38.476 256 HD21 LEU 33 HD21 LEU 33 -0.366 10.589 -37.826 257 HD22 LEU 33 HD22 LEU 33 -1.212 9.118 -37.344 258 HD23 LEU 33 HD23 LEU 33 -0.799 9.383 -39.038 259 H SER 34 HN SER 34 3.714 7.863 -36.657 260 HA SER 34 HA SER 34 5.331 7.781 -38.952 261 HB2 SER 34 HB2 SER 34 5.663 9.483 -37.229 262 HB3 SER 34 HB1 SER 34 6.146 8.244 -36.071 263 HG SER 34 HG SER 34 7.608 9.490 -38.002 264 H SER 35 HN SER 35 5.349 5.807 -36.024 265 HA SER 35 HA SER 35 7.626 4.291 -36.682 266 HB2 SER 35 HB2 SER 35 5.268 3.551 -34.938 267 HB3 SER 35 HB1 SER 35 6.832 2.738 -34.945 268 HG SER 35 HG SER 35 6.258 5.418 -34.168 269 H ALA 36 HN ALA 36 4.320 4.104 -37.727 270 HA ALA 36 HA ALA 36 4.486 1.378 -38.641 271 HB1 ALA 36 HB1 ALA 36 2.375 2.319 -37.841 272 HB2 ALA 36 HB2 ALA 36 2.239 1.732 -39.499 273 HB3 ALA 36 HB3 ALA 36 2.378 3.463 -39.183 274 H LEU 37 HN LEU 37 4.206 4.547 -40.287 275 HA LEU 37 HA LEU 37 4.759 3.203 -42.833 276 HB2 LEU 37 HB2 LEU 37 3.858 6.031 -42.283 277 HB3 LEU 37 HB1 LEU 37 4.020 5.306 -43.870 278 HG LEU 37 HG LEU 37 2.064 4.432 -41.738 279 HD11 LEU 37 HD11 LEU 37 1.497 6.604 -42.686 280 HD12 LEU 37 HD12 LEU 37 0.362 5.368 -43.224 281 HD13 LEU 37 HD13 LEU 37 1.624 5.940 -44.316 282 HD21 LEU 37 HD21 LEU 37 2.401 3.502 -44.592 283 HD22 LEU 37 HD22 LEU 37 1.118 3.004 -43.488 284 HD23 LEU 37 HD23 LEU 37 2.794 2.574 -43.146 285 H LYS 38 HN LYS 38 6.050 5.619 -40.697 286 HA LYS 38 HA LYS 38 7.936 6.811 -40.595 287 HB2 LYS 38 HB2 LYS 38 8.785 4.248 -41.769 288 HB3 LYS 38 HB1 LYS 38 9.921 5.581 -41.953 289 HG2 LYS 38 HG2 LYS 38 8.775 4.528 -39.375 290 HG3 LYS 38 HG1 LYS 38 10.441 4.378 -39.944 291 HD2 LYS 38 HD2 LYS 38 10.714 6.796 -39.840 292 HD3 LYS 38 HD1 LYS 38 9.034 6.982 -39.340 293 HE2 LYS 38 HE2 LYS 38 9.539 5.666 -37.305 294 HE3 LYS 38 HE1 LYS 38 11.232 5.607 -37.800 295 HZ1 LYS 38 HZ1 LYS 38 11.194 8.087 -37.786 296 HZ2 LYS 38 HZ2 LYS 38 11.000 7.375 -36.262 297 HZ3 LYS 38 HZ3 LYS 38 9.657 8.015 -37.071 298 HA PRO 39 HA PRO 39 7.819 8.988 -44.568 299 HB2 PRO 39 HB2 PRO 39 7.118 11.381 -43.558 300 HB3 PRO 39 HB1 PRO 39 5.917 10.139 -43.931 301 HG2 PRO 39 HG2 PRO 39 7.020 10.982 -41.300 302 HG3 PRO 39 HG1 PRO 39 5.392 10.423 -41.710 303 HD2 PRO 39 HD2 PRO 39 7.404 8.885 -40.532 304 HD3 PRO 39 HD1 PRO 39 5.939 8.258 -41.310 305 H THR 40 HN THR 40 9.613 9.998 -45.325 306 HA THR 40 HA THR 40 11.791 10.486 -43.516 307 HB THR 40 HB THR 40 13.000 11.197 -45.611 308 HG1 THR 40 HG1 THR 40 11.970 11.016 -47.557 309 HG21 THR 40 HG21 THR 40 13.109 8.896 -44.791 310 HG22 THR 40 HG22 THR 40 13.103 8.933 -46.555 311 HG23 THR 40 HG23 THR 40 11.634 8.502 -45.676 312 H PHE 41 HN PHE 41 9.328 12.289 -45.103 313 HA PHE 41 HA PHE 41 10.149 14.645 -43.568 314 HB2 PHE 41 HB2 PHE 41 10.776 15.059 -45.919 315 HB3 PHE 41 HB1 PHE 41 9.125 14.710 -46.420 316 HD1 PHE 41 HD1 PHE 41 11.081 16.982 -44.221 317 HD2 PHE 41 HD2 PHE 41 7.593 16.434 -46.598 318 HE1 PHE 41 HE1 PHE 41 10.492 19.348 -43.900 319 HE2 PHE 41 HE2 PHE 41 7.000 18.799 -46.281 320 HZ PHE 41 HZ PHE 41 8.450 20.261 -44.930 321 H LEU 42 HN LEU 42 8.546 15.284 -42.271 322 HA LEU 42 HA LEU 42 5.776 14.671 -43.023 323 HB2 LEU 42 HB2 LEU 42 6.592 12.913 -41.498 324 HB3 LEU 42 HB1 LEU 42 7.016 14.138 -40.321 325 HG LEU 42 HG LEU 42 4.615 14.740 -40.124 326 HD11 LEU 42 HD11 LEU 42 4.198 12.334 -41.895 327 HD12 LEU 42 HD12 LEU 42 3.871 14.013 -42.327 328 HD13 LEU 42 HD13 LEU 42 2.935 13.232 -41.053 329 HD21 LEU 42 HD21 LEU 42 5.256 11.834 -39.627 330 HD22 LEU 42 HD22 LEU 42 3.962 12.754 -38.862 331 HD23 LEU 42 HD23 LEU 42 5.645 13.180 -38.555 332 H GLU 43 HN GLU 43 4.754 16.557 -43.117 333 HA GLU 43 HA GLU 43 5.386 18.574 -41.064 334 HB2 GLU 43 HB2 GLU 43 6.162 19.493 -43.111 335 HB3 GLU 43 HB1 GLU 43 4.722 18.969 -43.978 336 HG2 GLU 43 HG2 GLU 43 3.368 20.564 -42.786 337 HG3 GLU 43 HG1 GLU 43 4.736 21.025 -41.779 338 H LEU 44 HN LEU 44 3.765 19.029 -39.748 339 HA LEU 44 HA LEU 44 1.072 18.236 -40.461 340 HB2 LEU 44 HB2 LEU 44 2.246 19.433 -37.962 341 HB3 LEU 44 HB1 LEU 44 0.525 19.174 -38.173 342 HG LEU 44 HG LEU 44 2.636 17.020 -38.224 343 HD11 LEU 44 HD11 LEU 44 1.622 16.320 -36.115 344 HD12 LEU 44 HD12 LEU 44 0.557 17.725 -36.160 345 HD13 LEU 44 HD13 LEU 44 2.301 17.943 -36.001 346 HD21 LEU 44 HD21 LEU 44 0.755 16.497 -39.678 347 HD22 LEU 44 HD22 LEU 44 -0.373 16.857 -38.371 348 HD23 LEU 44 HD23 LEU 44 0.726 15.483 -38.235 349 H VAL 45 HN VAL 45 -0.291 19.478 -41.450 350 HA VAL 45 HA VAL 45 0.052 22.400 -41.334 351 HB VAL 45 HB VAL 45 -1.499 20.742 -43.340 352 HG11 VAL 45 HG11 VAL 45 -0.942 23.705 -43.272 353 HG12 VAL 45 HG12 VAL 45 -2.502 22.934 -42.989 354 HG13 VAL 45 HG13 VAL 45 -1.747 22.840 -44.581 355 HG21 VAL 45 HG21 VAL 45 0.907 20.479 -43.608 356 HG22 VAL 45 HG22 VAL 45 1.106 22.232 -43.638 357 HG23 VAL 45 HG23 VAL 45 0.232 21.421 -44.938 358 H ASP 46 HN ASP 46 -1.191 23.270 -39.840 359 HA ASP 46 HA ASP 46 -3.412 21.938 -38.677 360 HB2 ASP 46 HB2 ASP 46 -1.853 23.661 -37.593 361 HB3 ASP 46 HB1 ASP 46 -2.806 24.884 -38.428 362 H LYS 47 HN LYS 47 -5.136 21.572 -39.938 363 HA LYS 47 HA LYS 47 -5.985 23.394 -41.985 364 HB2 LYS 47 HB2 LYS 47 -7.023 20.782 -40.925 365 HB3 LYS 47 HB1 LYS 47 -7.975 21.732 -42.054 366 HG2 LYS 47 HG2 LYS 47 -5.165 20.834 -42.624 367 HG3 LYS 47 HG1 LYS 47 -6.594 19.894 -43.056 368 HD2 LYS 47 HD2 LYS 47 -7.394 22.006 -44.261 369 HD3 LYS 47 HD1 LYS 47 -5.735 22.584 -44.085 370 HE2 LYS 47 HE2 LYS 47 -6.469 19.956 -45.366 371 HE3 LYS 47 HE1 LYS 47 -6.257 21.453 -46.269 372 HZ1 LYS 47 HZ1 LYS 47 -4.283 19.946 -46.198 373 HZ2 LYS 47 HZ2 LYS 47 -4.139 20.292 -44.549 374 HZ3 LYS 47 HZ3 LYS 47 -3.983 21.536 -45.690 375 H SER 48 HN SER 48 -8.296 24.083 -42.125 376 HA SER 48 HA SER 48 -9.051 25.638 -39.915 377 HB2 SER 48 HB2 SER 48 -11.312 25.624 -41.324 378 HB3 SER 48 HB1 SER 48 -9.886 26.506 -41.873 379 HG SER 48 HG SER 48 -10.473 23.824 -42.635 380 H CYS 49 HN CYS 49 -10.274 25.216 -38.191 381 HA CYS 49 HA CYS 49 -10.852 22.567 -37.470 382 HB2 CYS 49 HB2 CYS 49 -12.196 23.728 -35.602 383 HB3 CYS 49 HB1 CYS 49 -10.463 24.026 -35.689 384 HG CYS 49 HG CYS 49 -10.614 26.550 -36.698 385 H GLY 50 HN GLY 50 -13.264 25.178 -37.877 386 HA2 GLY 50 HA2 GLY 50 -15.376 25.142 -38.781 387 HA3 GLY 50 HA1 GLY 50 -14.920 23.668 -39.620 388 H CYS 51 HN CYS 51 -15.116 21.649 -38.466 389 HA CYS 51 HA CYS 51 -17.426 21.696 -36.681 390 HB2 CYS 51 HB2 CYS 51 -17.445 19.218 -37.135 391 HB3 CYS 51 HB1 CYS 51 -17.670 20.231 -38.557 392 HG CYS 51 HG CYS 51 -15.739 19.247 -39.926 393 H GLY 52 HN GLY 52 -14.033 21.205 -36.614 394 HA2 GLY 52 HA2 GLY 52 -13.773 21.215 -33.873 395 HA3 GLY 52 HA1 GLY 52 -13.921 19.518 -34.310 396 H THR 53 HN THR 53 -11.697 19.801 -33.196 397 HA THR 53 HA THR 53 -9.531 20.980 -34.498 398 HB THR 53 HB THR 53 -9.425 18.456 -32.837 399 HG1 THR 53 HG1 THR 53 -8.903 20.745 -31.475 400 HG21 THR 53 HG21 THR 53 -7.321 19.051 -33.941 401 HG22 THR 53 HG22 THR 53 -7.210 19.292 -32.197 402 HG23 THR 53 HG23 THR 53 -7.421 20.677 -33.267 403 H SER 54 HN SER 54 -8.739 20.586 -36.441 404 HA SER 54 HA SER 54 -8.805 17.837 -37.471 405 HB2 SER 54 HB2 SER 54 -9.331 20.352 -39.075 406 HB3 SER 54 HB1 SER 54 -9.345 18.698 -39.689 407 HG SER 54 HG SER 54 -11.152 19.936 -37.898 408 H PHE 55 HN PHE 55 -6.852 17.106 -37.928 409 HA PHE 55 HA PHE 55 -4.717 19.051 -38.513 410 HB2 PHE 55 HB2 PHE 55 -4.512 16.282 -37.301 411 HB3 PHE 55 HB1 PHE 55 -3.135 17.284 -37.740 412 HD1 PHE 55 HD1 PHE 55 -3.472 19.822 -36.740 413 HD2 PHE 55 HD2 PHE 55 -4.928 16.192 -35.068 414 HE1 PHE 55 HE1 PHE 55 -3.514 20.868 -34.510 415 HE2 PHE 55 HE2 PHE 55 -4.974 17.229 -32.838 416 HZ PHE 55 HZ PHE 55 -4.266 19.571 -32.558 417 H ASP 56 HN ASP 56 -3.532 18.823 -40.340 418 HA ASP 56 HA ASP 56 -4.124 16.494 -42.056 419 HB2 ASP 56 HB2 ASP 56 -4.965 18.542 -43.064 420 HB3 ASP 56 HB1 ASP 56 -3.414 19.337 -42.827 421 H ALA 57 HN ALA 57 -2.437 15.188 -42.406 422 HA ALA 57 HA ALA 57 0.220 16.193 -41.627 423 HB1 ALA 57 HB1 ALA 57 -0.760 13.345 -41.808 424 HB2 ALA 57 HB2 ALA 57 -0.608 14.292 -40.327 425 HB3 ALA 57 HB3 ALA 57 0.831 13.867 -41.254 426 H VAL 58 HN VAL 58 1.443 16.764 -43.293 427 HA VAL 58 HA VAL 58 1.166 15.536 -45.895 428 HB VAL 58 HB VAL 58 3.362 17.374 -44.919 429 HG11 VAL 58 HG11 VAL 58 3.651 17.888 -47.298 430 HG12 VAL 58 HG12 VAL 58 2.404 16.709 -47.700 431 HG13 VAL 58 HG13 VAL 58 3.917 16.177 -46.964 432 HG21 VAL 58 HG21 VAL 58 0.768 18.085 -46.278 433 HG22 VAL 58 HG22 VAL 58 2.092 19.200 -45.940 434 HG23 VAL 58 HG23 VAL 58 1.207 18.453 -44.610 435 H ILE 59 HN ILE 59 1.945 13.584 -46.232 436 HA ILE 59 HA ILE 59 4.244 12.712 -44.631 437 HB ILE 59 HB ILE 59 2.331 11.470 -43.971 438 HG12 ILE 59 HG12 ILE 59 4.575 10.230 -44.696 439 HG13 ILE 59 HG11 ILE 59 3.186 9.356 -44.069 440 HG21 ILE 59 HG21 ILE 59 1.808 10.894 -46.878 441 HG22 ILE 59 HG22 ILE 59 0.858 11.934 -45.817 442 HG23 ILE 59 HG23 ILE 59 0.919 10.196 -45.523 443 HD11 ILE 59 HD11 ILE 59 4.143 8.236 -45.998 444 HD12 ILE 59 HD12 ILE 59 3.898 9.684 -46.975 445 HD13 ILE 59 HD13 ILE 59 2.509 8.799 -46.348 446 H VAL 60 HN VAL 60 5.972 12.907 -45.806 447 HA VAL 60 HA VAL 60 5.977 11.934 -48.579 448 HB VAL 60 HB VAL 60 8.073 13.557 -47.108 449 HG11 VAL 60 HG11 VAL 60 7.863 12.790 -50.018 450 HG12 VAL 60 HG12 VAL 60 9.034 12.166 -48.855 451 HG13 VAL 60 HG13 VAL 60 9.076 13.866 -49.323 452 HG21 VAL 60 HG21 VAL 60 6.038 14.849 -47.481 453 HG22 VAL 60 HG22 VAL 60 6.064 14.417 -49.190 454 HG23 VAL 60 HG23 VAL 60 7.344 15.426 -48.516 455 H SER 61 HN SER 61 6.479 9.807 -48.669 456 HA SER 61 HA SER 61 8.578 8.819 -46.877 457 HB2 SER 61 HB2 SER 61 6.585 8.492 -45.568 458 HB3 SER 61 HB1 SER 61 5.757 7.741 -46.932 459 HG SER 61 HG SER 61 7.643 6.686 -45.183 460 H ASN 62 HN ASN 62 9.650 7.031 -47.527 461 HA ASN 62 HA ASN 62 9.659 6.207 -50.196 462 HB2 ASN 62 HB2 ASN 62 11.300 5.884 -48.021 463 HB3 ASN 62 HB1 ASN 62 10.637 4.263 -48.214 464 HD21 ASN 62 HD21 ASN 62 11.330 6.673 -50.664 465 HD22 ASN 62 HD22 ASN 62 12.494 5.739 -51.507 466 H ASN 63 HN ASN 63 7.709 5.294 -47.521 467 HA ASN 63 HA ASN 63 7.113 2.624 -48.203 468 HB2 ASN 63 HB2 ASN 63 6.631 3.616 -45.985 469 HB3 ASN 63 HB1 ASN 63 5.383 4.620 -46.716 470 HD21 ASN 63 HD21 ASN 63 3.442 3.677 -47.347 471 HD22 ASN 63 HD22 ASN 63 2.973 2.097 -46.840 472 H PHE 64 HN PHE 64 5.763 5.698 -49.210 473 HA PHE 64 HA PHE 64 3.805 4.281 -50.867 474 HB2 PHE 64 HB2 PHE 64 3.046 6.166 -49.368 475 HB3 PHE 64 HB1 PHE 64 3.974 7.263 -50.386 476 HD1 PHE 64 HD2 PHE 64 1.544 4.478 -50.912 477 HD2 PHE 64 HD1 PHE 64 2.720 8.444 -51.900 478 HE1 PHE 64 HE2 PHE 64 -0.361 4.649 -52.459 479 HE2 PHE 64 HE1 PHE 64 0.820 8.625 -53.452 480 HZ PHE 64 HZ PHE 64 -0.722 6.727 -53.732 481 H GLU 65 HN GLU 65 6.865 4.895 -51.204 482 HA GLU 65 HA GLU 65 6.875 6.253 -53.735 483 HB2 GLU 65 HB2 GLU 65 8.887 6.713 -52.805 484 HB3 GLU 65 HB1 GLU 65 8.818 5.312 -51.748 485 HG2 GLU 65 HG2 GLU 65 10.688 5.030 -53.131 486 HG3 GLU 65 HG1 GLU 65 9.432 3.926 -53.692 487 H ASP 66 HN ASP 66 6.912 3.014 -52.424 488 HA ASP 66 HA ASP 66 7.066 1.523 -54.779 489 HB2 ASP 66 HB2 ASP 66 6.967 0.458 -52.583 490 HB3 ASP 66 HB1 ASP 66 5.344 1.090 -52.321 491 H LYS 67 HN LYS 67 4.305 3.077 -53.205 492 HA LYS 67 HA LYS 67 2.816 4.514 -54.099 493 HB2 LYS 67 HB2 LYS 67 4.738 4.934 -55.717 494 HB3 LYS 67 HB1 LYS 67 3.896 3.877 -56.836 495 HG2 LYS 67 HG2 LYS 67 2.260 5.396 -57.261 496 HG3 LYS 67 HG1 LYS 67 2.369 6.127 -55.660 497 HD2 LYS 67 HD2 LYS 67 3.151 7.642 -57.440 498 HD3 LYS 67 HD1 LYS 67 4.419 7.264 -56.278 499 HE2 LYS 67 HE2 LYS 67 4.193 5.611 -58.747 500 HE3 LYS 67 HE1 LYS 67 4.874 7.229 -58.875 501 HZ1 LYS 67 HZ1 LYS 67 6.578 5.535 -58.541 502 HZ2 LYS 67 HZ2 LYS 67 5.880 5.087 -57.069 503 HZ3 LYS 67 HZ3 LYS 67 6.553 6.633 -57.251 504 H LYS 68 HN LYS 68 2.412 1.475 -53.964 505 HA LYS 68 HA LYS 68 0.275 1.036 -55.817 506 HB2 LYS 68 HB2 LYS 68 0.931 -0.294 -53.187 507 HB3 LYS 68 HB1 LYS 68 -0.361 -0.814 -54.257 508 HG2 LYS 68 HG2 LYS 68 1.436 -1.077 -56.036 509 HG3 LYS 68 HG1 LYS 68 2.596 -0.919 -54.712 510 HD2 LYS 68 HD2 LYS 68 0.384 -2.950 -54.893 511 HD3 LYS 68 HD1 LYS 68 2.094 -3.260 -55.196 512 HE2 LYS 68 HE2 LYS 68 0.968 -2.278 -52.578 513 HE3 LYS 68 HE1 LYS 68 1.323 -3.966 -52.935 514 HZ1 LYS 68 HZ1 LYS 68 3.331 -1.775 -52.995 515 HZ2 LYS 68 HZ2 LYS 68 3.634 -3.431 -53.189 516 HZ3 LYS 68 HZ3 LYS 68 3.106 -2.840 -51.692 517 H LEU 69 HN LEU 69 -1.735 1.843 -55.732 518 HA LEU 69 HA LEU 69 -2.343 3.682 -53.618 519 HB2 LEU 69 HB2 LEU 69 -4.383 4.195 -54.842 520 HB3 LEU 69 HB1 LEU 69 -2.973 4.257 -55.875 521 HG LEU 69 HG LEU 69 -3.730 1.793 -56.481 522 HD11 LEU 69 HD11 LEU 69 -6.161 1.594 -56.552 523 HD12 LEU 69 HD12 LEU 69 -6.316 3.110 -55.665 524 HD13 LEU 69 HD13 LEU 69 -5.577 1.707 -54.892 525 HD21 LEU 69 HD21 LEU 69 -5.035 4.290 -57.552 526 HD22 LEU 69 HD22 LEU 69 -4.964 2.732 -58.376 527 HD23 LEU 69 HD23 LEU 69 -3.479 3.626 -58.053 528 H LEU 70 HN LEU 70 -3.350 0.424 -54.448 529 HA LEU 70 HA LEU 70 -5.474 0.342 -52.574 530 HB2 LEU 70 HB2 LEU 70 -5.594 -2.009 -52.901 531 HB3 LEU 70 HB1 LEU 70 -5.299 -1.259 -54.446 532 HG LEU 70 HG LEU 70 -4.083 -3.261 -54.443 533 HD11 LEU 70 HD11 LEU 70 -2.129 -1.078 -53.806 534 HD12 LEU 70 HD12 LEU 70 -2.812 -1.462 -55.385 535 HD13 LEU 70 HD13 LEU 70 -1.741 -2.611 -54.585 536 HD21 LEU 70 HD21 LEU 70 -2.495 -3.933 -52.713 537 HD22 LEU 70 HD22 LEU 70 -4.137 -3.784 -52.091 538 HD23 LEU 70 HD23 LEU 70 -2.951 -2.524 -51.754 539 H ASP 71 HN ASP 71 -2.048 -0.071 -52.307 540 HA ASP 71 HA ASP 71 -2.070 -1.276 -49.713 541 HB2 ASP 71 HB2 ASP 71 -0.155 -1.430 -51.326 542 HB3 ASP 71 HB1 ASP 71 0.166 0.277 -51.037 543 H ARG 72 HN ARG 72 -1.792 1.993 -50.982 544 HA ARG 72 HA ARG 72 -1.501 3.438 -48.614 545 HB2 ARG 72 HB2 ARG 72 -1.436 4.401 -50.909 546 HB3 ARG 72 HB1 ARG 72 -3.169 4.153 -51.041 547 HG2 ARG 72 HG2 ARG 72 -3.317 5.656 -48.946 548 HG3 ARG 72 HG1 ARG 72 -1.668 6.129 -49.370 549 HD2 ARG 72 HD2 ARG 72 -2.549 6.617 -51.692 550 HD3 ARG 72 HD1 ARG 72 -4.166 6.425 -51.023 551 HE ARG 72 HE ARG 72 -2.308 8.619 -50.541 552 HH11 ARG 72 HH11 ARG 72 -5.324 7.077 -49.621 553 HH12 ARG 72 HH12 ARG 72 -6.038 8.552 -49.041 554 HH21 ARG 72 HH21 ARG 72 -3.270 10.560 -49.775 555 HH22 ARG 72 HH22 ARG 72 -4.885 10.516 -49.121 556 H HIS 73 HN HIS 73 -4.399 2.291 -50.270 557 HA HIS 73 HA HIS 73 -6.352 3.320 -48.577 558 HB2 HIS 73 HB2 HIS 73 -6.865 2.377 -50.763 559 HB3 HIS 73 HB1 HIS 73 -6.354 0.782 -50.230 560 HD1 HIS 73 HD1 HIS 73 -9.158 3.261 -49.847 561 HD2 HIS 73 HD2 HIS 73 -8.281 -0.687 -48.882 562 HE1 HIS 73 HE1 HIS 73 -11.330 2.251 -49.090 563 HE2 HIS 73 HE2 HIS 73 -10.816 -0.193 -48.778 564 H ARG 74 HN ARG 74 -4.839 0.089 -48.499 565 HA ARG 74 HA ARG 74 -6.419 -0.733 -46.286 566 HB2 ARG 74 HB2 ARG 74 -5.044 -2.758 -46.280 567 HB3 ARG 74 HB1 ARG 74 -5.626 -2.361 -47.888 568 HG2 ARG 74 HG2 ARG 74 -3.398 -1.339 -48.358 569 HG3 ARG 74 HG1 ARG 74 -2.850 -1.972 -46.804 570 HD2 ARG 74 HD2 ARG 74 -3.885 -3.574 -49.139 571 HD3 ARG 74 HD1 ARG 74 -2.212 -3.475 -48.590 572 HE ARG 74 HE ARG 74 -3.144 -4.483 -46.441 573 HH11 ARG 74 HH11 ARG 74 -4.571 -5.058 -49.583 574 HH12 ARG 74 HH12 ARG 74 -5.086 -6.668 -49.201 575 HH21 ARG 74 HH21 ARG 74 -3.834 -6.597 -45.918 576 HH22 ARG 74 HH22 ARG 74 -4.664 -7.553 -47.113 577 H LEU 75 HN LEU 75 -3.000 0.301 -46.526 578 HA LEU 75 HA LEU 75 -2.376 -0.291 -43.844 579 HB2 LEU 75 HB2 LEU 75 -1.134 1.585 -45.830 580 HB3 LEU 75 HB1 LEU 75 -0.517 1.429 -44.195 581 HG LEU 75 HG LEU 75 -0.635 -0.729 -46.299 582 HD11 LEU 75 HD11 LEU 75 1.176 0.873 -46.577 583 HD12 LEU 75 HD12 LEU 75 1.795 -0.699 -46.068 584 HD13 LEU 75 HD13 LEU 75 1.669 0.619 -44.902 585 HD21 LEU 75 HD21 LEU 75 0.278 -0.911 -43.430 586 HD22 LEU 75 HD22 LEU 75 0.446 -2.173 -44.651 587 HD23 LEU 75 HD23 LEU 75 -1.158 -1.677 -44.111 588 H VAL 76 HN VAL 76 -3.424 2.756 -45.345 589 HA VAL 76 HA VAL 76 -3.283 4.336 -43.048 590 HB VAL 76 HB VAL 76 -5.129 4.552 -45.433 591 HG11 VAL 76 HG11 VAL 76 -5.581 6.857 -44.696 592 HG12 VAL 76 HG12 VAL 76 -4.688 6.546 -43.208 593 HG13 VAL 76 HG13 VAL 76 -6.184 5.674 -43.535 594 HG21 VAL 76 HG21 VAL 76 -2.750 4.857 -45.906 595 HG22 VAL 76 HG22 VAL 76 -2.650 6.077 -44.637 596 HG23 VAL 76 HG23 VAL 76 -3.626 6.378 -46.074 597 H ASN 77 HN ASN 77 -6.012 2.413 -44.309 598 HA ASN 77 HA ASN 77 -7.755 3.124 -42.192 599 HB2 ASN 77 HB2 ASN 77 -7.773 0.966 -44.265 600 HB3 ASN 77 HB1 ASN 77 -8.937 0.915 -42.941 601 HD21 ASN 77 HD21 ASN 77 -7.894 2.618 -45.786 602 HD22 ASN 77 HD22 ASN 77 -9.307 3.606 -45.955 603 H THR 78 HN THR 78 -5.317 0.623 -42.503 604 HA THR 78 HA THR 78 -6.187 -1.083 -40.444 605 HB THR 78 HB THR 78 -3.364 -0.579 -41.414 606 HG1 THR 78 HG1 THR 78 -4.884 -1.421 -42.980 607 HG21 THR 78 HG21 THR 78 -3.346 -1.619 -39.203 608 HG22 THR 78 HG22 THR 78 -2.833 -2.769 -40.438 609 HG23 THR 78 HG23 THR 78 -4.461 -2.863 -39.768 610 H ILE 79 HN ILE 79 -3.570 1.376 -40.275 611 HA ILE 79 HA ILE 79 -3.428 1.085 -37.421 612 HB ILE 79 HB ILE 79 -2.101 3.092 -39.251 613 HG12 ILE 79 HG12 ILE 79 -0.053 1.713 -38.344 614 HG13 ILE 79 HG11 ILE 79 -1.271 0.477 -38.051 615 HG21 ILE 79 HG21 ILE 79 -2.377 4.072 -37.044 616 HG22 ILE 79 HG22 ILE 79 -0.682 3.691 -37.349 617 HG23 ILE 79 HG23 ILE 79 -1.645 2.648 -36.303 618 HD11 ILE 79 HD11 ILE 79 -1.882 0.531 -40.416 619 HD12 ILE 79 HD12 ILE 79 -0.179 0.134 -40.179 620 HD13 ILE 79 HD13 ILE 79 -0.642 1.756 -40.698 621 H LEU 80 HN LEU 80 -4.737 3.487 -39.654 622 HA LEU 80 HA LEU 80 -5.227 5.351 -37.540 623 HB2 LEU 80 HB2 LEU 80 -5.848 5.382 -40.471 624 HB3 LEU 80 HB1 LEU 80 -6.459 6.621 -39.393 625 HG LEU 80 HG LEU 80 -4.059 7.098 -38.739 626 HD11 LEU 80 HD11 LEU 80 -2.307 6.382 -40.276 627 HD12 LEU 80 HD12 LEU 80 -3.468 5.372 -41.138 628 HD13 LEU 80 HD13 LEU 80 -3.054 5.006 -39.463 629 HD21 LEU 80 HD21 LEU 80 -5.297 8.521 -40.269 630 HD22 LEU 80 HD22 LEU 80 -4.842 7.486 -41.624 631 HD23 LEU 80 HD23 LEU 80 -3.606 8.399 -40.758 632 H LYS 81 HN LYS 81 -6.956 2.658 -38.651 633 HA LYS 81 HA LYS 81 -9.603 3.317 -38.254 634 HB2 LYS 81 HB2 LYS 81 -9.040 1.064 -38.828 635 HB3 LYS 81 HB1 LYS 81 -8.056 0.869 -37.385 636 HG2 LYS 81 HG2 LYS 81 -10.137 -0.342 -37.172 637 HG3 LYS 81 HG1 LYS 81 -10.069 0.972 -36.001 638 HD2 LYS 81 HD2 LYS 81 -11.470 2.344 -37.498 639 HD3 LYS 81 HD1 LYS 81 -11.578 0.979 -38.614 640 HE2 LYS 81 HE2 LYS 81 -12.618 -0.369 -36.858 641 HE3 LYS 81 HE1 LYS 81 -12.517 0.996 -35.749 642 HZ1 LYS 81 HZ1 LYS 81 -14.716 0.787 -36.701 643 HZ2 LYS 81 HZ2 LYS 81 -14.086 0.927 -38.271 644 HZ3 LYS 81 HZ3 LYS 81 -13.995 2.242 -37.199 645 H GLU 82 HN GLU 82 -7.454 2.116 -35.705 646 HA GLU 82 HA GLU 82 -9.116 3.094 -33.592 647 HB2 GLU 82 HB2 GLU 82 -7.888 1.188 -33.026 648 HB3 GLU 82 HB1 GLU 82 -6.429 1.767 -33.814 649 HG2 GLU 82 HG2 GLU 82 -6.658 3.605 -31.870 650 HG3 GLU 82 HG1 GLU 82 -7.420 2.224 -31.081 651 H GLU 83 HN GLU 83 -6.309 4.231 -35.318 652 HA GLU 83 HA GLU 83 -5.268 6.099 -33.553 653 HB2 GLU 83 HB2 GLU 83 -4.403 5.289 -35.807 654 HB3 GLU 83 HB1 GLU 83 -5.451 6.510 -36.518 655 HG2 GLU 83 HG2 GLU 83 -3.417 7.529 -36.375 656 HG3 GLU 83 HG1 GLU 83 -4.280 8.147 -34.975 657 H LEU 84 HN LEU 84 -7.494 6.670 -36.219 658 HA LEU 84 HA LEU 84 -8.062 9.319 -35.922 659 HB2 LEU 84 HB2 LEU 84 -10.010 7.151 -36.688 660 HB3 LEU 84 HB1 LEU 84 -10.294 8.865 -36.915 661 HG LEU 84 HG LEU 84 -8.192 7.185 -38.264 662 HD11 LEU 84 HD11 LEU 84 -10.431 6.900 -39.157 663 HD12 LEU 84 HD12 LEU 84 -9.409 7.771 -40.299 664 HD13 LEU 84 HD13 LEU 84 -10.598 8.646 -39.335 665 HD21 LEU 84 HD21 LEU 84 -7.569 9.212 -39.477 666 HD22 LEU 84 HD22 LEU 84 -7.289 9.391 -37.744 667 HD23 LEU 84 HD23 LEU 84 -8.693 10.150 -38.494 668 H GLN 85 HN GLN 85 -9.269 6.739 -33.870 669 HA GLN 85 HA GLN 85 -11.532 7.941 -32.781 670 HB2 GLN 85 HB2 GLN 85 -9.538 6.270 -31.243 671 HB3 GLN 85 HB1 GLN 85 -11.223 6.532 -30.827 672 HG2 GLN 85 HG2 GLN 85 -10.052 4.841 -32.992 673 HG3 GLN 85 HG1 GLN 85 -11.184 4.395 -31.719 674 HE21 GLN 85 HE21 GLN 85 -10.787 5.589 -34.885 675 HE22 GLN 85 HE22 GLN 85 -12.453 5.710 -35.296 676 H ASN 86 HN ASN 86 -8.193 8.672 -32.313 677 HA ASN 86 HA ASN 86 -8.610 10.107 -29.826 678 HB2 ASN 86 HB2 ASN 86 -6.149 9.713 -31.539 679 HB3 ASN 86 HB1 ASN 86 -6.164 10.517 -29.973 680 HD21 ASN 86 HD21 ASN 86 -4.940 7.967 -31.079 681 HD22 ASN 86 HD22 ASN 86 -5.355 6.771 -29.906 682 H ILE 87 HN ILE 87 -9.053 10.832 -33.040 683 HA ILE 87 HA ILE 87 -8.503 13.703 -32.600 684 HB ILE 87 HB ILE 87 -8.402 12.503 -35.352 685 HG12 ILE 87 HG12 ILE 87 -6.085 12.609 -33.406 686 HG13 ILE 87 HG11 ILE 87 -6.844 11.154 -34.037 687 HG21 ILE 87 HG21 ILE 87 -8.471 14.928 -35.136 688 HG22 ILE 87 HG22 ILE 87 -6.914 14.406 -35.779 689 HG23 ILE 87 HG23 ILE 87 -7.053 14.890 -34.089 690 HD11 ILE 87 HD11 ILE 87 -5.325 13.188 -35.644 691 HD12 ILE 87 HD12 ILE 87 -6.093 11.733 -36.281 692 HD13 ILE 87 HD13 ILE 87 -4.744 11.598 -35.150 693 H HIS 88 HN HIS 88 -9.946 15.145 -33.853 694 HA HIS 88 HA HIS 88 -12.621 14.090 -34.080 695 HB2 HIS 88 HB2 HIS 88 -12.175 16.409 -33.267 696 HB3 HIS 88 HB1 HIS 88 -11.589 16.827 -34.873 697 HD1 HIS 88 HD1 HIS 88 -14.566 16.888 -32.852 698 HD2 HIS 88 HD2 HIS 88 -13.749 16.480 -36.915 699 HE1 HIS 88 HE1 HIS 88 -16.726 17.397 -34.039 700 HE2 HIS 88 HE2 HIS 88 -16.258 16.946 -36.475 701 H ALA 89 HN ALA 89 -10.339 15.638 -36.331 702 HA ALA 89 HA ALA 89 -11.229 13.816 -38.422 703 HB1 ALA 89 HB1 ALA 89 -11.527 15.618 -40.046 704 HB2 ALA 89 HB2 ALA 89 -11.219 16.813 -38.786 705 HB3 ALA 89 HB3 ALA 89 -12.652 15.789 -38.698 706 H PHE 90 HN PHE 90 -9.408 12.895 -39.101 707 HA PHE 90 HA PHE 90 -6.980 14.540 -39.224 708 HB2 PHE 90 HB2 PHE 90 -6.803 12.558 -37.781 709 HB3 PHE 90 HB1 PHE 90 -7.240 11.526 -39.139 710 HD1 PHE 90 HD1 PHE 90 -4.657 13.870 -37.898 711 HD2 PHE 90 HD2 PHE 90 -5.619 10.769 -40.646 712 HE1 PHE 90 HE1 PHE 90 -2.281 13.681 -38.512 713 HE2 PHE 90 HE2 PHE 90 -3.247 10.574 -41.265 714 HZ PHE 90 HZ PHE 90 -1.576 12.029 -40.196 715 H SER 91 HN SER 91 -6.134 15.021 -41.093 716 HA SER 91 HA SER 91 -7.046 13.606 -43.508 717 HB2 SER 91 HB2 SER 91 -7.796 15.928 -43.479 718 HB3 SER 91 HB1 SER 91 -6.163 16.484 -43.124 719 HG SER 91 HG SER 91 -5.598 16.230 -45.154 720 H MET 92 HN MET 92 -5.461 13.058 -45.047 721 HA MET 92 HA MET 92 -2.677 13.447 -44.191 722 HB2 MET 92 HB2 MET 92 -2.108 11.177 -44.786 723 HB3 MET 92 HB1 MET 92 -3.424 11.148 -43.625 724 HG2 MET 92 HG2 MET 92 -3.772 10.828 -46.598 725 HG3 MET 92 HG1 MET 92 -3.636 9.494 -45.457 726 HE1 MET 92 HE1 MET 92 -5.269 10.434 -42.962 727 HE2 MET 92 HE2 MET 92 -5.487 8.842 -43.691 728 HE3 MET 92 HE3 MET 92 -6.891 9.850 -43.338 729 H LYS 93 HN LYS 93 -1.373 14.202 -45.720 730 HA LYS 93 HA LYS 93 -2.307 14.080 -48.521 731 HB2 LYS 93 HB2 LYS 93 -1.912 16.349 -47.226 732 HB3 LYS 93 HB1 LYS 93 -0.224 16.016 -47.588 733 HG2 LYS 93 HG2 LYS 93 -1.350 15.623 -50.015 734 HG3 LYS 93 HG1 LYS 93 -2.405 16.870 -49.349 735 HD2 LYS 93 HD2 LYS 93 0.586 16.989 -49.691 736 HD3 LYS 93 HD1 LYS 93 -0.630 17.929 -50.556 737 HE2 LYS 93 HE2 LYS 93 -0.057 18.090 -47.599 738 HE3 LYS 93 HE1 LYS 93 0.500 19.240 -48.811 739 HZ1 LYS 93 HZ1 LYS 93 -1.392 20.166 -47.802 740 HZ2 LYS 93 HZ2 LYS 93 -2.289 18.735 -47.935 741 HZ3 LYS 93 HZ3 LYS 93 -1.912 19.630 -49.326 742 H CYS 94 HN CYS 94 -1.220 12.507 -49.581 743 HA CYS 94 HA CYS 94 1.351 11.660 -48.481 744 HB2 CYS 94 HB2 CYS 94 1.049 9.692 -50.007 745 HB3 CYS 94 HB1 CYS 94 -0.209 9.878 -48.790 746 HG CYS 94 HG CYS 94 -0.443 10.528 -52.140 747 H HIS 95 HN HIS 95 3.254 11.681 -49.552 748 HA HIS 95 HA HIS 95 3.349 12.301 -52.377 749 HB2 HIS 95 HB2 HIS 95 3.280 14.484 -50.886 750 HB3 HIS 95 HB1 HIS 95 4.975 14.099 -50.617 751 HD1 HIS 95 HD1 HIS 95 2.576 14.890 -53.443 752 HD2 HIS 95 HD2 HIS 95 6.662 14.852 -52.648 753 HE1 HIS 95 HE1 HIS 95 3.663 15.981 -55.426 754 HE2 HIS 95 HE2 HIS 95 6.118 16.068 -54.873 755 H THR 96 HN THR 96 5.475 11.947 -53.271 756 HA THR 96 HA THR 96 6.925 9.969 -51.702 757 HB THR 96 HB THR 96 8.046 9.654 -54.059 758 HG1 THR 96 HG1 THR 96 7.106 10.732 -55.623 759 HG21 THR 96 HG21 THR 96 5.198 8.834 -53.483 760 HG22 THR 96 HG22 THR 96 6.642 8.022 -52.880 761 HG23 THR 96 HG23 THR 96 6.300 8.047 -54.614 762 HA PRO 97 HA PRO 97 10.392 12.462 -50.853 763 HB2 PRO 97 HB2 PRO 97 12.382 10.605 -50.869 764 HB3 PRO 97 HB1 PRO 97 11.186 10.740 -49.575 765 HG2 PRO 97 HG2 PRO 97 11.262 8.858 -51.900 766 HG3 PRO 97 HG1 PRO 97 10.847 8.530 -50.207 767 HD2 PRO 97 HD2 PRO 97 8.970 8.840 -52.121 768 HD3 PRO 97 HD1 PRO 97 8.707 9.349 -50.441 769 H LEU 98 HN LEU 98 10.755 10.303 -53.639 770 HA LEU 98 HA LEU 98 13.031 11.487 -54.759 771 HB2 LEU 98 HB2 LEU 98 10.747 9.923 -55.908 772 HB3 LEU 98 HB1 LEU 98 11.938 10.641 -56.974 773 HG LEU 98 HG LEU 98 12.475 8.315 -56.572 774 HD11 LEU 98 HD11 LEU 98 14.766 8.559 -55.768 775 HD12 LEU 98 HD12 LEU 98 14.376 10.159 -55.136 776 HD13 LEU 98 HD13 LEU 98 14.326 9.860 -56.874 777 HD21 LEU 98 HD21 LEU 98 13.082 7.505 -54.343 778 HD22 LEU 98 HD22 LEU 98 11.394 8.011 -54.415 779 HD23 LEU 98 HD23 LEU 98 12.596 9.052 -53.651 780 H GLU 99 HN GLU 99 9.605 12.111 -55.354 781 HA GLU 99 HA GLU 99 9.980 14.291 -57.094 782 HB2 GLU 99 HB2 GLU 99 7.685 13.348 -55.400 783 HB3 GLU 99 HB1 GLU 99 7.577 14.840 -56.321 784 HG2 GLU 99 HG2 GLU 99 6.578 12.893 -57.459 785 HG3 GLU 99 HG1 GLU 99 7.857 13.668 -58.385 786 H TYR 100 HN TYR 100 9.800 14.045 -53.594 787 HA TYR 100 HA TYR 100 9.558 16.832 -53.093 788 HB2 TYR 100 HB2 TYR 100 8.886 15.398 -51.332 789 HB3 TYR 100 HB1 TYR 100 10.405 14.509 -51.369 790 HD1 TYR 100 HD1 TYR 100 9.060 17.928 -50.669 791 HD2 TYR 100 HD2 TYR 100 12.076 15.039 -49.843 792 HE1 TYR 100 HE1 TYR 100 9.978 19.392 -48.917 793 HE2 TYR 100 HE2 TYR 100 12.997 16.495 -48.090 794 HH TYR 100 HH TYR 100 11.348 19.296 -46.951 795 H ASP 101 HN ASP 101 12.297 14.687 -53.556 796 HA ASP 101 HA ASP 101 14.328 16.294 -52.521 797 HB2 ASP 101 HB2 ASP 101 14.669 13.955 -53.174 798 HB3 ASP 101 HB1 ASP 101 14.460 14.389 -54.867 799 H LYS 102 HN LYS 102 12.716 16.407 -55.646 800 HA LYS 102 HA LYS 102 14.520 18.346 -56.747 801 HB2 LYS 102 HB2 LYS 102 11.935 17.138 -57.612 802 HB3 LYS 102 HB1 LYS 102 12.416 18.661 -58.340 803 HG2 LYS 102 HG2 LYS 102 13.344 17.248 -59.844 804 HG3 LYS 102 HG1 LYS 102 14.687 17.348 -58.710 805 HD2 LYS 102 HD2 LYS 102 12.593 15.203 -58.502 806 HD3 LYS 102 HD1 LYS 102 13.998 15.030 -59.551 807 HE2 LYS 102 HE2 LYS 102 14.096 15.544 -56.584 808 HE3 LYS 102 HE1 LYS 102 14.292 13.968 -57.344 809 HZ1 LYS 102 HZ1 LYS 102 16.053 16.300 -57.882 810 HZ2 LYS 102 HZ2 LYS 102 16.284 14.698 -58.398 811 HZ3 LYS 102 HZ3 LYS 102 16.400 15.086 -56.747 812 H LEU 103 HN LEU 103 11.609 18.415 -54.860 813 HA LEU 103 HA LEU 103 10.910 21.126 -55.286 814 HB2 LEU 103 HB2 LEU 103 10.343 19.340 -52.920 815 HB3 LEU 103 HB1 LEU 103 9.577 20.887 -53.221 816 HG LEU 103 HG LEU 103 9.315 18.421 -54.943 817 HD11 LEU 103 HD11 LEU 103 8.128 18.246 -52.820 818 HD12 LEU 103 HD12 LEU 103 7.001 18.418 -54.166 819 HD13 LEU 103 HD13 LEU 103 7.346 19.798 -53.123 820 HD21 LEU 103 HD21 LEU 103 8.009 21.129 -55.186 821 HD22 LEU 103 HD22 LEU 103 7.642 19.713 -56.171 822 HD23 LEU 103 HD23 LEU 103 9.234 20.469 -56.269 823 H LYS 104 HN LYS 104 12.767 19.493 -52.736 824 HA LYS 104 HA LYS 104 13.392 21.919 -51.361 825 HB2 LYS 104 HB2 LYS 104 15.094 20.485 -50.173 826 HB3 LYS 104 HB1 LYS 104 13.428 19.930 -50.064 827 HG2 LYS 104 HG2 LYS 104 13.809 18.090 -51.358 828 HG3 LYS 104 HG1 LYS 104 15.135 18.845 -52.240 829 HD2 LYS 104 HD2 LYS 104 15.456 18.279 -49.329 830 HD3 LYS 104 HD1 LYS 104 15.598 16.953 -50.485 831 HE2 LYS 104 HE2 LYS 104 17.787 17.857 -50.051 832 HE3 LYS 104 HE1 LYS 104 17.316 18.251 -51.702 833 HZ1 LYS 104 HZ1 LYS 104 16.754 20.475 -50.987 834 HZ2 LYS 104 HZ2 LYS 104 18.355 20.128 -50.572 835 HZ3 LYS 104 HZ3 LYS 104 17.145 20.102 -49.384 836 H SER 105 HN SER 105 14.644 20.421 -54.151 837 HA SER 105 HA SER 105 17.258 21.622 -53.987 838 HB2 SER 105 HB2 SER 105 16.856 19.501 -55.231 839 HB3 SER 105 HB1 SER 105 15.851 20.390 -56.374 840 HG SER 105 HG SER 105 18.348 21.487 -55.979 841 H LYS 106 HN LYS 106 14.182 22.267 -55.569 842 HA LYS 106 HA LYS 106 14.639 25.062 -55.656 843 HB2 LYS 106 HB2 LYS 106 14.451 25.281 -58.161 844 HB3 LYS 106 HB1 LYS 106 16.003 24.727 -57.563 845 HG2 LYS 106 HG2 LYS 106 14.146 22.576 -58.258 846 HG3 LYS 106 HG1 LYS 106 14.598 23.613 -59.612 847 HD2 LYS 106 HD2 LYS 106 16.527 22.224 -57.751 848 HD3 LYS 106 HD1 LYS 106 16.101 21.674 -59.371 849 HE2 LYS 106 HE2 LYS 106 16.960 23.846 -60.256 850 HE3 LYS 106 HE1 LYS 106 17.512 24.238 -58.629 851 HZ1 LYS 106 HZ1 LYS 106 18.382 21.854 -60.170 852 HZ2 LYS 106 HZ2 LYS 106 18.989 22.359 -58.671 853 HZ3 LYS 106 HZ3 LYS 106 19.267 23.293 -60.058 854 H GLY 107 HN GLY 107 12.875 22.348 -56.997 855 HA2 GLY 107 HA2 GLY 107 10.498 22.173 -56.351 856 HA3 GLY 107 HA1 GLY 107 10.376 23.896 -56.691 857 H SER 108 HN SER 108 12.250 21.770 -58.704 858 HA SER 108 HA SER 108 10.149 21.737 -60.729 859 HB2 SER 108 HB2 SER 108 11.744 23.737 -61.020 860 HB3 SER 108 HB1 SER 108 12.976 22.546 -61.434 861 HG SER 108 HG SER 108 11.755 21.913 -63.198 Start of MODEL 3 1 H1 MET 1 HT1 MET 1 -14.523 9.837 7.710 2 H2 MET 1 HT2 MET 1 -14.961 8.236 8.039 3 H3 MET 1 HT3 MET 1 -15.710 9.506 8.873 4 HA MET 1 HA MET 1 -17.121 8.539 7.132 5 HB2 MET 1 HB2 MET 1 -17.816 10.665 6.162 6 HB3 MET 1 HB1 MET 1 -17.417 10.882 7.859 7 HG2 MET 1 HG2 MET 1 -15.241 11.800 7.231 8 HG3 MET 1 HG1 MET 1 -15.651 11.589 5.528 9 HE1 MET 1 HE1 MET 1 -14.657 14.346 6.644 10 HE2 MET 1 HE2 MET 1 -15.803 15.466 5.909 11 HE3 MET 1 HE3 MET 1 -15.164 14.118 4.970 12 H GLY 2 HN GLY 2 -17.518 9.263 4.631 13 HA2 GLY 2 HA2 GLY 2 -16.347 9.620 2.526 14 HA3 GLY 2 HA1 GLY 2 -14.987 8.737 3.202 15 H SER 3 HN SER 3 -18.209 7.592 3.742 16 HA SER 3 HA SER 3 -17.652 5.318 1.971 17 HB2 SER 3 HB2 SER 3 -19.735 5.597 4.155 18 HB3 SER 3 HB1 SER 3 -19.373 4.129 3.247 19 HG SER 3 HG SER 3 -17.666 3.796 4.443 20 H SER 4 HN SER 4 -19.183 8.195 1.920 21 HA SER 4 HA SER 4 -21.424 7.268 0.254 22 HB2 SER 4 HB2 SER 4 -21.160 10.011 1.479 23 HB3 SER 4 HB1 SER 4 -22.623 9.185 0.939 24 HG SER 4 HG SER 4 -22.812 8.536 2.920 25 H HIS 5 HN HIS 5 -21.778 8.296 -1.772 26 HA HIS 5 HA HIS 5 -19.325 9.461 -2.833 27 HB2 HIS 5 HB2 HIS 5 -20.434 9.146 -5.089 28 HB3 HIS 5 HB1 HIS 5 -20.032 7.684 -4.207 29 HD1 HIS 5 HD1 HIS 5 -21.832 5.995 -4.056 30 HD2 HIS 5 HD2 HIS 5 -23.334 9.784 -4.897 31 HE1 HIS 5 HE1 HIS 5 -24.288 5.671 -4.505 32 HE2 HIS 5 HE2 HIS 5 -25.128 7.945 -5.201 33 H HIS 6 HN HIS 6 -19.466 11.510 -1.926 34 HA HIS 6 HA HIS 6 -21.509 13.246 -3.159 35 HB2 HIS 6 HB2 HIS 6 -19.814 13.628 -0.688 36 HB3 HIS 6 HB1 HIS 6 -20.724 14.938 -1.428 37 HD1 HIS 6 HD1 HIS 6 -23.277 14.931 -1.130 38 HD2 HIS 6 HD2 HIS 6 -21.339 11.740 0.711 39 HE1 HIS 6 HE1 HIS 6 -24.984 13.883 0.396 40 HE2 HIS 6 HE2 HIS 6 -23.793 11.965 1.515 41 H HIS 7 HN HIS 7 -18.770 12.137 -4.094 42 HA HIS 7 HA HIS 7 -17.977 14.475 -5.523 43 HB2 HIS 7 HB2 HIS 7 -15.661 14.600 -4.690 44 HB3 HIS 7 HB1 HIS 7 -16.821 14.970 -3.421 45 HD1 HIS 7 HD1 HIS 7 -13.872 13.019 -4.049 46 HD2 HIS 7 HD2 HIS 7 -17.265 12.577 -1.678 47 HE1 HIS 7 HE1 HIS 7 -13.278 11.282 -2.326 48 HE2 HIS 7 HE2 HIS 7 -15.395 10.918 -1.001 49 H HIS 8 HN HIS 8 -16.767 13.988 -7.317 50 HA HIS 8 HA HIS 8 -16.525 11.143 -7.940 51 HB2 HIS 8 HB2 HIS 8 -17.637 12.843 -9.478 52 HB3 HIS 8 HB1 HIS 8 -16.033 13.506 -9.763 53 HD1 HIS 8 HD1 HIS 8 -14.385 12.053 -11.183 54 HD2 HIS 8 HD2 HIS 8 -18.211 10.464 -10.795 55 HE1 HIS 8 HE1 HIS 8 -14.571 10.291 -12.963 56 HE2 HIS 8 HE2 HIS 8 -16.920 9.400 -12.768 57 H HIS 9 HN HIS 9 -14.557 10.189 -8.605 58 HA HIS 9 HA HIS 9 -12.193 11.449 -7.507 59 HB2 HIS 9 HB2 HIS 9 -12.740 8.747 -8.705 60 HB3 HIS 9 HB1 HIS 9 -11.094 9.283 -8.385 61 HD1 HIS 9 HD1 HIS 9 -10.252 9.020 -6.043 62 HD2 HIS 9 HD2 HIS 9 -14.376 8.589 -6.300 63 HE1 HIS 9 HE1 HIS 9 -10.991 8.240 -3.769 64 HE2 HIS 9 HE2 HIS 9 -13.512 8.187 -3.896 65 H HIS 10 HN HIS 10 -10.139 10.711 -9.064 66 HA HIS 10 HA HIS 10 -10.506 12.524 -11.333 67 HB2 HIS 10 HB2 HIS 10 -8.073 11.594 -9.825 68 HB3 HIS 10 HB1 HIS 10 -7.943 12.426 -11.369 69 HD1 HIS 10 HD1 HIS 10 -8.173 14.924 -11.373 70 HD2 HIS 10 HD2 HIS 10 -9.175 13.213 -7.713 71 HE1 HIS 10 HE1 HIS 10 -8.415 16.845 -9.764 72 HE2 HIS 10 HE2 HIS 10 -9.192 15.802 -7.609 73 H SER 11 HN SER 11 -10.501 11.863 -13.348 74 HA SER 11 HA SER 11 -9.935 9.094 -13.988 75 HB2 SER 11 HB2 SER 11 -10.669 9.991 -16.326 76 HB3 SER 11 HB1 SER 11 -11.880 9.855 -15.051 77 HG SER 11 HG SER 11 -10.437 12.256 -15.409 78 H SER 12 HN SER 12 -9.138 9.920 -16.784 79 HA SER 12 HA SER 12 -6.346 9.822 -16.496 80 HB2 SER 12 HB2 SER 12 -7.678 9.151 -18.541 81 HB3 SER 12 HB1 SER 12 -7.848 10.866 -18.908 82 HG SER 12 HG SER 12 -6.088 10.077 -20.032 83 H GLY 13 HN GLY 13 -4.846 11.356 -16.203 84 HA2 GLY 13 HA2 GLY 13 -4.247 13.750 -16.764 85 HA3 GLY 13 HA1 GLY 13 -5.812 14.152 -16.070 86 H ARG 14 HN ARG 14 -4.728 11.616 -14.355 87 HA ARG 14 HA ARG 14 -3.790 13.321 -12.172 88 HB2 ARG 14 HB2 ARG 14 -4.106 11.288 -10.779 89 HB3 ARG 14 HB1 ARG 14 -5.576 11.753 -11.626 90 HG2 ARG 14 HG2 ARG 14 -5.188 10.033 -13.293 91 HG3 ARG 14 HG1 ARG 14 -3.674 9.591 -12.505 92 HD2 ARG 14 HD2 ARG 14 -4.900 8.914 -10.508 93 HD3 ARG 14 HD1 ARG 14 -6.420 9.389 -11.270 94 HE ARG 14 HE ARG 14 -5.551 7.658 -13.056 95 HH11 ARG 14 HH11 ARG 14 -5.543 7.386 -9.555 96 HH12 ARG 14 HH12 ARG 14 -5.616 5.651 -9.576 97 HH21 ARG 14 HH21 ARG 14 -5.628 5.383 -13.065 98 HH22 ARG 14 HH22 ARG 14 -5.656 4.514 -11.559 99 H GLU 15 HN GLU 15 -2.734 10.963 -14.446 100 HA GLU 15 HA GLU 15 -0.295 10.338 -13.005 101 HB2 GLU 15 HB2 GLU 15 0.171 8.890 -15.015 102 HB3 GLU 15 HB1 GLU 15 -1.278 8.478 -14.111 103 HG2 GLU 15 HG2 GLU 15 -1.433 10.240 -16.525 104 HG3 GLU 15 HG1 GLU 15 -1.349 8.487 -16.689 105 H ASN 16 HN ASN 16 -1.011 13.043 -14.292 106 HA ASN 16 HA ASN 16 0.905 13.467 -16.354 107 HB2 ASN 16 HB2 ASN 16 0.410 15.797 -16.170 108 HB3 ASN 16 HB1 ASN 16 -1.105 14.942 -15.902 109 HD21 ASN 16 HD21 ASN 16 -2.128 15.119 -13.951 110 HD22 ASN 16 HD22 ASN 16 -1.574 16.153 -12.674 111 H LEU 17 HN LEU 17 1.234 12.934 -13.079 112 HA LEU 17 HA LEU 17 3.475 14.561 -12.477 113 HB2 LEU 17 HB2 LEU 17 2.641 11.922 -11.265 114 HB3 LEU 17 HB1 LEU 17 3.796 13.044 -10.573 115 HG LEU 17 HG LEU 17 0.855 13.596 -10.989 116 HD11 LEU 17 HD11 LEU 17 0.727 13.514 -8.549 117 HD12 LEU 17 HD12 LEU 17 2.428 13.056 -8.474 118 HD13 LEU 17 HD13 LEU 17 1.255 11.971 -9.219 119 HD21 LEU 17 HD21 LEU 17 2.205 15.614 -11.192 120 HD22 LEU 17 HD22 LEU 17 3.002 15.248 -9.662 121 HD23 LEU 17 HD23 LEU 17 1.279 15.626 -9.690 122 H TYR 18 HN TYR 18 3.057 11.708 -14.312 123 HA TYR 18 HA TYR 18 5.945 11.154 -14.288 124 HB2 TYR 18 HB2 TYR 18 3.676 9.469 -15.371 125 HB3 TYR 18 HB1 TYR 18 5.372 9.000 -15.304 126 HD1 TYR 18 HD1 TYR 18 6.435 8.520 -13.129 127 HD2 TYR 18 HD2 TYR 18 2.271 9.336 -13.432 128 HE1 TYR 18 HE1 TYR 18 6.092 7.583 -10.882 129 HE2 TYR 18 HE2 TYR 18 1.919 8.401 -11.185 130 HH TYR 18 HH TYR 18 3.040 6.803 -9.662 131 H PHE 19 HN PHE 19 7.122 11.183 -16.202 132 HA PHE 19 HA PHE 19 6.361 13.123 -18.071 133 HB2 PHE 19 HB2 PHE 19 8.351 12.509 -19.338 134 HB3 PHE 19 HB1 PHE 19 8.712 12.568 -17.620 135 HD1 PHE 19 HD1 PHE 19 9.070 10.461 -16.365 136 HD2 PHE 19 HD2 PHE 19 8.582 10.508 -20.593 137 HE1 PHE 19 HE1 PHE 19 10.038 8.206 -16.500 138 HE2 PHE 19 HE2 PHE 19 9.546 8.249 -20.731 139 HZ PHE 19 HZ PHE 19 10.276 7.095 -18.683 140 H GLN 20 HN GLN 20 6.133 9.608 -18.238 141 HA GLN 20 HA GLN 20 5.077 9.740 -20.939 142 HB2 GLN 20 HB2 GLN 20 4.921 7.219 -20.675 143 HB3 GLN 20 HB1 GLN 20 6.530 7.915 -20.637 144 HG2 GLN 20 HG2 GLN 20 6.520 6.289 -18.961 145 HG3 GLN 20 HG1 GLN 20 6.367 7.822 -18.112 146 HE21 GLN 20 HE21 GLN 20 4.480 8.279 -17.015 147 HE22 GLN 20 HE22 GLN 20 3.246 7.104 -16.723 148 H GLY 21 HN GLY 21 3.742 10.560 -18.205 149 HA2 GLY 21 HA2 GLY 21 1.300 8.956 -18.408 150 HA3 GLY 21 HA1 GLY 21 1.703 10.073 -17.110 151 H HIS 22 HN HIS 22 2.519 11.827 -19.635 152 HA HIS 22 HA HIS 22 -0.126 12.594 -20.529 153 HB2 HIS 22 HB2 HIS 22 0.038 14.918 -19.836 154 HB3 HIS 22 HB1 HIS 22 0.150 13.875 -18.427 155 HD1 HIS 22 HD1 HIS 22 1.338 16.919 -19.147 156 HD2 HIS 22 HD2 HIS 22 3.376 13.374 -18.364 157 HE1 HIS 22 HE1 HIS 22 3.642 17.604 -18.404 158 HE2 HIS 22 HE2 HIS 22 4.825 15.451 -17.833 159 H MET 23 HN MET 23 0.090 12.684 -22.642 160 HA MET 23 HA MET 23 2.450 14.032 -23.751 161 HB2 MET 23 HB2 MET 23 1.227 11.437 -24.697 162 HB3 MET 23 HB1 MET 23 2.357 12.383 -25.657 163 HG2 MET 23 HG2 MET 23 4.056 12.113 -23.915 164 HG3 MET 23 HG1 MET 23 2.918 11.163 -22.960 165 HE1 MET 23 HE1 MET 23 1.465 9.358 -25.072 166 HE2 MET 23 HE2 MET 23 2.124 8.744 -23.556 167 HE3 MET 23 HE3 MET 23 2.496 7.929 -25.076 168 H CYS 24 HN CYS 24 2.100 15.232 -25.593 169 HA CYS 24 HA CYS 24 -0.470 16.353 -25.893 170 HB2 CYS 24 HB2 CYS 24 1.845 16.541 -27.830 171 HB3 CYS 24 HB1 CYS 24 0.514 17.682 -27.649 172 HG CYS 24 HG CYS 24 1.377 18.192 -24.882 173 H ILE 25 HN ILE 25 -1.968 16.179 -27.552 174 HA ILE 25 HA ILE 25 -2.455 13.653 -28.610 175 HB ILE 25 HB ILE 25 -4.197 15.361 -28.296 176 HG12 ILE 25 HG12 ILE 25 -5.405 15.006 -30.476 177 HG13 ILE 25 HG11 ILE 25 -3.933 14.267 -31.101 178 HG21 ILE 25 HG21 ILE 25 -2.981 16.708 -30.700 179 HG22 ILE 25 HG22 ILE 25 -2.987 17.324 -29.047 180 HG23 ILE 25 HG23 ILE 25 -4.504 17.155 -29.933 181 HD11 ILE 25 HD11 ILE 25 -5.511 12.584 -30.367 182 HD12 ILE 25 HD12 ILE 25 -5.544 13.294 -28.753 183 HD13 ILE 25 HD13 ILE 25 -4.063 12.556 -29.362 184 H GLN 26 HN GLN 26 -0.743 16.392 -29.981 185 HA GLN 26 HA GLN 26 -0.523 15.451 -32.626 186 HB2 GLN 26 HB2 GLN 26 -0.082 17.776 -32.016 187 HB3 GLN 26 HB1 GLN 26 1.294 17.278 -31.042 188 HG2 GLN 26 HG2 GLN 26 2.397 16.446 -33.079 189 HG3 GLN 26 HG1 GLN 26 1.035 17.039 -34.029 190 HE21 GLN 26 HE21 GLN 26 2.320 18.446 -35.191 191 HE22 GLN 26 HE22 GLN 26 2.964 19.902 -34.514 192 H LYS 27 HN LYS 27 1.406 14.910 -29.734 193 HA LYS 27 HA LYS 27 3.642 13.780 -31.057 194 HB2 LYS 27 HB2 LYS 27 3.912 14.734 -28.859 195 HB3 LYS 27 HB1 LYS 27 2.730 13.627 -28.182 196 HG2 LYS 27 HG2 LYS 27 4.812 12.803 -27.502 197 HG3 LYS 27 HG1 LYS 27 4.314 11.755 -28.826 198 HD2 LYS 27 HD2 LYS 27 6.185 14.099 -29.167 199 HD3 LYS 27 HD1 LYS 27 6.733 12.456 -28.849 200 HE2 LYS 27 HE2 LYS 27 5.471 11.750 -30.904 201 HE3 LYS 27 HE1 LYS 27 5.217 13.459 -31.250 202 HZ1 LYS 27 HZ1 LYS 27 7.714 13.669 -31.150 203 HZ2 LYS 27 HZ2 LYS 27 7.092 12.813 -32.475 204 HZ3 LYS 27 HZ3 LYS 27 7.775 11.973 -31.168 205 H VAL 28 HN VAL 28 0.842 12.343 -29.391 206 HA VAL 28 HA VAL 28 1.758 9.689 -29.670 207 HB VAL 28 HB VAL 28 0.118 10.150 -27.990 208 HG11 VAL 28 HG11 VAL 28 -2.197 10.746 -28.505 209 HG12 VAL 28 HG12 VAL 28 -1.773 10.892 -30.212 210 HG13 VAL 28 HG13 VAL 28 -1.063 11.993 -29.030 211 HG21 VAL 28 HG21 VAL 28 -1.543 8.404 -28.450 212 HG22 VAL 28 HG22 VAL 28 0.088 7.905 -28.901 213 HG23 VAL 28 HG23 VAL 28 -1.059 8.404 -30.145 214 H ILE 29 HN ILE 29 -0.511 11.605 -31.651 215 HA ILE 29 HA ILE 29 -1.112 9.591 -33.516 216 HB ILE 29 HB ILE 29 -1.269 12.574 -33.556 217 HG12 ILE 29 HG12 ILE 29 -3.641 12.102 -34.069 218 HG13 ILE 29 HG11 ILE 29 -3.278 10.383 -34.131 219 HG21 ILE 29 HG21 ILE 29 -1.654 10.885 -36.025 220 HG22 ILE 29 HG22 ILE 29 -0.385 12.084 -35.770 221 HG23 ILE 29 HG23 ILE 29 -2.071 12.592 -35.870 222 HD11 ILE 29 HD11 ILE 29 -4.337 10.987 -32.040 223 HD12 ILE 29 HD12 ILE 29 -3.052 12.148 -31.709 224 HD13 ILE 29 HD13 ILE 29 -2.688 10.424 -31.766 225 H GLU 30 HN GLU 30 1.428 12.082 -33.566 226 HA GLU 30 HA GLU 30 2.477 11.461 -36.084 227 HB2 GLU 30 HB2 GLU 30 3.027 13.522 -34.887 228 HB3 GLU 30 HB1 GLU 30 3.875 12.601 -33.656 229 HG2 GLU 30 HG2 GLU 30 4.826 12.187 -36.407 230 HG3 GLU 30 HG1 GLU 30 5.063 13.808 -35.757 231 H ASP 31 HN ASP 31 3.195 10.150 -32.892 232 HA ASP 31 HA ASP 31 5.492 8.697 -33.694 233 HB2 ASP 31 HB2 ASP 31 4.942 9.375 -31.338 234 HB3 ASP 31 HB1 ASP 31 3.716 8.108 -31.321 235 H LYS 32 HN LYS 32 2.067 7.917 -33.561 236 HA LYS 32 HA LYS 32 2.313 5.112 -33.836 237 HB2 LYS 32 HB2 LYS 32 0.063 6.947 -34.683 238 HB3 LYS 32 HB1 LYS 32 -0.042 5.195 -34.611 239 HG2 LYS 32 HG2 LYS 32 0.581 6.904 -32.222 240 HG3 LYS 32 HG1 LYS 32 -1.054 6.434 -32.684 241 HD2 LYS 32 HD2 LYS 32 -0.362 4.059 -32.529 242 HD3 LYS 32 HD1 LYS 32 1.218 4.591 -31.948 243 HE2 LYS 32 HE2 LYS 32 0.198 5.628 -30.016 244 HE3 LYS 32 HE1 LYS 32 -1.412 5.233 -30.617 245 HZ1 LYS 32 HZ1 LYS 32 -0.650 3.693 -28.897 246 HZ2 LYS 32 HZ2 LYS 32 0.663 3.246 -29.870 247 HZ3 LYS 32 HZ3 LYS 32 -0.919 2.902 -30.372 248 H LEU 33 HN LEU 33 1.577 7.624 -36.263 249 HA LEU 33 HA LEU 33 1.574 5.735 -38.388 250 HB2 LEU 33 HB2 LEU 33 1.460 7.781 -39.853 251 HB3 LEU 33 HB1 LEU 33 0.171 7.580 -38.685 252 HG LEU 33 HG LEU 33 1.593 9.197 -37.213 253 HD11 LEU 33 HD11 LEU 33 3.579 9.219 -38.613 254 HD12 LEU 33 HD12 LEU 33 2.862 10.829 -38.517 255 HD13 LEU 33 HD13 LEU 33 2.635 9.848 -39.964 256 HD21 LEU 33 HD21 LEU 33 0.435 11.098 -38.204 257 HD22 LEU 33 HD22 LEU 33 -0.619 9.686 -38.122 258 HD23 LEU 33 HD23 LEU 33 0.112 10.155 -39.658 259 H SER 34 HN SER 34 4.067 7.764 -37.015 260 HA SER 34 HA SER 34 5.841 7.595 -39.229 261 HB2 SER 34 HB2 SER 34 6.421 8.105 -36.303 262 HB3 SER 34 HB1 SER 34 7.589 8.302 -37.610 263 HG SER 34 HG SER 34 5.415 9.878 -36.898 264 H SER 35 HN SER 35 5.442 5.656 -36.296 265 HA SER 35 HA SER 35 7.695 3.990 -36.802 266 HB2 SER 35 HB2 SER 35 5.292 3.392 -35.060 267 HB3 SER 35 HB1 SER 35 6.898 2.668 -34.940 268 HG SER 35 HG SER 35 5.986 5.162 -34.103 269 H ALA 36 HN ALA 36 4.375 3.961 -37.823 270 HA ALA 36 HA ALA 36 4.469 1.188 -38.668 271 HB1 ALA 36 HB1 ALA 36 2.160 1.506 -39.336 272 HB2 ALA 36 HB2 ALA 36 2.298 3.242 -39.057 273 HB3 ALA 36 HB3 ALA 36 2.415 2.119 -37.702 274 H LEU 37 HN LEU 37 4.039 4.348 -40.287 275 HA LEU 37 HA LEU 37 4.093 3.072 -42.875 276 HB2 LEU 37 HB2 LEU 37 3.973 5.993 -42.123 277 HB3 LEU 37 HB1 LEU 37 3.792 5.363 -43.748 278 HG LEU 37 HG LEU 37 1.925 4.804 -41.440 279 HD11 LEU 37 HD11 LEU 37 1.770 7.104 -42.230 280 HD12 LEU 37 HD12 LEU 37 0.336 6.180 -42.682 281 HD13 LEU 37 HD13 LEU 37 1.577 6.531 -43.887 282 HD21 LEU 37 HD21 LEU 37 2.058 2.933 -43.003 283 HD22 LEU 37 HD22 LEU 37 1.739 4.027 -44.350 284 HD23 LEU 37 HD23 LEU 37 0.502 3.754 -43.122 285 H LYS 38 HN LYS 38 6.296 4.873 -40.869 286 HA LYS 38 HA LYS 38 8.483 5.437 -41.045 287 HB2 LYS 38 HB2 LYS 38 8.599 3.580 -43.428 288 HB3 LYS 38 HB1 LYS 38 9.960 4.170 -42.489 289 HG2 LYS 38 HG2 LYS 38 9.240 2.901 -40.569 290 HG3 LYS 38 HG1 LYS 38 7.783 2.386 -41.422 291 HD2 LYS 38 HD2 LYS 38 10.634 1.713 -42.152 292 HD3 LYS 38 HD1 LYS 38 9.437 0.613 -41.467 293 HE2 LYS 38 HE2 LYS 38 9.361 1.929 -44.183 294 HE3 LYS 38 HE1 LYS 38 9.610 0.218 -43.839 295 HZ1 LYS 38 HZ1 LYS 38 7.132 1.780 -43.358 296 HZ2 LYS 38 HZ2 LYS 38 7.356 0.175 -42.867 297 HZ3 LYS 38 HZ3 LYS 38 7.353 0.567 -44.520 298 HA PRO 39 HA PRO 39 7.796 8.310 -44.544 299 HB2 PRO 39 HB2 PRO 39 7.246 10.546 -43.146 300 HB3 PRO 39 HB1 PRO 39 6.005 9.361 -43.560 301 HG2 PRO 39 HG2 PRO 39 7.270 9.925 -40.959 302 HG3 PRO 39 HG1 PRO 39 5.691 9.209 -41.314 303 HD2 PRO 39 HD2 PRO 39 8.104 7.863 -40.582 304 HD3 PRO 39 HD1 PRO 39 6.544 7.136 -41.015 305 H THR 40 HN THR 40 9.513 9.297 -45.418 306 HA THR 40 HA THR 40 11.927 9.717 -43.976 307 HB THR 40 HB THR 40 12.666 10.888 -46.094 308 HG1 THR 40 HG1 THR 40 10.454 11.519 -46.683 309 HG21 THR 40 HG21 THR 40 11.441 8.138 -46.378 310 HG22 THR 40 HG22 THR 40 13.071 8.511 -45.814 311 HG23 THR 40 HG23 THR 40 12.619 8.841 -47.487 312 H PHE 41 HN PHE 41 9.196 11.680 -44.877 313 HA PHE 41 HA PHE 41 10.106 13.736 -43.017 314 HB2 PHE 41 HB2 PHE 41 10.740 14.556 -45.264 315 HB3 PHE 41 HB1 PHE 41 9.075 14.363 -45.798 316 HD1 PHE 41 HD1 PHE 41 11.188 16.170 -43.338 317 HD2 PHE 41 HD2 PHE 41 7.544 16.093 -45.536 318 HE1 PHE 41 HE1 PHE 41 10.689 18.457 -42.583 319 HE2 PHE 41 HE2 PHE 41 7.039 18.380 -44.785 320 HZ PHE 41 HZ PHE 41 8.612 19.565 -43.306 321 H LEU 42 HN LEU 42 8.466 14.466 -41.748 322 HA LEU 42 HA LEU 42 5.703 13.951 -42.556 323 HB2 LEU 42 HB2 LEU 42 6.763 12.035 -41.149 324 HB3 LEU 42 HB1 LEU 42 6.648 13.157 -39.812 325 HG LEU 42 HG LEU 42 4.792 11.505 -39.918 326 HD11 LEU 42 HD11 LEU 42 2.977 13.090 -39.542 327 HD12 LEU 42 HD12 LEU 42 3.953 14.377 -40.248 328 HD13 LEU 42 HD13 LEU 42 4.464 13.605 -38.747 329 HD21 LEU 42 HD21 LEU 42 4.032 13.001 -42.420 330 HD22 LEU 42 HD22 LEU 42 3.051 11.781 -41.607 331 HD23 LEU 42 HD23 LEU 42 4.593 11.331 -42.333 332 H GLU 43 HN GLU 43 4.499 15.700 -42.144 333 HA GLU 43 HA GLU 43 5.203 17.383 -39.852 334 HB2 GLU 43 HB2 GLU 43 6.225 18.478 -41.757 335 HB3 GLU 43 HB1 GLU 43 4.719 18.391 -42.659 336 HG2 GLU 43 HG2 GLU 43 3.665 19.933 -41.144 337 HG3 GLU 43 HG1 GLU 43 5.089 19.938 -40.104 338 H LEU 44 HN LEU 44 3.504 17.850 -38.636 339 HA LEU 44 HA LEU 44 0.827 17.254 -39.625 340 HB2 LEU 44 HB2 LEU 44 1.748 18.110 -36.872 341 HB3 LEU 44 HB1 LEU 44 0.112 17.666 -37.291 342 HG LEU 44 HG LEU 44 0.995 15.813 -36.158 343 HD11 LEU 44 HD11 LEU 44 1.068 14.034 -37.825 344 HD12 LEU 44 HD12 LEU 44 1.252 15.241 -39.099 345 HD13 LEU 44 HD13 LEU 44 -0.230 15.185 -38.142 346 HD21 LEU 44 HD21 LEU 44 3.343 16.424 -36.208 347 HD22 LEU 44 HD22 LEU 44 3.436 15.996 -37.916 348 HD23 LEU 44 HD23 LEU 44 3.128 14.746 -36.709 349 H VAL 45 HN VAL 45 -0.289 18.830 -40.594 350 HA VAL 45 HA VAL 45 0.314 21.615 -39.858 351 HB VAL 45 HB VAL 45 -0.972 20.584 -42.393 352 HG11 VAL 45 HG11 VAL 45 -1.709 22.827 -41.837 353 HG12 VAL 45 HG12 VAL 45 -0.625 22.870 -43.228 354 HG13 VAL 45 HG13 VAL 45 -0.036 23.348 -41.635 355 HG21 VAL 45 HG21 VAL 45 1.139 21.190 -43.486 356 HG22 VAL 45 HG22 VAL 45 1.362 19.923 -42.279 357 HG23 VAL 45 HG23 VAL 45 1.833 21.584 -41.914 358 H ASP 46 HN ASP 46 -1.140 22.521 -38.574 359 HA ASP 46 HA ASP 46 -3.920 21.640 -38.615 360 HB2 ASP 46 HB2 ASP 46 -2.918 22.036 -36.416 361 HB3 ASP 46 HB1 ASP 46 -2.505 23.684 -36.878 362 H LYS 47 HN LYS 47 -5.392 22.630 -39.845 363 HA LYS 47 HA LYS 47 -4.962 25.446 -40.528 364 HB2 LYS 47 HB2 LYS 47 -4.157 24.030 -42.406 365 HB3 LYS 47 HB1 LYS 47 -5.767 23.339 -42.539 366 HG2 LYS 47 HG2 LYS 47 -6.677 25.531 -43.077 367 HG3 LYS 47 HG1 LYS 47 -5.071 26.244 -42.913 368 HD2 LYS 47 HD2 LYS 47 -4.277 24.790 -44.743 369 HD3 LYS 47 HD1 LYS 47 -5.919 24.172 -44.933 370 HE2 LYS 47 HE2 LYS 47 -5.473 25.909 -46.569 371 HE3 LYS 47 HE1 LYS 47 -6.708 26.438 -45.428 372 HZ1 LYS 47 HZ1 LYS 47 -4.962 27.654 -44.219 373 HZ2 LYS 47 HZ2 LYS 47 -5.152 28.203 -45.808 374 HZ3 LYS 47 HZ3 LYS 47 -3.838 27.209 -45.410 375 H SER 48 HN SER 48 -6.547 25.960 -39.034 376 HA SER 48 HA SER 48 -8.625 26.545 -38.364 377 HB2 SER 48 HB2 SER 48 -9.256 26.164 -41.298 378 HB3 SER 48 HB1 SER 48 -10.237 27.071 -40.143 379 HG SER 48 HG SER 48 -7.892 28.087 -39.856 380 H CYS 49 HN CYS 49 -8.376 24.216 -37.408 381 HA CYS 49 HA CYS 49 -10.260 22.289 -38.382 382 HB2 CYS 49 HB2 CYS 49 -9.807 21.243 -36.077 383 HB3 CYS 49 HB1 CYS 49 -8.453 21.361 -37.196 384 HG CYS 49 HG CYS 49 -6.901 22.736 -35.675 385 H GLY 50 HN GLY 50 -12.370 22.599 -38.275 386 HA2 GLY 50 HA2 GLY 50 -13.476 24.618 -36.552 387 HA3 GLY 50 HA1 GLY 50 -14.355 23.640 -37.714 388 H CYS 51 HN CYS 51 -13.798 21.084 -36.769 389 HA CYS 51 HA CYS 51 -15.333 21.174 -34.260 390 HB2 CYS 51 HB2 CYS 51 -15.185 18.930 -36.278 391 HB3 CYS 51 HB1 CYS 51 -16.261 19.026 -34.888 392 HG CYS 51 HG CYS 51 -16.758 21.717 -36.639 393 H GLY 52 HN GLY 52 -13.878 21.038 -32.650 394 HA2 GLY 52 HA2 GLY 52 -12.518 19.949 -31.150 395 HA3 GLY 52 HA1 GLY 52 -12.697 18.498 -32.126 396 H THR 53 HN THR 53 -11.171 17.996 -33.659 397 HA THR 53 HA THR 53 -9.015 19.828 -34.193 398 HB THR 53 HB THR 53 -8.253 18.842 -32.089 399 HG1 THR 53 HG1 THR 53 -6.622 19.296 -33.553 400 HG21 THR 53 HG21 THR 53 -9.464 16.714 -32.188 401 HG22 THR 53 HG22 THR 53 -7.741 16.454 -31.915 402 HG23 THR 53 HG23 THR 53 -8.431 16.184 -33.516 403 H SER 54 HN SER 54 -8.127 19.489 -36.117 404 HA SER 54 HA SER 54 -8.387 16.936 -37.475 405 HB2 SER 54 HB2 SER 54 -9.487 19.522 -38.625 406 HB3 SER 54 HB1 SER 54 -9.331 18.005 -39.509 407 HG SER 54 HG SER 54 -11.434 18.200 -38.733 408 H PHE 55 HN PHE 55 -6.446 16.514 -38.317 409 HA PHE 55 HA PHE 55 -4.644 18.784 -38.837 410 HB2 PHE 55 HB2 PHE 55 -3.957 15.926 -38.112 411 HB3 PHE 55 HB1 PHE 55 -2.789 17.194 -38.447 412 HD1 PHE 55 HD1 PHE 55 -2.889 19.279 -36.919 413 HD2 PHE 55 HD2 PHE 55 -4.651 15.528 -35.955 414 HE1 PHE 55 HE1 PHE 55 -2.852 19.880 -34.535 415 HE2 PHE 55 HE2 PHE 55 -4.621 16.122 -33.568 416 HZ PHE 55 HZ PHE 55 -3.720 18.301 -32.854 417 H ASP 56 HN ASP 56 -3.784 19.017 -40.828 418 HA ASP 56 HA ASP 56 -4.092 16.802 -42.743 419 HB2 ASP 56 HB2 ASP 56 -4.850 19.122 -43.425 420 HB3 ASP 56 HB1 ASP 56 -3.167 19.631 -43.319 421 H ALA 57 HN ALA 57 -2.401 15.463 -42.756 422 HA ALA 57 HA ALA 57 0.169 16.522 -41.796 423 HB1 ALA 57 HB1 ALA 57 -0.811 14.748 -40.433 424 HB2 ALA 57 HB2 ALA 57 0.708 14.229 -41.167 425 HB3 ALA 57 HB3 ALA 57 -0.829 13.678 -41.836 426 H VAL 58 HN VAL 58 1.635 16.882 -43.281 427 HA VAL 58 HA VAL 58 1.535 15.722 -45.894 428 HB VAL 58 HB VAL 58 3.831 17.205 -44.588 429 HG11 VAL 58 HG11 VAL 58 4.493 15.948 -46.566 430 HG12 VAL 58 HG12 VAL 58 4.517 17.680 -46.896 431 HG13 VAL 58 HG13 VAL 58 3.186 16.688 -47.491 432 HG21 VAL 58 HG21 VAL 58 2.968 19.195 -45.733 433 HG22 VAL 58 HG22 VAL 58 1.816 18.568 -44.555 434 HG23 VAL 58 HG23 VAL 58 1.567 18.269 -46.275 435 H ILE 59 HN ILE 59 1.997 13.675 -46.208 436 HA ILE 59 HA ILE 59 4.037 12.404 -44.526 437 HB ILE 59 HB ILE 59 1.869 11.375 -44.279 438 HG12 ILE 59 HG12 ILE 59 4.063 9.967 -44.525 439 HG13 ILE 59 HG11 ILE 59 2.507 9.158 -44.424 440 HG21 ILE 59 HG21 ILE 59 1.866 10.975 -47.261 441 HG22 ILE 59 HG22 ILE 59 0.805 12.030 -46.328 442 HG23 ILE 59 HG23 ILE 59 0.695 10.278 -46.140 443 HD11 ILE 59 HD11 ILE 59 2.495 8.891 -46.854 444 HD12 ILE 59 HD12 ILE 59 3.913 8.144 -46.116 445 HD13 ILE 59 HD13 ILE 59 4.062 9.695 -46.944 446 H VAL 60 HN VAL 60 5.899 12.499 -45.480 447 HA VAL 60 HA VAL 60 6.080 11.901 -48.354 448 HB VAL 60 HB VAL 60 8.126 13.220 -46.547 449 HG11 VAL 60 HG11 VAL 60 9.338 13.718 -48.615 450 HG12 VAL 60 HG12 VAL 60 8.146 12.799 -49.533 451 HG13 VAL 60 HG13 VAL 60 9.175 11.981 -48.358 452 HG21 VAL 60 HG21 VAL 60 6.357 14.425 -48.674 453 HG22 VAL 60 HG22 VAL 60 7.621 15.272 -47.780 454 HG23 VAL 60 HG23 VAL 60 6.199 14.662 -46.932 455 H SER 61 HN SER 61 6.349 9.744 -48.570 456 HA SER 61 HA SER 61 8.485 8.466 -47.046 457 HB2 SER 61 HB2 SER 61 6.572 8.059 -45.635 458 HB3 SER 61 HB1 SER 61 5.607 7.536 -47.013 459 HG SER 61 HG SER 61 7.499 6.158 -45.537 460 H ASN 62 HN ASN 62 9.252 6.539 -47.943 461 HA ASN 62 HA ASN 62 9.074 6.270 -50.754 462 HB2 ASN 62 HB2 ASN 62 10.146 4.324 -48.703 463 HB3 ASN 62 HB1 ASN 62 10.439 4.249 -50.439 464 HD21 ASN 62 HD21 ASN 62 11.609 5.975 -51.412 465 HD22 ASN 62 HD22 ASN 62 12.777 6.863 -50.488 466 H ASN 63 HN ASN 63 7.192 5.090 -48.163 467 HA ASN 63 HA ASN 63 6.150 2.736 -49.315 468 HB2 ASN 63 HB2 ASN 63 5.900 3.440 -46.916 469 HB3 ASN 63 HB1 ASN 63 4.718 4.633 -47.439 470 HD21 ASN 63 HD21 ASN 63 3.071 3.709 -46.245 471 HD22 ASN 63 HD22 ASN 63 2.340 2.205 -46.680 472 H PHE 64 HN PHE 64 5.697 6.034 -50.088 473 HA PHE 64 HA PHE 64 3.130 5.563 -51.385 474 HB2 PHE 64 HB2 PHE 64 3.433 7.617 -50.049 475 HB3 PHE 64 HB1 PHE 64 4.725 8.122 -51.133 476 HD1 PHE 64 HD2 PHE 64 1.155 7.042 -51.282 477 HD2 PHE 64 HD1 PHE 64 4.199 9.590 -52.817 478 HE1 PHE 64 HE2 PHE 64 -0.498 8.130 -52.747 479 HE2 PHE 64 HE1 PHE 64 2.555 10.684 -54.281 480 HZ PHE 64 HZ PHE 64 0.201 9.952 -54.248 481 H GLU 65 HN GLU 65 6.479 5.627 -52.210 482 HA GLU 65 HA GLU 65 6.145 6.602 -54.876 483 HB2 GLU 65 HB2 GLU 65 8.434 6.005 -55.282 484 HB3 GLU 65 HB1 GLU 65 8.325 6.716 -53.679 485 HG2 GLU 65 HG2 GLU 65 8.451 4.521 -52.668 486 HG3 GLU 65 HG1 GLU 65 8.473 3.768 -54.262 487 H ASP 66 HN ASP 66 5.697 3.572 -53.356 488 HA ASP 66 HA ASP 66 5.848 1.912 -55.653 489 HB2 ASP 66 HB2 ASP 66 4.426 1.606 -53.009 490 HB3 ASP 66 HB1 ASP 66 4.362 0.375 -54.267 491 H LYS 67 HN LYS 67 3.563 4.176 -54.515 492 HA LYS 67 HA LYS 67 1.643 5.017 -55.377 493 HB2 LYS 67 HB2 LYS 67 3.166 4.324 -57.556 494 HB3 LYS 67 HB1 LYS 67 1.665 3.468 -57.873 495 HG2 LYS 67 HG2 LYS 67 1.702 5.668 -58.927 496 HG3 LYS 67 HG1 LYS 67 0.419 5.545 -57.722 497 HD2 LYS 67 HD2 LYS 67 1.642 7.700 -57.627 498 HD3 LYS 67 HD1 LYS 67 1.730 6.784 -56.123 499 HE2 LYS 67 HE2 LYS 67 3.893 7.734 -56.639 500 HE3 LYS 67 HE1 LYS 67 3.965 5.979 -56.770 501 HZ1 LYS 67 HZ1 LYS 67 3.771 7.912 -59.020 502 HZ2 LYS 67 HZ2 LYS 67 3.741 6.223 -59.195 503 HZ3 LYS 67 HZ3 LYS 67 5.129 6.990 -58.593 504 H LYS 68 HN LYS 68 1.828 2.305 -54.043 505 HA LYS 68 HA LYS 68 -0.351 0.768 -55.126 506 HB2 LYS 68 HB2 LYS 68 1.043 0.497 -52.455 507 HB3 LYS 68 HB1 LYS 68 0.009 -0.702 -53.215 508 HG2 LYS 68 HG2 LYS 68 2.618 0.260 -54.363 509 HG3 LYS 68 HG1 LYS 68 2.433 -1.194 -53.381 510 HD2 LYS 68 HD2 LYS 68 0.976 -0.686 -55.971 511 HD3 LYS 68 HD1 LYS 68 2.469 -1.617 -55.833 512 HE2 LYS 68 HE2 LYS 68 1.349 -3.193 -54.337 513 HE3 LYS 68 HE1 LYS 68 -0.139 -2.256 -54.458 514 HZ1 LYS 68 HZ1 LYS 68 -0.156 -4.181 -55.928 515 HZ2 LYS 68 HZ2 LYS 68 1.229 -3.611 -56.722 516 HZ3 LYS 68 HZ3 LYS 68 -0.223 -2.738 -56.815 517 H LEU 69 HN LEU 69 -2.307 1.719 -55.002 518 HA LEU 69 HA LEU 69 -3.042 3.500 -52.926 519 HB2 LEU 69 HB2 LEU 69 -5.276 3.465 -53.922 520 HB3 LEU 69 HB1 LEU 69 -4.027 3.698 -55.125 521 HG LEU 69 HG LEU 69 -4.336 1.029 -55.329 522 HD11 LEU 69 HD11 LEU 69 -7.066 2.078 -54.590 523 HD12 LEU 69 HD12 LEU 69 -6.105 0.942 -53.641 524 HD13 LEU 69 HD13 LEU 69 -6.706 0.477 -55.233 525 HD21 LEU 69 HD21 LEU 69 -6.034 3.121 -56.677 526 HD22 LEU 69 HD22 LEU 69 -5.752 1.485 -57.271 527 HD23 LEU 69 HD23 LEU 69 -4.413 2.627 -57.160 528 H LEU 70 HN LEU 70 -3.804 0.101 -53.550 529 HA LEU 70 HA LEU 70 -5.543 -0.142 -51.342 530 HB2 LEU 70 HB2 LEU 70 -5.563 -2.501 -51.732 531 HB3 LEU 70 HB1 LEU 70 -5.651 -1.664 -53.258 532 HG LEU 70 HG LEU 70 -4.315 -3.540 -53.646 533 HD11 LEU 70 HD11 LEU 70 -2.101 -2.716 -54.190 534 HD12 LEU 70 HD12 LEU 70 -2.385 -1.281 -53.208 535 HD13 LEU 70 HD13 LEU 70 -3.358 -1.568 -54.652 536 HD21 LEU 70 HD21 LEU 70 -3.902 -4.208 -51.366 537 HD22 LEU 70 HD22 LEU 70 -2.745 -2.893 -51.164 538 HD23 LEU 70 HD23 LEU 70 -2.399 -4.207 -52.289 539 H ASP 71 HN ASP 71 -2.079 -0.411 -51.651 540 HA ASP 71 HA ASP 71 -1.721 -1.757 -49.159 541 HB2 ASP 71 HB2 ASP 71 0.149 -0.431 -51.083 542 HB3 ASP 71 HB1 ASP 71 0.712 -0.860 -49.469 543 H ARG 72 HN ARG 72 -1.413 1.656 -50.169 544 HA ARG 72 HA ARG 72 -0.768 2.523 -47.545 545 HB2 ARG 72 HB2 ARG 72 -1.228 4.781 -48.304 546 HB3 ARG 72 HB1 ARG 72 -0.286 3.918 -49.506 547 HG2 ARG 72 HG2 ARG 72 -2.249 3.625 -50.887 548 HG3 ARG 72 HG1 ARG 72 -3.259 4.382 -49.650 549 HD2 ARG 72 HD2 ARG 72 -1.969 6.457 -49.880 550 HD3 ARG 72 HD1 ARG 72 -0.982 5.701 -51.129 551 HE ARG 72 HE ARG 72 -3.219 5.473 -52.349 552 HH11 ARG 72 HH11 ARG 72 -2.435 8.097 -50.176 553 HH12 ARG 72 HH12 ARG 72 -3.461 9.245 -50.977 554 HH21 ARG 72 HH21 ARG 72 -4.538 6.991 -53.447 555 HH22 ARG 72 HH22 ARG 72 -4.639 8.625 -52.849 556 H HIS 73 HN HIS 73 -3.761 1.920 -49.233 557 HA HIS 73 HA HIS 73 -5.542 3.074 -47.377 558 HB2 HIS 73 HB2 HIS 73 -6.228 2.397 -49.630 559 HB3 HIS 73 HB1 HIS 73 -5.915 0.712 -49.238 560 HD1 HIS 73 HD1 HIS 73 -8.287 3.528 -48.305 561 HD2 HIS 73 HD2 HIS 73 -8.038 -0.625 -48.159 562 HE1 HIS 73 HE1 HIS 73 -10.573 2.731 -47.625 563 HE2 HIS 73 HE2 HIS 73 -10.346 0.234 -47.362 564 H ARG 74 HN ARG 74 -4.327 -0.268 -47.683 565 HA ARG 74 HA ARG 74 -5.764 -1.278 -45.481 566 HB2 ARG 74 HB2 ARG 74 -4.521 -3.272 -45.742 567 HB3 ARG 74 HB1 ARG 74 -4.660 -2.601 -47.359 568 HG2 ARG 74 HG2 ARG 74 -2.327 -1.521 -46.676 569 HG3 ARG 74 HG1 ARG 74 -2.281 -2.943 -45.638 570 HD2 ARG 74 HD2 ARG 74 -2.702 -2.946 -48.621 571 HD3 ARG 74 HD1 ARG 74 -1.195 -3.332 -47.799 572 HE ARG 74 HE ARG 74 -3.365 -4.989 -46.936 573 HH11 ARG 74 HH11 ARG 74 -0.903 -4.527 -49.407 574 HH12 ARG 74 HH12 ARG 74 -0.929 -6.187 -49.912 575 HH21 ARG 74 HH21 ARG 74 -3.387 -7.185 -47.620 576 HH22 ARG 74 HH22 ARG 74 -2.306 -7.695 -48.890 577 H LEU 75 HN LEU 75 -2.521 0.119 -45.734 578 HA LEU 75 HA LEU 75 -1.716 -0.446 -43.081 579 HB2 LEU 75 HB2 LEU 75 -0.753 1.234 -45.298 580 HB3 LEU 75 HB1 LEU 75 -0.322 1.812 -43.702 581 HG LEU 75 HG LEU 75 1.462 0.450 -44.632 582 HD11 LEU 75 HD11 LEU 75 0.026 -0.938 -42.376 583 HD12 LEU 75 HD12 LEU 75 1.143 0.420 -42.223 584 HD13 LEU 75 HD13 LEU 75 1.726 -1.142 -42.799 585 HD21 LEU 75 HD21 LEU 75 -0.569 -1.774 -44.722 586 HD22 LEU 75 HD22 LEU 75 1.154 -1.933 -45.054 587 HD23 LEU 75 HD23 LEU 75 0.138 -0.958 -46.116 588 H VAL 76 HN VAL 76 -3.028 2.518 -44.553 589 HA VAL 76 HA VAL 76 -3.046 4.069 -42.238 590 HB VAL 76 HB VAL 76 -4.779 4.200 -44.704 591 HG11 VAL 76 HG11 VAL 76 -4.672 6.180 -42.429 592 HG12 VAL 76 HG12 VAL 76 -6.052 5.170 -42.863 593 HG13 VAL 76 HG13 VAL 76 -5.496 6.427 -43.968 594 HG21 VAL 76 HG21 VAL 76 -2.486 5.895 -43.719 595 HG22 VAL 76 HG22 VAL 76 -3.401 6.173 -45.201 596 HG23 VAL 76 HG23 VAL 76 -2.423 4.716 -45.028 597 H ASN 77 HN ASN 77 -5.594 1.944 -43.552 598 HA ASN 77 HA ASN 77 -7.506 2.614 -41.596 599 HB2 ASN 77 HB2 ASN 77 -7.203 0.078 -43.211 600 HB3 ASN 77 HB1 ASN 77 -8.594 0.435 -42.196 601 HD21 ASN 77 HD21 ASN 77 -8.465 3.326 -42.936 602 HD22 ASN 77 HD22 ASN 77 -9.122 3.402 -44.528 603 H THR 78 HN THR 78 -4.995 0.119 -41.632 604 HA THR 78 HA THR 78 -5.883 -1.356 -39.435 605 HB THR 78 HB THR 78 -3.032 -0.958 -40.361 606 HG1 THR 78 HG1 THR 78 -4.251 -1.829 -42.022 607 HG21 THR 78 HG21 THR 78 -3.149 -1.903 -38.105 608 HG22 THR 78 HG22 THR 78 -2.594 -3.106 -39.269 609 HG23 THR 78 HG23 THR 78 -4.256 -3.150 -38.680 610 H ILE 79 HN ILE 79 -3.415 1.252 -39.478 611 HA ILE 79 HA ILE 79 -3.315 1.167 -36.564 612 HB ILE 79 HB ILE 79 -1.771 2.898 -38.510 613 HG12 ILE 79 HG12 ILE 79 0.150 1.428 -37.547 614 HG13 ILE 79 HG11 ILE 79 -1.141 0.321 -37.093 615 HG21 ILE 79 HG21 ILE 79 -1.998 4.033 -36.385 616 HG22 ILE 79 HG22 ILE 79 -0.342 3.459 -36.587 617 HG23 ILE 79 HG23 ILE 79 -1.455 2.590 -35.528 618 HD11 ILE 79 HD11 ILE 79 -0.129 -0.309 -39.204 619 HD12 ILE 79 HD12 ILE 79 -0.526 1.270 -39.883 620 HD13 ILE 79 HD13 ILE 79 -1.815 0.155 -39.432 621 H LEU 80 HN LEU 80 -4.159 3.482 -39.110 622 HA LEU 80 HA LEU 80 -4.709 5.547 -37.231 623 HB2 LEU 80 HB2 LEU 80 -5.162 5.339 -40.192 624 HB3 LEU 80 HB1 LEU 80 -5.702 6.724 -39.263 625 HG LEU 80 HG LEU 80 -3.297 7.036 -38.533 626 HD11 LEU 80 HD11 LEU 80 -1.560 6.033 -39.915 627 HD12 LEU 80 HD12 LEU 80 -2.776 5.082 -40.767 628 HD13 LEU 80 HD13 LEU 80 -2.476 4.798 -39.052 629 HD21 LEU 80 HD21 LEU 80 -3.929 7.255 -41.471 630 HD22 LEU 80 HD22 LEU 80 -2.645 8.119 -40.624 631 HD23 LEU 80 HD23 LEU 80 -4.334 8.436 -40.225 632 H LYS 81 HN LYS 81 -6.520 2.841 -38.135 633 HA LYS 81 HA LYS 81 -9.133 3.767 -37.875 634 HB2 LYS 81 HB2 LYS 81 -8.633 1.408 -38.296 635 HB3 LYS 81 HB1 LYS 81 -7.910 1.257 -36.702 636 HG2 LYS 81 HG2 LYS 81 -10.127 0.285 -36.739 637 HG3 LYS 81 HG1 LYS 81 -10.081 1.687 -35.668 638 HD2 LYS 81 HD2 LYS 81 -12.116 1.685 -37.010 639 HD3 LYS 81 HD1 LYS 81 -11.092 3.059 -37.431 640 HE2 LYS 81 HE2 LYS 81 -10.289 1.893 -39.396 641 HE3 LYS 81 HE1 LYS 81 -11.214 0.459 -38.953 642 HZ1 LYS 81 HZ1 LYS 81 -12.300 1.809 -40.669 643 HZ2 LYS 81 HZ2 LYS 81 -12.404 3.106 -39.581 644 HZ3 LYS 81 HZ3 LYS 81 -13.244 1.668 -39.271 645 H GLU 82 HN GLU 82 -7.002 2.613 -35.271 646 HA GLU 82 HA GLU 82 -8.655 3.592 -33.183 647 HB2 GLU 82 HB2 GLU 82 -5.740 2.761 -33.241 648 HB3 GLU 82 HB1 GLU 82 -6.600 3.174 -31.766 649 HG2 GLU 82 HG2 GLU 82 -7.607 1.035 -33.597 650 HG3 GLU 82 HG1 GLU 82 -6.354 0.704 -32.400 651 H GLU 83 HN GLU 83 -5.927 4.876 -34.981 652 HA GLU 83 HA GLU 83 -5.273 7.131 -33.514 653 HB2 GLU 83 HB2 GLU 83 -4.292 6.202 -35.680 654 HB3 GLU 83 HB1 GLU 83 -5.551 7.104 -36.509 655 HG2 GLU 83 HG2 GLU 83 -3.862 8.583 -36.614 656 HG3 GLU 83 HG1 GLU 83 -4.594 9.089 -35.094 657 H LEU 84 HN LEU 84 -7.624 6.913 -36.155 658 HA LEU 84 HA LEU 84 -8.644 9.456 -36.170 659 HB2 LEU 84 HB2 LEU 84 -10.160 6.900 -36.677 660 HB3 LEU 84 HB1 LEU 84 -10.739 8.498 -37.095 661 HG LEU 84 HG LEU 84 -8.379 7.047 -38.271 662 HD11 LEU 84 HD11 LEU 84 -10.535 6.341 -39.128 663 HD12 LEU 84 HD12 LEU 84 -9.643 7.246 -40.350 664 HD13 LEU 84 HD13 LEU 84 -10.963 8.017 -39.472 665 HD21 LEU 84 HD21 LEU 84 -7.805 9.397 -38.002 666 HD22 LEU 84 HD22 LEU 84 -9.306 9.867 -38.798 667 HD23 LEU 84 HD23 LEU 84 -8.063 9.002 -39.701 668 H GLN 85 HN GLN 85 -9.352 6.946 -33.846 669 HA GLN 85 HA GLN 85 -11.840 7.779 -32.927 670 HB2 GLN 85 HB2 GLN 85 -9.616 6.642 -31.227 671 HB3 GLN 85 HB1 GLN 85 -11.323 6.667 -30.820 672 HG2 GLN 85 HG2 GLN 85 -9.889 4.989 -32.835 673 HG3 GLN 85 HG1 GLN 85 -10.932 4.489 -31.506 674 HE21 GLN 85 HE21 GLN 85 -10.748 5.446 -34.776 675 HE22 GLN 85 HE22 GLN 85 -12.417 5.276 -35.157 676 H ASN 86 HN ASN 86 -8.736 9.260 -32.483 677 HA ASN 86 HA ASN 86 -9.822 10.997 -30.368 678 HB2 ASN 86 HB2 ASN 86 -6.931 10.585 -31.168 679 HB3 ASN 86 HB1 ASN 86 -7.508 11.542 -29.808 680 HD21 ASN 86 HD21 ASN 86 -6.804 8.393 -31.003 681 HD22 ASN 86 HD22 ASN 86 -7.086 7.539 -29.526 682 H ILE 87 HN ILE 87 -9.809 11.052 -33.540 683 HA ILE 87 HA ILE 87 -9.196 13.937 -33.717 684 HB ILE 87 HB ILE 87 -8.772 12.041 -36.030 685 HG12 ILE 87 HG12 ILE 87 -6.677 12.995 -34.064 686 HG13 ILE 87 HG11 ILE 87 -7.269 11.344 -34.218 687 HG21 ILE 87 HG21 ILE 87 -7.388 13.872 -36.900 688 HG22 ILE 87 HG22 ILE 87 -7.764 14.828 -35.467 689 HG23 ILE 87 HG23 ILE 87 -9.047 14.388 -36.596 690 HD11 ILE 87 HD11 ILE 87 -5.112 11.604 -35.288 691 HD12 ILE 87 HD12 ILE 87 -5.763 12.876 -36.322 692 HD13 ILE 87 HD13 ILE 87 -6.361 11.223 -36.473 693 H HIS 88 HN HIS 88 -10.534 15.089 -35.289 694 HA HIS 88 HA HIS 88 -13.108 13.802 -35.691 695 HB2 HIS 88 HB2 HIS 88 -13.012 16.163 -34.938 696 HB3 HIS 88 HB1 HIS 88 -12.234 16.599 -36.457 697 HD1 HIS 88 HD1 HIS 88 -15.532 15.369 -35.091 698 HD2 HIS 88 HD2 HIS 88 -13.943 16.956 -38.594 699 HE1 HIS 88 HE1 HIS 88 -17.505 15.873 -36.567 700 HE2 HIS 88 HE2 HIS 88 -16.489 16.534 -38.775 701 H ALA 89 HN ALA 89 -10.852 15.597 -37.803 702 HA ALA 89 HA ALA 89 -11.338 13.575 -39.867 703 HB1 ALA 89 HB1 ALA 89 -12.845 15.441 -40.352 704 HB2 ALA 89 HB2 ALA 89 -11.605 15.268 -41.593 705 HB3 ALA 89 HB3 ALA 89 -11.468 16.542 -40.382 706 H PHE 90 HN PHE 90 -9.314 12.720 -39.621 707 HA PHE 90 HA PHE 90 -6.986 14.428 -39.848 708 HB2 PHE 90 HB2 PHE 90 -6.933 12.430 -38.399 709 HB3 PHE 90 HB1 PHE 90 -7.190 11.408 -39.809 710 HD1 PHE 90 HD1 PHE 90 -4.818 13.750 -38.213 711 HD2 PHE 90 HD2 PHE 90 -5.388 10.756 -41.187 712 HE1 PHE 90 HE1 PHE 90 -2.385 13.631 -38.557 713 HE2 PHE 90 HE2 PHE 90 -2.956 10.634 -41.532 714 HZ PHE 90 HZ PHE 90 -1.453 12.072 -40.217 715 H SER 91 HN SER 91 -6.243 15.117 -41.720 716 HA SER 91 HA SER 91 -6.726 13.493 -44.132 717 HB2 SER 91 HB2 SER 91 -6.199 16.473 -43.926 718 HB3 SER 91 HB1 SER 91 -6.531 15.577 -45.410 719 HG SER 91 HG SER 91 -8.515 14.951 -43.917 720 H MET 92 HN MET 92 -4.957 13.466 -45.710 721 HA MET 92 HA MET 92 -2.343 14.090 -44.552 722 HB2 MET 92 HB2 MET 92 -1.415 11.956 -45.211 723 HB3 MET 92 HB1 MET 92 -2.789 11.691 -44.150 724 HG2 MET 92 HG2 MET 92 -2.925 11.502 -47.149 725 HG3 MET 92 HG1 MET 92 -2.623 10.131 -46.087 726 HE1 MET 92 HE1 MET 92 -5.969 9.849 -44.102 727 HE2 MET 92 HE2 MET 92 -4.505 10.704 -43.619 728 HE3 MET 92 HE3 MET 92 -4.388 9.132 -44.409 729 H LYS 93 HN LYS 93 -0.886 14.876 -45.939 730 HA LYS 93 HA LYS 93 -1.686 15.120 -48.760 731 HB2 LYS 93 HB2 LYS 93 -1.106 17.158 -47.272 732 HB3 LYS 93 HB1 LYS 93 0.560 16.611 -47.398 733 HG2 LYS 93 HG2 LYS 93 0.172 18.331 -49.013 734 HG3 LYS 93 HG1 LYS 93 0.399 16.799 -49.854 735 HD2 LYS 93 HD2 LYS 93 -1.420 18.007 -50.881 736 HD3 LYS 93 HD1 LYS 93 -2.059 16.587 -50.056 737 HE2 LYS 93 HE2 LYS 93 -2.010 19.284 -48.732 738 HE3 LYS 93 HE1 LYS 93 -3.321 18.816 -49.810 739 HZ1 LYS 93 HZ1 LYS 93 -3.639 16.838 -48.343 740 HZ2 LYS 93 HZ2 LYS 93 -3.992 18.318 -47.605 741 HZ3 LYS 93 HZ3 LYS 93 -2.543 17.528 -47.250 742 H CYS 94 HN CYS 94 -0.807 13.574 -50.010 743 HA CYS 94 HA CYS 94 1.409 12.036 -48.942 744 HB2 CYS 94 HB2 CYS 94 -0.185 11.523 -51.455 745 HB3 CYS 94 HB1 CYS 94 0.813 10.373 -50.570 746 HG CYS 94 HG CYS 94 -2.263 11.579 -49.761 747 H HIS 95 HN HIS 95 3.451 12.209 -49.583 748 HA HIS 95 HA HIS 95 4.041 12.833 -52.364 749 HB2 HIS 95 HB2 HIS 95 5.009 14.516 -50.060 750 HB3 HIS 95 HB1 HIS 95 5.909 14.412 -51.566 751 HD1 HIS 95 HD1 HIS 95 4.152 14.938 -53.766 752 HD2 HIS 95 HD2 HIS 95 3.402 16.663 -50.048 753 HE1 HIS 95 HE1 HIS 95 2.703 16.940 -54.219 754 HE2 HIS 95 HE2 HIS 95 2.518 18.115 -52.000 755 H THR 96 HN THR 96 6.252 12.353 -52.937 756 HA THR 96 HA THR 96 7.461 10.335 -51.168 757 HB THR 96 HB THR 96 8.683 9.641 -53.275 758 HG1 THR 96 HG1 THR 96 6.731 11.381 -54.451 759 HG21 THR 96 HG21 THR 96 6.780 8.390 -52.421 760 HG22 THR 96 HG22 THR 96 6.764 8.420 -54.185 761 HG23 THR 96 HG23 THR 96 5.672 9.466 -53.274 762 HA PRO 97 HA PRO 97 11.149 12.722 -50.513 763 HB2 PRO 97 HB2 PRO 97 13.104 10.854 -51.118 764 HB3 PRO 97 HB1 PRO 97 12.287 10.998 -49.559 765 HG2 PRO 97 HG2 PRO 97 11.747 9.123 -51.817 766 HG3 PRO 97 HG1 PRO 97 11.694 8.823 -50.071 767 HD2 PRO 97 HD2 PRO 97 9.454 9.157 -51.513 768 HD3 PRO 97 HD1 PRO 97 9.588 9.758 -49.846 769 H LEU 98 HN LEU 98 10.769 10.942 -53.498 770 HA LEU 98 HA LEU 98 12.796 12.174 -55.007 771 HB2 LEU 98 HB2 LEU 98 10.154 10.968 -55.832 772 HB3 LEU 98 HB1 LEU 98 11.325 11.573 -56.984 773 HG LEU 98 HG LEU 98 11.598 9.225 -56.911 774 HD11 LEU 98 HD11 LEU 98 13.884 8.954 -56.091 775 HD12 LEU 98 HD12 LEU 98 13.754 10.487 -55.228 776 HD13 LEU 98 HD13 LEU 98 13.680 10.456 -56.990 777 HD21 LEU 98 HD21 LEU 98 11.787 9.435 -53.909 778 HD22 LEU 98 HD22 LEU 98 12.004 7.965 -54.858 779 HD23 LEU 98 HD23 LEU 98 10.434 8.769 -54.823 780 H GLU 99 HN GLU 99 9.343 12.932 -54.676 781 HA GLU 99 HA GLU 99 9.322 15.282 -56.207 782 HB2 GLU 99 HB2 GLU 99 7.647 14.556 -53.798 783 HB3 GLU 99 HB1 GLU 99 7.286 15.855 -54.925 784 HG2 GLU 99 HG2 GLU 99 6.834 14.349 -56.674 785 HG3 GLU 99 HG1 GLU 99 7.537 12.993 -55.785 786 H TYR 100 HN TYR 100 9.812 14.761 -52.740 787 HA TYR 100 HA TYR 100 9.992 17.451 -51.985 788 HB2 TYR 100 HB2 TYR 100 9.661 15.595 -50.395 789 HB3 TYR 100 HB1 TYR 100 11.310 15.055 -50.689 790 HD1 TYR 100 HD1 TYR 100 9.572 18.241 -49.777 791 HD2 TYR 100 HD2 TYR 100 12.843 15.616 -49.064 792 HE1 TYR 100 HE1 TYR 100 10.357 19.719 -47.978 793 HE2 TYR 100 HE2 TYR 100 13.635 17.086 -47.258 794 HH TYR 100 HH TYR 100 11.732 19.574 -45.949 795 H ASP 101 HN ASP 101 12.469 15.190 -53.100 796 HA ASP 101 HA ASP 101 14.717 16.772 -52.556 797 HB2 ASP 101 HB2 ASP 101 14.926 14.419 -53.147 798 HB3 ASP 101 HB1 ASP 101 14.293 14.741 -54.758 799 H LYS 102 HN LYS 102 12.514 16.718 -55.300 800 HA LYS 102 HA LYS 102 14.034 18.557 -56.873 801 HB2 LYS 102 HB2 LYS 102 11.399 17.240 -57.079 802 HB3 LYS 102 HB1 LYS 102 11.517 18.805 -57.866 803 HG2 LYS 102 HG2 LYS 102 12.158 17.509 -59.600 804 HG3 LYS 102 HG1 LYS 102 13.735 17.719 -58.845 805 HD2 LYS 102 HD2 LYS 102 11.938 15.378 -58.243 806 HD3 LYS 102 HD1 LYS 102 13.111 15.364 -59.558 807 HE2 LYS 102 HE2 LYS 102 13.706 15.744 -56.628 808 HE3 LYS 102 HE1 LYS 102 14.018 14.292 -57.576 809 HZ1 LYS 102 HZ1 LYS 102 15.256 16.938 -58.081 810 HZ2 LYS 102 HZ2 LYS 102 15.615 15.497 -58.890 811 HZ3 LYS 102 HZ3 LYS 102 15.999 15.670 -57.240 812 H LEU 103 HN LEU 103 11.515 18.822 -54.462 813 HA LEU 103 HA LEU 103 10.862 21.534 -54.845 814 HB2 LEU 103 HB2 LEU 103 10.789 19.912 -52.299 815 HB3 LEU 103 HB1 LEU 103 9.988 21.451 -52.545 816 HG LEU 103 HG LEU 103 9.357 18.874 -53.986 817 HD11 LEU 103 HD11 LEU 103 7.247 18.982 -52.760 818 HD12 LEU 103 HD12 LEU 103 7.818 20.414 -51.902 819 HD13 LEU 103 HD13 LEU 103 8.627 18.864 -51.670 820 HD21 LEU 103 HD21 LEU 103 8.039 21.579 -54.177 821 HD22 LEU 103 HD22 LEU 103 7.473 20.095 -54.944 822 HD23 LEU 103 HD23 LEU 103 9.012 20.808 -55.428 823 H LYS 104 HN LYS 104 13.299 19.961 -52.799 824 HA LYS 104 HA LYS 104 14.317 22.309 -51.598 825 HB2 LYS 104 HB2 LYS 104 16.228 20.134 -52.302 826 HB3 LYS 104 HB1 LYS 104 16.063 21.034 -50.805 827 HG2 LYS 104 HG2 LYS 104 14.133 19.708 -50.189 828 HG3 LYS 104 HG1 LYS 104 14.216 18.852 -51.732 829 HD2 LYS 104 HD2 LYS 104 16.271 18.814 -49.527 830 HD3 LYS 104 HD1 LYS 104 15.227 17.483 -50.033 831 HE2 LYS 104 HE2 LYS 104 16.311 17.562 -52.272 832 HE3 LYS 104 HE1 LYS 104 17.420 18.780 -51.650 833 HZ1 LYS 104 HZ1 LYS 104 18.436 16.610 -51.564 834 HZ2 LYS 104 HZ2 LYS 104 17.143 15.991 -50.660 835 HZ3 LYS 104 HZ3 LYS 104 18.165 17.162 -49.981 836 H SER 105 HN SER 105 15.067 20.615 -54.562 837 HA SER 105 HA SER 105 17.409 22.072 -55.191 838 HB2 SER 105 HB2 SER 105 15.621 20.383 -56.949 839 HB3 SER 105 HB1 SER 105 17.254 20.911 -57.360 840 HG SER 105 HG SER 105 16.418 19.075 -55.372 841 H LYS 106 HN LYS 106 14.368 21.987 -57.077 842 HA LYS 106 HA LYS 106 15.026 24.680 -58.032 843 HB2 LYS 106 HB2 LYS 106 13.012 24.025 -59.621 844 HB3 LYS 106 HB1 LYS 106 14.653 23.481 -59.938 845 HG2 LYS 106 HG2 LYS 106 14.185 21.316 -59.404 846 HG3 LYS 106 HG1 LYS 106 12.909 21.757 -58.266 847 HD2 LYS 106 HD2 LYS 106 11.402 22.248 -60.036 848 HD3 LYS 106 HD1 LYS 106 12.676 22.096 -61.244 849 HE2 LYS 106 HE2 LYS 106 12.817 19.754 -60.932 850 HE3 LYS 106 HE1 LYS 106 11.838 19.823 -59.468 851 HZ1 LYS 106 HZ1 LYS 106 10.797 20.559 -62.149 852 HZ2 LYS 106 HZ2 LYS 106 9.908 20.304 -60.725 853 HZ3 LYS 106 HZ3 LYS 106 10.667 18.999 -61.497 854 H GLY 107 HN GLY 107 12.505 22.842 -56.430 855 HA2 GLY 107 HA2 GLY 107 11.108 23.971 -54.801 856 HA3 GLY 107 HA1 GLY 107 11.145 25.392 -55.835 857 H SER 108 HN SER 108 10.841 22.513 -57.554 858 HA SER 108 HA SER 108 7.979 22.283 -57.416 859 HB2 SER 108 HB2 SER 108 9.271 23.198 -60.003 860 HB3 SER 108 HB1 SER 108 7.568 22.805 -59.777 861 HG SER 108 HG SER 108 8.156 24.592 -57.945 Start of MODEL 4 1 H1 MET 1 HT1 MET 1 29.666 8.398 9.615 2 H2 MET 1 HT2 MET 1 30.348 9.858 10.138 3 H3 MET 1 HT3 MET 1 28.733 9.811 9.622 4 HA MET 1 HA MET 1 29.803 8.385 11.987 5 HB2 MET 1 HB2 MET 1 28.077 10.869 11.808 6 HB3 MET 1 HB1 MET 1 28.468 10.015 13.294 7 HG2 MET 1 HG2 MET 1 30.809 10.551 13.022 8 HG3 MET 1 HG1 MET 1 30.471 11.334 11.479 9 HE1 MET 1 HE1 MET 1 27.685 12.794 12.171 10 HE2 MET 1 HE2 MET 1 28.989 13.535 11.244 11 HE3 MET 1 HE3 MET 1 28.282 14.394 12.612 12 H GLY 2 HN GLY 2 26.672 9.861 11.343 13 HA2 GLY 2 HA2 GLY 2 25.451 7.185 11.372 14 HA3 GLY 2 HA1 GLY 2 24.606 8.708 11.652 15 H SER 3 HN SER 3 25.273 6.319 9.430 16 HA SER 3 HA SER 3 25.538 7.589 6.992 17 HB2 SER 3 HB2 SER 3 24.003 5.058 7.619 18 HB3 SER 3 HB1 SER 3 24.533 5.552 6.011 19 HG SER 3 HG SER 3 26.206 4.982 8.246 20 H SER 4 HN SER 4 24.355 9.187 6.211 21 HA SER 4 HA SER 4 21.621 9.569 7.020 22 HB2 SER 4 HB2 SER 4 23.267 11.103 4.992 23 HB3 SER 4 HB1 SER 4 21.759 11.637 5.738 24 HG SER 4 HG SER 4 23.650 10.891 7.567 25 H HIS 5 HN HIS 5 19.975 8.595 6.102 26 HA HIS 5 HA HIS 5 20.269 7.625 3.339 27 HB2 HIS 5 HB2 HIS 5 18.531 6.640 5.607 28 HB3 HIS 5 HB1 HIS 5 18.375 6.071 3.948 29 HD1 HIS 5 HD1 HIS 5 19.595 4.759 6.852 30 HD2 HIS 5 HD2 HIS 5 21.403 5.434 3.166 31 HE1 HIS 5 HE1 HIS 5 21.575 3.213 6.771 32 HE2 HIS 5 HE2 HIS 5 22.752 3.767 4.611 33 H HIS 6 HN HIS 6 17.926 7.357 2.312 34 HA HIS 6 HA HIS 6 16.895 10.114 2.325 35 HB2 HIS 6 HB2 HIS 6 16.472 7.990 0.212 36 HB3 HIS 6 HB1 HIS 6 16.118 9.708 0.077 37 HD1 HIS 6 HD1 HIS 6 18.057 7.959 -1.782 38 HD2 HIS 6 HD2 HIS 6 19.188 10.619 1.212 39 HE1 HIS 6 HE1 HIS 6 20.412 8.649 -2.337 40 HE2 HIS 6 HE2 HIS 6 21.151 10.047 -0.376 41 H HIS 7 HN HIS 7 14.702 10.534 2.506 42 HA HIS 7 HA HIS 7 13.092 8.310 3.514 43 HB2 HIS 7 HB2 HIS 7 12.638 11.300 3.587 44 HB3 HIS 7 HB1 HIS 7 11.461 10.118 4.156 45 HD1 HIS 7 HD1 HIS 7 13.271 12.356 5.797 46 HD2 HIS 7 HD2 HIS 7 13.558 8.205 5.828 47 HE1 HIS 7 HE1 HIS 7 14.424 11.769 7.952 48 HE2 HIS 7 HE2 HIS 7 14.806 9.281 7.819 49 H HIS 8 HN HIS 8 10.936 7.972 2.704 50 HA HIS 8 HA HIS 8 11.026 7.889 -0.150 51 HB2 HIS 8 HB2 HIS 8 10.026 6.129 1.403 52 HB3 HIS 8 HB1 HIS 8 8.637 7.202 1.559 53 HD1 HIS 8 HD1 HIS 8 10.443 5.052 -0.929 54 HD2 HIS 8 HD2 HIS 8 6.904 7.215 -0.612 55 HE1 HIS 8 HE1 HIS 8 9.060 4.391 -2.928 56 HE2 HIS 8 HE2 HIS 8 6.858 5.582 -2.622 57 H HIS 9 HN HIS 9 10.263 9.289 -1.559 58 HA HIS 9 HA HIS 9 8.419 11.387 -0.605 59 HB2 HIS 9 HB2 HIS 9 10.397 11.506 -2.899 60 HB3 HIS 9 HB1 HIS 9 9.318 12.806 -2.415 61 HD1 HIS 9 HD1 HIS 9 12.441 13.050 -2.496 62 HD2 HIS 9 HD2 HIS 9 10.172 12.263 0.901 63 HE1 HIS 9 HE1 HIS 9 13.855 13.780 -0.549 64 HE2 HIS 9 HE2 HIS 9 12.555 13.081 1.492 65 H HIS 10 HN HIS 10 7.083 12.315 -2.520 66 HA HIS 10 HA HIS 10 5.887 10.033 -3.875 67 HB2 HIS 10 HB2 HIS 10 3.986 11.394 -4.321 68 HB3 HIS 10 HB1 HIS 10 4.465 11.735 -2.668 69 HD1 HIS 10 HD1 HIS 10 5.611 14.107 -2.255 70 HD2 HIS 10 HD2 HIS 10 3.914 13.562 -6.014 71 HE1 HIS 10 HE1 HIS 10 5.386 16.409 -3.240 72 HE2 HIS 10 HE2 HIS 10 4.205 16.072 -5.440 73 H SER 11 HN SER 11 6.460 9.473 -5.822 74 HA SER 11 HA SER 11 7.897 11.358 -7.518 75 HB2 SER 11 HB2 SER 11 7.313 8.414 -7.928 76 HB3 SER 11 HB1 SER 11 8.427 9.398 -8.878 77 HG SER 11 HG SER 11 9.664 9.702 -6.976 78 H SER 12 HN SER 12 7.300 11.452 -9.871 79 HA SER 12 HA SER 12 4.447 11.932 -10.022 80 HB2 SER 12 HB2 SER 12 6.623 12.533 -12.030 81 HB3 SER 12 HB1 SER 12 4.963 13.128 -12.092 82 HG SER 12 HG SER 12 7.092 14.060 -10.671 83 H GLY 13 HN GLY 13 6.083 9.278 -10.328 84 HA2 GLY 13 HA2 GLY 13 5.028 8.284 -12.845 85 HA3 GLY 13 HA1 GLY 13 5.972 7.369 -11.673 86 H ARG 14 HN ARG 14 3.486 9.109 -10.279 87 HA ARG 14 HA ARG 14 2.096 6.784 -9.417 88 HB2 ARG 14 HB2 ARG 14 0.501 8.552 -8.451 89 HB3 ARG 14 HB1 ARG 14 2.155 8.530 -7.852 90 HG2 ARG 14 HG2 ARG 14 2.736 10.461 -9.050 91 HG3 ARG 14 HG1 ARG 14 1.317 10.343 -10.092 92 HD2 ARG 14 HD2 ARG 14 1.085 10.773 -7.127 93 HD3 ARG 14 HD1 ARG 14 1.288 12.116 -8.253 94 HE ARG 14 HE ARG 14 -0.822 11.558 -9.237 95 HH11 ARG 14 HH11 ARG 14 -0.083 9.856 -6.247 96 HH12 ARG 14 HH12 ARG 14 -1.743 9.406 -5.961 97 HH21 ARG 14 HH21 ARG 14 -3.001 10.985 -8.823 98 HH22 ARG 14 HH22 ARG 14 -3.381 10.067 -7.394 99 H GLU 15 HN GLU 15 1.531 9.240 -11.853 100 HA GLU 15 HA GLU 15 -0.992 7.902 -12.536 101 HB2 GLU 15 HB2 GLU 15 -1.649 10.204 -13.452 102 HB3 GLU 15 HB1 GLU 15 -1.656 9.976 -11.709 103 HG2 GLU 15 HG2 GLU 15 0.646 10.985 -11.679 104 HG3 GLU 15 HG1 GLU 15 0.389 11.411 -13.372 105 H ASN 16 HN ASN 16 0.843 6.698 -13.682 106 HA ASN 16 HA ASN 16 1.595 7.851 -16.246 107 HB2 ASN 16 HB2 ASN 16 2.724 5.631 -16.577 108 HB3 ASN 16 HB1 ASN 16 3.268 6.495 -15.141 109 HD21 ASN 16 HD21 ASN 16 2.817 5.686 -13.129 110 HD22 ASN 16 HD22 ASN 16 2.149 4.118 -12.872 111 H LEU 17 HN LEU 17 -1.164 6.702 -15.114 112 HA LEU 17 HA LEU 17 -1.837 4.651 -16.980 113 HB2 LEU 17 HB2 LEU 17 -3.592 6.296 -15.162 114 HB3 LEU 17 HB1 LEU 17 -4.114 4.881 -16.057 115 HG LEU 17 HG LEU 17 -2.014 4.894 -13.886 116 HD11 LEU 17 HD11 LEU 17 -3.683 3.690 -12.569 117 HD12 LEU 17 HD12 LEU 17 -4.856 3.886 -13.872 118 HD13 LEU 17 HD13 LEU 17 -4.249 5.301 -13.011 119 HD21 LEU 17 HD21 LEU 17 -1.589 3.175 -15.552 120 HD22 LEU 17 HD22 LEU 17 -3.257 2.618 -15.427 121 HD23 LEU 17 HD23 LEU 17 -2.167 2.452 -14.052 122 H TYR 18 HN TYR 18 -2.228 8.132 -16.904 123 HA TYR 18 HA TYR 18 -4.188 8.144 -19.018 124 HB2 TYR 18 HB2 TYR 18 -2.626 10.562 -18.188 125 HB3 TYR 18 HB1 TYR 18 -4.270 10.461 -18.793 126 HD1 TYR 18 HD1 TYR 18 -5.866 8.983 -17.150 127 HD2 TYR 18 HD2 TYR 18 -2.377 11.121 -15.990 128 HE1 TYR 18 HE1 TYR 18 -6.713 9.110 -14.842 129 HE2 TYR 18 HE2 TYR 18 -3.210 11.247 -13.687 130 HH TYR 18 HH TYR 18 -5.389 11.186 -12.521 131 H PHE 19 HN PHE 19 -3.126 7.091 -20.717 132 HA PHE 19 HA PHE 19 -0.627 8.161 -21.697 133 HB2 PHE 19 HB2 PHE 19 -0.836 6.446 -23.489 134 HB3 PHE 19 HB1 PHE 19 -0.884 5.778 -21.864 135 HD1 PHE 19 HD1 PHE 19 -2.986 4.893 -20.951 136 HD2 PHE 19 HD2 PHE 19 -2.700 6.268 -24.970 137 HE1 PHE 19 HE1 PHE 19 -5.058 3.690 -21.506 138 HE2 PHE 19 HE2 PHE 19 -4.775 5.070 -25.530 139 HZ PHE 19 HZ PHE 19 -5.957 3.777 -23.795 140 H GLN 20 HN GLN 20 -3.905 8.819 -22.135 141 HA GLN 20 HA GLN 20 -3.190 10.625 -24.342 142 HB2 GLN 20 HB2 GLN 20 -5.206 10.221 -25.492 143 HB3 GLN 20 HB1 GLN 20 -4.627 8.626 -25.047 144 HG2 GLN 20 HG2 GLN 20 -6.807 10.179 -23.663 145 HG3 GLN 20 HG1 GLN 20 -7.030 8.818 -24.755 146 HE21 GLN 20 HE21 GLN 20 -6.172 9.823 -21.565 147 HE22 GLN 20 HE22 GLN 20 -6.180 8.251 -20.842 148 H GLY 21 HN GLY 21 -3.561 10.687 -21.303 149 HA2 GLY 21 HA2 GLY 21 -5.942 12.352 -21.027 150 HA3 GLY 21 HA1 GLY 21 -5.024 11.632 -19.717 151 H HIS 22 HN HIS 22 -2.450 12.591 -20.296 152 HA HIS 22 HA HIS 22 -2.884 15.490 -20.019 153 HB2 HIS 22 HB2 HIS 22 -2.516 14.042 -17.844 154 HB3 HIS 22 HB1 HIS 22 -0.825 14.143 -18.324 155 HD1 HIS 22 HD1 HIS 22 0.400 16.263 -17.738 156 HD2 HIS 22 HD2 HIS 22 -3.731 16.632 -17.378 157 HE1 HIS 22 HE1 HIS 22 0.007 18.495 -16.645 158 HE2 HIS 22 HE2 HIS 22 -2.501 18.781 -16.626 159 H MET 23 HN MET 23 -1.700 13.565 -22.106 160 HA MET 23 HA MET 23 0.831 15.035 -22.436 161 HB2 MET 23 HB2 MET 23 0.154 12.240 -23.376 162 HB3 MET 23 HB1 MET 23 1.607 13.114 -23.835 163 HG2 MET 23 HG2 MET 23 2.183 13.254 -21.404 164 HG3 MET 23 HG1 MET 23 0.827 12.175 -21.088 165 HE1 MET 23 HE1 MET 23 0.676 9.683 -22.115 166 HE2 MET 23 HE2 MET 23 1.955 8.959 -23.088 167 HE3 MET 23 HE3 MET 23 1.015 10.306 -23.730 168 H CYS 24 HN CYS 24 1.408 15.542 -24.662 169 HA CYS 24 HA CYS 24 -0.693 16.761 -26.049 170 HB2 CYS 24 HB2 CYS 24 2.063 16.022 -27.056 171 HB3 CYS 24 HB1 CYS 24 0.965 17.160 -27.831 172 HG CYS 24 HG CYS 24 1.457 19.227 -26.342 173 H ILE 25 HN ILE 25 -2.308 15.681 -26.950 174 HA ILE 25 HA ILE 25 -2.250 13.025 -27.801 175 HB ILE 25 HB ILE 25 -4.321 14.243 -27.236 176 HG12 ILE 25 HG12 ILE 25 -5.728 13.326 -29.088 177 HG13 ILE 25 HG11 ILE 25 -4.255 13.010 -29.998 178 HG21 ILE 25 HG21 ILE 25 -3.856 16.367 -28.306 179 HG22 ILE 25 HG22 ILE 25 -5.385 15.710 -28.885 180 HG23 ILE 25 HG23 ILE 25 -3.943 15.610 -29.896 181 HD11 ILE 25 HD11 ILE 25 -3.504 11.491 -28.232 182 HD12 ILE 25 HD12 ILE 25 -5.053 10.998 -28.918 183 HD13 ILE 25 HD13 ILE 25 -4.997 11.797 -27.346 184 H GLN 26 HN GLN 26 -1.487 15.979 -29.496 185 HA GLN 26 HA GLN 26 -1.530 15.055 -32.136 186 HB2 GLN 26 HB2 GLN 26 -1.295 17.429 -31.495 187 HB3 GLN 26 HB1 GLN 26 0.323 17.097 -30.893 188 HG2 GLN 26 HG2 GLN 26 1.018 16.460 -33.160 189 HG3 GLN 26 HG1 GLN 26 -0.597 16.848 -33.749 190 HE21 GLN 26 HE21 GLN 26 0.144 18.447 -35.123 191 HE22 GLN 26 HE22 GLN 26 0.729 19.973 -34.552 192 H LYS 27 HN LYS 27 1.019 14.976 -29.689 193 HA LYS 27 HA LYS 27 3.005 13.845 -31.359 194 HB2 LYS 27 HB2 LYS 27 3.702 14.994 -29.383 195 HB3 LYS 27 HB1 LYS 27 2.698 13.978 -28.360 196 HG2 LYS 27 HG2 LYS 27 5.064 13.408 -28.170 197 HG3 LYS 27 HG1 LYS 27 4.118 12.067 -28.817 198 HD2 LYS 27 HD2 LYS 27 4.814 12.920 -31.123 199 HD3 LYS 27 HD1 LYS 27 6.008 13.900 -30.267 200 HE2 LYS 27 HE2 LYS 27 7.034 11.944 -29.336 201 HE3 LYS 27 HE1 LYS 27 5.752 10.913 -29.969 202 HZ1 LYS 27 HZ1 LYS 27 7.444 10.624 -31.482 203 HZ2 LYS 27 HZ2 LYS 27 7.947 12.238 -31.413 204 HZ3 LYS 27 HZ3 LYS 27 6.519 11.834 -32.240 205 H VAL 28 HN VAL 28 0.547 12.466 -29.243 206 HA VAL 28 HA VAL 28 1.406 9.809 -29.225 207 HB VAL 28 HB VAL 28 -1.455 10.798 -29.239 208 HG11 VAL 28 HG11 VAL 28 -1.333 8.422 -29.680 209 HG12 VAL 28 HG12 VAL 28 -1.941 8.698 -28.047 210 HG13 VAL 28 HG13 VAL 28 -0.269 8.193 -28.292 211 HG21 VAL 28 HG21 VAL 28 -0.162 11.859 -27.474 212 HG22 VAL 28 HG22 VAL 28 0.415 10.283 -26.930 213 HG23 VAL 28 HG23 VAL 28 -1.295 10.690 -26.794 214 H ILE 29 HN ILE 29 -0.897 11.396 -31.425 215 HA ILE 29 HA ILE 29 -1.236 9.188 -33.145 216 HB ILE 29 HB ILE 29 -1.820 12.117 -33.382 217 HG12 ILE 29 HG12 ILE 29 -4.128 11.249 -33.751 218 HG13 ILE 29 HG11 ILE 29 -3.510 9.612 -33.573 219 HG21 ILE 29 HG21 ILE 29 -2.076 10.165 -35.665 220 HG22 ILE 29 HG22 ILE 29 -0.990 11.551 -35.591 221 HG23 ILE 29 HG23 ILE 29 -2.736 11.800 -35.634 222 HD11 ILE 29 HD11 ILE 29 -2.855 10.122 -31.276 223 HD12 ILE 29 HD12 ILE 29 -4.582 10.369 -31.542 224 HD13 ILE 29 HD13 ILE 29 -3.492 11.755 -31.461 225 H GLU 30 HN GLU 30 0.884 12.036 -33.349 226 HA GLU 30 HA GLU 30 2.016 11.561 -35.837 227 HB2 GLU 30 HB2 GLU 30 2.337 13.635 -34.573 228 HB3 GLU 30 HB1 GLU 30 3.297 12.779 -33.381 229 HG2 GLU 30 HG2 GLU 30 4.142 12.838 -36.251 230 HG3 GLU 30 HG1 GLU 30 4.470 14.203 -35.188 231 H ASP 31 HN ASP 31 3.169 10.476 -32.649 232 HA ASP 31 HA ASP 31 5.482 9.206 -33.659 233 HB2 ASP 31 HB2 ASP 31 5.017 9.961 -31.262 234 HB3 ASP 31 HB1 ASP 31 4.096 8.470 -31.086 235 H LYS 32 HN LYS 32 2.184 8.137 -33.213 236 HA LYS 32 HA LYS 32 2.729 5.353 -33.370 237 HB2 LYS 32 HB2 LYS 32 0.661 6.265 -32.379 238 HB3 LYS 32 HB1 LYS 32 0.155 6.821 -33.970 239 HG2 LYS 32 HG2 LYS 32 -0.955 4.742 -33.335 240 HG3 LYS 32 HG1 LYS 32 0.055 4.531 -34.766 241 HD2 LYS 32 HD2 LYS 32 1.851 3.639 -33.288 242 HD3 LYS 32 HD1 LYS 32 0.720 3.723 -31.936 243 HE2 LYS 32 HE2 LYS 32 -0.772 2.171 -33.058 244 HE3 LYS 32 HE1 LYS 32 0.297 2.128 -34.459 245 HZ1 LYS 32 HZ1 LYS 32 0.675 0.202 -33.109 246 HZ2 LYS 32 HZ2 LYS 32 0.919 1.148 -31.721 247 HZ3 LYS 32 HZ3 LYS 32 2.038 1.206 -32.996 248 H LEU 33 HN LEU 33 1.351 7.616 -35.796 249 HA LEU 33 HA LEU 33 1.482 5.638 -37.844 250 HB2 LEU 33 HB2 LEU 33 0.955 7.520 -39.400 251 HB3 LEU 33 HB1 LEU 33 -0.189 7.290 -38.097 252 HG LEU 33 HG LEU 33 1.082 9.203 -36.914 253 HD11 LEU 33 HD11 LEU 33 2.157 10.807 -38.386 254 HD12 LEU 33 HD12 LEU 33 1.945 9.717 -39.757 255 HD13 LEU 33 HD13 LEU 33 3.010 9.262 -38.428 256 HD21 LEU 33 HD21 LEU 33 -0.312 10.853 -38.017 257 HD22 LEU 33 HD22 LEU 33 -1.195 9.341 -37.805 258 HD23 LEU 33 HD23 LEU 33 -0.542 9.770 -39.389 259 H SER 34 HN SER 34 3.719 8.010 -36.660 260 HA SER 34 HA SER 34 5.443 8.089 -38.902 261 HB2 SER 34 HB2 SER 34 5.441 9.690 -36.930 262 HB3 SER 34 HB1 SER 34 6.261 8.431 -36.009 263 HG SER 34 HG SER 34 7.484 10.178 -37.289 264 H SER 35 HN SER 35 5.333 6.042 -36.016 265 HA SER 35 HA SER 35 7.675 4.563 -36.664 266 HB2 SER 35 HB2 SER 35 5.371 3.789 -34.859 267 HB3 SER 35 HB1 SER 35 6.977 3.058 -34.868 268 HG SER 35 HG SER 35 6.162 5.591 -33.952 269 H ALA 36 HN ALA 36 4.336 4.333 -37.572 270 HA ALA 36 HA ALA 36 4.486 1.602 -38.472 271 HB1 ALA 36 HB1 ALA 36 2.395 2.556 -37.605 272 HB2 ALA 36 HB2 ALA 36 2.210 1.935 -39.245 273 HB3 ALA 36 HB3 ALA 36 2.348 3.671 -38.971 274 H LEU 37 HN LEU 37 4.192 4.767 -40.097 275 HA LEU 37 HA LEU 37 4.470 3.525 -42.696 276 HB2 LEU 37 HB2 LEU 37 4.347 6.450 -41.943 277 HB3 LEU 37 HB1 LEU 37 4.216 5.796 -43.571 278 HG LEU 37 HG LEU 37 2.239 5.296 -41.343 279 HD11 LEU 37 HD11 LEU 37 2.187 7.611 -42.087 280 HD12 LEU 37 HD12 LEU 37 0.750 6.747 -42.635 281 HD13 LEU 37 HD13 LEU 37 2.062 7.083 -43.764 282 HD21 LEU 37 HD21 LEU 37 2.164 4.571 -44.268 283 HD22 LEU 37 HD22 LEU 37 0.848 4.342 -43.116 284 HD23 LEU 37 HD23 LEU 37 2.355 3.447 -42.921 285 H LYS 38 HN LYS 38 6.370 5.577 -40.569 286 HA LYS 38 HA LYS 38 8.466 6.383 -40.609 287 HB2 LYS 38 HB2 LYS 38 8.909 3.765 -42.030 288 HB3 LYS 38 HB1 LYS 38 10.229 4.846 -41.595 289 HG2 LYS 38 HG2 LYS 38 9.482 4.721 -39.234 290 HG3 LYS 38 HG1 LYS 38 8.282 3.524 -39.719 291 HD2 LYS 38 HD2 LYS 38 9.998 1.989 -40.391 292 HD3 LYS 38 HD1 LYS 38 11.250 3.212 -40.150 293 HE2 LYS 38 HE2 LYS 38 10.724 3.271 -37.759 294 HE3 LYS 38 HE1 LYS 38 9.481 2.048 -38.002 295 HZ1 LYS 38 HZ1 LYS 38 11.120 0.451 -38.586 296 HZ2 LYS 38 HZ2 LYS 38 11.630 1.188 -37.148 297 HZ3 LYS 38 HZ3 LYS 38 12.352 1.617 -38.619 298 HA PRO 39 HA PRO 39 8.313 8.247 -44.732 299 HB2 PRO 39 HB2 PRO 39 7.678 10.738 -43.938 300 HB3 PRO 39 HB1 PRO 39 6.467 9.464 -44.105 301 HG2 PRO 39 HG2 PRO 39 7.590 10.677 -41.668 302 HG3 PRO 39 HG1 PRO 39 6.052 9.833 -41.899 303 HD2 PRO 39 HD2 PRO 39 8.497 8.800 -40.800 304 HD3 PRO 39 HD1 PRO 39 6.953 7.957 -41.021 305 H THR 40 HN THR 40 9.826 9.517 -45.771 306 HA THR 40 HA THR 40 12.275 10.083 -44.388 307 HB THR 40 HB THR 40 12.890 11.114 -46.663 308 HG1 THR 40 HG1 THR 40 10.549 11.265 -47.245 309 HG21 THR 40 HG21 THR 40 13.599 8.869 -45.995 310 HG22 THR 40 HG22 THR 40 13.183 8.912 -47.708 311 HG23 THR 40 HG23 THR 40 12.057 8.212 -46.545 312 H PHE 41 HN PHE 41 9.452 11.818 -45.395 313 HA PHE 41 HA PHE 41 10.334 14.100 -43.805 314 HB2 PHE 41 HB2 PHE 41 10.814 14.756 -46.125 315 HB3 PHE 41 HB1 PHE 41 9.167 14.343 -46.595 316 HD1 PHE 41 HD1 PHE 41 11.105 16.585 -44.359 317 HD2 PHE 41 HD2 PHE 41 7.494 15.946 -46.513 318 HE1 PHE 41 HE1 PHE 41 10.389 18.877 -43.828 319 HE2 PHE 41 HE2 PHE 41 6.769 18.236 -45.987 320 HZ PHE 41 HZ PHE 41 8.217 19.705 -44.643 321 H LEU 42 HN LEU 42 8.726 14.794 -42.486 322 HA LEU 42 HA LEU 42 5.955 14.148 -43.160 323 HB2 LEU 42 HB2 LEU 42 6.769 12.278 -41.785 324 HB3 LEU 42 HB1 LEU 42 7.262 13.407 -40.538 325 HG LEU 42 HG LEU 42 4.883 14.048 -40.221 326 HD11 LEU 42 HD11 LEU 42 3.135 12.650 -41.197 327 HD12 LEU 42 HD12 LEU 42 4.351 11.779 -42.134 328 HD13 LEU 42 HD13 LEU 42 4.054 13.489 -42.446 329 HD21 LEU 42 HD21 LEU 42 5.915 12.370 -38.790 330 HD22 LEU 42 HD22 LEU 42 5.488 11.106 -39.945 331 HD23 LEU 42 HD23 LEU 42 4.220 11.981 -39.086 332 H GLU 43 HN GLU 43 4.791 15.940 -42.939 333 HA GLU 43 HA GLU 43 5.549 17.813 -40.798 334 HB2 GLU 43 HB2 GLU 43 6.154 18.786 -42.955 335 HB3 GLU 43 HB1 GLU 43 4.520 18.523 -43.553 336 HG2 GLU 43 HG2 GLU 43 3.634 20.103 -41.970 337 HG3 GLU 43 HG1 GLU 43 5.215 20.291 -41.218 338 H LEU 44 HN LEU 44 4.056 17.794 -39.288 339 HA LEU 44 HA LEU 44 1.276 17.248 -39.908 340 HB2 LEU 44 HB2 LEU 44 2.776 17.777 -37.349 341 HB3 LEU 44 HB1 LEU 44 1.026 17.763 -37.389 342 HG LEU 44 HG LEU 44 1.837 15.642 -36.584 343 HD11 LEU 44 HD11 LEU 44 -0.182 15.604 -37.920 344 HD12 LEU 44 HD12 LEU 44 0.756 14.130 -38.165 345 HD13 LEU 44 HD13 LEU 44 0.772 15.403 -39.388 346 HD21 LEU 44 HD21 LEU 44 4.052 15.634 -37.571 347 HD22 LEU 44 HD22 LEU 44 3.357 15.435 -39.180 348 HD23 LEU 44 HD23 LEU 44 3.193 14.152 -37.980 349 H VAL 45 HN VAL 45 0.005 18.818 -40.619 350 HA VAL 45 HA VAL 45 0.720 21.591 -39.946 351 HB VAL 45 HB VAL 45 -1.117 20.678 -42.163 352 HG11 VAL 45 HG11 VAL 45 -0.718 22.921 -43.061 353 HG12 VAL 45 HG12 VAL 45 0.279 23.304 -41.658 354 HG13 VAL 45 HG13 VAL 45 -1.443 22.981 -41.453 355 HG21 VAL 45 HG21 VAL 45 1.822 21.345 -42.312 356 HG22 VAL 45 HG22 VAL 45 0.761 21.074 -43.695 357 HG23 VAL 45 HG23 VAL 45 1.094 19.759 -42.569 358 H ASP 46 HN ASP 46 -0.401 22.366 -38.297 359 HA ASP 46 HA ASP 46 -3.006 21.446 -37.575 360 HB2 ASP 46 HB2 ASP 46 -1.545 22.358 -35.860 361 HB3 ASP 46 HB1 ASP 46 -1.460 23.900 -36.707 362 H LYS 47 HN LYS 47 -4.611 21.765 -38.952 363 HA LYS 47 HA LYS 47 -5.193 24.527 -39.744 364 HB2 LYS 47 HB2 LYS 47 -5.317 22.081 -41.515 365 HB3 LYS 47 HB1 LYS 47 -6.155 23.579 -41.898 366 HG2 LYS 47 HG2 LYS 47 -4.022 24.767 -41.940 367 HG3 LYS 47 HG1 LYS 47 -3.178 23.271 -41.543 368 HD2 LYS 47 HD2 LYS 47 -4.873 23.666 -44.009 369 HD3 LYS 47 HD1 LYS 47 -3.121 23.866 -43.963 370 HE2 LYS 47 HE2 LYS 47 -2.928 21.515 -43.184 371 HE3 LYS 47 HE1 LYS 47 -4.669 21.342 -43.398 372 HZ1 LYS 47 HZ1 LYS 47 -3.421 20.488 -45.297 373 HZ2 LYS 47 HZ2 LYS 47 -2.732 22.018 -45.552 374 HZ3 LYS 47 HZ3 LYS 47 -4.405 21.798 -45.748 375 H SER 48 HN SER 48 -6.768 24.854 -38.277 376 HA SER 48 HA SER 48 -8.701 22.950 -37.522 377 HB2 SER 48 HB2 SER 48 -8.140 24.922 -36.145 378 HB3 SER 48 HB1 SER 48 -8.869 25.970 -37.360 379 HG SER 48 HG SER 48 -10.640 25.659 -36.275 380 H CYS 49 HN CYS 49 -10.092 22.073 -38.845 381 HA CYS 49 HA CYS 49 -11.056 23.402 -41.204 382 HB2 CYS 49 HB2 CYS 49 -10.563 20.934 -41.025 383 HB3 CYS 49 HB1 CYS 49 -11.992 20.787 -40.009 384 HG CYS 49 HG CYS 49 -11.772 20.700 -43.264 385 H GLY 50 HN GLY 50 -11.935 23.387 -37.966 386 HA2 GLY 50 HA2 GLY 50 -13.919 25.189 -37.994 387 HA3 GLY 50 HA1 GLY 50 -14.789 23.713 -38.382 388 H CYS 51 HN CYS 51 -13.914 21.827 -36.828 389 HA CYS 51 HA CYS 51 -14.938 22.530 -34.269 390 HB2 CYS 51 HB2 CYS 51 -14.297 20.129 -33.729 391 HB3 CYS 51 HB1 CYS 51 -15.420 20.352 -35.068 392 HG CYS 51 HG CYS 51 -13.868 19.518 -37.018 393 H GLY 52 HN GLY 52 -11.720 22.083 -35.563 394 HA2 GLY 52 HA2 GLY 52 -9.926 23.310 -34.431 395 HA3 GLY 52 HA1 GLY 52 -10.631 22.778 -32.909 396 H THR 53 HN THR 53 -11.111 20.114 -33.455 397 HA THR 53 HA THR 53 -8.433 19.059 -33.285 398 HB THR 53 HB THR 53 -9.815 16.845 -33.039 399 HG1 THR 53 HG1 THR 53 -11.921 17.930 -31.932 400 HG21 THR 53 HG21 THR 53 -10.157 17.332 -30.648 401 HG22 THR 53 HG22 THR 53 -9.916 19.049 -30.970 402 HG23 THR 53 HG23 THR 53 -8.591 17.914 -31.216 403 H SER 54 HN SER 54 -8.198 19.873 -35.612 404 HA SER 54 HA SER 54 -8.632 17.589 -37.395 405 HB2 SER 54 HB2 SER 54 -9.088 19.257 -39.246 406 HB3 SER 54 HB1 SER 54 -10.360 19.123 -38.032 407 HG SER 54 HG SER 54 -8.339 21.121 -38.167 408 H PHE 55 HN PHE 55 -6.725 16.911 -38.093 409 HA PHE 55 HA PHE 55 -4.574 18.883 -38.463 410 HB2 PHE 55 HB2 PHE 55 -4.343 16.098 -37.298 411 HB3 PHE 55 HB1 PHE 55 -2.971 17.112 -37.730 412 HD1 PHE 55 HD1 PHE 55 -2.586 19.239 -36.494 413 HD2 PHE 55 HD2 PHE 55 -5.493 16.388 -35.259 414 HE1 PHE 55 HE1 PHE 55 -2.637 20.266 -34.260 415 HE2 PHE 55 HE2 PHE 55 -5.551 17.411 -33.023 416 HZ PHE 55 HZ PHE 55 -4.123 19.354 -32.520 417 H ASP 56 HN ASP 56 -3.412 18.720 -40.288 418 HA ASP 56 HA ASP 56 -4.077 16.512 -42.123 419 HB2 ASP 56 HB2 ASP 56 -4.889 18.695 -42.909 420 HB3 ASP 56 HB1 ASP 56 -3.268 19.360 -42.764 421 H ALA 57 HN ALA 57 -2.444 15.195 -42.617 422 HA ALA 57 HA ALA 57 0.245 16.031 -41.768 423 HB1 ALA 57 HB1 ALA 57 0.741 13.678 -41.458 424 HB2 ALA 57 HB2 ALA 57 -0.852 13.241 -42.076 425 HB3 ALA 57 HB3 ALA 57 -0.705 14.125 -40.556 426 H VAL 58 HN VAL 58 1.528 16.605 -43.382 427 HA VAL 58 HA VAL 58 1.254 15.448 -46.023 428 HB VAL 58 HB VAL 58 3.427 17.285 -44.986 429 HG11 VAL 58 HG11 VAL 58 2.586 16.577 -47.796 430 HG12 VAL 58 HG12 VAL 58 4.078 16.083 -46.994 431 HG13 VAL 58 HG13 VAL 58 3.797 17.784 -47.362 432 HG21 VAL 58 HG21 VAL 58 1.264 18.364 -44.766 433 HG22 VAL 58 HG22 VAL 58 0.867 17.952 -46.435 434 HG23 VAL 58 HG23 VAL 58 2.170 19.090 -46.095 435 H ILE 59 HN ILE 59 2.031 13.496 -46.426 436 HA ILE 59 HA ILE 59 4.320 12.561 -44.835 437 HB ILE 59 HB ILE 59 2.327 11.332 -44.268 438 HG12 ILE 59 HG12 ILE 59 4.623 10.148 -44.673 439 HG13 ILE 59 HG11 ILE 59 3.188 9.188 -44.344 440 HG21 ILE 59 HG21 ILE 59 2.056 10.674 -47.191 441 HG22 ILE 59 HG22 ILE 59 1.002 11.723 -46.243 442 HG23 ILE 59 HG23 ILE 59 1.075 9.997 -45.890 443 HD11 ILE 59 HD11 ILE 59 4.368 9.701 -47.067 444 HD12 ILE 59 HD12 ILE 59 2.957 8.701 -46.716 445 HD13 ILE 59 HD13 ILE 59 4.548 8.224 -46.121 446 H VAL 60 HN VAL 60 6.097 12.528 -45.919 447 HA VAL 60 HA VAL 60 6.087 11.747 -48.764 448 HB VAL 60 HB VAL 60 8.051 13.456 -47.219 449 HG11 VAL 60 HG11 VAL 60 9.223 13.760 -49.355 450 HG12 VAL 60 HG12 VAL 60 8.157 12.568 -50.096 451 HG13 VAL 60 HG13 VAL 60 9.259 12.083 -48.808 452 HG21 VAL 60 HG21 VAL 60 6.012 14.628 -47.811 453 HG22 VAL 60 HG22 VAL 60 6.187 14.126 -49.491 454 HG23 VAL 60 HG23 VAL 60 7.363 15.227 -48.772 455 H SER 61 HN SER 61 6.617 9.606 -48.885 456 HA SER 61 HA SER 61 8.922 8.687 -47.339 457 HB2 SER 61 HB2 SER 61 7.091 8.271 -45.804 458 HB3 SER 61 HB1 SER 61 6.183 7.434 -47.063 459 HG SER 61 HG SER 61 7.986 6.417 -45.377 460 H ASN 62 HN ASN 62 9.877 6.790 -48.032 461 HA ASN 62 HA ASN 62 9.609 6.033 -50.751 462 HB2 ASN 62 HB2 ASN 62 11.057 4.806 -48.403 463 HB3 ASN 62 HB1 ASN 62 11.076 4.065 -49.999 464 HD21 ASN 62 HD21 ASN 62 11.180 6.425 -51.531 465 HD22 ASN 62 HD22 ASN 62 12.726 7.154 -51.285 466 H ASN 63 HN ASN 63 8.027 5.072 -47.857 467 HA ASN 63 HA ASN 63 7.210 2.470 -48.609 468 HB2 ASN 63 HB2 ASN 63 7.117 3.269 -46.284 469 HB3 ASN 63 HB1 ASN 63 5.885 4.444 -46.728 470 HD21 ASN 63 HD21 ASN 63 3.789 3.808 -46.891 471 HD22 ASN 63 HD22 ASN 63 3.239 2.213 -46.512 472 H PHE 64 HN PHE 64 6.168 5.623 -49.491 473 HA PHE 64 HA PHE 64 3.763 4.559 -50.792 474 HB2 PHE 64 HB2 PHE 64 3.380 6.497 -49.353 475 HB3 PHE 64 HB1 PHE 64 4.602 7.416 -50.224 476 HD1 PHE 64 HD2 PHE 64 1.430 5.557 -50.870 477 HD2 PHE 64 HD1 PHE 64 3.909 8.872 -51.858 478 HE1 PHE 64 HE2 PHE 64 -0.288 6.375 -52.430 479 HE2 PHE 64 HE1 PHE 64 2.198 9.693 -53.422 480 HZ PHE 64 HZ PHE 64 0.097 8.443 -53.711 481 H GLU 65 HN GLU 65 6.936 4.973 -51.516 482 HA GLU 65 HA GLU 65 6.758 6.459 -53.935 483 HB2 GLU 65 HB2 GLU 65 8.888 6.689 -53.249 484 HB3 GLU 65 HB1 GLU 65 8.820 5.234 -52.268 485 HG2 GLU 65 HG2 GLU 65 10.502 4.901 -53.871 486 HG3 GLU 65 HG1 GLU 65 9.106 3.928 -54.339 487 H ASP 66 HN ASP 66 6.690 3.090 -52.995 488 HA ASP 66 HA ASP 66 6.901 1.954 -55.563 489 HB2 ASP 66 HB2 ASP 66 6.920 0.840 -53.182 490 HB3 ASP 66 HB1 ASP 66 5.182 0.709 -53.443 491 H LYS 67 HN LYS 67 4.497 3.804 -54.089 492 HA LYS 67 HA LYS 67 2.548 4.670 -54.791 493 HB2 LYS 67 HB2 LYS 67 3.594 3.610 -57.411 494 HB3 LYS 67 HB1 LYS 67 2.085 4.509 -57.296 495 HG2 LYS 67 HG2 LYS 67 3.233 6.440 -56.437 496 HG3 LYS 67 HG1 LYS 67 4.748 5.547 -56.341 497 HD2 LYS 67 HD2 LYS 67 3.316 5.885 -58.954 498 HD3 LYS 67 HD1 LYS 67 4.373 7.149 -58.327 499 HE2 LYS 67 HE2 LYS 67 5.214 4.284 -58.751 500 HE3 LYS 67 HE1 LYS 67 5.476 5.576 -59.920 501 HZ1 LYS 67 HZ1 LYS 67 6.631 5.372 -57.185 502 HZ2 LYS 67 HZ2 LYS 67 6.765 6.749 -58.161 503 HZ3 LYS 67 HZ3 LYS 67 7.462 5.289 -58.661 504 H LYS 68 HN LYS 68 2.219 2.472 -53.413 505 HA LYS 68 HA LYS 68 0.452 0.639 -54.809 506 HB2 LYS 68 HB2 LYS 68 1.182 0.714 -51.876 507 HB3 LYS 68 HB1 LYS 68 0.432 -0.619 -52.745 508 HG2 LYS 68 HG2 LYS 68 3.204 0.443 -53.241 509 HG3 LYS 68 HG1 LYS 68 2.807 -1.012 -52.322 510 HD2 LYS 68 HD2 LYS 68 1.942 -0.624 -55.175 511 HD3 LYS 68 HD1 LYS 68 3.502 -1.330 -54.751 512 HE2 LYS 68 HE2 LYS 68 2.358 -3.079 -53.476 513 HE3 LYS 68 HE1 LYS 68 0.801 -2.371 -53.907 514 HZ1 LYS 68 HZ1 LYS 68 2.749 -3.284 -55.941 515 HZ2 LYS 68 HZ2 LYS 68 1.102 -2.932 -56.154 516 HZ3 LYS 68 HZ3 LYS 68 1.571 -4.311 -55.286 517 H LEU 69 HN LEU 69 -1.388 1.744 -55.296 518 HA LEU 69 HA LEU 69 -2.704 3.645 -53.766 519 HB2 LEU 69 HB2 LEU 69 -3.257 3.314 -56.078 520 HB3 LEU 69 HB1 LEU 69 -3.784 1.670 -55.769 521 HG LEU 69 HG LEU 69 -5.623 2.618 -54.338 522 HD11 LEU 69 HD11 LEU 69 -4.747 5.208 -55.602 523 HD12 LEU 69 HD12 LEU 69 -4.626 4.793 -53.891 524 HD13 LEU 69 HD13 LEU 69 -6.210 4.962 -54.649 525 HD21 LEU 69 HD21 LEU 69 -5.576 3.426 -57.239 526 HD22 LEU 69 HD22 LEU 69 -7.018 3.252 -56.237 527 HD23 LEU 69 HD23 LEU 69 -6.023 1.842 -56.607 528 H LEU 70 HN LEU 70 -3.727 0.243 -54.118 529 HA LEU 70 HA LEU 70 -5.672 0.488 -52.098 530 HB2 LEU 70 HB2 LEU 70 -6.092 -1.858 -52.348 531 HB3 LEU 70 HB1 LEU 70 -5.881 -1.134 -53.920 532 HG LEU 70 HG LEU 70 -4.881 -3.236 -54.069 533 HD11 LEU 70 HD11 LEU 70 -2.613 -1.346 -53.512 534 HD12 LEU 70 HD12 LEU 70 -3.463 -1.541 -55.045 535 HD13 LEU 70 HD13 LEU 70 -2.503 -2.870 -54.393 536 HD21 LEU 70 HD21 LEU 70 -4.840 -3.827 -51.736 537 HD22 LEU 70 HD22 LEU 70 -3.493 -2.724 -51.450 538 HD23 LEU 70 HD23 LEU 70 -3.270 -4.146 -52.470 539 H ASP 71 HN ASP 71 -2.309 -0.406 -51.991 540 HA ASP 71 HA ASP 71 -2.478 -1.706 -49.460 541 HB2 ASP 71 HB2 ASP 71 -0.135 -0.744 -51.076 542 HB3 ASP 71 HB1 ASP 71 0.055 -1.457 -49.476 543 H ARG 72 HN ARG 72 -1.673 1.609 -50.459 544 HA ARG 72 HA ARG 72 -1.012 2.420 -47.804 545 HB2 ARG 72 HB2 ARG 72 -1.174 4.702 -48.571 546 HB3 ARG 72 HB1 ARG 72 -0.349 3.752 -49.795 547 HG2 ARG 72 HG2 ARG 72 -2.077 3.927 -51.294 548 HG3 ARG 72 HG1 ARG 72 -3.287 4.181 -50.035 549 HD2 ARG 72 HD2 ARG 72 -2.481 6.416 -49.646 550 HD3 ARG 72 HD1 ARG 72 -1.139 6.166 -50.760 551 HE ARG 72 HE ARG 72 -2.643 6.297 -52.568 552 HH11 ARG 72 HH11 ARG 72 -4.264 6.755 -49.489 553 HH12 ARG 72 HH12 ARG 72 -5.621 7.585 -50.194 554 HH21 ARG 72 HH21 ARG 72 -4.401 7.396 -53.486 555 HH22 ARG 72 HH22 ARG 72 -5.700 7.954 -52.466 556 H HIS 73 HN HIS 73 -3.952 2.128 -49.637 557 HA HIS 73 HA HIS 73 -5.671 3.578 -47.936 558 HB2 HIS 73 HB2 HIS 73 -6.149 2.804 -50.299 559 HB3 HIS 73 HB1 HIS 73 -6.404 1.191 -49.646 560 HD1 HIS 73 HD1 HIS 73 -8.106 4.336 -50.330 561 HD2 HIS 73 HD2 HIS 73 -8.692 1.062 -47.828 562 HE1 HIS 73 HE1 HIS 73 -10.508 4.463 -49.593 563 HE2 HIS 73 HE2 HIS 73 -10.880 2.387 -48.212 564 H ARG 74 HN ARG 74 -4.905 0.117 -48.130 565 HA ARG 74 HA ARG 74 -6.561 -0.627 -45.948 566 HB2 ARG 74 HB2 ARG 74 -5.369 -2.799 -46.079 567 HB3 ARG 74 HB1 ARG 74 -5.981 -2.254 -47.634 568 HG2 ARG 74 HG2 ARG 74 -3.715 -1.419 -48.178 569 HG3 ARG 74 HG1 ARG 74 -3.135 -2.105 -46.665 570 HD2 ARG 74 HD2 ARG 74 -4.481 -3.711 -48.826 571 HD3 ARG 74 HD1 ARG 74 -2.735 -3.507 -48.702 572 HE ARG 74 HE ARG 74 -4.298 -4.695 -46.502 573 HH11 ARG 74 HH11 ARG 74 -1.651 -4.802 -48.820 574 HH12 ARG 74 HH12 ARG 74 -0.982 -6.273 -48.174 575 HH21 ARG 74 HH21 ARG 74 -3.416 -6.632 -45.653 576 HH22 ARG 74 HH22 ARG 74 -1.996 -7.325 -46.389 577 H LEU 75 HN LEU 75 -3.111 0.145 -46.209 578 HA LEU 75 HA LEU 75 -2.395 -0.704 -43.618 579 HB2 LEU 75 HB2 LEU 75 -0.804 -0.277 -45.485 580 HB3 LEU 75 HB1 LEU 75 -1.087 1.442 -45.290 581 HG LEU 75 HG LEU 75 -0.157 1.330 -43.010 582 HD11 LEU 75 HD11 LEU 75 -0.728 -1.002 -42.525 583 HD12 LEU 75 HD12 LEU 75 0.983 -0.679 -42.252 584 HD13 LEU 75 HD13 LEU 75 0.468 -1.536 -43.705 585 HD21 LEU 75 HD21 LEU 75 2.174 0.968 -43.667 586 HD22 LEU 75 HD22 LEU 75 1.295 1.903 -44.877 587 HD23 LEU 75 HD23 LEU 75 1.631 0.194 -45.156 588 H VAL 76 HN VAL 76 -3.239 2.503 -44.897 589 HA VAL 76 HA VAL 76 -3.008 3.957 -42.527 590 HB VAL 76 HB VAL 76 -4.761 4.364 -44.949 591 HG11 VAL 76 HG11 VAL 76 -4.468 6.230 -42.593 592 HG12 VAL 76 HG12 VAL 76 -5.932 5.358 -43.042 593 HG13 VAL 76 HG13 VAL 76 -5.287 6.605 -44.109 594 HG21 VAL 76 HG21 VAL 76 -2.318 5.785 -43.895 595 HG22 VAL 76 HG22 VAL 76 -3.210 6.232 -45.350 596 HG23 VAL 76 HG23 VAL 76 -2.375 4.679 -45.268 597 H ASN 77 HN ASN 77 -5.841 2.266 -43.858 598 HA ASN 77 HA ASN 77 -7.624 2.975 -41.809 599 HB2 ASN 77 HB2 ASN 77 -7.562 0.843 -43.891 600 HB3 ASN 77 HB1 ASN 77 -8.720 0.680 -42.573 601 HD21 ASN 77 HD21 ASN 77 -7.743 2.605 -45.315 602 HD22 ASN 77 HD22 ASN 77 -9.221 3.509 -45.450 603 H THR 78 HN THR 78 -5.248 0.412 -42.014 604 HA THR 78 HA THR 78 -6.214 -1.181 -39.909 605 HB THR 78 HB THR 78 -3.386 -0.884 -40.933 606 HG1 THR 78 HG1 THR 78 -4.868 -1.635 -42.508 607 HG21 THR 78 HG21 THR 78 -2.990 -3.084 -39.927 608 HG22 THR 78 HG22 THR 78 -4.617 -3.070 -39.248 609 HG23 THR 78 HG23 THR 78 -3.422 -1.895 -38.699 610 H ILE 79 HN ILE 79 -3.544 1.235 -39.851 611 HA ILE 79 HA ILE 79 -3.366 1.044 -36.979 612 HB ILE 79 HB ILE 79 -2.070 2.991 -38.897 613 HG12 ILE 79 HG12 ILE 79 0.004 1.701 -37.958 614 HG13 ILE 79 HG11 ILE 79 -1.179 0.469 -37.535 615 HG21 ILE 79 HG21 ILE 79 -2.359 4.083 -36.755 616 HG22 ILE 79 HG22 ILE 79 -0.659 3.683 -37.005 617 HG23 ILE 79 HG23 ILE 79 -1.648 2.697 -35.928 618 HD11 ILE 79 HD11 ILE 79 -0.147 -0.040 -39.648 619 HD12 ILE 79 HD12 ILE 79 -0.611 1.536 -40.286 620 HD13 ILE 79 HD13 ILE 79 -1.851 0.344 -39.893 621 H LEU 80 HN LEU 80 -4.605 3.438 -39.275 622 HA LEU 80 HA LEU 80 -5.255 5.308 -37.226 623 HB2 LEU 80 HB2 LEU 80 -5.866 5.195 -40.161 624 HB3 LEU 80 HB1 LEU 80 -6.582 6.420 -39.132 625 HG LEU 80 HG LEU 80 -4.240 7.117 -38.491 626 HD11 LEU 80 HD11 LEU 80 -3.474 5.357 -40.813 627 HD12 LEU 80 HD12 LEU 80 -3.064 5.078 -39.120 628 HD13 LEU 80 HD13 LEU 80 -2.412 6.482 -39.964 629 HD21 LEU 80 HD21 LEU 80 -3.869 8.364 -40.561 630 HD22 LEU 80 HD22 LEU 80 -5.566 8.376 -40.082 631 HD23 LEU 80 HD23 LEU 80 -5.026 7.322 -41.389 632 H LYS 81 HN LYS 81 -6.780 2.447 -38.148 633 HA LYS 81 HA LYS 81 -9.459 2.967 -37.790 634 HB2 LYS 81 HB2 LYS 81 -8.766 0.707 -38.183 635 HB3 LYS 81 HB1 LYS 81 -7.791 0.684 -36.722 636 HG2 LYS 81 HG2 LYS 81 -9.879 -0.600 -36.512 637 HG3 LYS 81 HG1 LYS 81 -9.761 0.714 -35.342 638 HD2 LYS 81 HD2 LYS 81 -11.182 2.100 -36.844 639 HD3 LYS 81 HD1 LYS 81 -11.379 0.691 -37.891 640 HE2 LYS 81 HE2 LYS 81 -12.457 -0.534 -36.123 641 HE3 LYS 81 HE1 LYS 81 -12.131 0.761 -34.973 642 HZ1 LYS 81 HZ1 LYS 81 -13.585 2.213 -36.225 643 HZ2 LYS 81 HZ2 LYS 81 -14.418 0.810 -35.763 644 HZ3 LYS 81 HZ3 LYS 81 -13.881 0.989 -37.364 645 H GLU 82 HN GLU 82 -7.249 2.117 -35.117 646 HA GLU 82 HA GLU 82 -9.026 3.224 -33.156 647 HB2 GLU 82 HB2 GLU 82 -7.591 1.340 -32.585 648 HB3 GLU 82 HB1 GLU 82 -6.152 2.265 -32.980 649 HG2 GLU 82 HG2 GLU 82 -6.318 2.174 -30.621 650 HG3 GLU 82 HG1 GLU 82 -6.734 3.815 -31.109 651 H GLU 83 HN GLU 83 -6.136 4.309 -34.862 652 HA GLU 83 HA GLU 83 -5.423 6.453 -33.230 653 HB2 GLU 83 HB2 GLU 83 -4.043 5.569 -35.062 654 HB3 GLU 83 HB1 GLU 83 -5.165 6.246 -36.231 655 HG2 GLU 83 HG2 GLU 83 -4.618 8.480 -35.529 656 HG3 GLU 83 HG1 GLU 83 -3.590 7.854 -34.238 657 H LEU 84 HN LEU 84 -7.699 6.391 -35.952 658 HA LEU 84 HA LEU 84 -8.198 9.118 -36.153 659 HB2 LEU 84 HB2 LEU 84 -9.952 6.762 -36.781 660 HB3 LEU 84 HB1 LEU 84 -10.449 8.412 -37.097 661 HG LEU 84 HG LEU 84 -8.097 6.979 -38.325 662 HD11 LEU 84 HD11 LEU 84 -10.692 7.967 -39.493 663 HD12 LEU 84 HD12 LEU 84 -10.232 6.284 -39.235 664 HD13 LEU 84 HD13 LEU 84 -9.357 7.268 -40.408 665 HD21 LEU 84 HD21 LEU 84 -7.563 9.331 -37.945 666 HD22 LEU 84 HD22 LEU 84 -9.058 9.807 -38.752 667 HD23 LEU 84 HD23 LEU 84 -7.781 9.000 -39.663 668 H GLN 85 HN GLN 85 -9.421 6.840 -33.805 669 HA GLN 85 HA GLN 85 -11.825 8.067 -33.107 670 HB2 GLN 85 HB2 GLN 85 -9.946 6.696 -31.180 671 HB3 GLN 85 HB1 GLN 85 -11.666 6.954 -30.958 672 HG2 GLN 85 HG2 GLN 85 -10.254 5.005 -32.716 673 HG3 GLN 85 HG1 GLN 85 -11.532 4.729 -31.537 674 HE21 GLN 85 HE21 GLN 85 -10.751 5.405 -34.771 675 HE22 GLN 85 HE22 GLN 85 -12.350 5.420 -35.394 676 H ASN 86 HN ASN 86 -8.597 9.097 -32.505 677 HA ASN 86 HA ASN 86 -9.348 10.793 -30.256 678 HB2 ASN 86 HB2 ASN 86 -6.648 10.464 -31.581 679 HB3 ASN 86 HB1 ASN 86 -6.972 11.248 -30.039 680 HD21 ASN 86 HD21 ASN 86 -6.606 8.241 -31.707 681 HD22 ASN 86 HD22 ASN 86 -6.609 7.228 -30.305 682 H ILE 87 HN ILE 87 -9.486 11.030 -33.540 683 HA ILE 87 HA ILE 87 -9.006 13.941 -33.488 684 HB ILE 87 HB ILE 87 -8.663 12.290 -35.981 685 HG12 ILE 87 HG12 ILE 87 -6.525 12.958 -33.942 686 HG13 ILE 87 HG11 ILE 87 -7.107 11.354 -34.365 687 HG21 ILE 87 HG21 ILE 87 -8.940 14.691 -36.247 688 HG22 ILE 87 HG22 ILE 87 -7.304 14.202 -36.689 689 HG23 ILE 87 HG23 ILE 87 -7.602 14.983 -35.136 690 HD11 ILE 87 HD11 ILE 87 -6.210 11.613 -36.613 691 HD12 ILE 87 HD12 ILE 87 -4.957 11.805 -35.387 692 HD13 ILE 87 HD13 ILE 87 -5.626 13.223 -36.193 693 H HIS 88 HN HIS 88 -10.622 15.192 -34.343 694 HA HIS 88 HA HIS 88 -13.117 13.924 -34.974 695 HB2 HIS 88 HB2 HIS 88 -12.948 16.124 -33.787 696 HB3 HIS 88 HB1 HIS 88 -12.365 16.841 -35.284 697 HD1 HIS 88 HD1 HIS 88 -15.383 16.314 -33.414 698 HD2 HIS 88 HD2 HIS 88 -14.406 16.540 -37.456 699 HE1 HIS 88 HE1 HIS 88 -17.548 16.775 -34.617 700 HE2 HIS 88 HE2 HIS 88 -16.941 16.846 -37.064 701 H ALA 89 HN ALA 89 -10.712 15.819 -36.780 702 HA ALA 89 HA ALA 89 -11.598 14.469 -39.217 703 HB1 ALA 89 HB1 ALA 89 -11.645 16.541 -40.492 704 HB2 ALA 89 HB2 ALA 89 -11.276 17.462 -39.033 705 HB3 ALA 89 HB3 ALA 89 -12.807 16.597 -39.167 706 H PHE 90 HN PHE 90 -9.711 13.304 -39.332 707 HA PHE 90 HA PHE 90 -7.188 14.750 -39.471 708 HB2 PHE 90 HB2 PHE 90 -7.254 12.615 -38.250 709 HB3 PHE 90 HB1 PHE 90 -7.774 11.789 -39.713 710 HD1 PHE 90 HD1 PHE 90 -4.976 13.751 -38.265 711 HD2 PHE 90 HD2 PHE 90 -6.206 10.946 -41.220 712 HE1 PHE 90 HE1 PHE 90 -2.625 13.362 -38.868 713 HE2 PHE 90 HE2 PHE 90 -3.855 10.553 -41.829 714 HZ PHE 90 HZ PHE 90 -2.061 11.760 -40.652 715 H SER 91 HN SER 91 -5.958 14.946 -41.313 716 HA SER 91 HA SER 91 -7.014 13.797 -43.800 717 HB2 SER 91 HB2 SER 91 -6.068 16.658 -43.465 718 HB3 SER 91 HB1 SER 91 -6.553 15.908 -44.986 719 HG SER 91 HG SER 91 -8.407 15.678 -42.972 720 H MET 92 HN MET 92 -5.327 13.786 -45.542 721 HA MET 92 HA MET 92 -2.594 13.919 -44.546 722 HB2 MET 92 HB2 MET 92 -2.017 11.675 -45.135 723 HB3 MET 92 HB1 MET 92 -3.429 11.594 -44.094 724 HG2 MET 92 HG2 MET 92 -3.532 11.426 -47.098 725 HG3 MET 92 HG1 MET 92 -3.468 10.030 -46.025 726 HE1 MET 92 HE1 MET 92 -5.308 10.717 -43.625 727 HE2 MET 92 HE2 MET 92 -5.446 9.205 -44.523 728 HE3 MET 92 HE3 MET 92 -6.886 10.165 -44.189 729 H LYS 93 HN LYS 93 -1.048 14.162 -46.132 730 HA LYS 93 HA LYS 93 -2.004 14.249 -48.921 731 HB2 LYS 93 HB2 LYS 93 0.077 16.063 -47.669 732 HB3 LYS 93 HB1 LYS 93 -0.466 16.112 -49.340 733 HG2 LYS 93 HG2 LYS 93 -2.194 16.676 -46.937 734 HG3 LYS 93 HG1 LYS 93 -1.453 17.894 -47.976 735 HD2 LYS 93 HD2 LYS 93 -2.749 17.182 -49.853 736 HD3 LYS 93 HD1 LYS 93 -3.350 15.777 -48.972 737 HE2 LYS 93 HE2 LYS 93 -3.887 18.644 -48.209 738 HE3 LYS 93 HE1 LYS 93 -4.993 17.634 -49.137 739 HZ1 LYS 93 HZ1 LYS 93 -5.655 17.607 -46.857 740 HZ2 LYS 93 HZ2 LYS 93 -4.095 17.196 -46.333 741 HZ3 LYS 93 HZ3 LYS 93 -5.013 16.082 -47.222 742 H CYS 94 HN CYS 94 -1.103 12.551 -49.924 743 HA CYS 94 HA CYS 94 1.361 11.435 -48.841 744 HB2 CYS 94 HB2 CYS 94 0.767 9.499 -50.360 745 HB3 CYS 94 HB1 CYS 94 -0.385 9.840 -49.073 746 HG CYS 94 HG CYS 94 -0.794 10.916 -52.294 747 H HIS 95 HN HIS 95 3.272 11.736 -49.755 748 HA HIS 95 HA HIS 95 3.488 11.886 -52.651 749 HB2 HIS 95 HB2 HIS 95 4.099 14.161 -50.834 750 HB3 HIS 95 HB1 HIS 95 5.221 13.861 -52.158 751 HD1 HIS 95 HD1 HIS 95 4.126 13.867 -54.604 752 HD2 HIS 95 HD2 HIS 95 1.812 15.498 -51.557 753 HE1 HIS 95 HE1 HIS 95 2.346 15.227 -55.756 754 HE2 HIS 95 HE2 HIS 95 0.855 16.058 -53.902 755 H THR 96 HN THR 96 5.949 12.111 -53.232 756 HA THR 96 HA THR 96 7.354 10.204 -51.479 757 HB THR 96 HB THR 96 8.463 9.298 -53.453 758 HG1 THR 96 HG1 THR 96 6.904 11.236 -54.857 759 HG21 THR 96 HG21 THR 96 6.474 8.287 -54.560 760 HG22 THR 96 HG22 THR 96 5.457 9.403 -53.648 761 HG23 THR 96 HG23 THR 96 6.438 8.207 -52.797 762 HA PRO 97 HA PRO 97 10.913 12.757 -51.070 763 HB2 PRO 97 HB2 PRO 97 12.933 11.096 -51.994 764 HB3 PRO 97 HB1 PRO 97 12.270 11.079 -50.356 765 HG2 PRO 97 HG2 PRO 97 11.632 9.319 -52.683 766 HG3 PRO 97 HG1 PRO 97 11.794 8.898 -50.967 767 HD2 PRO 97 HD2 PRO 97 9.390 9.140 -52.116 768 HD3 PRO 97 HD1 PRO 97 9.672 9.685 -50.448 769 H LEU 98 HN LEU 98 10.236 11.296 -54.156 770 HA LEU 98 HA LEU 98 12.129 12.665 -55.722 771 HB2 LEU 98 HB2 LEU 98 9.425 11.506 -56.344 772 HB3 LEU 98 HB1 LEU 98 10.343 12.367 -57.561 773 HG LEU 98 HG LEU 98 10.664 9.997 -57.841 774 HD11 LEU 98 HD11 LEU 98 12.569 11.413 -58.335 775 HD12 LEU 98 HD12 LEU 98 13.104 9.863 -57.688 776 HD13 LEU 98 HD13 LEU 98 13.113 11.299 -56.662 777 HD21 LEU 98 HD21 LEU 98 11.648 9.981 -54.993 778 HD22 LEU 98 HD22 LEU 98 11.708 8.619 -56.111 779 HD23 LEU 98 HD23 LEU 98 10.151 9.259 -55.584 780 H GLU 99 HN GLU 99 8.730 13.450 -54.997 781 HA GLU 99 HA GLU 99 8.736 15.957 -56.251 782 HB2 GLU 99 HB2 GLU 99 7.091 14.960 -53.924 783 HB3 GLU 99 HB1 GLU 99 6.823 16.506 -54.713 784 HG2 GLU 99 HG2 GLU 99 5.270 15.186 -55.744 785 HG3 GLU 99 HG1 GLU 99 6.623 15.069 -56.868 786 H TYR 100 HN TYR 100 9.441 15.036 -52.881 787 HA TYR 100 HA TYR 100 9.785 17.719 -52.011 788 HB2 TYR 100 HB2 TYR 100 9.330 15.904 -50.426 789 HB3 TYR 100 HB1 TYR 100 10.909 15.200 -50.774 790 HD1 TYR 100 HD1 TYR 100 9.413 18.442 -49.690 791 HD2 TYR 100 HD2 TYR 100 12.674 15.730 -49.355 792 HE1 TYR 100 HE1 TYR 100 10.425 19.883 -47.979 793 HE2 TYR 100 HE2 TYR 100 13.697 17.165 -47.636 794 HH TYR 100 HH TYR 100 11.980 19.848 -46.225 795 H ASP 101 HN ASP 101 12.099 15.288 -53.156 796 HA ASP 101 HA ASP 101 14.421 16.786 -52.561 797 HB2 ASP 101 HB2 ASP 101 14.435 14.347 -53.043 798 HB3 ASP 101 HB1 ASP 101 14.079 14.702 -54.730 799 H LYS 102 HN LYS 102 12.249 16.739 -55.318 800 HA LYS 102 HA LYS 102 13.914 18.401 -56.940 801 HB2 LYS 102 HB2 LYS 102 11.196 17.265 -57.146 802 HB3 LYS 102 HB1 LYS 102 11.453 18.775 -58.006 803 HG2 LYS 102 HG2 LYS 102 11.850 17.000 -59.534 804 HG3 LYS 102 HG1 LYS 102 13.412 17.713 -59.140 805 HD2 LYS 102 HD2 LYS 102 12.424 15.332 -57.620 806 HD3 LYS 102 HD1 LYS 102 13.137 15.121 -59.218 807 HE2 LYS 102 HE2 LYS 102 14.491 16.544 -56.931 808 HE3 LYS 102 HE1 LYS 102 14.735 14.844 -57.318 809 HZ1 LYS 102 HZ1 LYS 102 16.459 16.332 -58.233 810 HZ2 LYS 102 HZ2 LYS 102 15.281 17.068 -59.204 811 HZ3 LYS 102 HZ3 LYS 102 15.652 15.433 -59.425 812 H LEU 103 HN LEU 103 11.693 19.000 -54.361 813 HA LEU 103 HA LEU 103 11.224 21.751 -54.937 814 HB2 LEU 103 HB2 LEU 103 11.179 20.298 -52.290 815 HB3 LEU 103 HB1 LEU 103 10.576 21.923 -52.558 816 HG LEU 103 HG LEU 103 9.464 19.383 -53.748 817 HD11 LEU 103 HD11 LEU 103 8.321 21.313 -51.737 818 HD12 LEU 103 HD12 LEU 103 8.931 19.694 -51.390 819 HD13 LEU 103 HD13 LEU 103 7.501 19.902 -52.403 820 HD21 LEU 103 HD21 LEU 103 8.569 22.240 -54.108 821 HD22 LEU 103 HD22 LEU 103 7.716 20.810 -54.689 822 HD23 LEU 103 HD23 LEU 103 9.304 21.213 -55.340 823 H LYS 104 HN LYS 104 13.478 20.097 -52.731 824 HA LYS 104 HA LYS 104 14.997 22.421 -52.143 825 HB2 LYS 104 HB2 LYS 104 16.796 20.469 -51.690 826 HB3 LYS 104 HB1 LYS 104 15.499 20.858 -50.567 827 HG2 LYS 104 HG2 LYS 104 14.234 19.019 -51.194 828 HG3 LYS 104 HG1 LYS 104 15.102 18.824 -52.716 829 HD2 LYS 104 HD2 LYS 104 16.300 18.357 -49.991 830 HD3 LYS 104 HD1 LYS 104 15.649 17.089 -51.033 831 HE2 LYS 104 HE2 LYS 104 17.259 18.004 -52.805 832 HE3 LYS 104 HE1 LYS 104 18.052 18.831 -51.467 833 HZ1 LYS 104 HZ1 LYS 104 19.161 16.785 -51.797 834 HZ2 LYS 104 HZ2 LYS 104 17.708 15.912 -51.846 835 HZ3 LYS 104 HZ3 LYS 104 18.235 16.602 -50.385 836 H SER 105 HN SER 105 14.970 20.235 -54.819 837 HA SER 105 HA SER 105 17.544 20.923 -55.853 838 HB2 SER 105 HB2 SER 105 16.446 18.801 -56.439 839 HB3 SER 105 HB1 SER 105 15.139 19.683 -57.221 840 HG SER 105 HG SER 105 17.873 19.798 -57.997 841 H LYS 106 HN LYS 106 14.409 21.485 -57.472 842 HA LYS 106 HA LYS 106 15.473 24.009 -58.486 843 HB2 LYS 106 HB2 LYS 106 13.209 23.798 -59.836 844 HB3 LYS 106 HB1 LYS 106 14.642 22.893 -60.307 845 HG2 LYS 106 HG2 LYS 106 13.793 20.894 -59.575 846 HG3 LYS 106 HG1 LYS 106 12.710 21.657 -58.410 847 HD2 LYS 106 HD2 LYS 106 11.317 22.461 -60.231 848 HD3 LYS 106 HD1 LYS 106 12.404 21.714 -61.400 849 HE2 LYS 106 HE2 LYS 106 11.848 19.530 -60.646 850 HE3 LYS 106 HE1 LYS 106 10.996 20.165 -59.240 851 HZ1 LYS 106 HZ1 LYS 106 9.349 21.131 -60.717 852 HZ2 LYS 106 HZ2 LYS 106 9.455 19.455 -60.949 853 HZ3 LYS 106 HZ3 LYS 106 10.162 20.510 -62.069 854 H GLY 107 HN GLY 107 12.465 22.760 -57.001 855 HA2 GLY 107 HA2 GLY 107 11.491 23.944 -55.130 856 HA3 GLY 107 HA1 GLY 107 12.090 25.441 -55.827 857 H SER 108 HN SER 108 10.979 23.781 -58.390 858 HA SER 108 HA SER 108 8.260 24.864 -58.095 859 HB2 SER 108 HB2 SER 108 9.817 26.087 -59.711 860 HB3 SER 108 HB1 SER 108 9.763 24.638 -60.711 861 HG SER 108 HG SER 108 8.021 25.492 -61.512 Start of MODEL 5 1 H1 MET 1 HT1 MET 1 -20.541 -30.556 -49.709 2 H2 MET 1 HT2 MET 1 -21.607 -30.594 -51.024 3 H3 MET 1 HT3 MET 1 -21.015 -32.043 -50.367 4 HA MET 1 HA MET 1 -22.788 -30.108 -48.996 5 HB2 MET 1 HB2 MET 1 -23.907 -31.438 -50.765 6 HB3 MET 1 HB1 MET 1 -23.336 -32.914 -49.999 7 HG2 MET 1 HG2 MET 1 -24.650 -32.407 -48.013 8 HG3 MET 1 HG1 MET 1 -25.203 -30.905 -48.753 9 HE1 MET 1 HE1 MET 1 -26.313 -35.121 -50.272 10 HE2 MET 1 HE2 MET 1 -25.344 -34.818 -48.830 11 HE3 MET 1 HE3 MET 1 -24.690 -34.447 -50.425 12 H GLY 2 HN GLY 2 -22.289 -30.056 -46.907 13 HA2 GLY 2 HA2 GLY 2 -21.843 -30.930 -44.779 14 HA3 GLY 2 HA1 GLY 2 -21.589 -32.517 -45.504 15 H SER 3 HN SER 3 -20.057 -30.145 -47.248 16 HA SER 3 HA SER 3 -17.459 -31.004 -46.236 17 HB2 SER 3 HB2 SER 3 -18.005 -29.393 -48.732 18 HB3 SER 3 HB1 SER 3 -16.588 -30.375 -48.359 19 HG SER 3 HG SER 3 -17.620 -32.130 -48.951 20 H SER 4 HN SER 4 -17.387 -29.685 -44.383 21 HA SER 4 HA SER 4 -17.751 -26.856 -44.544 22 HB2 SER 4 HB2 SER 4 -16.434 -28.493 -42.367 23 HB3 SER 4 HB1 SER 4 -17.048 -26.845 -42.216 24 HG SER 4 HG SER 4 -19.029 -28.295 -43.178 25 H HIS 5 HN HIS 5 -16.277 -25.271 -44.802 26 HA HIS 5 HA HIS 5 -13.494 -26.118 -45.331 27 HB2 HIS 5 HB2 HIS 5 -14.980 -23.732 -46.465 28 HB3 HIS 5 HB1 HIS 5 -13.318 -24.178 -46.834 29 HD1 HIS 5 HD1 HIS 5 -13.017 -26.481 -48.183 30 HD2 HIS 5 HD2 HIS 5 -16.876 -24.931 -48.025 31 HE1 HIS 5 HE1 HIS 5 -14.299 -27.655 -50.002 32 HE2 HIS 5 HE2 HIS 5 -16.673 -26.851 -49.751 33 H HIS 6 HN HIS 6 -12.075 -25.458 -43.839 34 HA HIS 6 HA HIS 6 -12.760 -23.021 -42.327 35 HB2 HIS 6 HB2 HIS 6 -11.610 -25.606 -41.287 36 HB3 HIS 6 HB1 HIS 6 -11.571 -24.102 -40.373 37 HD1 HIS 6 HD1 HIS 6 -13.948 -23.074 -39.741 38 HD2 HIS 6 HD2 HIS 6 -13.962 -26.994 -41.133 39 HE1 HIS 6 HE1 HIS 6 -16.199 -24.015 -39.106 40 HE2 HIS 6 HE2 HIS 6 -16.074 -26.455 -39.738 41 H HIS 7 HN HIS 7 -11.450 -21.611 -43.373 42 HA HIS 7 HA HIS 7 -8.623 -22.091 -43.612 43 HB2 HIS 7 HB2 HIS 7 -10.415 -19.738 -44.073 44 HB3 HIS 7 HB1 HIS 7 -8.689 -19.464 -43.882 45 HD1 HIS 7 HD1 HIS 7 -11.211 -20.453 -46.326 46 HD2 HIS 7 HD2 HIS 7 -7.091 -20.799 -45.896 47 HE1 HIS 7 HE1 HIS 7 -10.329 -20.983 -48.623 48 HE2 HIS 7 HE2 HIS 7 -7.822 -20.887 -48.373 49 H HIS 8 HN HIS 8 -7.054 -21.546 -42.216 50 HA HIS 8 HA HIS 8 -7.821 -20.980 -39.503 51 HB2 HIS 8 HB2 HIS 8 -5.084 -21.241 -40.775 52 HB3 HIS 8 HB1 HIS 8 -5.381 -21.105 -39.046 53 HD1 HIS 8 HD1 HIS 8 -5.786 -23.481 -41.934 54 HD2 HIS 8 HD2 HIS 8 -6.190 -23.445 -37.791 55 HE1 HIS 8 HE1 HIS 8 -6.063 -25.889 -41.254 56 HE2 HIS 8 HE2 HIS 8 -6.463 -25.828 -38.766 57 H HIS 9 HN HIS 9 -8.267 -18.994 -38.833 58 HA HIS 9 HA HIS 9 -6.976 -16.741 -40.175 59 HB2 HIS 9 HB2 HIS 9 -8.578 -15.297 -39.025 60 HB3 HIS 9 HB1 HIS 9 -9.412 -16.572 -39.896 61 HD1 HIS 9 HD1 HIS 9 -11.197 -17.718 -38.618 62 HD2 HIS 9 HD2 HIS 9 -8.417 -15.904 -36.108 63 HE1 HIS 9 HE1 HIS 9 -12.083 -18.026 -36.286 64 HE2 HIS 9 HE2 HIS 9 -10.477 -16.769 -34.803 65 H HIS 10 HN HIS 10 -5.576 -15.373 -39.177 66 HA HIS 10 HA HIS 10 -4.466 -16.379 -36.670 67 HB2 HIS 10 HB2 HIS 10 -2.951 -15.930 -38.600 68 HB3 HIS 10 HB1 HIS 10 -3.389 -14.227 -38.508 69 HD1 HIS 10 HD1 HIS 10 -1.975 -12.807 -37.027 70 HD2 HIS 10 HD2 HIS 10 -1.583 -16.862 -36.172 71 HE1 HIS 10 HE1 HIS 10 -0.171 -12.965 -35.282 72 HE2 HIS 10 HE2 HIS 10 0.197 -15.435 -34.948 73 H SER 11 HN SER 11 -5.746 -15.661 -35.049 74 HA SER 11 HA SER 11 -6.851 -13.042 -34.942 75 HB2 SER 11 HB2 SER 11 -7.749 -15.035 -33.702 76 HB3 SER 11 HB1 SER 11 -6.347 -14.946 -32.638 77 HG SER 11 HG SER 11 -8.620 -13.392 -32.711 78 H SER 12 HN SER 12 -5.962 -11.190 -34.248 79 HA SER 12 HA SER 12 -3.216 -11.349 -33.205 80 HB2 SER 12 HB2 SER 12 -3.429 -10.439 -35.522 81 HB3 SER 12 HB1 SER 12 -4.425 -9.133 -34.880 82 HG SER 12 HG SER 12 -1.703 -9.460 -34.836 83 H GLY 13 HN GLY 13 -2.565 -9.737 -31.702 84 HA2 GLY 13 HA2 GLY 13 -3.885 -7.657 -30.606 85 HA3 GLY 13 HA1 GLY 13 -4.676 -9.040 -29.858 86 H ARG 14 HN ARG 14 -1.406 -7.822 -30.551 87 HA ARG 14 HA ARG 14 -0.436 -9.183 -28.145 88 HB2 ARG 14 HB2 ARG 14 1.148 -7.684 -30.242 89 HB3 ARG 14 HB1 ARG 14 1.791 -8.740 -28.991 90 HG2 ARG 14 HG2 ARG 14 0.064 -9.570 -31.315 91 HG3 ARG 14 HG1 ARG 14 1.795 -9.861 -31.132 92 HD2 ARG 14 HD2 ARG 14 -0.319 -10.904 -29.253 93 HD3 ARG 14 HD1 ARG 14 0.365 -11.828 -30.588 94 HE ARG 14 HE ARG 14 2.515 -10.955 -29.080 95 HH11 ARG 14 HH11 ARG 14 -0.360 -12.873 -28.480 96 HH12 ARG 14 HH12 ARG 14 0.432 -13.958 -27.376 97 HH21 ARG 14 HH21 ARG 14 3.564 -12.370 -27.614 98 HH22 ARG 14 HH22 ARG 14 2.664 -13.660 -26.874 99 H GLU 15 HN GLU 15 -0.310 -5.982 -29.676 100 HA GLU 15 HA GLU 15 0.410 -4.761 -27.125 101 HB2 GLU 15 HB2 GLU 15 0.596 -2.679 -28.482 102 HB3 GLU 15 HB1 GLU 15 1.629 -3.981 -29.052 103 HG2 GLU 15 HG2 GLU 15 -0.176 -4.506 -30.738 104 HG3 GLU 15 HG1 GLU 15 -0.927 -2.980 -30.269 105 H ASN 16 HN ASN 16 -2.229 -5.996 -27.730 106 HA ASN 16 HA ASN 16 -4.162 -3.970 -28.136 107 HB2 ASN 16 HB2 ASN 16 -5.809 -5.636 -27.735 108 HB3 ASN 16 HB1 ASN 16 -4.489 -6.417 -28.588 109 HD21 ASN 16 HD21 ASN 16 -2.820 -6.581 -26.135 110 HD22 ASN 16 HD22 ASN 16 -3.519 -7.843 -25.193 111 H LEU 17 HN LEU 17 -2.223 -4.270 -25.550 112 HA LEU 17 HA LEU 17 -4.264 -3.264 -23.671 113 HB2 LEU 17 HB2 LEU 17 -1.555 -4.435 -23.024 114 HB3 LEU 17 HB1 LEU 17 -2.775 -3.939 -21.869 115 HG LEU 17 HG LEU 17 -3.816 -5.933 -23.697 116 HD11 LEU 17 HD11 LEU 17 -1.484 -6.645 -23.807 117 HD12 LEU 17 HD12 LEU 17 -2.456 -7.800 -22.893 118 HD13 LEU 17 HD13 LEU 17 -1.400 -6.669 -22.046 119 HD21 LEU 17 HD21 LEU 17 -4.835 -5.308 -21.564 120 HD22 LEU 17 HD22 LEU 17 -3.401 -5.874 -20.709 121 HD23 LEU 17 HD23 LEU 17 -4.411 -7.018 -21.589 122 H TYR 18 HN TYR 18 -1.768 -2.324 -25.671 123 HA TYR 18 HA TYR 18 -0.824 -0.256 -23.799 124 HB2 TYR 18 HB2 TYR 18 0.790 -1.621 -25.966 125 HB3 TYR 18 HB1 TYR 18 1.383 -0.437 -24.804 126 HD1 TYR 18 HD1 TYR 18 1.539 -1.052 -22.392 127 HD2 TYR 18 HD2 TYR 18 0.587 -3.923 -25.387 128 HE1 TYR 18 HE1 TYR 18 2.079 -2.865 -20.820 129 HE2 TYR 18 HE2 TYR 18 1.126 -5.742 -23.823 130 HH TYR 18 HH TYR 18 2.389 -6.145 -21.822 131 H PHE 19 HN PHE 19 -1.796 1.553 -24.413 132 HA PHE 19 HA PHE 19 -1.946 2.193 -27.263 133 HB2 PHE 19 HB2 PHE 19 -3.477 4.040 -26.514 134 HB3 PHE 19 HB1 PHE 19 -4.063 2.417 -26.180 135 HD1 PHE 19 HD1 PHE 19 -3.988 1.540 -23.855 136 HD2 PHE 19 HD2 PHE 19 -3.082 5.594 -24.778 137 HE1 PHE 19 HE1 PHE 19 -4.335 2.150 -21.497 138 HE2 PHE 19 HE2 PHE 19 -3.421 6.211 -22.420 139 HZ PHE 19 HZ PHE 19 -4.049 4.487 -20.777 140 H GLN 20 HN GLN 20 -0.042 2.814 -24.577 141 HA GLN 20 HA GLN 20 1.679 4.216 -24.134 142 HB2 GLN 20 HB2 GLN 20 1.591 4.326 -27.133 143 HB3 GLN 20 HB1 GLN 20 2.738 5.311 -26.242 144 HG2 GLN 20 HG2 GLN 20 3.902 3.370 -26.844 145 HG3 GLN 20 HG1 GLN 20 3.526 3.190 -25.135 146 HE21 GLN 20 HE21 GLN 20 1.288 2.684 -27.808 147 HE22 GLN 20 HE22 GLN 20 1.080 0.990 -27.542 148 H GLY 21 HN GLY 21 -0.773 5.364 -23.631 149 HA2 GLY 21 HA2 GLY 21 -0.939 7.962 -24.883 150 HA3 GLY 21 HA1 GLY 21 -1.985 7.345 -23.615 151 H HIS 22 HN HIS 22 1.507 7.398 -23.363 152 HA HIS 22 HA HIS 22 1.260 9.333 -21.174 153 HB2 HIS 22 HB2 HIS 22 3.511 8.592 -20.478 154 HB3 HIS 22 HB1 HIS 22 2.368 7.259 -20.548 155 HD1 HIS 22 HD1 HIS 22 5.560 8.490 -21.983 156 HD2 HIS 22 HD2 HIS 22 2.855 5.395 -22.638 157 HE1 HIS 22 HE1 HIS 22 6.752 6.845 -23.464 158 HE2 HIS 22 HE2 HIS 22 5.168 4.896 -23.690 159 H MET 23 HN MET 23 1.570 9.574 -24.280 160 HA MET 23 HA MET 23 3.614 11.693 -24.210 161 HB2 MET 23 HB2 MET 23 2.473 10.136 -26.542 162 HB3 MET 23 HB1 MET 23 3.544 11.520 -26.716 163 HG2 MET 23 HG2 MET 23 4.243 8.952 -25.305 164 HG3 MET 23 HG1 MET 23 4.699 9.364 -26.956 165 HE1 MET 23 HE1 MET 23 7.249 9.000 -26.544 166 HE2 MET 23 HE2 MET 23 6.872 8.457 -24.910 167 HE3 MET 23 HE3 MET 23 8.131 9.666 -25.170 168 H CYS 24 HN CYS 24 3.060 13.616 -25.593 169 HA CYS 24 HA CYS 24 0.526 14.690 -24.986 170 HB2 CYS 24 HB2 CYS 24 2.491 16.092 -25.471 171 HB3 CYS 24 HB1 CYS 24 2.492 15.522 -27.136 172 HG CYS 24 HG CYS 24 1.350 18.244 -26.373 173 H ILE 25 HN ILE 25 -1.282 15.084 -26.337 174 HA ILE 25 HA ILE 25 -2.227 12.902 -27.701 175 HB ILE 25 HB ILE 25 -3.729 14.572 -26.866 176 HG12 ILE 25 HG12 ILE 25 -5.204 14.919 -28.858 177 HG13 ILE 25 HG11 ILE 25 -3.896 14.319 -29.874 178 HG21 ILE 25 HG21 ILE 25 -2.400 16.561 -27.207 179 HG22 ILE 25 HG22 ILE 25 -4.000 16.768 -27.920 180 HG23 ILE 25 HG23 ILE 25 -2.611 16.432 -28.954 181 HD11 ILE 25 HD11 ILE 25 -5.305 12.778 -27.707 182 HD12 ILE 25 HD12 ILE 25 -3.983 12.175 -28.707 183 HD13 ILE 25 HD13 ILE 25 -5.531 12.587 -29.445 184 H GLN 26 HN GLN 26 -0.790 15.817 -29.165 185 HA GLN 26 HA GLN 26 -1.162 15.017 -31.840 186 HB2 GLN 26 HB2 GLN 26 -0.645 17.340 -31.135 187 HB3 GLN 26 HB1 GLN 26 0.986 16.827 -30.719 188 HG2 GLN 26 HG2 GLN 26 1.339 16.173 -33.076 189 HG3 GLN 26 HG1 GLN 26 -0.257 16.814 -33.461 190 HE21 GLN 26 HE21 GLN 26 0.534 18.362 -34.853 191 HE22 GLN 26 HE22 GLN 26 1.385 19.766 -34.304 192 H LYS 27 HN LYS 27 1.531 14.617 -29.589 193 HA LYS 27 HA LYS 27 3.328 13.464 -31.428 194 HB2 LYS 27 HB2 LYS 27 3.185 13.291 -28.417 195 HB3 LYS 27 HB1 LYS 27 4.509 12.633 -29.369 196 HG2 LYS 27 HG2 LYS 27 3.689 15.528 -29.222 197 HG3 LYS 27 HG1 LYS 27 5.099 14.796 -28.455 198 HD2 LYS 27 HD2 LYS 27 4.581 14.992 -31.423 199 HD3 LYS 27 HD1 LYS 27 5.735 15.957 -30.501 200 HE2 LYS 27 HE2 LYS 27 6.982 13.936 -29.939 201 HE3 LYS 27 HE1 LYS 27 5.819 12.960 -30.833 202 HZ1 LYS 27 HZ1 LYS 27 7.667 13.299 -32.236 203 HZ2 LYS 27 HZ2 LYS 27 7.709 14.966 -31.924 204 HZ3 LYS 27 HZ3 LYS 27 6.435 14.304 -32.834 205 H VAL 28 HN VAL 28 0.852 12.082 -29.326 206 HA VAL 28 HA VAL 28 1.560 9.384 -29.570 207 HB VAL 28 HB VAL 28 -1.210 10.576 -29.291 208 HG11 VAL 28 HG11 VAL 28 -1.343 8.292 -30.131 209 HG12 VAL 28 HG12 VAL 28 -1.888 8.371 -28.456 210 HG13 VAL 28 HG13 VAL 28 -0.285 7.738 -28.832 211 HG21 VAL 28 HG21 VAL 28 0.695 9.479 -27.224 212 HG22 VAL 28 HG22 VAL 28 -0.951 10.033 -26.914 213 HG23 VAL 28 HG23 VAL 28 0.277 11.177 -27.458 214 H ILE 29 HN ILE 29 -0.820 11.245 -31.487 215 HA ILE 29 HA ILE 29 -1.270 9.137 -33.333 216 HB ILE 29 HB ILE 29 -1.868 12.083 -33.408 217 HG12 ILE 29 HG12 ILE 29 -4.220 11.199 -33.548 218 HG13 ILE 29 HG11 ILE 29 -3.567 9.580 -33.344 219 HG21 ILE 29 HG21 ILE 29 -2.416 10.131 -35.638 220 HG22 ILE 29 HG22 ILE 29 -1.311 11.504 -35.699 221 HG23 ILE 29 HG23 ILE 29 -3.046 11.775 -35.535 222 HD11 ILE 29 HD11 ILE 29 -4.447 10.445 -31.260 223 HD12 ILE 29 HD12 ILE 29 -3.362 11.833 -31.360 224 HD13 ILE 29 HD13 ILE 29 -2.702 10.211 -31.151 225 H GLU 30 HN GLU 30 0.885 11.927 -33.353 226 HA GLU 30 HA GLU 30 1.789 11.791 -35.990 227 HB2 GLU 30 HB2 GLU 30 2.220 13.695 -34.520 228 HB3 GLU 30 HB1 GLU 30 3.248 12.697 -33.502 229 HG2 GLU 30 HG2 GLU 30 4.434 12.376 -35.918 230 HG3 GLU 30 HG1 GLU 30 3.821 14.023 -36.050 231 H ASP 31 HN ASP 31 3.201 10.339 -33.052 232 HA ASP 31 HA ASP 31 5.430 9.273 -34.496 233 HB2 ASP 31 HB2 ASP 31 5.431 9.938 -32.051 234 HB3 ASP 31 HB1 ASP 31 4.524 8.463 -31.732 235 H LYS 32 HN LYS 32 2.318 8.069 -33.488 236 HA LYS 32 HA LYS 32 2.761 5.320 -33.789 237 HB2 LYS 32 HB2 LYS 32 0.333 7.063 -33.955 238 HB3 LYS 32 HB1 LYS 32 0.219 5.350 -34.337 239 HG2 LYS 32 HG2 LYS 32 1.466 6.232 -31.771 240 HG3 LYS 32 HG1 LYS 32 -0.290 6.169 -31.937 241 HD2 LYS 32 HD2 LYS 32 0.846 3.763 -32.987 242 HD3 LYS 32 HD1 LYS 32 1.481 4.050 -31.365 243 HE2 LYS 32 HE2 LYS 32 -0.620 2.712 -31.411 244 HE3 LYS 32 HE1 LYS 32 -0.721 4.186 -30.449 245 HZ1 LYS 32 HZ1 LYS 32 -1.689 3.965 -33.249 246 HZ2 LYS 32 HZ2 LYS 32 -1.914 5.275 -32.203 247 HZ3 LYS 32 HZ3 LYS 32 -2.674 3.795 -31.888 248 H LEU 33 HN LEU 33 1.330 7.602 -36.153 249 HA LEU 33 HA LEU 33 1.330 5.644 -38.219 250 HB2 LEU 33 HB2 LEU 33 0.811 7.561 -39.732 251 HB3 LEU 33 HB1 LEU 33 -0.288 7.360 -38.386 252 HG LEU 33 HG LEU 33 1.194 9.197 -37.251 253 HD11 LEU 33 HD11 LEU 33 2.104 10.808 -38.843 254 HD12 LEU 33 HD12 LEU 33 1.733 9.711 -40.172 255 HD13 LEU 33 HD13 LEU 33 2.930 9.254 -38.961 256 HD21 LEU 33 HD21 LEU 33 -0.274 10.909 -38.169 257 HD22 LEU 33 HD22 LEU 33 -1.168 9.424 -37.842 258 HD23 LEU 33 HD23 LEU 33 -0.715 9.834 -39.496 259 H SER 34 HN SER 34 3.666 7.964 -37.100 260 HA SER 34 HA SER 34 5.371 7.839 -39.364 261 HB2 SER 34 HB2 SER 34 5.978 8.504 -36.477 262 HB3 SER 34 HB1 SER 34 7.122 8.702 -37.806 263 HG SER 34 HG SER 34 4.784 10.134 -37.218 264 H SER 35 HN SER 35 5.044 5.884 -36.455 265 HA SER 35 HA SER 35 7.302 4.239 -36.985 266 HB2 SER 35 HB2 SER 35 4.827 3.689 -35.333 267 HB3 SER 35 HB1 SER 35 6.306 2.727 -35.304 268 HG SER 35 HG SER 35 5.872 5.367 -34.389 269 H ALA 36 HN ALA 36 3.941 4.191 -37.956 270 HA ALA 36 HA ALA 36 3.929 1.506 -38.914 271 HB1 ALA 36 HB1 ALA 36 2.034 3.762 -39.550 272 HB2 ALA 36 HB2 ALA 36 1.889 2.651 -38.188 273 HB3 ALA 36 HB3 ALA 36 1.748 2.046 -39.839 274 H LEU 37 HN LEU 37 3.938 4.652 -40.623 275 HA LEU 37 HA LEU 37 4.454 3.268 -43.132 276 HB2 LEU 37 HB2 LEU 37 4.054 6.200 -42.556 277 HB3 LEU 37 HB1 LEU 37 4.224 5.507 -44.153 278 HG LEU 37 HG LEU 37 1.967 4.970 -42.220 279 HD11 LEU 37 HD11 LEU 37 0.600 6.159 -43.862 280 HD12 LEU 37 HD12 LEU 37 2.043 6.501 -44.816 281 HD13 LEU 37 HD13 LEU 37 1.868 7.193 -43.204 282 HD21 LEU 37 HD21 LEU 37 2.408 3.971 -45.034 283 HD22 LEU 37 HD22 LEU 37 0.951 3.729 -44.069 284 HD23 LEU 37 HD23 LEU 37 2.475 3.000 -43.563 285 H LYS 38 HN LYS 38 6.105 5.247 -40.815 286 HA LYS 38 HA LYS 38 8.272 5.762 -40.476 287 HB2 LYS 38 HB2 LYS 38 8.319 3.207 -41.021 288 HB3 LYS 38 HB1 LYS 38 9.110 3.725 -42.501 289 HG2 LYS 38 HG2 LYS 38 10.988 4.476 -41.394 290 HG3 LYS 38 HG1 LYS 38 10.132 4.664 -39.860 291 HD2 LYS 38 HD2 LYS 38 10.800 2.042 -41.202 292 HD3 LYS 38 HD1 LYS 38 11.637 2.731 -39.808 293 HE2 LYS 38 HE2 LYS 38 9.636 2.578 -38.471 294 HE3 LYS 38 HE1 LYS 38 8.699 2.046 -39.865 295 HZ1 LYS 38 HZ1 LYS 38 9.975 0.023 -39.945 296 HZ2 LYS 38 HZ2 LYS 38 9.325 0.215 -38.392 297 HZ3 LYS 38 HZ3 LYS 38 10.964 0.542 -38.670 298 HA PRO 39 HA PRO 39 8.631 8.222 -44.303 299 HB2 PRO 39 HB2 PRO 39 7.856 10.595 -43.265 300 HB3 PRO 39 HB1 PRO 39 6.708 9.367 -43.801 301 HG2 PRO 39 HG2 PRO 39 7.345 10.250 -41.084 302 HG3 PRO 39 HG1 PRO 39 5.955 9.321 -41.662 303 HD2 PRO 39 HD2 PRO 39 8.385 8.368 -40.380 304 HD3 PRO 39 HD1 PRO 39 6.904 7.470 -40.771 305 H THR 40 HN THR 40 10.076 9.889 -44.922 306 HA THR 40 HA THR 40 12.360 10.272 -43.170 307 HB THR 40 HB THR 40 13.276 11.537 -45.159 308 HG1 THR 40 HG1 THR 40 11.789 12.135 -46.548 309 HG21 THR 40 HG21 THR 40 13.786 9.167 -44.836 310 HG22 THR 40 HG22 THR 40 13.622 9.549 -46.549 311 HG23 THR 40 HG23 THR 40 12.313 8.727 -45.701 312 H PHE 41 HN PHE 41 9.793 12.096 -44.710 313 HA PHE 41 HA PHE 41 10.254 14.291 -42.805 314 HB2 PHE 41 HB2 PHE 41 10.814 15.015 -45.089 315 HB3 PHE 41 HB1 PHE 41 9.228 14.500 -45.650 316 HD1 PHE 41 HD1 PHE 41 10.911 16.863 -43.331 317 HD2 PHE 41 HD2 PHE 41 7.423 15.967 -45.599 318 HE1 PHE 41 HE1 PHE 41 10.015 19.099 -42.828 319 HE2 PHE 41 HE2 PHE 41 6.520 18.201 -45.100 320 HZ PHE 41 HZ PHE 41 7.816 19.770 -43.714 321 H LEU 42 HN LEU 42 8.581 14.726 -41.524 322 HA LEU 42 HA LEU 42 5.891 13.904 -42.313 323 HB2 LEU 42 HB2 LEU 42 7.089 12.100 -40.953 324 HB3 LEU 42 HB1 LEU 42 7.045 13.219 -39.609 325 HG LEU 42 HG LEU 42 5.266 11.420 -39.644 326 HD11 LEU 42 HD11 LEU 42 3.496 12.910 -38.869 327 HD12 LEU 42 HD12 LEU 42 4.350 14.289 -39.562 328 HD13 LEU 42 HD13 LEU 42 5.069 13.383 -38.229 329 HD21 LEU 42 HD21 LEU 42 4.152 13.141 -41.855 330 HD22 LEU 42 HD22 LEU 42 3.308 11.816 -41.051 331 HD23 LEU 42 HD23 LEU 42 4.747 11.489 -42.019 332 H GLU 43 HN GLU 43 4.671 15.664 -42.113 333 HA GLU 43 HA GLU 43 5.220 17.493 -39.874 334 HB2 GLU 43 HB2 GLU 43 6.177 18.511 -41.846 335 HB3 GLU 43 HB1 GLU 43 4.695 18.248 -42.753 336 HG2 GLU 43 HG2 GLU 43 3.514 19.819 -41.347 337 HG3 GLU 43 HG1 GLU 43 4.947 20.034 -40.344 338 H LEU 44 HN LEU 44 3.500 18.053 -38.719 339 HA LEU 44 HA LEU 44 0.828 17.605 -39.873 340 HB2 LEU 44 HB2 LEU 44 1.884 17.445 -37.092 341 HB3 LEU 44 HB1 LEU 44 0.238 18.004 -37.305 342 HG LEU 44 HG LEU 44 -0.249 15.884 -38.548 343 HD11 LEU 44 HD11 LEU 44 1.291 14.012 -38.290 344 HD12 LEU 44 HD12 LEU 44 2.470 15.085 -37.536 345 HD13 LEU 44 HD13 LEU 44 2.016 15.321 -39.224 346 HD21 LEU 44 HD21 LEU 44 -0.360 14.492 -36.540 347 HD22 LEU 44 HD22 LEU 44 -0.863 16.149 -36.210 348 HD23 LEU 44 HD23 LEU 44 0.738 15.597 -35.714 349 H VAL 45 HN VAL 45 -0.078 19.390 -40.627 350 HA VAL 45 HA VAL 45 0.547 21.934 -39.291 351 HB VAL 45 HB VAL 45 -0.453 23.006 -41.348 352 HG11 VAL 45 HG11 VAL 45 1.953 22.898 -40.986 353 HG12 VAL 45 HG12 VAL 45 1.571 22.699 -42.696 354 HG13 VAL 45 HG13 VAL 45 2.003 21.295 -41.720 355 HG21 VAL 45 HG21 VAL 45 -0.483 21.635 -43.400 356 HG22 VAL 45 HG22 VAL 45 -1.711 21.172 -42.223 357 HG23 VAL 45 HG23 VAL 45 -0.253 20.197 -42.402 358 H ASP 46 HN ASP 46 -1.075 23.342 -38.697 359 HA ASP 46 HA ASP 46 -3.490 22.233 -37.766 360 HB2 ASP 46 HB2 ASP 46 -2.530 24.224 -36.733 361 HB3 ASP 46 HB1 ASP 46 -2.728 25.126 -38.230 362 H LYS 47 HN LYS 47 -5.215 21.679 -38.878 363 HA LYS 47 HA LYS 47 -5.852 23.167 -41.342 364 HB2 LYS 47 HB2 LYS 47 -5.115 20.732 -41.609 365 HB3 LYS 47 HB1 LYS 47 -6.604 20.292 -40.789 366 HG2 LYS 47 HG2 LYS 47 -7.820 21.586 -42.594 367 HG3 LYS 47 HG1 LYS 47 -6.279 21.634 -43.455 368 HD2 LYS 47 HD2 LYS 47 -6.214 19.122 -43.232 369 HD3 LYS 47 HD1 LYS 47 -7.879 19.207 -42.656 370 HE2 LYS 47 HE2 LYS 47 -8.047 18.740 -44.952 371 HE3 LYS 47 HE1 LYS 47 -8.394 20.462 -44.808 372 HZ1 LYS 47 HZ1 LYS 47 -6.876 19.908 -46.650 373 HZ2 LYS 47 HZ2 LYS 47 -5.736 19.343 -45.528 374 HZ3 LYS 47 HZ3 LYS 47 -6.183 20.982 -45.536 375 H SER 48 HN SER 48 -7.204 24.618 -40.260 376 HA SER 48 HA SER 48 -9.007 23.923 -38.235 377 HB2 SER 48 HB2 SER 48 -9.205 26.257 -40.151 378 HB3 SER 48 HB1 SER 48 -9.962 26.134 -38.562 379 HG SER 48 HG SER 48 -7.398 25.653 -38.200 380 H CYS 49 HN CYS 49 -10.389 22.280 -38.633 381 HA CYS 49 HA CYS 49 -12.296 22.623 -40.836 382 HB2 CYS 49 HB2 CYS 49 -11.757 20.207 -39.091 383 HB3 CYS 49 HB1 CYS 49 -12.944 20.275 -40.390 384 HG CYS 49 HG CYS 49 -11.325 19.401 -42.164 385 H GLY 50 HN GLY 50 -12.485 21.328 -37.489 386 HA2 GLY 50 HA2 GLY 50 -13.847 23.291 -36.242 387 HA3 GLY 50 HA1 GLY 50 -15.105 22.527 -37.198 388 H CYS 51 HN CYS 51 -14.546 22.774 -34.268 389 HA CYS 51 HA CYS 51 -14.998 21.604 -32.396 390 HB2 CYS 51 HB2 CYS 51 -16.225 19.680 -34.374 391 HB3 CYS 51 HB1 CYS 51 -16.464 19.611 -32.632 392 HG CYS 51 HG CYS 51 -17.593 22.263 -32.598 393 H GLY 52 HN GLY 52 -12.745 21.268 -31.966 394 HA2 GLY 52 HA2 GLY 52 -11.513 19.590 -30.792 395 HA3 GLY 52 HA1 GLY 52 -12.174 18.386 -31.889 396 H THR 53 HN THR 53 -9.969 17.659 -32.118 397 HA THR 53 HA THR 53 -8.014 19.411 -33.264 398 HB THR 53 HB THR 53 -6.652 17.312 -33.487 399 HG1 THR 53 HG1 THR 53 -8.611 16.010 -31.928 400 HG21 THR 53 HG21 THR 53 -6.351 17.002 -31.068 401 HG22 THR 53 HG22 THR 53 -7.868 17.851 -30.774 402 HG23 THR 53 HG23 THR 53 -6.503 18.709 -31.486 403 H SER 54 HN SER 54 -7.475 19.695 -35.327 404 HA SER 54 HA SER 54 -8.321 17.777 -37.351 405 HB2 SER 54 HB2 SER 54 -8.871 20.752 -37.585 406 HB3 SER 54 HB1 SER 54 -9.237 19.524 -38.797 407 HG SER 54 HG SER 54 -10.296 18.924 -36.357 408 H PHE 55 HN PHE 55 -6.516 17.259 -38.434 409 HA PHE 55 HA PHE 55 -4.431 19.311 -38.735 410 HB2 PHE 55 HB2 PHE 55 -4.042 16.488 -37.733 411 HB3 PHE 55 HB1 PHE 55 -2.725 17.533 -38.249 412 HD1 PHE 55 HD1 PHE 55 -2.248 19.615 -36.975 413 HD2 PHE 55 HD2 PHE 55 -4.998 16.679 -35.585 414 HE1 PHE 55 HE1 PHE 55 -2.095 20.550 -34.705 415 HE2 PHE 55 HE2 PHE 55 -4.854 17.613 -33.314 416 HZ PHE 55 HZ PHE 55 -3.400 19.551 -32.872 417 H ASP 56 HN ASP 56 -3.161 19.182 -40.522 418 HA ASP 56 HA ASP 56 -3.859 17.121 -42.517 419 HB2 ASP 56 HB2 ASP 56 -4.115 19.697 -42.993 420 HB3 ASP 56 HB1 ASP 56 -2.371 19.649 -43.152 421 H ALA 57 HN ALA 57 -2.337 15.588 -42.775 422 HA ALA 57 HA ALA 57 0.351 16.180 -41.739 423 HB1 ALA 57 HB1 ALA 57 -0.979 13.502 -42.095 424 HB2 ALA 57 HB2 ALA 57 -0.843 14.392 -40.578 425 HB3 ALA 57 HB3 ALA 57 0.608 13.796 -41.385 426 H VAL 58 HN VAL 58 1.924 16.404 -43.133 427 HA VAL 58 HA VAL 58 1.682 15.286 -45.824 428 HB VAL 58 HB VAL 58 3.861 17.057 -44.689 429 HG11 VAL 58 HG11 VAL 58 4.447 17.456 -47.037 430 HG12 VAL 58 HG12 VAL 58 3.208 16.304 -47.536 431 HG13 VAL 58 HG13 VAL 58 4.599 15.754 -46.605 432 HG21 VAL 58 HG21 VAL 58 1.720 18.215 -44.675 433 HG22 VAL 58 HG22 VAL 58 1.466 17.799 -46.370 434 HG23 VAL 58 HG23 VAL 58 2.781 18.883 -45.915 435 H ILE 59 HN ILE 59 2.355 13.251 -46.051 436 HA ILE 59 HA ILE 59 4.585 12.346 -44.370 437 HB ILE 59 HB ILE 59 2.650 11.071 -43.845 438 HG12 ILE 59 HG12 ILE 59 4.931 9.869 -44.393 439 HG13 ILE 59 HG11 ILE 59 3.499 8.937 -43.984 440 HG21 ILE 59 HG21 ILE 59 1.292 9.867 -45.436 441 HG22 ILE 59 HG22 ILE 59 2.303 10.437 -46.762 442 HG23 ILE 59 HG23 ILE 59 1.333 11.584 -45.838 443 HD11 ILE 59 HD11 ILE 59 4.701 7.947 -45.851 444 HD12 ILE 59 HD12 ILE 59 4.539 9.445 -46.768 445 HD13 ILE 59 HD13 ILE 59 3.106 8.502 -46.357 446 H VAL 60 HN VAL 60 6.416 12.274 -45.340 447 HA VAL 60 HA VAL 60 6.557 11.510 -48.183 448 HB VAL 60 HB VAL 60 8.551 13.070 -46.514 449 HG11 VAL 60 HG11 VAL 60 9.740 13.441 -48.616 450 HG12 VAL 60 HG12 VAL 60 8.595 12.388 -49.448 451 HG13 VAL 60 HG13 VAL 60 9.661 11.726 -48.207 452 HG21 VAL 60 HG21 VAL 60 7.948 14.969 -47.946 453 HG22 VAL 60 HG22 VAL 60 6.570 14.382 -47.015 454 HG23 VAL 60 HG23 VAL 60 6.713 13.980 -48.727 455 H SER 61 HN SER 61 7.002 9.364 -48.300 456 HA SER 61 HA SER 61 9.103 8.275 -46.587 457 HB2 SER 61 HB2 SER 61 7.168 7.884 -45.225 458 HB3 SER 61 HB1 SER 61 6.252 7.271 -46.601 459 HG SER 61 HG SER 61 7.914 5.945 -44.930 460 H ASN 62 HN ASN 62 9.960 6.298 -47.254 461 HA ASN 62 HA ASN 62 9.909 5.680 -50.021 462 HB2 ASN 62 HB2 ASN 62 11.087 4.386 -47.590 463 HB3 ASN 62 HB1 ASN 62 11.014 3.472 -49.092 464 HD21 ASN 62 HD21 ASN 62 11.454 6.936 -49.016 465 HD22 ASN 62 HD22 ASN 62 13.098 6.934 -49.564 466 H ASN 63 HN ASN 63 7.863 4.830 -47.407 467 HA ASN 63 HA ASN 63 7.004 2.281 -48.331 468 HB2 ASN 63 HB2 ASN 63 6.753 3.295 -45.990 469 HB3 ASN 63 HB1 ASN 63 5.365 4.159 -46.636 470 HD21 ASN 63 HD21 ASN 63 3.495 3.013 -47.148 471 HD22 ASN 63 HD22 ASN 63 3.231 1.398 -46.604 472 H PHE 64 HN PHE 64 6.706 5.136 -49.859 473 HA PHE 64 HA PHE 64 4.148 4.364 -51.089 474 HB2 PHE 64 HB2 PHE 64 3.965 6.425 -49.701 475 HB3 PHE 64 HB1 PHE 64 5.180 7.188 -50.720 476 HD1 PHE 64 HD2 PHE 64 1.930 5.380 -51.099 477 HD2 PHE 64 HD1 PHE 64 4.424 8.589 -52.363 478 HE1 PHE 64 HE2 PHE 64 0.163 6.148 -52.629 479 HE2 PHE 64 HE1 PHE 64 2.662 9.362 -53.895 480 HZ PHE 64 HZ PHE 64 0.528 8.141 -54.030 481 H GLU 65 HN GLU 65 7.339 4.299 -51.642 482 HA GLU 65 HA GLU 65 7.469 5.681 -54.156 483 HB2 GLU 65 HB2 GLU 65 9.710 4.689 -54.411 484 HB3 GLU 65 HB1 GLU 65 9.501 5.518 -52.880 485 HG2 GLU 65 HG2 GLU 65 10.698 3.602 -52.353 486 HG3 GLU 65 HG1 GLU 65 9.045 3.225 -51.882 487 H ASP 66 HN ASP 66 6.122 2.779 -53.276 488 HA ASP 66 HA ASP 66 6.677 1.418 -55.779 489 HB2 ASP 66 HB2 ASP 66 5.405 -0.429 -54.866 490 HB3 ASP 66 HB1 ASP 66 6.545 0.139 -53.655 491 H LYS 67 HN LYS 67 4.539 3.681 -54.575 492 HA LYS 67 HA LYS 67 2.856 4.853 -55.536 493 HB2 LYS 67 HB2 LYS 67 4.371 4.584 -57.555 494 HB3 LYS 67 HB1 LYS 67 3.342 3.248 -58.046 495 HG2 LYS 67 HG2 LYS 67 1.418 4.796 -58.110 496 HG3 LYS 67 HG1 LYS 67 2.509 6.124 -57.713 497 HD2 LYS 67 HD2 LYS 67 2.090 6.030 -60.113 498 HD3 LYS 67 HD1 LYS 67 3.784 5.684 -59.758 499 HE2 LYS 67 HE2 LYS 67 2.958 4.150 -61.442 500 HE3 LYS 67 HE1 LYS 67 3.315 3.280 -59.952 501 HZ1 LYS 67 HZ1 LYS 67 1.262 2.473 -60.729 502 HZ2 LYS 67 HZ2 LYS 67 0.655 4.025 -61.028 503 HZ3 LYS 67 HZ3 LYS 67 0.877 3.498 -59.434 504 H LYS 68 HN LYS 68 2.427 2.146 -54.286 505 HA LYS 68 HA LYS 68 -0.064 1.362 -55.606 506 HB2 LYS 68 HB2 LYS 68 1.330 0.141 -53.214 507 HB3 LYS 68 HB1 LYS 68 -0.099 -0.507 -54.007 508 HG2 LYS 68 HG2 LYS 68 2.545 -0.126 -55.390 509 HG3 LYS 68 HG1 LYS 68 2.054 -1.626 -54.607 510 HD2 LYS 68 HD2 LYS 68 0.389 -0.316 -56.741 511 HD3 LYS 68 HD1 LYS 68 1.687 -1.448 -57.126 512 HE2 LYS 68 HE2 LYS 68 0.574 -3.117 -55.649 513 HE3 LYS 68 HE1 LYS 68 -0.765 -1.990 -55.457 514 HZ1 LYS 68 HZ1 LYS 68 -1.191 -2.107 -57.817 515 HZ2 LYS 68 HZ2 LYS 68 -1.183 -3.672 -57.168 516 HZ3 LYS 68 HZ3 LYS 68 0.153 -3.114 -58.050 517 H LEU 69 HN LEU 69 -1.414 3.058 -55.184 518 HA LEU 69 HA LEU 69 -1.507 4.343 -52.652 519 HB2 LEU 69 HB2 LEU 69 -3.509 5.515 -53.577 520 HB3 LEU 69 HB1 LEU 69 -2.057 5.653 -54.546 521 HG LEU 69 HG LEU 69 -3.110 3.655 -55.889 522 HD11 LEU 69 HD11 LEU 69 -4.981 3.258 -54.386 523 HD12 LEU 69 HD12 LEU 69 -5.546 3.759 -55.981 524 HD13 LEU 69 HD13 LEU 69 -5.551 4.908 -54.643 525 HD21 LEU 69 HD21 LEU 69 -2.636 5.866 -56.789 526 HD22 LEU 69 HD22 LEU 69 -4.134 6.482 -56.091 527 HD23 LEU 69 HD23 LEU 69 -4.191 5.268 -57.369 528 H LEU 70 HN LEU 70 -3.290 1.711 -54.087 529 HA LEU 70 HA LEU 70 -5.345 1.670 -52.144 530 HB2 LEU 70 HB2 LEU 70 -5.956 -0.505 -52.951 531 HB3 LEU 70 HB1 LEU 70 -5.618 0.548 -54.299 532 HG LEU 70 HG LEU 70 -4.820 -1.572 -54.903 533 HD11 LEU 70 HD11 LEU 70 -2.451 -1.323 -55.219 534 HD12 LEU 70 HD12 LEU 70 -2.388 -0.080 -53.975 535 HD13 LEU 70 HD13 LEU 70 -3.270 0.217 -55.471 536 HD21 LEU 70 HD21 LEU 70 -3.397 -1.753 -52.258 537 HD22 LEU 70 HD22 LEU 70 -3.295 -2.934 -53.564 538 HD23 LEU 70 HD23 LEU 70 -4.833 -2.654 -52.747 539 H ASP 71 HN ASP 71 -2.117 0.334 -52.232 540 HA ASP 71 HA ASP 71 -2.457 -1.251 -49.874 541 HB2 ASP 71 HB2 ASP 71 -0.691 -1.635 -51.661 542 HB3 ASP 71 HB1 ASP 71 0.164 -0.249 -50.991 543 H ARG 72 HN ARG 72 -1.132 1.946 -50.609 544 HA ARG 72 HA ARG 72 -0.413 2.707 -48.016 545 HB2 ARG 72 HB2 ARG 72 0.068 3.973 -50.139 546 HB3 ARG 72 HB1 ARG 72 -1.607 4.495 -50.151 547 HG2 ARG 72 HG2 ARG 72 0.109 5.049 -47.769 548 HG3 ARG 72 HG1 ARG 72 0.242 6.056 -49.209 549 HD2 ARG 72 HD2 ARG 72 -2.363 5.514 -47.795 550 HD3 ARG 72 HD1 ARG 72 -1.331 6.894 -47.427 551 HE ARG 72 HE ARG 72 -1.648 7.290 -50.003 552 HH11 ARG 72 HH11 ARG 72 -4.038 6.237 -47.681 553 HH12 ARG 72 HH12 ARG 72 -5.372 6.980 -48.505 554 HH21 ARG 72 HH21 ARG 72 -3.398 8.286 -51.112 555 HH22 ARG 72 HH22 ARG 72 -5.007 8.142 -50.466 556 H HIS 73 HN HIS 73 -3.495 2.938 -49.720 557 HA HIS 73 HA HIS 73 -5.025 4.204 -47.766 558 HB2 HIS 73 HB2 HIS 73 -5.769 3.871 -50.075 559 HB3 HIS 73 HB1 HIS 73 -5.841 2.134 -49.819 560 HD1 HIS 73 HD1 HIS 73 -7.626 5.327 -48.878 561 HD2 HIS 73 HD2 HIS 73 -8.197 1.206 -48.750 562 HE1 HIS 73 HE1 HIS 73 -10.043 4.990 -48.267 563 HE2 HIS 73 HE2 HIS 73 -10.311 2.499 -48.001 564 H ARG 74 HN ARG 74 -4.683 0.690 -48.352 565 HA ARG 74 HA ARG 74 -6.391 -0.092 -46.267 566 HB2 ARG 74 HB2 ARG 74 -5.421 -2.338 -46.551 567 HB3 ARG 74 HB1 ARG 74 -5.839 -1.597 -48.089 568 HG2 ARG 74 HG2 ARG 74 -3.437 -0.937 -48.317 569 HG3 ARG 74 HG1 ARG 74 -3.101 -1.917 -46.891 570 HD2 ARG 74 HD2 ARG 74 -4.382 -2.950 -49.414 571 HD3 ARG 74 HD1 ARG 74 -2.664 -3.076 -49.042 572 HE ARG 74 HE ARG 74 -4.828 -4.402 -47.528 573 HH11 ARG 74 HH11 ARG 74 -1.474 -4.161 -48.550 574 HH12 ARG 74 HH12 ARG 74 -1.036 -5.722 -47.906 575 HH21 ARG 74 HH21 ARG 74 -4.251 -6.454 -46.680 576 HH22 ARG 74 HH22 ARG 74 -2.611 -7.027 -46.848 577 H LEU 75 HN LEU 75 -2.864 0.358 -46.303 578 HA LEU 75 HA LEU 75 -2.394 -0.672 -43.718 579 HB2 LEU 75 HB2 LEU 75 -0.846 1.380 -45.301 580 HB3 LEU 75 HB1 LEU 75 -0.275 0.637 -43.820 581 HG LEU 75 HG LEU 75 -0.860 -0.821 -46.399 582 HD11 LEU 75 HD11 LEU 75 1.754 -0.132 -45.063 583 HD12 LEU 75 HD12 LEU 75 1.126 0.581 -46.549 584 HD13 LEU 75 HD13 LEU 75 1.563 -1.126 -46.507 585 HD21 LEU 75 HD21 LEU 75 0.157 -2.745 -45.290 586 HD22 LEU 75 HD22 LEU 75 -1.287 -2.206 -44.434 587 HD23 LEU 75 HD23 LEU 75 0.311 -1.812 -43.802 588 H VAL 76 HN VAL 76 -2.815 2.667 -44.853 589 HA VAL 76 HA VAL 76 -2.591 3.954 -42.396 590 HB VAL 76 HB VAL 76 -4.180 4.712 -44.850 591 HG11 VAL 76 HG11 VAL 76 -5.186 5.812 -42.922 592 HG12 VAL 76 HG12 VAL 76 -4.317 6.976 -43.923 593 HG13 VAL 76 HG13 VAL 76 -3.601 6.400 -42.418 594 HG21 VAL 76 HG21 VAL 76 -2.345 6.302 -45.193 595 HG22 VAL 76 HG22 VAL 76 -1.769 4.635 -45.153 596 HG23 VAL 76 HG23 VAL 76 -1.545 5.682 -43.750 597 H ASN 77 HN ASN 77 -5.478 2.614 -43.985 598 HA ASN 77 HA ASN 77 -7.313 3.493 -42.028 599 HB2 ASN 77 HB2 ASN 77 -7.499 1.158 -43.939 600 HB3 ASN 77 HB1 ASN 77 -8.836 1.759 -42.968 601 HD21 ASN 77 HD21 ASN 77 -7.943 4.569 -43.329 602 HD22 ASN 77 HD22 ASN 77 -8.412 4.985 -44.935 603 H THR 78 HN THR 78 -5.222 0.703 -42.184 604 HA THR 78 HA THR 78 -6.560 -0.877 -40.260 605 HB THR 78 HB THR 78 -3.636 -0.904 -41.037 606 HG1 THR 78 HG1 THR 78 -5.004 -1.347 -42.805 607 HG21 THR 78 HG21 THR 78 -4.016 -2.046 -38.906 608 HG22 THR 78 HG22 THR 78 -3.640 -3.206 -40.180 609 HG23 THR 78 HG23 THR 78 -5.306 -3.001 -39.639 610 H ILE 79 HN ILE 79 -3.756 1.330 -39.956 611 HA ILE 79 HA ILE 79 -3.697 0.968 -37.087 612 HB ILE 79 HB ILE 79 -2.182 2.885 -38.870 613 HG12 ILE 79 HG12 ILE 79 -0.252 1.425 -37.868 614 HG13 ILE 79 HG11 ILE 79 -1.539 0.270 -37.543 615 HG21 ILE 79 HG21 ILE 79 -0.824 3.443 -36.906 616 HG22 ILE 79 HG22 ILE 79 -1.907 2.486 -35.894 617 HG23 ILE 79 HG23 ILE 79 -2.507 3.932 -36.705 618 HD11 ILE 79 HD11 ILE 79 -0.784 1.377 -40.234 619 HD12 ILE 79 HD12 ILE 79 -2.097 0.240 -39.925 620 HD13 ILE 79 HD13 ILE 79 -0.424 -0.238 -39.626 621 H LEU 80 HN LEU 80 -4.693 3.540 -39.314 622 HA LEU 80 HA LEU 80 -5.323 5.340 -37.199 623 HB2 LEU 80 HB2 LEU 80 -5.710 5.397 -40.157 624 HB3 LEU 80 HB1 LEU 80 -6.548 6.563 -39.152 625 HG LEU 80 HG LEU 80 -4.328 7.279 -38.234 626 HD11 LEU 80 HD11 LEU 80 -3.053 5.260 -38.717 627 HD12 LEU 80 HD12 LEU 80 -2.310 6.675 -39.463 628 HD13 LEU 80 HD13 LEU 80 -3.241 5.547 -40.447 629 HD21 LEU 80 HD21 LEU 80 -4.685 7.509 -41.217 630 HD22 LEU 80 HD22 LEU 80 -3.687 8.558 -40.211 631 HD23 LEU 80 HD23 LEU 80 -5.438 8.536 -39.995 632 H LYS 81 HN LYS 81 -6.942 2.643 -38.353 633 HA LYS 81 HA LYS 81 -9.612 3.226 -38.109 634 HB2 LYS 81 HB2 LYS 81 -9.196 1.003 -38.600 635 HB3 LYS 81 HB1 LYS 81 -7.937 0.859 -37.387 636 HG2 LYS 81 HG2 LYS 81 -9.852 -0.502 -36.812 637 HG3 LYS 81 HG1 LYS 81 -9.628 0.785 -35.631 638 HD2 LYS 81 HD2 LYS 81 -11.400 2.084 -36.781 639 HD3 LYS 81 HD1 LYS 81 -11.661 0.708 -37.860 640 HE2 LYS 81 HE2 LYS 81 -12.279 -0.692 -35.998 641 HE3 LYS 81 HE1 LYS 81 -11.880 0.589 -34.856 642 HZ1 LYS 81 HZ1 LYS 81 -14.250 0.461 -35.197 643 HZ2 LYS 81 HZ2 LYS 81 -14.065 0.660 -36.865 644 HZ3 LYS 81 HZ3 LYS 81 -13.666 1.928 -35.812 645 H GLU 82 HN GLU 82 -7.629 2.114 -35.342 646 HA GLU 82 HA GLU 82 -9.480 3.235 -33.463 647 HB2 GLU 82 HB2 GLU 82 -7.905 1.222 -33.126 648 HB3 GLU 82 HB1 GLU 82 -6.644 2.412 -32.847 649 HG2 GLU 82 HG2 GLU 82 -7.450 1.749 -30.730 650 HG3 GLU 82 HG1 GLU 82 -8.079 3.369 -31.031 651 H GLU 83 HN GLU 83 -6.445 4.187 -34.912 652 HA GLU 83 HA GLU 83 -5.533 6.150 -33.202 653 HB2 GLU 83 HB2 GLU 83 -4.587 5.155 -35.383 654 HB3 GLU 83 HB1 GLU 83 -5.451 6.466 -36.172 655 HG2 GLU 83 HG2 GLU 83 -3.399 7.350 -35.906 656 HG3 GLU 83 HG1 GLU 83 -4.210 7.953 -34.466 657 H LEU 84 HN LEU 84 -7.502 6.648 -36.075 658 HA LEU 84 HA LEU 84 -7.835 9.351 -36.052 659 HB2 LEU 84 HB2 LEU 84 -9.823 7.262 -36.912 660 HB3 LEU 84 HB1 LEU 84 -10.027 8.975 -37.222 661 HG LEU 84 HG LEU 84 -7.846 7.191 -38.296 662 HD11 LEU 84 HD11 LEU 84 -9.993 6.919 -39.397 663 HD12 LEU 84 HD12 LEU 84 -8.842 7.729 -40.461 664 HD13 LEU 84 HD13 LEU 84 -10.101 8.661 -39.650 665 HD21 LEU 84 HD21 LEU 84 -6.949 9.403 -37.781 666 HD22 LEU 84 HD22 LEU 84 -8.263 10.154 -38.685 667 HD23 LEU 84 HD23 LEU 84 -7.073 9.161 -39.524 668 H GLN 85 HN GLN 85 -9.510 7.106 -33.931 669 HA GLN 85 HA GLN 85 -11.806 8.527 -33.316 670 HB2 GLN 85 HB2 GLN 85 -10.149 7.009 -31.299 671 HB3 GLN 85 HB1 GLN 85 -11.858 7.382 -31.181 672 HG2 GLN 85 HG2 GLN 85 -10.475 5.358 -32.879 673 HG3 GLN 85 HG1 GLN 85 -11.832 5.157 -31.776 674 HE21 GLN 85 HE21 GLN 85 -10.832 5.843 -34.960 675 HE22 GLN 85 HE22 GLN 85 -12.395 5.974 -35.665 676 H ASN 86 HN ASN 86 -8.528 9.212 -32.395 677 HA ASN 86 HA ASN 86 -9.187 10.965 -30.212 678 HB2 ASN 86 HB2 ASN 86 -6.596 10.607 -31.737 679 HB3 ASN 86 HB1 ASN 86 -6.782 11.553 -30.265 680 HD21 ASN 86 HD21 ASN 86 -6.563 8.388 -31.631 681 HD22 ASN 86 HD22 ASN 86 -6.445 7.526 -30.134 682 H ILE 87 HN ILE 87 -8.904 11.272 -33.625 683 HA ILE 87 HA ILE 87 -8.659 14.202 -33.465 684 HB ILE 87 HB ILE 87 -8.562 12.715 -36.062 685 HG12 ILE 87 HG12 ILE 87 -6.275 12.861 -34.081 686 HG13 ILE 87 HG11 ILE 87 -7.091 11.405 -34.644 687 HG21 ILE 87 HG21 ILE 87 -8.513 15.151 -36.058 688 HG22 ILE 87 HG22 ILE 87 -6.985 14.496 -36.646 689 HG23 ILE 87 HG23 ILE 87 -7.098 15.133 -35.006 690 HD11 ILE 87 HD11 ILE 87 -4.940 11.674 -35.723 691 HD12 ILE 87 HD12 ILE 87 -5.433 13.253 -36.336 692 HD13 ILE 87 HD13 ILE 87 -6.253 11.795 -36.893 693 H HIS 88 HN HIS 88 -10.122 15.485 -34.803 694 HA HIS 88 HA HIS 88 -12.711 14.149 -35.134 695 HB2 HIS 88 HB2 HIS 88 -12.604 16.258 -33.802 696 HB3 HIS 88 HB1 HIS 88 -12.097 17.109 -35.257 697 HD1 HIS 88 HD1 HIS 88 -15.081 15.598 -33.602 698 HD2 HIS 88 HD2 HIS 88 -14.133 17.547 -37.152 699 HE1 HIS 88 HE1 HIS 88 -17.283 16.206 -34.653 700 HE2 HIS 88 HE2 HIS 88 -16.689 17.436 -36.773 701 H ALA 89 HN ALA 89 -10.271 15.955 -36.903 702 HA ALA 89 HA ALA 89 -11.305 14.820 -39.373 703 HB1 ALA 89 HB1 ALA 89 -12.439 16.983 -39.211 704 HB2 ALA 89 HB2 ALA 89 -11.296 16.950 -40.554 705 HB3 ALA 89 HB3 ALA 89 -10.878 17.790 -39.061 706 H PHE 90 HN PHE 90 -9.478 13.603 -39.618 707 HA PHE 90 HA PHE 90 -6.911 15.010 -39.719 708 HB2 PHE 90 HB2 PHE 90 -7.072 12.946 -38.350 709 HB3 PHE 90 HB1 PHE 90 -7.475 12.040 -39.803 710 HD1 PHE 90 HD1 PHE 90 -4.828 14.264 -38.423 711 HD2 PHE 90 HD2 PHE 90 -5.789 11.018 -41.000 712 HE1 PHE 90 HE1 PHE 90 -2.434 13.893 -38.845 713 HE2 PHE 90 HE2 PHE 90 -3.397 10.642 -41.425 714 HZ PHE 90 HZ PHE 90 -1.717 12.079 -40.347 715 H SER 91 HN SER 91 -5.800 15.293 -41.553 716 HA SER 91 HA SER 91 -6.772 13.984 -44.006 717 HB2 SER 91 HB2 SER 91 -7.459 16.314 -44.059 718 HB3 SER 91 HB1 SER 91 -5.835 16.841 -43.627 719 HG SER 91 HG SER 91 -5.364 16.824 -45.648 720 H MET 92 HN MET 92 -5.081 13.553 -45.599 721 HA MET 92 HA MET 92 -2.350 13.817 -44.611 722 HB2 MET 92 HB2 MET 92 -1.813 11.494 -44.808 723 HB3 MET 92 HB1 MET 92 -3.223 11.632 -43.772 724 HG2 MET 92 HG2 MET 92 -3.336 10.918 -46.694 725 HG3 MET 92 HG1 MET 92 -3.285 9.741 -45.388 726 HE1 MET 92 HE1 MET 92 -5.243 9.399 -43.621 727 HE2 MET 92 HE2 MET 92 -6.681 10.418 -43.554 728 HE3 MET 92 HE3 MET 92 -5.099 11.099 -43.173 729 H LYS 93 HN LYS 93 -0.913 14.207 -46.152 730 HA LYS 93 HA LYS 93 -1.660 13.643 -48.954 731 HB2 LYS 93 HB2 LYS 93 -0.119 15.935 -47.757 732 HB3 LYS 93 HB1 LYS 93 0.139 15.462 -49.428 733 HG2 LYS 93 HG2 LYS 93 -1.411 17.311 -49.287 734 HG3 LYS 93 HG1 LYS 93 -2.221 15.875 -49.912 735 HD2 LYS 93 HD2 LYS 93 -3.412 15.540 -47.951 736 HD3 LYS 93 HD1 LYS 93 -2.295 16.507 -46.992 737 HE2 LYS 93 HE2 LYS 93 -4.348 17.728 -47.270 738 HE3 LYS 93 HE1 LYS 93 -3.087 18.522 -48.210 739 HZ1 LYS 93 HZ1 LYS 93 -3.945 17.384 -50.191 740 HZ2 LYS 93 HZ2 LYS 93 -5.107 18.392 -49.476 741 HZ3 LYS 93 HZ3 LYS 93 -5.193 16.712 -49.259 742 H CYS 94 HN CYS 94 -0.607 11.901 -49.598 743 HA CYS 94 HA CYS 94 1.955 11.260 -48.367 744 HB2 CYS 94 HB2 CYS 94 1.658 9.055 -49.573 745 HB3 CYS 94 HB1 CYS 94 0.467 9.422 -48.333 746 HG CYS 94 HG CYS 94 -0.679 10.547 -51.181 747 H HIS 95 HN HIS 95 3.845 11.402 -49.316 748 HA HIS 95 HA HIS 95 4.034 11.483 -52.231 749 HB2 HIS 95 HB2 HIS 95 5.061 13.651 -50.389 750 HB3 HIS 95 HB1 HIS 95 5.671 13.422 -52.022 751 HD1 HIS 95 HD1 HIS 95 3.179 15.245 -50.182 752 HD2 HIS 95 HD2 HIS 95 3.465 13.668 -54.016 753 HE1 HIS 95 HE1 HIS 95 1.454 16.463 -51.542 754 HE2 HIS 95 HE2 HIS 95 1.801 15.647 -53.902 755 H THR 96 HN THR 96 6.359 11.351 -52.916 756 HA THR 96 HA THR 96 7.842 9.626 -51.068 757 HB THR 96 HB THR 96 9.197 9.046 -53.102 758 HG1 THR 96 HG1 THR 96 7.419 9.808 -54.956 759 HG21 THR 96 HG21 THR 96 6.220 8.576 -53.320 760 HG22 THR 96 HG22 THR 96 7.360 7.607 -52.384 761 HG23 THR 96 HG23 THR 96 7.471 7.645 -54.145 762 HA PRO 97 HA PRO 97 11.104 12.618 -50.427 763 HB2 PRO 97 HB2 PRO 97 13.031 10.505 -51.238 764 HB3 PRO 97 HB1 PRO 97 12.964 11.455 -49.748 765 HG2 PRO 97 HG2 PRO 97 12.232 8.894 -49.758 766 HG3 PRO 97 HG1 PRO 97 11.347 10.091 -48.795 767 HD2 PRO 97 HD2 PRO 97 10.612 8.845 -51.414 768 HD3 PRO 97 HD1 PRO 97 9.580 9.234 -50.022 769 H LEU 98 HN LEU 98 11.106 10.608 -53.294 770 HA LEU 98 HA LEU 98 12.834 12.213 -54.869 771 HB2 LEU 98 HB2 LEU 98 11.660 9.753 -55.152 772 HB3 LEU 98 HB1 LEU 98 10.728 10.718 -56.277 773 HG LEU 98 HG LEU 98 12.576 9.596 -57.404 774 HD11 LEU 98 HD11 LEU 98 12.993 12.573 -57.208 775 HD12 LEU 98 HD12 LEU 98 11.854 11.750 -58.273 776 HD13 LEU 98 HD13 LEU 98 13.589 11.529 -58.498 777 HD21 LEU 98 HD21 LEU 98 14.894 10.173 -56.897 778 HD22 LEU 98 HD22 LEU 98 14.102 9.427 -55.508 779 HD23 LEU 98 HD23 LEU 98 14.355 11.172 -55.548 780 H GLU 99 HN GLU 99 9.297 12.007 -54.554 781 HA GLU 99 HA GLU 99 8.653 14.036 -56.389 782 HB2 GLU 99 HB2 GLU 99 7.008 12.439 -55.481 783 HB3 GLU 99 HB1 GLU 99 7.160 13.187 -53.899 784 HG2 GLU 99 HG2 GLU 99 5.170 14.005 -54.872 785 HG3 GLU 99 HG1 GLU 99 6.345 15.316 -54.917 786 H TYR 100 HN TYR 100 9.306 14.122 -52.920 787 HA TYR 100 HA TYR 100 8.855 16.878 -52.534 788 HB2 TYR 100 HB2 TYR 100 8.976 15.218 -50.704 789 HB3 TYR 100 HB1 TYR 100 10.693 15.013 -51.012 790 HD1 TYR 100 HD1 TYR 100 8.258 17.757 -50.262 791 HD2 TYR 100 HD2 TYR 100 12.159 16.169 -49.661 792 HE1 TYR 100 HE1 TYR 100 8.740 19.561 -48.661 793 HE2 TYR 100 HE2 TYR 100 12.654 17.971 -48.062 794 HH TYR 100 HH TYR 100 10.206 20.065 -46.842 795 H ASP 101 HN ASP 101 11.600 15.044 -53.668 796 HA ASP 101 HA ASP 101 13.638 16.928 -53.364 797 HB2 ASP 101 HB2 ASP 101 13.948 14.525 -53.963 798 HB3 ASP 101 HB1 ASP 101 13.378 14.894 -55.587 799 H LYS 102 HN LYS 102 11.256 16.530 -55.948 800 HA LYS 102 HA LYS 102 12.347 18.452 -57.705 801 HB2 LYS 102 HB2 LYS 102 9.647 17.224 -57.389 802 HB3 LYS 102 HB1 LYS 102 9.778 18.690 -58.346 803 HG2 LYS 102 HG2 LYS 102 9.956 16.998 -59.916 804 HG3 LYS 102 HG1 LYS 102 11.632 17.455 -59.619 805 HD2 LYS 102 HD2 LYS 102 11.437 15.047 -59.690 806 HD3 LYS 102 HD1 LYS 102 11.840 15.563 -58.051 807 HE2 LYS 102 HE2 LYS 102 10.137 13.844 -57.984 808 HE3 LYS 102 HE1 LYS 102 9.475 15.377 -57.425 809 HZ1 LYS 102 HZ1 LYS 102 7.881 14.405 -58.836 810 HZ2 LYS 102 HZ2 LYS 102 9.030 14.059 -60.042 811 HZ3 LYS 102 HZ3 LYS 102 8.584 15.666 -59.736 812 H LEU 103 HN LEU 103 10.021 18.711 -55.061 813 HA LEU 103 HA LEU 103 9.291 21.394 -55.494 814 HB2 LEU 103 HB2 LEU 103 9.334 19.935 -52.855 815 HB3 LEU 103 HB1 LEU 103 8.352 21.325 -53.274 816 HG LEU 103 HG LEU 103 8.084 18.552 -54.438 817 HD11 LEU 103 HD11 LEU 103 5.946 18.520 -53.253 818 HD12 LEU 103 HD12 LEU 103 6.319 20.090 -52.543 819 HD13 LEU 103 HD13 LEU 103 7.307 18.685 -52.144 820 HD21 LEU 103 HD21 LEU 103 6.083 19.414 -55.540 821 HD22 LEU 103 HD22 LEU 103 7.527 20.269 -56.081 822 HD23 LEU 103 HD23 LEU 103 6.434 21.030 -54.925 823 H LYS 104 HN LYS 104 11.629 19.958 -53.243 824 HA LYS 104 HA LYS 104 12.508 22.424 -52.154 825 HB2 LYS 104 HB2 LYS 104 14.434 21.015 -51.299 826 HB3 LYS 104 HB1 LYS 104 12.823 20.478 -50.838 827 HG2 LYS 104 HG2 LYS 104 12.860 18.760 -52.520 828 HG3 LYS 104 HG1 LYS 104 14.404 19.350 -53.135 829 HD2 LYS 104 HD2 LYS 104 14.030 18.370 -50.316 830 HD3 LYS 104 HD1 LYS 104 14.499 17.310 -51.648 831 HE2 LYS 104 HE2 LYS 104 16.421 18.844 -52.079 832 HE3 LYS 104 HE1 LYS 104 15.992 19.707 -50.603 833 HZ1 LYS 104 HZ1 LYS 104 17.745 18.048 -50.255 834 HZ2 LYS 104 HZ2 LYS 104 16.678 16.819 -50.738 835 HZ3 LYS 104 HZ3 LYS 104 16.363 17.710 -49.333 836 H SER 105 HN SER 105 13.272 20.798 -55.072 837 HA SER 105 HA SER 105 15.909 21.657 -55.498 838 HB2 SER 105 HB2 SER 105 14.851 19.925 -56.864 839 HB3 SER 105 HB1 SER 105 13.720 21.108 -57.516 840 HG SER 105 HG SER 105 16.299 21.915 -57.825 841 H LYS 106 HN LYS 106 12.883 23.332 -55.746 842 HA LYS 106 HA LYS 106 14.354 25.709 -56.670 843 HB2 LYS 106 HB2 LYS 106 12.017 26.563 -57.335 844 HB3 LYS 106 HB1 LYS 106 12.814 25.406 -58.386 845 HG2 LYS 106 HG2 LYS 106 10.937 24.404 -56.309 846 HG3 LYS 106 HG1 LYS 106 10.282 25.175 -57.754 847 HD2 LYS 106 HD2 LYS 106 12.214 22.858 -57.752 848 HD3 LYS 106 HD1 LYS 106 10.469 22.716 -57.965 849 HE2 LYS 106 HE2 LYS 106 10.607 24.101 -59.983 850 HE3 LYS 106 HE1 LYS 106 12.351 24.241 -59.764 851 HZ1 LYS 106 HZ1 LYS 106 12.619 21.925 -60.153 852 HZ2 LYS 106 HZ2 LYS 106 11.631 22.519 -61.396 853 HZ3 LYS 106 HZ3 LYS 106 10.947 21.650 -60.115 854 H GLY 107 HN GLY 107 11.847 24.486 -54.546 855 HA2 GLY 107 HA2 GLY 107 11.826 25.161 -52.233 856 HA3 GLY 107 HA1 GLY 107 12.418 26.740 -52.737 857 H SER 108 HN SER 108 9.753 24.722 -53.901 858 HA SER 108 HA SER 108 7.996 27.042 -53.821 859 HB2 SER 108 HB2 SER 108 7.501 24.263 -54.926 860 HB3 SER 108 HB1 SER 108 6.471 25.677 -55.162 861 HG SER 108 HG SER 108 8.595 26.602 -56.029 Start of MODEL 6 1 H1 MET 1 HT1 MET 1 -16.270 10.460 -51.544 2 H2 MET 1 HT2 MET 1 -14.712 10.641 -50.906 3 H3 MET 1 HT3 MET 1 -15.287 9.097 -51.301 4 HA MET 1 HA MET 1 -13.716 9.922 -52.937 5 HB2 MET 1 HB2 MET 1 -15.460 8.353 -53.634 6 HB3 MET 1 HB1 MET 1 -16.572 9.686 -53.914 7 HG2 MET 1 HG2 MET 1 -15.617 8.822 -55.989 8 HG3 MET 1 HG1 MET 1 -15.188 10.509 -55.715 9 HE1 MET 1 HE1 MET 1 -13.721 8.598 -57.832 10 HE2 MET 1 HE2 MET 1 -12.041 9.070 -57.564 11 HE3 MET 1 HE3 MET 1 -13.312 10.294 -57.586 12 H GLY 2 HN GLY 2 -12.891 11.592 -54.009 13 HA2 GLY 2 HA2 GLY 2 -14.178 13.621 -55.336 14 HA3 GLY 2 HA1 GLY 2 -14.012 14.203 -53.682 15 H SER 3 HN SER 3 -12.753 15.583 -55.679 16 HA SER 3 HA SER 3 -10.057 14.683 -56.023 17 HB2 SER 3 HB2 SER 3 -11.410 16.265 -57.551 18 HB3 SER 3 HB1 SER 3 -10.990 17.525 -56.392 19 HG SER 3 HG SER 3 -9.502 16.466 -58.363 20 H SER 4 HN SER 4 -9.191 14.335 -54.004 21 HA SER 4 HA SER 4 -9.353 16.383 -51.972 22 HB2 SER 4 HB2 SER 4 -7.826 13.772 -51.904 23 HB3 SER 4 HB1 SER 4 -8.301 14.765 -50.525 24 HG SER 4 HG SER 4 -10.454 14.174 -52.026 25 H HIS 5 HN HIS 5 -8.172 18.113 -52.756 26 HA HIS 5 HA HIS 5 -5.358 17.672 -53.422 27 HB2 HIS 5 HB2 HIS 5 -7.095 20.139 -53.618 28 HB3 HIS 5 HB1 HIS 5 -5.383 20.105 -54.022 29 HD1 HIS 5 HD1 HIS 5 -5.164 17.602 -55.705 30 HD2 HIS 5 HD2 HIS 5 -8.333 20.285 -56.011 31 HE1 HIS 5 HE1 HIS 5 -6.119 17.272 -58.007 32 HE2 HIS 5 HE2 HIS 5 -8.096 18.828 -58.136 33 H HIS 6 HN HIS 6 -4.120 19.913 -52.628 34 HA HIS 6 HA HIS 6 -4.572 20.042 -49.718 35 HB2 HIS 6 HB2 HIS 6 -2.488 18.738 -50.599 36 HB3 HIS 6 HB1 HIS 6 -1.837 20.340 -50.929 37 HD1 HIS 6 HD1 HIS 6 -0.667 21.463 -49.013 38 HD2 HIS 6 HD2 HIS 6 -3.186 18.386 -47.774 39 HE1 HIS 6 HE1 HIS 6 -0.259 21.195 -46.543 40 HE2 HIS 6 HE2 HIS 6 -1.739 19.274 -45.822 41 H HIS 7 HN HIS 7 -3.119 21.612 -52.521 42 HA HIS 7 HA HIS 7 -3.061 23.735 -53.271 43 HB2 HIS 7 HB2 HIS 7 -5.500 23.726 -52.513 44 HB3 HIS 7 HB1 HIS 7 -4.943 24.583 -51.077 45 HD1 HIS 7 HD1 HIS 7 -5.102 27.055 -51.285 46 HD2 HIS 7 HD2 HIS 7 -4.574 25.203 -54.974 47 HE1 HIS 7 HE1 HIS 7 -5.141 28.904 -52.988 48 HE2 HIS 7 HE2 HIS 7 -4.986 27.743 -55.220 49 H HIS 8 HN HIS 8 -3.172 23.794 -49.716 50 HA HIS 8 HA HIS 8 -1.410 25.990 -49.429 51 HB2 HIS 8 HB2 HIS 8 -1.927 23.733 -47.469 52 HB3 HIS 8 HB1 HIS 8 -1.209 25.294 -47.085 53 HD1 HIS 8 HD1 HIS 8 -2.820 27.366 -47.049 54 HD2 HIS 8 HD2 HIS 8 -4.696 23.709 -47.690 55 HE1 HIS 8 HE1 HIS 8 -5.272 27.791 -46.705 56 HE2 HIS 8 HE2 HIS 8 -6.388 25.639 -47.400 57 H HIS 9 HN HIS 9 0.803 26.064 -49.193 58 HA HIS 9 HA HIS 9 2.069 23.939 -50.705 59 HB2 HIS 9 HB2 HIS 9 3.170 26.609 -49.805 60 HB3 HIS 9 HB1 HIS 9 3.965 25.497 -50.914 61 HD1 HIS 9 HD1 HIS 9 1.790 28.373 -50.857 62 HD2 HIS 9 HD2 HIS 9 2.339 25.108 -53.381 63 HE1 HIS 9 HE1 HIS 9 0.724 29.013 -53.043 64 HE2 HIS 9 HE2 HIS 9 1.197 27.091 -54.600 65 H HIS 10 HN HIS 10 3.457 25.851 -48.055 66 HA HIS 10 HA HIS 10 4.361 23.401 -46.751 67 HB2 HIS 10 HB2 HIS 10 6.114 23.821 -48.344 68 HB3 HIS 10 HB1 HIS 10 6.169 25.524 -47.921 69 HD1 HIS 10 HD1 HIS 10 6.401 22.493 -45.595 70 HD2 HIS 10 HD2 HIS 10 8.603 25.807 -46.813 71 HE1 HIS 10 HE1 HIS 10 8.524 22.434 -44.253 72 HE2 HIS 10 HE2 HIS 10 9.898 24.368 -45.102 73 H SER 11 HN SER 11 4.484 23.604 -44.591 74 HA SER 11 HA SER 11 3.875 26.267 -43.488 75 HB2 SER 11 HB2 SER 11 3.470 23.544 -42.220 76 HB3 SER 11 HB1 SER 11 2.896 25.091 -41.596 77 HG SER 11 HG SER 11 2.065 23.739 -43.940 78 H SER 12 HN SER 12 4.571 25.760 -40.820 79 HA SER 12 HA SER 12 7.482 25.615 -41.040 80 HB2 SER 12 HB2 SER 12 5.744 26.581 -38.758 81 HB3 SER 12 HB1 SER 12 7.507 26.657 -38.809 82 HG SER 12 HG SER 12 6.277 27.748 -41.013 83 H GLY 13 HN GLY 13 7.149 23.247 -41.393 84 HA2 GLY 13 HA2 GLY 13 6.995 21.832 -38.793 85 HA3 GLY 13 HA1 GLY 13 6.516 21.113 -40.329 86 H ARG 14 HN ARG 14 9.212 23.181 -40.137 87 HA ARG 14 HA ARG 14 10.943 21.353 -41.416 88 HB2 ARG 14 HB2 ARG 14 12.612 23.145 -41.167 89 HB3 ARG 14 HB1 ARG 14 11.073 23.781 -41.739 90 HG2 ARG 14 HG2 ARG 14 10.531 24.476 -39.443 91 HG3 ARG 14 HG1 ARG 14 12.108 23.894 -38.914 92 HD2 ARG 14 HD2 ARG 14 13.038 25.494 -40.709 93 HD3 ARG 14 HD1 ARG 14 11.441 26.238 -40.654 94 HE ARG 14 HE ARG 14 12.472 25.911 -38.030 95 HH11 ARG 14 HH11 ARG 14 12.825 27.969 -40.870 96 HH12 ARG 14 HH12 ARG 14 13.435 29.312 -39.943 97 HH21 ARG 14 HH21 ARG 14 13.239 27.644 -36.863 98 HH22 ARG 14 HH22 ARG 14 13.662 29.134 -37.660 99 H GLU 15 HN GLU 15 10.431 22.235 -38.069 100 HA GLU 15 HA GLU 15 12.666 20.484 -37.275 101 HB2 GLU 15 HB2 GLU 15 13.154 22.080 -35.439 102 HB3 GLU 15 HB1 GLU 15 13.389 22.794 -37.030 103 HG2 GLU 15 HG2 GLU 15 11.119 23.797 -36.839 104 HG3 GLU 15 HG1 GLU 15 11.052 23.202 -35.183 105 H ASN 16 HN ASN 16 9.570 20.454 -37.401 106 HA ASN 16 HA ASN 16 8.695 20.464 -34.683 107 HB2 ASN 16 HB2 ASN 16 6.564 20.160 -35.508 108 HB3 ASN 16 HB1 ASN 16 7.352 20.851 -36.920 109 HD21 ASN 16 HD21 ASN 16 7.873 19.478 -38.677 110 HD22 ASN 16 HD22 ASN 16 7.088 17.953 -38.879 111 H LEU 17 HN LEU 17 10.520 18.281 -36.345 112 HA LEU 17 HA LEU 17 9.265 15.824 -35.641 113 HB2 LEU 17 HB2 LEU 17 12.062 16.446 -36.578 114 HB3 LEU 17 HB1 LEU 17 11.478 14.819 -36.298 115 HG LEU 17 HG LEU 17 11.345 15.155 -38.622 116 HD11 LEU 17 HD11 LEU 17 8.596 15.639 -37.493 117 HD12 LEU 17 HD12 LEU 17 9.380 14.075 -37.705 118 HD13 LEU 17 HD13 LEU 17 8.955 15.046 -39.114 119 HD21 LEU 17 HD21 LEU 17 11.598 17.570 -38.682 120 HD22 LEU 17 HD22 LEU 17 9.950 17.773 -38.086 121 HD23 LEU 17 HD23 LEU 17 10.232 17.063 -39.676 122 H TYR 18 HN TYR 18 10.730 18.024 -33.694 123 HA TYR 18 HA TYR 18 11.909 16.030 -31.908 124 HB2 TYR 18 HB2 TYR 18 12.028 19.041 -31.984 125 HB3 TYR 18 HB1 TYR 18 12.572 18.123 -30.581 126 HD1 TYR 18 HD2 TYR 18 13.116 18.493 -34.249 127 HD2 TYR 18 HD1 TYR 18 14.726 17.223 -30.520 128 HE1 TYR 18 HE2 TYR 18 15.298 18.128 -35.321 129 HE2 TYR 18 HE1 TYR 18 16.911 16.853 -31.584 130 HH TYR 18 HH TYR 18 17.592 17.905 -34.810 131 H PHE 19 HN PHE 19 10.998 15.424 -30.041 132 HA PHE 19 HA PHE 19 8.221 16.218 -29.654 133 HB2 PHE 19 HB2 PHE 19 9.644 14.138 -28.016 134 HB3 PHE 19 HB1 PHE 19 7.944 14.219 -28.466 135 HD1 PHE 19 HD2 PHE 19 7.199 13.455 -30.655 136 HD2 PHE 19 HD1 PHE 19 11.289 13.247 -29.508 137 HE1 PHE 19 HE2 PHE 19 7.649 11.935 -32.539 138 HE2 PHE 19 HE1 PHE 19 11.749 11.737 -31.380 139 HZ PHE 19 HZ PHE 19 9.928 11.073 -32.905 140 H GLN 20 HN GLN 20 11.326 16.372 -28.093 141 HA GLN 20 HA GLN 20 12.134 17.668 -26.408 142 HB2 GLN 20 HB2 GLN 20 9.434 19.027 -26.528 143 HB3 GLN 20 HB1 GLN 20 10.824 19.617 -25.630 144 HG2 GLN 20 HG2 GLN 20 10.705 19.267 -28.617 145 HG3 GLN 20 HG1 GLN 20 10.490 20.790 -27.758 146 HE21 GLN 20 HE21 GLN 20 12.748 18.362 -28.767 147 HE22 GLN 20 HE22 GLN 20 14.187 19.264 -28.426 148 H GLY 21 HN GLY 21 10.356 15.223 -26.011 149 HA2 GLY 21 HA2 GLY 21 10.056 13.927 -24.106 150 HA3 GLY 21 HA1 GLY 21 10.425 15.334 -23.122 151 H HIS 22 HN HIS 22 8.167 16.375 -25.243 152 HA HIS 22 HA HIS 22 6.060 16.040 -23.237 153 HB2 HIS 22 HB2 HIS 22 6.350 17.949 -25.563 154 HB3 HIS 22 HB1 HIS 22 4.896 17.837 -24.582 155 HD1 HIS 22 HD1 HIS 22 5.559 20.453 -24.203 156 HD2 HIS 22 HD2 HIS 22 7.947 17.602 -22.336 157 HE1 HIS 22 HE1 HIS 22 6.812 21.687 -22.401 158 HE2 HIS 22 HE2 HIS 22 8.321 19.965 -21.343 159 H MET 23 HN MET 23 4.859 14.279 -23.552 160 HA MET 23 HA MET 23 4.450 13.209 -26.197 161 HB2 MET 23 HB2 MET 23 3.148 11.445 -25.063 162 HB3 MET 23 HB1 MET 23 4.749 11.650 -24.371 163 HG2 MET 23 HG2 MET 23 3.803 12.895 -22.509 164 HG3 MET 23 HG1 MET 23 2.194 12.744 -23.213 165 HE1 MET 23 HE1 MET 23 1.844 10.378 -20.171 166 HE2 MET 23 HE2 MET 23 1.132 11.706 -21.086 167 HE3 MET 23 HE3 MET 23 2.667 11.935 -20.250 168 H CYS 24 HN CYS 24 3.490 15.372 -26.773 169 HA CYS 24 HA CYS 24 0.845 16.024 -25.977 170 HB2 CYS 24 HB2 CYS 24 2.235 16.776 -28.556 171 HB3 CYS 24 HB1 CYS 24 0.900 17.626 -27.783 172 HG CYS 24 HG CYS 24 4.186 17.579 -26.904 173 H ILE 25 HN ILE 25 -1.091 15.882 -27.317 174 HA ILE 25 HA ILE 25 -1.608 13.304 -28.219 175 HB ILE 25 HB ILE 25 -3.377 14.857 -27.500 176 HG12 ILE 25 HG12 ILE 25 -5.047 14.279 -29.260 177 HG13 ILE 25 HG11 ILE 25 -3.723 13.736 -30.286 178 HG21 ILE 25 HG21 ILE 25 -2.603 16.899 -28.550 179 HG22 ILE 25 HG22 ILE 25 -4.261 16.547 -29.037 180 HG23 ILE 25 HG23 ILE 25 -2.928 16.223 -30.146 181 HD11 ILE 25 HD11 ILE 25 -3.147 12.034 -28.634 182 HD12 ILE 25 HD12 ILE 25 -4.811 11.866 -29.193 183 HD13 ILE 25 HD13 ILE 25 -4.479 12.577 -27.614 184 H GLN 26 HN GLN 26 -0.600 16.166 -30.021 185 HA GLN 26 HA GLN 26 -0.839 15.275 -32.629 186 HB2 GLN 26 HB2 GLN 26 -0.127 17.507 -32.273 187 HB3 GLN 26 HB1 GLN 26 1.227 17.003 -31.275 188 HG2 GLN 26 HG2 GLN 26 2.251 15.977 -33.300 189 HG3 GLN 26 HG1 GLN 26 0.944 16.681 -34.253 190 HE21 GLN 26 HE21 GLN 26 2.453 17.896 -35.440 191 HE22 GLN 26 HE22 GLN 26 3.196 19.307 -34.776 192 H LYS 27 HN LYS 27 1.827 14.711 -30.353 193 HA LYS 27 HA LYS 27 3.408 13.316 -32.263 194 HB2 LYS 27 HB2 LYS 27 3.652 13.632 -29.278 195 HB3 LYS 27 HB1 LYS 27 4.818 12.738 -30.248 196 HG2 LYS 27 HG2 LYS 27 4.140 15.662 -30.448 197 HG3 LYS 27 HG1 LYS 27 5.666 14.942 -29.923 198 HD2 LYS 27 HD2 LYS 27 6.020 14.020 -32.144 199 HD3 LYS 27 HD1 LYS 27 4.465 14.656 -32.677 200 HE2 LYS 27 HE2 LYS 27 5.309 16.945 -32.203 201 HE3 LYS 27 HE1 LYS 27 6.886 16.244 -31.837 202 HZ1 LYS 27 HZ1 LYS 27 5.449 16.141 -34.438 203 HZ2 LYS 27 HZ2 LYS 27 6.869 15.292 -34.110 204 HZ3 LYS 27 HZ3 LYS 27 6.882 16.987 -34.096 205 H VAL 28 HN VAL 28 0.949 12.338 -30.028 206 HA VAL 28 HA VAL 28 1.611 9.577 -29.939 207 HB VAL 28 HB VAL 28 -1.136 10.826 -29.705 208 HG11 VAL 28 HG11 VAL 28 -1.690 8.820 -28.415 209 HG12 VAL 28 HG12 VAL 28 -0.077 8.177 -28.729 210 HG13 VAL 28 HG13 VAL 28 -1.206 8.417 -30.062 211 HG21 VAL 28 HG21 VAL 28 0.904 10.231 -27.564 212 HG22 VAL 28 HG22 VAL 28 -0.745 10.792 -27.284 213 HG23 VAL 28 HG23 VAL 28 0.412 11.832 -28.117 214 H ILE 29 HN ILE 29 -0.738 11.391 -31.894 215 HA ILE 29 HA ILE 29 -1.444 9.330 -33.665 216 HB ILE 29 HB ILE 29 -1.497 12.336 -33.895 217 HG12 ILE 29 HG12 ILE 29 -3.959 11.938 -34.038 218 HG13 ILE 29 HG11 ILE 29 -3.660 10.221 -33.810 219 HG21 ILE 29 HG21 ILE 29 -1.016 11.549 -36.136 220 HG22 ILE 29 HG22 ILE 29 -2.674 12.141 -36.035 221 HG23 ILE 29 HG23 ILE 29 -2.356 10.406 -36.043 222 HD11 ILE 29 HD11 ILE 29 -2.737 10.681 -31.601 223 HD12 ILE 29 HD12 ILE 29 -4.391 11.273 -31.758 224 HD13 ILE 29 HD13 ILE 29 -3.038 12.401 -31.837 225 H GLU 30 HN GLU 30 1.002 11.859 -33.883 226 HA GLU 30 HA GLU 30 1.993 11.349 -36.423 227 HB2 GLU 30 HB2 GLU 30 2.470 13.282 -34.827 228 HB3 GLU 30 HB1 GLU 30 3.669 12.238 -34.083 229 HG2 GLU 30 HG2 GLU 30 4.820 12.074 -36.263 230 HG3 GLU 30 HG1 GLU 30 3.644 13.215 -36.927 231 H ASP 31 HN ASP 31 3.117 10.070 -33.297 232 HA ASP 31 HA ASP 31 5.299 8.607 -34.209 233 HB2 ASP 31 HB2 ASP 31 5.034 8.954 -31.857 234 HB3 ASP 31 HB1 ASP 31 3.469 8.147 -31.853 235 H LYS 32 HN LYS 32 1.941 7.500 -33.731 236 HA LYS 32 HA LYS 32 2.510 4.827 -34.408 237 HB2 LYS 32 HB2 LYS 32 0.013 6.411 -34.117 238 HB3 LYS 32 HB1 LYS 32 -0.081 4.851 -34.929 239 HG2 LYS 32 HG2 LYS 32 0.985 3.802 -32.961 240 HG3 LYS 32 HG1 LYS 32 0.951 5.368 -32.147 241 HD2 LYS 32 HD2 LYS 32 -1.613 4.446 -33.274 242 HD3 LYS 32 HD1 LYS 32 -0.990 3.508 -31.917 243 HE2 LYS 32 HE2 LYS 32 -2.493 5.313 -31.197 244 HE3 LYS 32 HE1 LYS 32 -0.863 5.499 -30.552 245 HZ1 LYS 32 HZ1 LYS 32 -1.963 7.558 -31.450 246 HZ2 LYS 32 HZ2 LYS 32 -1.779 6.903 -33.002 247 HZ3 LYS 32 HZ3 LYS 32 -0.414 7.235 -32.052 248 H LEU 33 HN LEU 33 1.197 7.458 -36.455 249 HA LEU 33 HA LEU 33 1.036 5.732 -38.723 250 HB2 LEU 33 HB2 LEU 33 0.682 7.796 -40.042 251 HB3 LEU 33 HB1 LEU 33 -0.417 7.613 -38.694 252 HG LEU 33 HG LEU 33 1.249 9.207 -37.460 253 HD11 LEU 33 HD11 LEU 33 1.829 9.872 -40.345 254 HD12 LEU 33 HD12 LEU 33 2.979 9.205 -39.185 255 HD13 LEU 33 HD13 LEU 33 2.320 10.823 -38.944 256 HD21 LEU 33 HD21 LEU 33 -1.083 9.698 -38.025 257 HD22 LEU 33 HD22 LEU 33 -0.580 10.197 -39.641 258 HD23 LEU 33 HD23 LEU 33 -0.047 11.110 -38.228 259 H SER 34 HN SER 34 3.531 7.748 -37.376 260 HA SER 34 HA SER 34 5.252 7.728 -39.632 261 HB2 SER 34 HB2 SER 34 5.459 9.312 -37.711 262 HB3 SER 34 HB1 SER 34 6.010 7.971 -36.708 263 HG SER 34 HG SER 34 7.709 9.261 -37.656 264 H SER 35 HN SER 35 4.785 5.565 -36.895 265 HA SER 35 HA SER 35 7.018 3.898 -37.479 266 HB2 SER 35 HB2 SER 35 4.517 3.244 -35.908 267 HB3 SER 35 HB1 SER 35 6.044 2.363 -35.853 268 HG SER 35 HG SER 35 5.685 5.093 -35.119 269 H ALA 36 HN ALA 36 3.759 4.079 -38.660 270 HA ALA 36 HA ALA 36 3.678 1.370 -39.626 271 HB1 ALA 36 HB1 ALA 36 1.821 3.672 -40.200 272 HB2 ALA 36 HB2 ALA 36 1.651 2.521 -38.875 273 HB3 ALA 36 HB3 ALA 36 1.513 1.970 -40.546 274 H LEU 37 HN LEU 37 3.741 4.571 -41.241 275 HA LEU 37 HA LEU 37 4.277 3.247 -43.778 276 HB2 LEU 37 HB2 LEU 37 3.738 6.119 -43.056 277 HB3 LEU 37 HB1 LEU 37 4.239 5.641 -44.664 278 HG LEU 37 HG LEU 37 2.197 4.135 -44.723 279 HD11 LEU 37 HD11 LEU 37 1.736 4.048 -42.335 280 HD12 LEU 37 HD12 LEU 37 0.359 4.707 -43.219 281 HD13 LEU 37 HD13 LEU 37 1.427 5.784 -42.320 282 HD21 LEU 37 HD21 LEU 37 1.781 7.109 -44.487 283 HD22 LEU 37 HD22 LEU 37 0.693 5.975 -45.288 284 HD23 LEU 37 HD23 LEU 37 2.315 6.244 -45.928 285 H LYS 38 HN LYS 38 5.921 5.002 -41.322 286 HA LYS 38 HA LYS 38 8.086 5.488 -40.922 287 HB2 LYS 38 HB2 LYS 38 8.199 3.009 -41.542 288 HB3 LYS 38 HB1 LYS 38 8.828 3.544 -43.093 289 HG2 LYS 38 HG2 LYS 38 10.743 4.527 -42.055 290 HG3 LYS 38 HG1 LYS 38 10.076 4.240 -40.446 291 HD2 LYS 38 HD2 LYS 38 10.853 2.115 -42.444 292 HD3 LYS 38 HD1 LYS 38 11.776 2.574 -41.012 293 HE2 LYS 38 HE2 LYS 38 8.946 1.536 -40.921 294 HE3 LYS 38 HE1 LYS 38 10.368 0.507 -40.757 295 HZ1 LYS 38 HZ1 LYS 38 11.005 1.717 -38.796 296 HZ2 LYS 38 HZ2 LYS 38 9.417 1.162 -38.609 297 HZ3 LYS 38 HZ3 LYS 38 9.709 2.791 -38.968 298 HA PRO 39 HA PRO 39 8.526 8.244 -44.531 299 HB2 PRO 39 HB2 PRO 39 7.772 10.535 -43.367 300 HB3 PRO 39 HB1 PRO 39 6.591 9.343 -43.920 301 HG2 PRO 39 HG2 PRO 39 7.429 10.029 -41.172 302 HG3 PRO 39 HG1 PRO 39 5.905 9.335 -41.744 303 HD2 PRO 39 HD2 PRO 39 8.142 7.970 -40.586 304 HD3 PRO 39 HD1 PRO 39 6.629 7.266 -41.189 305 H THR 40 HN THR 40 10.073 9.837 -45.007 306 HA THR 40 HA THR 40 12.257 10.049 -43.100 307 HB THR 40 HB THR 40 13.367 11.301 -45.025 308 HG1 THR 40 HG1 THR 40 12.158 11.714 -46.703 309 HG21 THR 40 HG21 THR 40 13.853 8.956 -44.541 310 HG22 THR 40 HG22 THR 40 13.840 9.245 -46.280 311 HG23 THR 40 HG23 THR 40 12.464 8.458 -45.505 312 H PHE 41 HN PHE 41 9.677 11.921 -44.477 313 HA PHE 41 HA PHE 41 10.347 14.104 -42.635 314 HB2 PHE 41 HB2 PHE 41 11.165 14.772 -44.871 315 HB3 PHE 41 HB1 PHE 41 9.554 14.513 -45.531 316 HD1 PHE 41 HD1 PHE 41 11.406 16.519 -43.008 317 HD2 PHE 41 HD2 PHE 41 8.007 16.248 -45.556 318 HE1 PHE 41 HE1 PHE 41 10.818 18.845 -42.466 319 HE2 PHE 41 HE2 PHE 41 7.415 18.575 -45.018 320 HZ PHE 41 HZ PHE 41 8.821 19.877 -43.470 321 H LEU 42 HN LEU 42 8.608 15.031 -41.671 322 HA LEU 42 HA LEU 42 5.921 14.398 -42.626 323 HB2 LEU 42 HB2 LEU 42 6.971 12.842 -40.695 324 HB3 LEU 42 HB1 LEU 42 6.389 14.157 -39.698 325 HG LEU 42 HG LEU 42 4.742 12.394 -39.749 326 HD11 LEU 42 HD11 LEU 42 3.837 14.721 -41.432 327 HD12 LEU 42 HD12 LEU 42 3.868 14.660 -39.670 328 HD13 LEU 42 HD13 LEU 42 2.785 13.599 -40.571 329 HD21 LEU 42 HD21 LEU 42 4.775 12.710 -42.744 330 HD22 LEU 42 HD22 LEU 42 3.661 11.694 -41.829 331 HD23 LEU 42 HD23 LEU 42 5.386 11.330 -41.831 332 H GLU 43 HN GLU 43 4.961 16.325 -42.819 333 HA GLU 43 HA GLU 43 5.581 18.375 -40.800 334 HB2 GLU 43 HB2 GLU 43 6.326 19.087 -43.002 335 HB3 GLU 43 HB1 GLU 43 4.735 18.762 -43.677 336 HG2 GLU 43 HG2 GLU 43 3.774 20.598 -42.632 337 HG3 GLU 43 HG1 GLU 43 5.064 20.715 -41.437 338 H LEU 44 HN LEU 44 3.996 19.038 -39.549 339 HA LEU 44 HA LEU 44 1.293 18.082 -40.110 340 HB2 LEU 44 HB2 LEU 44 2.635 19.025 -37.582 341 HB3 LEU 44 HB1 LEU 44 0.900 18.815 -37.692 342 HG LEU 44 HG LEU 44 1.825 16.882 -36.637 343 HD11 LEU 44 HD11 LEU 44 -0.027 16.480 -38.155 344 HD12 LEU 44 HD12 LEU 44 1.081 15.107 -38.139 345 HD13 LEU 44 HD13 LEU 44 1.099 16.243 -39.490 346 HD21 LEU 44 HD21 LEU 44 3.483 15.448 -37.722 347 HD22 LEU 44 HD22 LEU 44 4.120 17.064 -37.417 348 HD23 LEU 44 HD23 LEU 44 3.618 16.606 -39.045 349 H VAL 45 HN VAL 45 -0.027 19.422 -41.036 350 HA VAL 45 HA VAL 45 0.328 22.319 -40.696 351 HB VAL 45 HB VAL 45 -1.361 20.870 -42.752 352 HG11 VAL 45 HG11 VAL 45 -0.420 23.730 -42.624 353 HG12 VAL 45 HG12 VAL 45 -2.064 23.163 -42.331 354 HG13 VAL 45 HG13 VAL 45 -1.350 23.008 -43.936 355 HG21 VAL 45 HG21 VAL 45 0.981 20.285 -43.067 356 HG22 VAL 45 HG22 VAL 45 1.423 21.993 -43.053 357 HG23 VAL 45 HG23 VAL 45 0.427 21.350 -44.358 358 H ASP 46 HN ASP 46 -1.421 23.587 -40.033 359 HA ASP 46 HA ASP 46 -3.306 22.357 -38.300 360 HB2 ASP 46 HB2 ASP 46 -2.312 24.723 -38.147 361 HB3 ASP 46 HB1 ASP 46 -3.495 25.171 -39.371 362 H LYS 47 HN LYS 47 -5.318 21.655 -38.715 363 HA LYS 47 HA LYS 47 -6.241 21.498 -41.417 364 HB2 LYS 47 HB2 LYS 47 -6.796 20.188 -38.980 365 HB3 LYS 47 HB1 LYS 47 -8.306 20.922 -39.491 366 HG2 LYS 47 HG2 LYS 47 -6.622 19.004 -41.089 367 HG3 LYS 47 HG1 LYS 47 -8.145 18.643 -40.279 368 HD2 LYS 47 HD2 LYS 47 -8.979 19.016 -42.354 369 HD3 LYS 47 HD1 LYS 47 -8.943 20.694 -41.811 370 HE2 LYS 47 HE2 LYS 47 -7.978 20.458 -44.047 371 HE3 LYS 47 HE1 LYS 47 -6.770 21.001 -42.878 372 HZ1 LYS 47 HZ1 LYS 47 -7.116 18.208 -43.835 373 HZ2 LYS 47 HZ2 LYS 47 -5.964 18.733 -42.715 374 HZ3 LYS 47 HZ3 LYS 47 -5.880 19.268 -44.315 375 H SER 48 HN SER 48 -6.849 23.522 -38.666 376 HA SER 48 HA SER 48 -8.112 25.553 -40.139 377 HB2 SER 48 HB2 SER 48 -10.012 23.908 -40.103 378 HB3 SER 48 HB1 SER 48 -9.998 23.994 -38.343 379 HG SER 48 HG SER 48 -10.083 26.481 -39.391 380 H CYS 49 HN CYS 49 -6.795 26.932 -39.089 381 HA CYS 49 HA CYS 49 -6.056 26.901 -36.427 382 HB2 CYS 49 HB2 CYS 49 -6.357 29.264 -38.288 383 HB3 CYS 49 HB1 CYS 49 -5.501 29.304 -36.747 384 HG CYS 49 HG CYS 49 -3.870 27.021 -37.783 385 H GLY 50 HN GLY 50 -7.299 26.892 -34.743 386 HA2 GLY 50 HA2 GLY 50 -8.778 28.678 -33.545 387 HA3 GLY 50 HA1 GLY 50 -9.898 28.240 -34.830 388 H CYS 51 HN CYS 51 -9.046 25.456 -34.884 389 HA CYS 51 HA CYS 51 -9.970 24.524 -32.250 390 HB2 CYS 51 HB2 CYS 51 -10.891 23.413 -34.911 391 HB3 CYS 51 HB1 CYS 51 -11.398 22.862 -33.318 392 HG CYS 51 HG CYS 51 -12.441 25.496 -35.116 393 H GLY 52 HN GLY 52 -8.202 23.554 -31.456 394 HA2 GLY 52 HA2 GLY 52 -6.337 22.182 -33.211 395 HA3 GLY 52 HA1 GLY 52 -6.165 22.418 -31.477 396 H THR 53 HN THR 53 -8.563 20.827 -33.559 397 HA THR 53 HA THR 53 -8.175 18.379 -31.969 398 HB THR 53 HB THR 53 -10.269 19.444 -31.293 399 HG1 THR 53 HG1 THR 53 -10.084 17.059 -31.624 400 HG21 THR 53 HG21 THR 53 -12.124 19.721 -32.873 401 HG22 THR 53 HG22 THR 53 -11.072 19.216 -34.196 402 HG23 THR 53 HG23 THR 53 -10.737 20.714 -33.326 403 H SER 54 HN SER 54 -7.822 19.734 -34.925 404 HA SER 54 HA SER 54 -7.996 17.129 -36.247 405 HB2 SER 54 HB2 SER 54 -8.848 18.410 -38.312 406 HB3 SER 54 HB1 SER 54 -10.001 18.113 -37.012 407 HG SER 54 HG SER 54 -8.493 20.497 -37.096 408 H PHE 55 HN PHE 55 -6.353 16.737 -37.712 409 HA PHE 55 HA PHE 55 -4.384 18.895 -38.025 410 HB2 PHE 55 HB2 PHE 55 -3.817 16.019 -37.287 411 HB3 PHE 55 HB1 PHE 55 -2.586 17.195 -37.730 412 HD1 PHE 55 HD1 PHE 55 -2.433 19.321 -36.292 413 HD2 PHE 55 HD2 PHE 55 -4.479 15.789 -35.080 414 HE1 PHE 55 HE1 PHE 55 -2.266 20.030 -33.941 415 HE2 PHE 55 HE2 PHE 55 -4.321 16.498 -32.731 416 HZ PHE 55 HZ PHE 55 -3.213 18.620 -32.158 417 H ASP 56 HN ASP 56 -3.082 18.823 -39.841 418 HA ASP 56 HA ASP 56 -3.906 16.958 -41.975 419 HB2 ASP 56 HB2 ASP 56 -4.346 19.402 -42.376 420 HB3 ASP 56 HB1 ASP 56 -2.617 19.691 -42.237 421 H ALA 57 HN ALA 57 -2.269 15.698 -42.885 422 HA ALA 57 HA ALA 57 0.413 16.154 -41.759 423 HB1 ALA 57 HB1 ALA 57 -0.704 14.318 -40.595 424 HB2 ALA 57 HB2 ALA 57 0.708 13.765 -41.495 425 HB3 ALA 57 HB3 ALA 57 -0.911 13.475 -42.131 426 H VAL 58 HN VAL 58 1.847 16.538 -43.262 427 HA VAL 58 HA VAL 58 1.571 15.357 -45.917 428 HB VAL 58 HB VAL 58 3.747 17.176 -44.859 429 HG11 VAL 58 HG11 VAL 58 4.449 15.863 -46.781 430 HG12 VAL 58 HG12 VAL 58 4.262 17.560 -47.222 431 HG13 VAL 58 HG13 VAL 58 3.024 16.388 -47.678 432 HG21 VAL 58 HG21 VAL 58 2.610 18.975 -46.074 433 HG22 VAL 58 HG22 VAL 58 1.592 18.308 -44.797 434 HG23 VAL 58 HG23 VAL 58 1.298 17.867 -46.479 435 H ILE 59 HN ILE 59 2.279 13.337 -46.131 436 HA ILE 59 HA ILE 59 4.487 12.448 -44.417 437 HB ILE 59 HB ILE 59 2.632 11.097 -43.955 438 HG12 ILE 59 HG12 ILE 59 4.866 9.906 -44.719 439 HG13 ILE 59 HG11 ILE 59 3.438 8.976 -44.290 440 HG21 ILE 59 HG21 ILE 59 1.195 10.042 -45.584 441 HG22 ILE 59 HG22 ILE 59 2.151 10.719 -46.899 442 HG23 ILE 59 HG23 ILE 59 1.237 11.787 -45.834 443 HD11 ILE 59 HD11 ILE 59 2.896 8.712 -46.659 444 HD12 ILE 59 HD12 ILE 59 4.510 8.100 -46.294 445 HD13 ILE 59 HD13 ILE 59 4.319 9.661 -47.092 446 H VAL 60 HN VAL 60 6.385 12.220 -45.297 447 HA VAL 60 HA VAL 60 6.564 11.711 -48.196 448 HB VAL 60 HB VAL 60 8.564 13.126 -46.417 449 HG11 VAL 60 HG11 VAL 60 9.719 13.669 -48.513 450 HG12 VAL 60 HG12 VAL 60 8.563 12.671 -49.396 451 HG13 VAL 60 HG13 VAL 60 9.654 11.930 -48.224 452 HG21 VAL 60 HG21 VAL 60 7.955 15.143 -47.670 453 HG22 VAL 60 HG22 VAL 60 6.576 14.482 -46.790 454 HG23 VAL 60 HG23 VAL 60 6.714 14.229 -48.529 455 H SER 61 HN SER 61 6.966 9.579 -48.465 456 HA SER 61 HA SER 61 9.316 8.428 -47.215 457 HB2 SER 61 HB2 SER 61 8.132 6.457 -46.335 458 HB3 SER 61 HB1 SER 61 7.572 7.934 -45.552 459 HG SER 61 HG SER 61 5.695 7.813 -46.623 460 H ASN 62 HN ASN 62 10.071 6.546 -48.266 461 HA ASN 62 HA ASN 62 9.403 6.294 -51.005 462 HB2 ASN 62 HB2 ASN 62 11.190 4.784 -49.152 463 HB3 ASN 62 HB1 ASN 62 10.804 4.091 -50.723 464 HD21 ASN 62 HD21 ASN 62 12.393 6.668 -49.038 465 HD22 ASN 62 HD22 ASN 62 13.308 7.263 -50.387 466 H ASN 63 HN ASN 63 7.977 4.907 -48.212 467 HA ASN 63 HA ASN 63 7.194 2.401 -49.090 468 HB2 ASN 63 HB2 ASN 63 6.816 3.279 -46.797 469 HB3 ASN 63 HB1 ASN 63 5.521 4.293 -47.422 470 HD21 ASN 63 HD21 ASN 63 3.558 3.355 -47.974 471 HD22 ASN 63 HD22 ASN 63 3.148 1.722 -47.576 472 H PHE 64 HN PHE 64 6.105 5.494 -50.202 473 HA PHE 64 HA PHE 64 3.709 4.325 -51.414 474 HB2 PHE 64 HB2 PHE 64 3.561 6.398 -50.000 475 HB3 PHE 64 HB1 PHE 64 4.469 7.244 -51.247 476 HD1 PHE 64 HD2 PHE 64 1.453 5.058 -50.959 477 HD2 PHE 64 HD1 PHE 64 3.262 8.460 -52.770 478 HE1 PHE 64 HE2 PHE 64 -0.648 5.541 -52.144 479 HE2 PHE 64 HE1 PHE 64 1.163 8.948 -53.956 480 HZ PHE 64 HZ PHE 64 -0.795 7.488 -53.644 481 H GLU 65 HN GLU 65 6.869 4.784 -52.379 482 HA GLU 65 HA GLU 65 6.363 5.961 -54.948 483 HB2 GLU 65 HB2 GLU 65 8.677 5.228 -55.557 484 HB3 GLU 65 HB1 GLU 65 8.571 6.273 -54.157 485 HG2 GLU 65 HG2 GLU 65 10.219 4.594 -53.774 486 HG3 GLU 65 HG1 GLU 65 8.855 4.312 -52.703 487 H ASP 66 HN ASP 66 5.880 2.872 -53.719 488 HA ASP 66 HA ASP 66 6.285 1.441 -56.181 489 HB2 ASP 66 HB2 ASP 66 6.410 0.575 -53.712 490 HB3 ASP 66 HB1 ASP 66 4.670 0.377 -53.887 491 H LYS 67 HN LYS 67 4.138 3.668 -55.414 492 HA LYS 67 HA LYS 67 2.138 4.358 -56.229 493 HB2 LYS 67 HB2 LYS 67 2.447 2.075 -58.191 494 HB3 LYS 67 HB1 LYS 67 1.348 3.437 -58.354 495 HG2 LYS 67 HG2 LYS 67 4.358 3.536 -58.400 496 HG3 LYS 67 HG1 LYS 67 3.268 3.758 -59.769 497 HD2 LYS 67 HD2 LYS 67 3.426 5.546 -57.342 498 HD3 LYS 67 HD1 LYS 67 4.135 5.893 -58.918 499 HE2 LYS 67 HE2 LYS 67 1.916 5.892 -59.929 500 HE3 LYS 67 HE1 LYS 67 1.193 5.498 -58.369 501 HZ1 LYS 67 HZ1 LYS 67 2.671 7.986 -59.051 502 HZ2 LYS 67 HZ2 LYS 67 2.086 7.604 -57.506 503 HZ3 LYS 67 HZ3 LYS 67 0.999 7.845 -58.790 504 H LYS 68 HN LYS 68 2.303 2.321 -54.135 505 HA LYS 68 HA LYS 68 0.077 0.549 -54.592 506 HB2 LYS 68 HB2 LYS 68 1.944 0.964 -52.275 507 HB3 LYS 68 HB1 LYS 68 0.538 -0.087 -52.160 508 HG2 LYS 68 HG2 LYS 68 2.788 -0.376 -54.135 509 HG3 LYS 68 HG1 LYS 68 2.558 -1.338 -52.673 510 HD2 LYS 68 HD2 LYS 68 0.478 -2.221 -53.532 511 HD3 LYS 68 HD1 LYS 68 0.583 -1.174 -54.949 512 HE2 LYS 68 HE2 LYS 68 2.686 -2.306 -55.563 513 HE3 LYS 68 HE1 LYS 68 2.459 -3.410 -54.211 514 HZ1 LYS 68 HZ1 LYS 68 0.516 -3.085 -56.436 515 HZ2 LYS 68 HZ2 LYS 68 0.477 -4.257 -55.209 516 HZ3 LYS 68 HZ3 LYS 68 1.705 -4.293 -56.377 517 H LEU 69 HN LEU 69 -1.757 1.686 -54.752 518 HA LEU 69 HA LEU 69 -2.548 3.664 -52.845 519 HB2 LEU 69 HB2 LEU 69 -3.364 3.480 -55.233 520 HB3 LEU 69 HB1 LEU 69 -4.299 2.085 -54.740 521 HG LEU 69 HG LEU 69 -5.532 4.305 -54.942 522 HD11 LEU 69 HD11 LEU 69 -6.938 3.876 -52.995 523 HD12 LEU 69 HD12 LEU 69 -5.692 2.823 -52.325 524 HD13 LEU 69 HD13 LEU 69 -6.508 2.380 -53.823 525 HD21 LEU 69 HD21 LEU 69 -5.417 5.791 -53.003 526 HD22 LEU 69 HD22 LEU 69 -3.877 5.719 -53.860 527 HD23 LEU 69 HD23 LEU 69 -4.090 4.833 -52.349 528 H LEU 70 HN LEU 70 -3.228 0.235 -53.383 529 HA LEU 70 HA LEU 70 -5.076 0.022 -51.259 530 HB2 LEU 70 HB2 LEU 70 -5.054 -2.347 -51.578 531 HB3 LEU 70 HB1 LEU 70 -5.085 -1.554 -53.130 532 HG LEU 70 HG LEU 70 -3.722 -3.438 -53.393 533 HD11 LEU 70 HD11 LEU 70 -2.764 -1.516 -54.461 534 HD12 LEU 70 HD12 LEU 70 -1.493 -2.594 -53.887 535 HD13 LEU 70 HD13 LEU 70 -1.863 -1.118 -53.000 536 HD21 LEU 70 HD21 LEU 70 -2.232 -2.669 -50.895 537 HD22 LEU 70 HD22 LEU 70 -1.830 -4.017 -51.959 538 HD23 LEU 70 HD23 LEU 70 -3.358 -4.015 -51.079 539 H ASP 71 HN ASP 71 -1.578 -0.349 -51.388 540 HA ASP 71 HA ASP 71 -1.295 -1.491 -48.806 541 HB2 ASP 71 HB2 ASP 71 0.545 -1.560 -50.394 542 HB3 ASP 71 HB1 ASP 71 0.627 0.197 -50.422 543 H ARG 72 HN ARG 72 -1.016 1.848 -49.968 544 HA ARG 72 HA ARG 72 -0.724 3.129 -47.512 545 HB2 ARG 72 HB2 ARG 72 -0.581 4.058 -49.926 546 HB3 ARG 72 HB1 ARG 72 -2.319 4.268 -49.807 547 HG2 ARG 72 HG2 ARG 72 -0.434 5.476 -47.810 548 HG3 ARG 72 HG1 ARG 72 -0.845 6.281 -49.322 549 HD2 ARG 72 HD2 ARG 72 -2.798 5.424 -47.188 550 HD3 ARG 72 HD1 ARG 72 -2.228 7.068 -47.460 551 HE ARG 72 HE ARG 72 -4.052 5.545 -49.181 552 HH11 ARG 72 HH11 ARG 72 -2.359 8.528 -48.501 553 HH12 ARG 72 HH12 ARG 72 -3.416 9.510 -49.469 554 HH21 ARG 72 HH21 ARG 72 -5.468 6.821 -50.450 555 HH22 ARG 72 HH22 ARG 72 -5.175 8.529 -50.594 556 H HIS 73 HN HIS 73 -3.617 2.183 -49.291 557 HA HIS 73 HA HIS 73 -5.536 3.323 -47.597 558 HB2 HIS 73 HB2 HIS 73 -6.127 2.610 -49.813 559 HB3 HIS 73 HB1 HIS 73 -5.661 0.953 -49.462 560 HD1 HIS 73 HD1 HIS 73 -8.336 3.481 -48.515 561 HD2 HIS 73 HD2 HIS 73 -7.675 -0.627 -48.527 562 HE1 HIS 73 HE1 HIS 73 -10.550 2.432 -47.942 563 HE2 HIS 73 HE2 HIS 73 -10.161 -0.055 -48.110 564 H ARG 74 HN ARG 74 -4.210 -0.000 -47.625 565 HA ARG 74 HA ARG 74 -5.922 -0.811 -45.485 566 HB2 ARG 74 HB2 ARG 74 -4.817 -2.938 -45.585 567 HB3 ARG 74 HB1 ARG 74 -5.084 -2.374 -47.226 568 HG2 ARG 74 HG2 ARG 74 -2.687 -1.549 -47.176 569 HG3 ARG 74 HG1 ARG 74 -2.509 -2.488 -45.693 570 HD2 ARG 74 HD2 ARG 74 -3.240 -3.513 -48.429 571 HD3 ARG 74 HD1 ARG 74 -1.749 -3.817 -47.541 572 HE ARG 74 HE ARG 74 -4.398 -4.856 -46.742 573 HH11 ARG 74 HH11 ARG 74 -0.913 -5.146 -46.956 574 HH12 ARG 74 HH12 ARG 74 -0.889 -6.760 -46.306 575 HH21 ARG 74 HH21 ARG 74 -4.357 -6.987 -45.882 576 HH22 ARG 74 HH22 ARG 74 -2.828 -7.805 -45.717 577 H LEU 75 HN LEU 75 -2.560 0.280 -45.677 578 HA LEU 75 HA LEU 75 -1.865 -0.309 -43.006 579 HB2 LEU 75 HB2 LEU 75 -0.775 1.344 -45.176 580 HB3 LEU 75 HB1 LEU 75 -0.390 1.920 -43.567 581 HG LEU 75 HG LEU 75 0.602 -0.264 -43.023 582 HD11 LEU 75 HD11 LEU 75 -0.717 -1.675 -44.503 583 HD12 LEU 75 HD12 LEU 75 1.007 -1.898 -44.794 584 HD13 LEU 75 HD13 LEU 75 0.042 -0.930 -45.910 585 HD21 LEU 75 HD21 LEU 75 1.684 1.008 -45.532 586 HD22 LEU 75 HD22 LEU 75 2.583 -0.040 -44.435 587 HD23 LEU 75 HD23 LEU 75 2.004 1.530 -43.878 588 H VAL 76 HN VAL 76 -3.082 2.682 -44.492 589 HA VAL 76 HA VAL 76 -3.149 4.217 -42.162 590 HB VAL 76 HB VAL 76 -4.778 4.398 -44.694 591 HG11 VAL 76 HG11 VAL 76 -6.131 5.342 -42.895 592 HG12 VAL 76 HG12 VAL 76 -5.521 6.614 -43.952 593 HG13 VAL 76 HG13 VAL 76 -4.769 6.337 -42.381 594 HG21 VAL 76 HG21 VAL 76 -3.368 6.365 -45.093 595 HG22 VAL 76 HG22 VAL 76 -2.403 4.902 -44.888 596 HG23 VAL 76 HG23 VAL 76 -2.532 6.067 -43.570 597 H ASN 77 HN ASN 77 -5.693 2.177 -43.598 598 HA ASN 77 HA ASN 77 -7.663 2.845 -41.709 599 HB2 ASN 77 HB2 ASN 77 -7.320 0.633 -43.676 600 HB3 ASN 77 HB1 ASN 77 -8.553 0.457 -42.430 601 HD21 ASN 77 HD21 ASN 77 -7.488 2.365 -45.157 602 HD22 ASN 77 HD22 ASN 77 -9.003 3.164 -45.435 603 H THR 78 HN THR 78 -5.170 0.353 -41.671 604 HA THR 78 HA THR 78 -6.170 -1.162 -39.534 605 HB THR 78 HB THR 78 -3.312 -0.774 -40.437 606 HG1 THR 78 HG1 THR 78 -4.526 -1.750 -42.037 607 HG21 THR 78 HG21 THR 78 -2.834 -2.863 -39.242 608 HG22 THR 78 HG22 THR 78 -4.483 -2.886 -38.620 609 HG23 THR 78 HG23 THR 78 -3.376 -1.601 -38.136 610 H ILE 79 HN ILE 79 -3.612 1.347 -39.459 611 HA ILE 79 HA ILE 79 -3.556 1.241 -36.571 612 HB ILE 79 HB ILE 79 -2.063 3.008 -38.518 613 HG12 ILE 79 HG12 ILE 79 -0.099 1.654 -37.516 614 HG13 ILE 79 HG11 ILE 79 -1.335 0.531 -36.964 615 HG21 ILE 79 HG21 ILE 79 -2.376 4.203 -36.431 616 HG22 ILE 79 HG22 ILE 79 -0.692 3.715 -36.614 617 HG23 ILE 79 HG23 ILE 79 -1.754 2.823 -35.525 618 HD11 ILE 79 HD11 ILE 79 -0.835 1.317 -39.826 619 HD12 ILE 79 HD12 ILE 79 -2.032 0.152 -39.261 620 HD13 ILE 79 HD13 ILE 79 -0.311 -0.182 -39.058 621 H LEU 80 HN LEU 80 -4.551 3.563 -39.053 622 HA LEU 80 HA LEU 80 -5.200 5.555 -37.119 623 HB2 LEU 80 HB2 LEU 80 -5.613 5.384 -40.082 624 HB3 LEU 80 HB1 LEU 80 -6.308 6.687 -39.141 625 HG LEU 80 HG LEU 80 -3.962 7.228 -38.354 626 HD11 LEU 80 HD11 LEU 80 -3.206 5.363 -40.597 627 HD12 LEU 80 HD12 LEU 80 -2.906 5.098 -38.880 628 HD13 LEU 80 HD13 LEU 80 -2.107 6.428 -39.720 629 HD21 LEU 80 HD21 LEU 80 -3.384 8.410 -40.414 630 HD22 LEU 80 HD22 LEU 80 -5.104 8.540 -40.052 631 HD23 LEU 80 HD23 LEU 80 -4.550 7.428 -41.302 632 H LYS 81 HN LYS 81 -6.826 2.770 -38.116 633 HA LYS 81 HA LYS 81 -9.490 3.390 -37.875 634 HB2 LYS 81 HB2 LYS 81 -8.873 1.104 -38.172 635 HB3 LYS 81 HB1 LYS 81 -7.914 1.098 -36.700 636 HG2 LYS 81 HG2 LYS 81 -9.988 -0.136 -36.419 637 HG3 LYS 81 HG1 LYS 81 -9.937 1.275 -35.361 638 HD2 LYS 81 HD2 LYS 81 -11.324 2.503 -37.000 639 HD3 LYS 81 HD1 LYS 81 -11.428 1.033 -37.973 640 HE2 LYS 81 HE2 LYS 81 -12.409 1.361 -35.139 641 HE3 LYS 81 HE1 LYS 81 -13.416 1.318 -36.586 642 HZ1 LYS 81 HZ1 LYS 81 -12.583 -0.947 -37.003 643 HZ2 LYS 81 HZ2 LYS 81 -13.427 -0.823 -35.538 644 HZ3 LYS 81 HZ3 LYS 81 -11.736 -0.897 -35.536 645 H GLU 82 HN GLU 82 -7.417 2.530 -35.114 646 HA GLU 82 HA GLU 82 -9.258 3.644 -33.223 647 HB2 GLU 82 HB2 GLU 82 -7.639 1.687 -32.861 648 HB3 GLU 82 HB1 GLU 82 -6.374 2.897 -32.707 649 HG2 GLU 82 HG2 GLU 82 -7.100 2.255 -30.527 650 HG3 GLU 82 HG1 GLU 82 -7.631 3.909 -30.834 651 H GLU 83 HN GLU 83 -6.404 4.697 -34.902 652 HA GLU 83 HA GLU 83 -5.555 6.836 -33.349 653 HB2 GLU 83 HB2 GLU 83 -4.480 5.860 -35.396 654 HB3 GLU 83 HB1 GLU 83 -5.645 6.762 -36.357 655 HG2 GLU 83 HG2 GLU 83 -3.704 8.027 -36.339 656 HG3 GLU 83 HG1 GLU 83 -4.795 8.827 -35.212 657 H LEU 84 HN LEU 84 -7.714 6.947 -36.142 658 HA LEU 84 HA LEU 84 -8.363 9.601 -36.203 659 HB2 LEU 84 HB2 LEU 84 -10.170 7.275 -36.834 660 HB3 LEU 84 HB1 LEU 84 -10.519 8.938 -37.258 661 HG LEU 84 HG LEU 84 -8.241 7.261 -38.294 662 HD11 LEU 84 HD11 LEU 84 -10.684 8.384 -39.652 663 HD12 LEU 84 HD12 LEU 84 -10.390 6.689 -39.263 664 HD13 LEU 84 HD13 LEU 84 -9.373 7.511 -40.446 665 HD21 LEU 84 HD21 LEU 84 -8.944 10.129 -38.906 666 HD22 LEU 84 HD22 LEU 84 -7.714 9.172 -39.730 667 HD23 LEU 84 HD23 LEU 84 -7.523 9.571 -38.023 668 H GLN 85 HN GLN 85 -9.590 7.236 -33.940 669 HA GLN 85 HA GLN 85 -11.982 8.410 -33.173 670 HB2 GLN 85 HB2 GLN 85 -10.048 7.093 -31.266 671 HB3 GLN 85 HB1 GLN 85 -11.787 7.237 -31.079 672 HG2 GLN 85 HG2 GLN 85 -10.245 5.470 -32.942 673 HG3 GLN 85 HG1 GLN 85 -11.392 5.014 -31.686 674 HE21 GLN 85 HE21 GLN 85 -10.953 5.991 -34.928 675 HE22 GLN 85 HE22 GLN 85 -12.592 5.836 -35.433 676 H ASN 86 HN ASN 86 -8.715 9.373 -32.455 677 HA ASN 86 HA ASN 86 -9.606 11.232 -30.376 678 HB2 ASN 86 HB2 ASN 86 -6.821 10.435 -31.260 679 HB3 ASN 86 HB1 ASN 86 -7.180 11.541 -29.941 680 HD21 ASN 86 HD21 ASN 86 -7.223 8.231 -31.004 681 HD22 ASN 86 HD22 ASN 86 -7.529 7.521 -29.456 682 H ILE 87 HN ILE 87 -9.558 11.352 -33.581 683 HA ILE 87 HA ILE 87 -8.639 14.158 -33.676 684 HB ILE 87 HB ILE 87 -8.654 12.343 -36.080 685 HG12 ILE 87 HG12 ILE 87 -6.321 12.851 -34.217 686 HG13 ILE 87 HG11 ILE 87 -7.179 11.324 -34.401 687 HG21 ILE 87 HG21 ILE 87 -8.594 14.737 -36.496 688 HG22 ILE 87 HG22 ILE 87 -7.060 13.994 -36.947 689 HG23 ILE 87 HG23 ILE 87 -7.191 14.903 -35.441 690 HD11 ILE 87 HD11 ILE 87 -5.071 11.320 -35.606 691 HD12 ILE 87 HD12 ILE 87 -5.601 12.715 -36.547 692 HD13 ILE 87 HD13 ILE 87 -6.440 11.171 -36.707 693 H HIS 88 HN HIS 88 -10.053 15.612 -34.518 694 HA HIS 88 HA HIS 88 -12.763 14.800 -34.947 695 HB2 HIS 88 HB2 HIS 88 -12.052 17.002 -33.953 696 HB3 HIS 88 HB1 HIS 88 -11.533 17.494 -35.560 697 HD1 HIS 88 HD1 HIS 88 -14.687 16.458 -33.727 698 HD2 HIS 88 HD2 HIS 88 -13.512 18.582 -37.107 699 HE1 HIS 88 HE1 HIS 88 -16.776 17.547 -34.608 700 HE2 HIS 88 HE2 HIS 88 -16.020 18.945 -36.562 701 H ALA 89 HN ALA 89 -10.101 15.803 -37.007 702 HA ALA 89 HA ALA 89 -11.221 14.439 -39.260 703 HB1 ALA 89 HB1 ALA 89 -10.962 17.443 -39.420 704 HB2 ALA 89 HB2 ALA 89 -12.477 16.540 -39.401 705 HB3 ALA 89 HB3 ALA 89 -11.361 16.364 -40.756 706 H PHE 90 HN PHE 90 -9.354 13.325 -39.551 707 HA PHE 90 HA PHE 90 -6.834 14.787 -39.709 708 HB2 PHE 90 HB2 PHE 90 -6.947 12.671 -38.415 709 HB3 PHE 90 HB1 PHE 90 -7.367 11.813 -39.893 710 HD1 PHE 90 HD1 PHE 90 -4.707 13.841 -38.300 711 HD2 PHE 90 HD2 PHE 90 -5.707 11.030 -41.333 712 HE1 PHE 90 HE1 PHE 90 -2.317 13.513 -38.778 713 HE2 PHE 90 HE2 PHE 90 -3.318 10.695 -41.815 714 HZ PHE 90 HZ PHE 90 -1.622 11.937 -40.537 715 H SER 91 HN SER 91 -5.682 15.041 -41.565 716 HA SER 91 HA SER 91 -6.746 13.816 -44.025 717 HB2 SER 91 HB2 SER 91 -5.568 16.600 -43.867 718 HB3 SER 91 HB1 SER 91 -6.375 15.853 -45.246 719 HG SER 91 HG SER 91 -8.121 15.706 -43.350 720 H MET 92 HN MET 92 -5.181 13.021 -45.427 721 HA MET 92 HA MET 92 -2.391 13.465 -44.633 722 HB2 MET 92 HB2 MET 92 -1.834 11.161 -44.879 723 HB3 MET 92 HB1 MET 92 -3.240 11.239 -43.831 724 HG2 MET 92 HG2 MET 92 -3.355 10.614 -46.773 725 HG3 MET 92 HG1 MET 92 -3.287 9.400 -45.501 726 HE1 MET 92 HE1 MET 92 -5.247 8.883 -43.825 727 HE2 MET 92 HE2 MET 92 -6.699 9.872 -43.680 728 HE3 MET 92 HE3 MET 92 -5.129 10.542 -43.235 729 H LYS 93 HN LYS 93 -1.046 13.963 -46.231 730 HA LYS 93 HA LYS 93 -1.877 13.310 -48.981 731 HB2 LYS 93 HB2 LYS 93 -2.092 15.723 -48.621 732 HB3 LYS 93 HB1 LYS 93 -0.425 15.804 -48.064 733 HG2 LYS 93 HG2 LYS 93 -0.752 16.570 -50.402 734 HG3 LYS 93 HG1 LYS 93 0.399 15.240 -50.239 735 HD2 LYS 93 HD2 LYS 93 -1.502 13.680 -50.794 736 HD3 LYS 93 HD1 LYS 93 -2.452 15.109 -51.203 737 HE2 LYS 93 HE2 LYS 93 -0.922 15.710 -52.942 738 HE3 LYS 93 HE1 LYS 93 0.212 14.454 -52.447 739 HZ1 LYS 93 HZ1 LYS 93 -2.482 14.050 -53.631 740 HZ2 LYS 93 HZ2 LYS 93 -1.513 12.801 -53.020 741 HZ3 LYS 93 HZ3 LYS 93 -0.983 13.705 -54.352 742 H CYS 94 HN CYS 94 -0.563 11.915 -49.889 743 HA CYS 94 HA CYS 94 1.971 11.343 -48.600 744 HB2 CYS 94 HB2 CYS 94 0.515 9.873 -50.803 745 HB3 CYS 94 HB1 CYS 94 1.949 9.298 -49.957 746 HG CYS 94 HG CYS 94 0.529 9.376 -47.426 747 H HIS 95 HN HIS 95 3.903 11.711 -49.385 748 HA HIS 95 HA HIS 95 4.262 12.306 -52.237 749 HB2 HIS 95 HB2 HIS 95 5.370 13.926 -49.928 750 HB3 HIS 95 HB1 HIS 95 5.995 14.028 -51.567 751 HD1 HIS 95 HD1 HIS 95 4.873 15.657 -53.100 752 HD2 HIS 95 HD2 HIS 95 2.626 14.852 -49.686 753 HE1 HIS 95 HE1 HIS 95 2.954 17.280 -53.149 754 HE2 HIS 95 HE2 HIS 95 1.736 16.906 -50.978 755 H THR 96 HN THR 96 6.339 11.748 -53.015 756 HA THR 96 HA THR 96 7.780 9.835 -51.365 757 HB THR 96 HB THR 96 9.112 9.844 -53.716 758 HG1 THR 96 HG1 THR 96 7.890 10.571 -55.340 759 HG21 THR 96 HG21 THR 96 7.687 7.946 -54.362 760 HG22 THR 96 HG22 THR 96 6.499 8.435 -53.153 761 HG23 THR 96 HG23 THR 96 8.103 7.896 -52.648 762 HA PRO 97 HA PRO 97 11.040 12.559 -50.143 763 HB2 PRO 97 HB2 PRO 97 12.943 10.442 -51.003 764 HB3 PRO 97 HB1 PRO 97 12.778 11.240 -49.434 765 HG2 PRO 97 HG2 PRO 97 11.920 8.748 -49.763 766 HG3 PRO 97 HG1 PRO 97 10.987 9.904 -48.795 767 HD2 PRO 97 HD2 PRO 97 10.502 8.950 -51.592 768 HD3 PRO 97 HD1 PRO 97 9.337 9.253 -50.286 769 H LEU 98 HN LEU 98 11.394 10.875 -53.202 770 HA LEU 98 HA LEU 98 13.286 12.638 -54.349 771 HB2 LEU 98 HB2 LEU 98 11.254 10.800 -55.619 772 HB3 LEU 98 HB1 LEU 98 12.431 11.714 -56.538 773 HG LEU 98 HG LEU 98 13.288 9.521 -56.366 774 HD11 LEU 98 HD11 LEU 98 14.650 11.208 -54.278 775 HD12 LEU 98 HD12 LEU 98 14.958 11.240 -56.015 776 HD13 LEU 98 HD13 LEU 98 15.345 9.797 -55.076 777 HD21 LEU 98 HD21 LEU 98 12.776 9.651 -53.398 778 HD22 LEU 98 HD22 LEU 98 13.565 8.324 -54.251 779 HD23 LEU 98 HD23 LEU 98 11.872 8.695 -54.572 780 H GLU 99 HN GLU 99 9.738 12.450 -54.628 781 HA GLU 99 HA GLU 99 9.525 14.729 -56.290 782 HB2 GLU 99 HB2 GLU 99 7.597 13.057 -54.751 783 HB3 GLU 99 HB1 GLU 99 7.057 14.620 -55.347 784 HG2 GLU 99 HG2 GLU 99 6.543 12.721 -56.857 785 HG3 GLU 99 HG1 GLU 99 7.504 13.994 -57.607 786 H TYR 100 HN TYR 100 9.621 14.342 -52.814 787 HA TYR 100 HA TYR 100 8.854 17.041 -52.258 788 HB2 TYR 100 HB2 TYR 100 8.675 15.378 -50.493 789 HB3 TYR 100 HB1 TYR 100 10.406 15.054 -50.579 790 HD1 TYR 100 HD1 TYR 100 7.953 17.752 -49.844 791 HD2 TYR 100 HD2 TYR 100 11.898 16.274 -49.248 792 HE1 TYR 100 HE1 TYR 100 8.366 19.533 -48.204 793 HE2 TYR 100 HE2 TYR 100 12.321 18.052 -47.602 794 HH TYR 100 HH TYR 100 9.854 19.962 -46.283 795 H ASP 101 HN ASP 101 11.830 15.375 -52.994 796 HA ASP 101 HA ASP 101 13.674 17.364 -52.311 797 HB2 ASP 101 HB2 ASP 101 14.216 15.001 -53.003 798 HB3 ASP 101 HB1 ASP 101 13.892 15.478 -54.666 799 H LYS 102 HN LYS 102 11.838 16.803 -55.276 800 HA LYS 102 HA LYS 102 12.861 18.862 -56.851 801 HB2 LYS 102 HB2 LYS 102 10.460 17.192 -56.831 802 HB3 LYS 102 HB1 LYS 102 10.172 18.789 -57.504 803 HG2 LYS 102 HG2 LYS 102 10.718 17.318 -59.293 804 HG3 LYS 102 HG1 LYS 102 12.076 18.417 -59.059 805 HD2 LYS 102 HD2 LYS 102 12.931 16.204 -59.430 806 HD3 LYS 102 HD1 LYS 102 13.214 16.640 -57.746 807 HE2 LYS 102 HE2 LYS 102 12.444 14.358 -57.876 808 HE3 LYS 102 HE1 LYS 102 11.221 15.355 -57.099 809 HZ1 LYS 102 HZ1 LYS 102 11.177 14.472 -59.936 810 HZ2 LYS 102 HZ2 LYS 102 9.985 15.404 -59.171 811 HZ3 LYS 102 HZ3 LYS 102 10.253 13.800 -58.677 812 H LEU 103 HN LEU 103 10.589 18.948 -54.204 813 HA LEU 103 HA LEU 103 9.602 21.583 -54.796 814 HB2 LEU 103 HB2 LEU 103 9.303 19.951 -52.278 815 HB3 LEU 103 HB1 LEU 103 8.379 21.379 -52.700 816 HG LEU 103 HG LEU 103 8.287 18.713 -54.114 817 HD11 LEU 103 HD11 LEU 103 7.163 18.713 -51.956 818 HD12 LEU 103 HD12 LEU 103 5.997 18.628 -53.277 819 HD13 LEU 103 HD13 LEU 103 6.250 20.148 -52.420 820 HD21 LEU 103 HD21 LEU 103 6.478 19.697 -55.438 821 HD22 LEU 103 HD22 LEU 103 8.008 20.534 -55.702 822 HD23 LEU 103 HD23 LEU 103 6.772 21.261 -54.675 823 H LYS 104 HN LYS 104 11.951 20.200 -52.523 824 HA LYS 104 HA LYS 104 12.291 22.820 -51.312 825 HB2 LYS 104 HB2 LYS 104 13.746 21.688 -49.675 826 HB3 LYS 104 HB1 LYS 104 12.142 20.988 -49.767 827 HG2 LYS 104 HG2 LYS 104 13.537 19.149 -49.587 828 HG3 LYS 104 HG1 LYS 104 13.211 19.241 -51.318 829 HD2 LYS 104 HD2 LYS 104 15.347 20.309 -51.699 830 HD3 LYS 104 HD1 LYS 104 15.664 20.362 -49.965 831 HE2 LYS 104 HE2 LYS 104 15.890 18.015 -49.839 832 HE3 LYS 104 HE1 LYS 104 15.197 17.789 -51.444 833 HZ1 LYS 104 HZ1 LYS 104 17.776 19.172 -50.934 834 HZ2 LYS 104 HZ2 LYS 104 17.124 18.744 -52.438 835 HZ3 LYS 104 HZ3 LYS 104 17.638 17.536 -51.363 836 H SER 105 HN SER 105 14.005 20.762 -53.561 837 HA SER 105 HA SER 105 16.537 22.036 -53.185 838 HB2 SER 105 HB2 SER 105 15.529 20.345 -55.486 839 HB3 SER 105 HB1 SER 105 17.205 20.842 -55.253 840 HG SER 105 HG SER 105 16.251 18.667 -54.391 841 H LYS 106 HN LYS 106 13.813 22.529 -55.367 842 HA LYS 106 HA LYS 106 14.763 25.159 -55.997 843 HB2 LYS 106 HB2 LYS 106 14.645 24.723 -58.514 844 HB3 LYS 106 HB1 LYS 106 16.076 24.163 -57.667 845 HG2 LYS 106 HG2 LYS 106 15.458 22.473 -59.206 846 HG3 LYS 106 HG1 LYS 106 15.043 21.895 -57.597 847 HD2 LYS 106 HD2 LYS 106 12.725 22.356 -57.948 848 HD3 LYS 106 HD1 LYS 106 13.070 23.176 -59.470 849 HE2 LYS 106 HE2 LYS 106 13.617 20.259 -58.943 850 HE3 LYS 106 HE1 LYS 106 12.171 20.873 -59.743 851 HZ1 LYS 106 HZ1 LYS 106 14.976 21.092 -60.699 852 HZ2 LYS 106 HZ2 LYS 106 13.668 21.905 -61.415 853 HZ3 LYS 106 HZ3 LYS 106 13.710 20.207 -61.408 854 H GLY 107 HN GLY 107 13.273 25.867 -58.065 855 HA2 GLY 107 HA2 GLY 107 10.515 25.025 -57.430 856 HA3 GLY 107 HA1 GLY 107 10.934 26.724 -57.613 857 H SER 108 HN SER 108 12.798 24.956 -59.676 858 HA SER 108 HA SER 108 10.864 24.993 -61.870 859 HB2 SER 108 HB2 SER 108 12.205 27.130 -61.866 860 HB3 SER 108 HB1 SER 108 13.658 26.157 -62.076 861 HG SER 108 HG SER 108 13.093 25.690 -64.100 Start of MODEL 7 1 H1 MET 1 HT1 MET 1 22.283 20.216 -26.968 2 H2 MET 1 HT2 MET 1 21.924 21.761 -26.364 3 H3 MET 1 HT3 MET 1 20.750 20.541 -26.320 4 HA MET 1 HA MET 1 22.007 19.280 -24.754 5 HB2 MET 1 HB2 MET 1 24.006 21.521 -25.068 6 HB3 MET 1 HB1 MET 1 24.029 20.402 -23.710 7 HG2 MET 1 HG2 MET 1 24.258 18.539 -25.328 8 HG3 MET 1 HG1 MET 1 24.380 19.726 -26.622 9 HE1 MET 1 HE1 MET 1 28.054 18.373 -26.289 10 HE2 MET 1 HE2 MET 1 26.683 18.615 -27.371 11 HE3 MET 1 HE3 MET 1 26.570 17.447 -26.054 12 H GLY 2 HN GLY 2 22.276 19.919 -22.382 13 HA2 GLY 2 HA2 GLY 2 21.538 21.104 -20.533 14 HA3 GLY 2 HA1 GLY 2 21.087 22.430 -21.600 15 H SER 3 HN SER 3 18.999 22.863 -21.369 16 HA SER 3 HA SER 3 17.109 20.669 -21.738 17 HB2 SER 3 HB2 SER 3 17.447 21.183 -19.238 18 HB3 SER 3 HB1 SER 3 16.639 22.716 -19.566 19 HG SER 3 HG SER 3 15.579 20.114 -20.029 20 H SER 4 HN SER 4 15.580 21.213 -23.174 21 HA SER 4 HA SER 4 15.727 23.870 -24.316 22 HB2 SER 4 HB2 SER 4 14.063 21.486 -25.164 23 HB3 SER 4 HB1 SER 4 14.344 22.952 -26.106 24 HG SER 4 HG SER 4 16.721 22.097 -25.452 25 H HIS 5 HN HIS 5 14.785 25.087 -22.594 26 HA HIS 5 HA HIS 5 11.856 24.813 -22.521 27 HB2 HIS 5 HB2 HIS 5 13.766 25.563 -20.332 28 HB3 HIS 5 HB1 HIS 5 12.091 26.104 -20.281 29 HD1 HIS 5 HD1 HIS 5 10.473 24.530 -19.255 30 HD2 HIS 5 HD2 HIS 5 13.951 22.611 -20.493 31 HE1 HIS 5 HE1 HIS 5 10.257 22.154 -18.465 32 HE2 HIS 5 HE2 HIS 5 12.259 20.967 -19.430 33 H HIS 6 HN HIS 6 11.836 26.089 -24.411 34 HA HIS 6 HA HIS 6 11.308 28.824 -23.737 35 HB2 HIS 6 HB2 HIS 6 12.656 29.796 -25.602 36 HB3 HIS 6 HB1 HIS 6 13.640 29.139 -24.306 37 HD1 HIS 6 HD1 HIS 6 13.280 29.099 -27.908 38 HD2 HIS 6 HD2 HIS 6 14.745 26.487 -25.019 39 HE1 HIS 6 HE1 HIS 6 14.722 27.450 -29.147 40 HE2 HIS 6 HE2 HIS 6 15.772 26.027 -27.345 41 H HIS 7 HN HIS 7 9.242 28.637 -24.304 42 HA HIS 7 HA HIS 7 8.575 27.055 -26.663 43 HB2 HIS 7 HB2 HIS 7 7.495 26.501 -24.515 44 HB3 HIS 7 HB1 HIS 7 6.785 28.110 -24.466 45 HD1 HIS 7 HD1 HIS 7 6.506 24.804 -26.213 46 HD2 HIS 7 HD2 HIS 7 4.547 28.473 -26.085 47 HE1 HIS 7 HE1 HIS 7 4.339 24.465 -27.451 48 HE2 HIS 7 HE2 HIS 7 3.094 26.640 -27.189 49 H HIS 8 HN HIS 8 7.894 27.888 -28.482 50 HA HIS 8 HA HIS 8 6.391 30.408 -28.453 51 HB2 HIS 8 HB2 HIS 8 8.885 29.825 -29.960 52 HB3 HIS 8 HB1 HIS 8 7.605 30.641 -30.846 53 HD1 HIS 8 HD1 HIS 8 7.124 33.065 -30.277 54 HD2 HIS 8 HD2 HIS 8 10.045 31.343 -27.872 55 HE1 HIS 8 HE1 HIS 8 8.211 34.978 -29.055 56 HE2 HIS 8 HE2 HIS 8 10.127 33.927 -27.798 57 H HIS 9 HN HIS 9 4.484 30.146 -29.475 58 HA HIS 9 HA HIS 9 4.056 27.735 -31.031 59 HB2 HIS 9 HB2 HIS 9 2.302 28.705 -29.470 60 HB3 HIS 9 HB1 HIS 9 2.090 30.001 -30.642 61 HD1 HIS 9 HD1 HIS 9 1.118 26.531 -29.906 62 HD2 HIS 9 HD2 HIS 9 0.996 29.106 -33.172 63 HE1 HIS 9 HE1 HIS 9 -0.453 25.466 -31.558 64 HE2 HIS 9 HE2 HIS 9 -0.338 26.928 -33.603 65 H HIS 10 HN HIS 10 5.744 28.407 -32.517 66 HA HIS 10 HA HIS 10 5.151 30.577 -34.324 67 HB2 HIS 10 HB2 HIS 10 7.254 29.659 -35.506 68 HB3 HIS 10 HB1 HIS 10 7.443 30.409 -33.928 69 HD1 HIS 10 HD1 HIS 10 9.299 29.202 -32.859 70 HD2 HIS 10 HD2 HIS 10 6.669 26.591 -34.740 71 HE1 HIS 10 HE1 HIS 10 10.108 26.893 -32.277 72 HE2 HIS 10 HE2 HIS 10 8.656 25.349 -33.635 73 H SER 11 HN SER 11 5.595 30.013 -36.742 74 HA SER 11 HA SER 11 3.308 28.791 -37.688 75 HB2 SER 11 HB2 SER 11 5.890 29.085 -39.231 76 HB3 SER 11 HB1 SER 11 4.249 29.066 -39.879 77 HG SER 11 HG SER 11 4.209 30.983 -38.140 78 H SER 12 HN SER 12 2.705 26.764 -38.002 79 HA SER 12 HA SER 12 4.522 24.606 -37.463 80 HB2 SER 12 HB2 SER 12 1.647 24.518 -38.413 81 HB3 SER 12 HB1 SER 12 2.568 23.162 -37.757 82 HG SER 12 HG SER 12 2.800 24.510 -35.818 83 H GLY 13 HN GLY 13 6.044 24.777 -39.059 84 HA2 GLY 13 HA2 GLY 13 5.770 23.127 -41.256 85 HA3 GLY 13 HA1 GLY 13 5.461 24.762 -41.834 86 H ARG 14 HN ARG 14 7.094 26.376 -41.373 87 HA ARG 14 HA ARG 14 9.565 25.622 -42.414 88 HB2 ARG 14 HB2 ARG 14 10.288 27.903 -41.937 89 HB3 ARG 14 HB1 ARG 14 8.645 27.904 -42.564 90 HG2 ARG 14 HG2 ARG 14 7.782 28.155 -40.288 91 HG3 ARG 14 HG1 ARG 14 9.432 28.169 -39.668 92 HD2 ARG 14 HD2 ARG 14 8.205 30.181 -41.550 93 HD3 ARG 14 HD1 ARG 14 8.562 30.430 -39.842 94 HE ARG 14 HE ARG 14 10.569 30.118 -41.983 95 HH11 ARG 14 HH11 ARG 14 9.765 31.041 -38.693 96 HH12 ARG 14 HH12 ARG 14 11.193 32.014 -38.496 97 HH21 ARG 14 HH21 ARG 14 12.445 31.348 -41.704 98 HH22 ARG 14 HH22 ARG 14 12.731 32.169 -40.194 99 H GLU 15 HN GLU 15 8.476 25.708 -39.122 100 HA GLU 15 HA GLU 15 11.098 24.827 -38.203 101 HB2 GLU 15 HB2 GLU 15 11.041 26.501 -36.349 102 HB3 GLU 15 HB1 GLU 15 11.233 27.217 -37.945 103 HG2 GLU 15 HG2 GLU 15 8.740 27.599 -37.934 104 HG3 GLU 15 HG1 GLU 15 8.772 27.161 -36.227 105 H ASN 16 HN ASN 16 8.649 23.383 -38.482 106 HA ASN 16 HA ASN 16 7.644 23.199 -35.735 107 HB2 ASN 16 HB2 ASN 16 5.707 22.219 -36.536 108 HB3 ASN 16 HB1 ASN 16 6.130 23.296 -37.858 109 HD21 ASN 16 HD21 ASN 16 6.903 22.405 -39.801 110 HD22 ASN 16 HD22 ASN 16 6.685 20.741 -40.181 111 H LEU 17 HN LEU 17 9.801 21.630 -37.846 112 HA LEU 17 HA LEU 17 9.476 18.984 -36.733 113 HB2 LEU 17 HB2 LEU 17 11.590 20.092 -38.582 114 HB3 LEU 17 HB1 LEU 17 11.459 18.411 -38.117 115 HG LEU 17 HG LEU 17 10.520 18.449 -40.230 116 HD11 LEU 17 HD11 LEU 17 9.039 17.322 -38.680 117 HD12 LEU 17 HD12 LEU 17 8.119 18.102 -39.968 118 HD13 LEU 17 HD13 LEU 17 8.188 18.834 -38.365 119 HD21 LEU 17 HD21 LEU 17 9.088 20.998 -39.501 120 HD22 LEU 17 HD22 LEU 17 8.957 20.149 -41.041 121 HD23 LEU 17 HD23 LEU 17 10.498 20.853 -40.549 122 H TYR 18 HN TYR 18 10.669 21.612 -35.345 123 HA TYR 18 HA TYR 18 13.245 20.625 -34.527 124 HB2 TYR 18 HB2 TYR 18 11.690 23.109 -33.863 125 HB3 TYR 18 HB1 TYR 18 13.180 22.697 -33.018 126 HD1 TYR 18 HD2 TYR 18 11.730 23.742 -36.221 127 HD2 TYR 18 HD1 TYR 18 15.318 22.789 -34.144 128 HE1 TYR 18 HE2 TYR 18 13.044 24.733 -38.046 129 HE2 TYR 18 HE1 TYR 18 16.643 23.776 -35.965 130 HH TYR 18 HH TYR 18 15.276 25.711 -38.390 131 H PHE 19 HN PHE 19 13.600 21.170 -31.997 132 HA PHE 19 HA PHE 19 12.648 18.784 -30.833 133 HB2 PHE 19 HB2 PHE 19 13.913 19.692 -28.798 134 HB3 PHE 19 HB1 PHE 19 14.834 19.399 -30.270 135 HD1 PHE 19 HD1 PHE 19 13.250 22.037 -28.216 136 HD2 PHE 19 HD2 PHE 19 15.976 21.142 -31.358 137 HE1 PHE 19 HE1 PHE 19 14.049 24.362 -28.179 138 HE2 PHE 19 HE2 PHE 19 16.782 23.466 -31.326 139 HZ PHE 19 HZ PHE 19 15.816 25.080 -29.736 140 H GLN 20 HN GLN 20 11.113 21.779 -30.955 141 HA GLN 20 HA GLN 20 10.076 21.793 -28.286 142 HB2 GLN 20 HB2 GLN 20 8.914 23.724 -28.838 143 HB3 GLN 20 HB1 GLN 20 10.314 23.806 -29.889 144 HG2 GLN 20 HG2 GLN 20 7.587 22.852 -30.735 145 HG3 GLN 20 HG1 GLN 20 8.198 24.485 -30.966 146 HE21 GLN 20 HE21 GLN 20 8.235 21.241 -32.079 147 HE22 GLN 20 HE22 GLN 20 9.197 21.501 -33.491 148 H GLY 21 HN GLY 21 9.400 20.015 -31.054 149 HA2 GLY 21 HA2 GLY 21 6.603 19.537 -30.364 150 HA3 GLY 21 HA1 GLY 21 7.448 18.921 -31.778 151 H HIS 22 HN HIS 22 7.306 18.624 -28.258 152 HA HIS 22 HA HIS 22 8.257 15.859 -28.509 153 HB2 HIS 22 HB2 HIS 22 8.518 17.931 -26.443 154 HB3 HIS 22 HB1 HIS 22 8.125 16.333 -25.814 155 HD1 HIS 22 HD1 HIS 22 10.832 18.190 -27.671 156 HD2 HIS 22 HD2 HIS 22 10.145 14.445 -25.991 157 HE1 HIS 22 HE1 HIS 22 13.061 17.024 -27.670 158 HE2 HIS 22 HE2 HIS 22 12.585 14.702 -26.800 159 H MET 23 HN MET 23 7.117 15.115 -25.915 160 HA MET 23 HA MET 23 4.906 13.759 -26.818 161 HB2 MET 23 HB2 MET 23 4.393 13.265 -24.481 162 HB3 MET 23 HB1 MET 23 6.115 13.121 -24.805 163 HG2 MET 23 HG2 MET 23 6.453 15.353 -23.813 164 HG3 MET 23 HG1 MET 23 4.735 15.408 -23.419 165 HE1 MET 23 HE1 MET 23 5.264 15.849 -20.862 166 HE2 MET 23 HE2 MET 23 6.990 15.840 -21.225 167 HE3 MET 23 HE3 MET 23 6.363 14.856 -19.903 168 H CYS 24 HN CYS 24 2.849 14.119 -27.074 169 HA CYS 24 HA CYS 24 1.231 16.070 -25.880 170 HB2 CYS 24 HB2 CYS 24 2.685 17.632 -27.172 171 HB3 CYS 24 HB1 CYS 24 2.259 16.781 -28.652 172 HG CYS 24 HG CYS 24 0.513 19.055 -26.896 173 H ILE 25 HN ILE 25 -0.927 16.127 -27.062 174 HA ILE 25 HA ILE 25 -1.712 13.571 -27.900 175 HB ILE 25 HB ILE 25 -3.344 15.131 -27.020 176 HG12 ILE 25 HG12 ILE 25 -5.136 14.894 -28.732 177 HG13 ILE 25 HG11 ILE 25 -3.916 14.391 -29.897 178 HG21 ILE 25 HG21 ILE 25 -2.889 16.751 -29.516 179 HG22 ILE 25 HG22 ILE 25 -2.439 17.208 -27.874 180 HG23 ILE 25 HG23 ILE 25 -4.140 17.055 -28.311 181 HD11 ILE 25 HD11 ILE 25 -4.621 12.958 -27.344 182 HD12 ILE 25 HD12 ILE 25 -3.402 12.448 -28.512 183 HD13 ILE 25 HD13 ILE 25 -5.103 12.486 -28.974 184 H GLN 26 HN GLN 26 -0.753 16.420 -29.740 185 HA GLN 26 HA GLN 26 -1.241 15.395 -32.313 186 HB2 GLN 26 HB2 GLN 26 -0.856 17.765 -31.960 187 HB3 GLN 26 HB1 GLN 26 0.759 17.452 -31.345 188 HG2 GLN 26 HG2 GLN 26 0.297 16.418 -34.039 189 HG3 GLN 26 HG1 GLN 26 0.144 18.169 -33.901 190 HE21 GLN 26 HE21 GLN 26 2.002 18.499 -35.133 191 HE22 GLN 26 HE22 GLN 26 3.584 18.205 -34.505 192 H LYS 27 HN LYS 27 1.515 15.158 -30.142 193 HA LYS 27 HA LYS 27 3.256 13.905 -31.997 194 HB2 LYS 27 HB2 LYS 27 4.177 15.056 -30.091 195 HB3 LYS 27 HB1 LYS 27 3.279 14.035 -28.980 196 HG2 LYS 27 HG2 LYS 27 5.652 13.447 -29.079 197 HG3 LYS 27 HG1 LYS 27 4.617 12.119 -29.600 198 HD2 LYS 27 HD2 LYS 27 6.575 12.339 -31.045 199 HD3 LYS 27 HD1 LYS 27 5.088 12.658 -31.936 200 HE2 LYS 27 HE2 LYS 27 5.470 15.039 -31.801 201 HE3 LYS 27 HE1 LYS 27 6.887 14.784 -30.781 202 HZ1 LYS 27 HZ1 LYS 27 7.982 13.673 -32.604 203 HZ2 LYS 27 HZ2 LYS 27 7.475 15.209 -33.099 204 HZ3 LYS 27 HZ3 LYS 27 6.607 13.837 -33.590 205 H VAL 28 HN VAL 28 0.897 12.718 -29.668 206 HA VAL 28 HA VAL 28 1.556 10.008 -29.719 207 HB VAL 28 HB VAL 28 -1.199 11.243 -29.510 208 HG11 VAL 28 HG11 VAL 28 -0.274 8.455 -28.814 209 HG12 VAL 28 HG12 VAL 28 -1.349 8.894 -30.142 210 HG13 VAL 28 HG13 VAL 28 -1.870 9.122 -28.472 211 HG21 VAL 28 HG21 VAL 28 0.723 10.320 -27.374 212 HG22 VAL 28 HG22 VAL 28 -0.913 10.920 -27.100 213 HG23 VAL 28 HG23 VAL 28 0.321 11.995 -27.758 214 H ILE 29 HN ILE 29 -0.753 11.780 -31.780 215 HA ILE 29 HA ILE 29 -1.279 9.562 -33.470 216 HB ILE 29 HB ILE 29 -1.814 12.507 -33.719 217 HG12 ILE 29 HG12 ILE 29 -4.185 11.655 -33.812 218 HG13 ILE 29 HG11 ILE 29 -3.555 10.044 -33.505 219 HG21 ILE 29 HG21 ILE 29 -2.421 10.447 -35.837 220 HG22 ILE 29 HG22 ILE 29 -1.272 11.776 -35.976 221 HG23 ILE 29 HG23 ILE 29 -2.996 12.115 -35.826 222 HD11 ILE 29 HD11 ILE 29 -3.303 12.413 -31.669 223 HD12 ILE 29 HD12 ILE 29 -2.686 10.791 -31.356 224 HD13 ILE 29 HD13 ILE 29 -4.424 11.064 -31.485 225 H GLU 30 HN GLU 30 0.921 12.340 -33.773 226 HA GLU 30 HA GLU 30 1.725 11.855 -36.420 227 HB2 GLU 30 HB2 GLU 30 2.083 13.979 -35.197 228 HB3 GLU 30 HB1 GLU 30 3.289 13.188 -34.200 229 HG2 GLU 30 HG2 GLU 30 3.610 13.242 -37.166 230 HG3 GLU 30 HG1 GLU 30 4.013 14.661 -36.205 231 H ASP 31 HN ASP 31 3.293 10.934 -33.350 232 HA ASP 31 HA ASP 31 5.463 9.615 -34.634 233 HB2 ASP 31 HB2 ASP 31 5.612 10.526 -32.337 234 HB3 ASP 31 HB1 ASP 31 4.471 9.301 -31.791 235 H LYS 32 HN LYS 32 2.284 8.639 -33.648 236 HA LYS 32 HA LYS 32 2.645 5.851 -33.586 237 HB2 LYS 32 HB2 LYS 32 0.440 7.733 -33.623 238 HB3 LYS 32 HB1 LYS 32 0.078 6.306 -34.582 239 HG2 LYS 32 HG2 LYS 32 1.093 6.145 -31.761 240 HG3 LYS 32 HG1 LYS 32 -0.623 6.254 -32.157 241 HD2 LYS 32 HD2 LYS 32 1.292 4.098 -33.044 242 HD3 LYS 32 HD1 LYS 32 0.009 3.935 -31.843 243 HE2 LYS 32 HE2 LYS 32 -0.327 4.494 -34.788 244 HE3 LYS 32 HE1 LYS 32 -0.722 2.998 -33.947 245 HZ1 LYS 32 HZ1 LYS 32 -2.694 4.305 -34.342 246 HZ2 LYS 32 HZ2 LYS 32 -2.035 5.638 -33.538 247 HZ3 LYS 32 HZ3 LYS 32 -2.403 4.217 -32.676 248 H LEU 33 HN LEU 33 1.382 7.902 -36.237 249 HA LEU 33 HA LEU 33 1.530 5.743 -38.102 250 HB2 LEU 33 HB2 LEU 33 0.994 7.498 -39.804 251 HB3 LEU 33 HB1 LEU 33 -0.161 7.338 -38.500 252 HG LEU 33 HG LEU 33 1.190 9.340 -37.456 253 HD11 LEU 33 HD11 LEU 33 2.951 9.383 -39.139 254 HD12 LEU 33 HD12 LEU 33 2.026 10.885 -39.151 255 HD13 LEU 33 HD13 LEU 33 1.752 9.672 -40.400 256 HD21 LEU 33 HD21 LEU 33 -1.167 9.377 -38.076 257 HD22 LEU 33 HD22 LEU 33 -0.727 9.669 -39.759 258 HD23 LEU 33 HD23 LEU 33 -0.367 10.882 -38.531 259 H SER 34 HN SER 34 3.674 8.319 -37.155 260 HA SER 34 HA SER 34 5.411 8.268 -39.369 261 HB2 SER 34 HB2 SER 34 5.374 10.042 -37.613 262 HB3 SER 34 HB1 SER 34 6.115 8.902 -36.494 263 HG SER 34 HG SER 34 7.404 10.500 -37.954 264 H SER 35 HN SER 35 5.618 6.580 -36.233 265 HA SER 35 HA SER 35 8.013 5.210 -36.936 266 HB2 SER 35 HB2 SER 35 6.020 4.579 -34.750 267 HB3 SER 35 HB1 SER 35 7.669 3.962 -34.859 268 HG SER 35 HG SER 35 6.745 6.493 -34.139 269 H ALA 36 HN ALA 36 4.635 4.551 -37.378 270 HA ALA 36 HA ALA 36 4.939 1.739 -37.827 271 HB1 ALA 36 HB1 ALA 36 2.832 2.696 -37.027 272 HB2 ALA 36 HB2 ALA 36 2.614 1.789 -38.524 273 HB3 ALA 36 HB3 ALA 36 2.645 3.551 -38.558 274 H LEU 37 HN LEU 37 4.288 4.503 -39.994 275 HA LEU 37 HA LEU 37 4.585 2.812 -42.324 276 HB2 LEU 37 HB2 LEU 37 4.133 5.787 -42.070 277 HB3 LEU 37 HB1 LEU 37 4.140 4.903 -43.584 278 HG LEU 37 HG LEU 37 2.177 4.461 -41.332 279 HD11 LEU 37 HD11 LEU 37 0.553 5.517 -42.817 280 HD12 LEU 37 HD12 LEU 37 1.831 5.845 -43.988 281 HD13 LEU 37 HD13 LEU 37 1.861 6.626 -42.408 282 HD21 LEU 37 HD21 LEU 37 2.282 3.337 -44.131 283 HD22 LEU 37 HD22 LEU 37 0.979 3.090 -42.968 284 HD23 LEU 37 HD23 LEU 37 2.587 2.445 -42.640 285 H LYS 38 HN LYS 38 6.420 5.240 -40.623 286 HA LYS 38 HA LYS 38 8.520 6.016 -40.770 287 HB2 LYS 38 HB2 LYS 38 8.910 3.424 -42.244 288 HB3 LYS 38 HB1 LYS 38 10.234 4.539 -41.928 289 HG2 LYS 38 HG2 LYS 38 9.774 4.358 -39.517 290 HG3 LYS 38 HG1 LYS 38 8.503 3.186 -39.866 291 HD2 LYS 38 HD2 LYS 38 10.117 1.662 -40.817 292 HD3 LYS 38 HD1 LYS 38 11.403 2.853 -40.622 293 HE2 LYS 38 HE2 LYS 38 11.497 1.173 -38.860 294 HE3 LYS 38 HE1 LYS 38 11.125 2.764 -38.198 295 HZ1 LYS 38 HZ1 LYS 38 9.734 1.084 -37.196 296 HZ2 LYS 38 HZ2 LYS 38 9.172 0.584 -38.716 297 HZ3 LYS 38 HZ3 LYS 38 8.777 2.123 -38.133 298 HA PRO 39 HA PRO 39 8.239 7.942 -44.854 299 HB2 PRO 39 HB2 PRO 39 7.544 10.395 -44.038 300 HB3 PRO 39 HB1 PRO 39 6.352 9.096 -44.169 301 HG2 PRO 39 HG2 PRO 39 7.557 10.314 -41.758 302 HG3 PRO 39 HG1 PRO 39 5.993 9.508 -41.950 303 HD2 PRO 39 HD2 PRO 39 8.429 8.412 -40.909 304 HD3 PRO 39 HD1 PRO 39 6.874 7.589 -41.137 305 H THR 40 HN THR 40 9.681 9.478 -45.803 306 HA THR 40 HA THR 40 12.149 9.878 -44.368 307 HB THR 40 HB THR 40 12.816 11.114 -46.485 308 HG1 THR 40 HG1 THR 40 11.194 11.626 -47.739 309 HG21 THR 40 HG21 THR 40 12.988 9.064 -47.832 310 HG22 THR 40 HG22 THR 40 11.819 8.277 -46.772 311 HG23 THR 40 HG23 THR 40 13.391 8.766 -46.141 312 H PHE 41 HN PHE 41 9.330 11.688 -45.257 313 HA PHE 41 HA PHE 41 10.162 13.823 -43.447 314 HB2 PHE 41 HB2 PHE 41 10.705 14.665 -45.683 315 HB3 PHE 41 HB1 PHE 41 9.077 14.293 -46.238 316 HD1 PHE 41 HD1 PHE 41 10.879 16.309 -43.680 317 HD2 PHE 41 HD2 PHE 41 7.453 15.936 -46.178 318 HE1 PHE 41 HE1 PHE 41 10.146 18.558 -43.003 319 HE2 PHE 41 HE2 PHE 41 6.715 18.184 -45.507 320 HZ PHE 41 HZ PHE 41 8.060 19.498 -43.917 321 H LEU 42 HN LEU 42 8.547 14.482 -42.153 322 HA LEU 42 HA LEU 42 5.775 13.916 -42.890 323 HB2 LEU 42 HB2 LEU 42 6.883 12.086 -41.404 324 HB3 LEU 42 HB1 LEU 42 6.785 13.279 -40.127 325 HG LEU 42 HG LEU 42 4.941 11.641 -40.057 326 HD11 LEU 42 HD11 LEU 42 4.568 13.848 -39.116 327 HD12 LEU 42 HD12 LEU 42 3.091 13.216 -39.846 328 HD13 LEU 42 HD13 LEU 42 4.037 14.442 -40.689 329 HD21 LEU 42 HD21 LEU 42 3.189 11.703 -41.759 330 HD22 LEU 42 HD22 LEU 42 4.737 11.198 -42.435 331 HD23 LEU 42 HD23 LEU 42 4.150 12.839 -42.706 332 H GLU 43 HN GLU 43 4.871 15.879 -42.844 333 HA GLU 43 HA GLU 43 5.605 17.676 -40.629 334 HB2 GLU 43 HB2 GLU 43 6.170 18.614 -42.837 335 HB3 GLU 43 HB1 GLU 43 4.496 18.424 -43.347 336 HG2 GLU 43 HG2 GLU 43 3.766 20.029 -41.709 337 HG3 GLU 43 HG1 GLU 43 5.394 20.148 -41.047 338 H LEU 44 HN LEU 44 4.097 17.966 -39.147 339 HA LEU 44 HA LEU 44 1.352 17.145 -39.759 340 HB2 LEU 44 HB2 LEU 44 2.975 16.608 -37.616 341 HB3 LEU 44 HB1 LEU 44 2.031 17.957 -37.015 342 HG LEU 44 HG LEU 44 1.021 15.853 -36.351 343 HD11 LEU 44 HD11 LEU 44 -0.587 17.263 -38.470 344 HD12 LEU 44 HD12 LEU 44 -0.457 17.731 -36.775 345 HD13 LEU 44 HD13 LEU 44 -1.233 16.210 -37.213 346 HD21 LEU 44 HD21 LEU 44 0.109 14.307 -38.003 347 HD22 LEU 44 HD22 LEU 44 1.859 14.456 -38.163 348 HD23 LEU 44 HD23 LEU 44 0.796 15.282 -39.302 349 H VAL 45 HN VAL 45 -0.015 18.700 -40.344 350 HA VAL 45 HA VAL 45 0.505 21.443 -39.395 351 HB VAL 45 HB VAL 45 -1.004 20.612 -41.882 352 HG11 VAL 45 HG11 VAL 45 -0.807 22.967 -42.517 353 HG12 VAL 45 HG12 VAL 45 -0.011 23.314 -40.982 354 HG13 VAL 45 HG13 VAL 45 -1.691 22.775 -41.003 355 HG21 VAL 45 HG21 VAL 45 1.339 19.995 -42.093 356 HG22 VAL 45 HG22 VAL 45 1.827 21.624 -41.625 357 HG23 VAL 45 HG23 VAL 45 0.965 21.364 -43.142 358 H ASP 46 HN ASP 46 -1.040 22.470 -38.256 359 HA ASP 46 HA ASP 46 -3.469 21.215 -37.501 360 HB2 ASP 46 HB2 ASP 46 -2.622 22.831 -35.984 361 HB3 ASP 46 HB1 ASP 46 -2.446 24.041 -37.248 362 H LYS 47 HN LYS 47 -5.126 20.891 -38.782 363 HA LYS 47 HA LYS 47 -5.268 22.263 -41.323 364 HB2 LYS 47 HB2 LYS 47 -5.600 19.781 -40.977 365 HB3 LYS 47 HB1 LYS 47 -7.139 20.164 -40.223 366 HG2 LYS 47 HG2 LYS 47 -7.958 21.120 -42.281 367 HG3 LYS 47 HG1 LYS 47 -6.385 20.877 -43.050 368 HD2 LYS 47 HD2 LYS 47 -6.623 18.445 -42.696 369 HD3 LYS 47 HD1 LYS 47 -8.229 18.721 -42.020 370 HE2 LYS 47 HE2 LYS 47 -8.396 18.040 -44.342 371 HE3 LYS 47 HE1 LYS 47 -8.943 19.703 -44.148 372 HZ1 LYS 47 HZ1 LYS 47 -7.541 19.433 -46.100 373 HZ2 LYS 47 HZ2 LYS 47 -6.256 18.879 -45.135 374 HZ3 LYS 47 HZ3 LYS 47 -6.819 20.470 -44.978 375 H SER 48 HN SER 48 -6.876 22.333 -38.259 376 HA SER 48 HA SER 48 -8.598 23.531 -37.394 377 HB2 SER 48 HB2 SER 48 -7.933 25.412 -39.672 378 HB3 SER 48 HB1 SER 48 -8.905 25.824 -38.259 379 HG SER 48 HG SER 48 -6.537 24.733 -37.520 380 H CYS 49 HN CYS 49 -9.198 21.522 -39.468 381 HA CYS 49 HA CYS 49 -11.507 22.611 -40.855 382 HB2 CYS 49 HB2 CYS 49 -9.963 20.961 -41.944 383 HB3 CYS 49 HB1 CYS 49 -10.499 19.756 -40.779 384 HG CYS 49 HG CYS 49 -12.927 21.263 -42.565 385 H GLY 50 HN GLY 50 -13.283 22.889 -39.684 386 HA2 GLY 50 HA2 GLY 50 -15.155 22.155 -38.482 387 HA3 GLY 50 HA1 GLY 50 -14.282 20.688 -38.056 388 H CYS 51 HN CYS 51 -13.713 20.539 -36.000 389 HA CYS 51 HA CYS 51 -12.653 22.828 -34.580 390 HB2 CYS 51 HB2 CYS 51 -15.103 21.353 -33.583 391 HB3 CYS 51 HB1 CYS 51 -14.187 22.535 -32.656 392 HG CYS 51 HG CYS 51 -15.000 23.955 -35.466 393 H GLY 52 HN GLY 52 -11.532 22.215 -32.641 394 HA2 GLY 52 HA2 GLY 52 -10.554 20.771 -31.125 395 HA3 GLY 52 HA1 GLY 52 -11.464 19.450 -31.839 396 H THR 53 HN THR 53 -9.891 17.976 -32.117 397 HA THR 53 HA THR 53 -7.310 18.654 -33.126 398 HB THR 53 HB THR 53 -7.115 16.090 -33.313 399 HG1 THR 53 HG1 THR 53 -8.712 14.992 -32.035 400 HG21 THR 53 HG21 THR 53 -6.801 15.864 -30.891 401 HG22 THR 53 HG22 THR 53 -7.681 17.373 -30.639 402 HG23 THR 53 HG23 THR 53 -6.136 17.383 -31.489 403 H SER 54 HN SER 54 -7.288 19.448 -35.139 404 HA SER 54 HA SER 54 -8.289 17.673 -37.258 405 HB2 SER 54 HB2 SER 54 -9.644 19.751 -37.115 406 HB3 SER 54 HB1 SER 54 -8.177 20.702 -37.349 407 HG SER 54 HG SER 54 -9.127 18.753 -39.183 408 H PHE 55 HN PHE 55 -6.633 16.822 -38.331 409 HA PHE 55 HA PHE 55 -4.114 18.343 -38.401 410 HB2 PHE 55 HB2 PHE 55 -4.411 15.365 -37.971 411 HB3 PHE 55 HB1 PHE 55 -2.889 16.238 -38.095 412 HD1 PHE 55 HD1 PHE 55 -2.942 18.415 -36.394 413 HD2 PHE 55 HD2 PHE 55 -4.920 14.686 -35.859 414 HE1 PHE 55 HE1 PHE 55 -2.942 18.769 -33.960 415 HE2 PHE 55 HE2 PHE 55 -4.928 15.035 -33.424 416 HZ PHE 55 HZ PHE 55 -3.937 17.079 -32.471 417 H ASP 56 HN ASP 56 -3.218 18.558 -40.321 418 HA ASP 56 HA ASP 56 -3.931 16.625 -42.433 419 HB2 ASP 56 HB2 ASP 56 -4.541 19.107 -42.799 420 HB3 ASP 56 HB1 ASP 56 -2.809 19.387 -42.932 421 H ALA 57 HN ALA 57 -2.323 15.255 -42.804 422 HA ALA 57 HA ALA 57 0.332 16.012 -41.803 423 HB1 ALA 57 HB1 ALA 57 0.763 13.639 -41.504 424 HB2 ALA 57 HB2 ALA 57 -0.815 13.252 -42.194 425 HB3 ALA 57 HB3 ALA 57 -0.711 14.117 -40.661 426 H VAL 58 HN VAL 58 1.753 16.522 -43.285 427 HA VAL 58 HA VAL 58 1.568 15.528 -45.991 428 HB VAL 58 HB VAL 58 3.831 17.061 -44.688 429 HG11 VAL 58 HG11 VAL 58 3.130 16.641 -47.590 430 HG12 VAL 58 HG12 VAL 58 4.496 15.927 -46.732 431 HG13 VAL 58 HG13 VAL 58 4.429 17.671 -46.988 432 HG21 VAL 58 HG21 VAL 58 2.845 19.061 -45.712 433 HG22 VAL 58 HG22 VAL 58 1.759 18.324 -44.533 434 HG23 VAL 58 HG23 VAL 58 1.473 18.097 -46.260 435 H ILE 59 HN ILE 59 2.134 13.515 -46.413 436 HA ILE 59 HA ILE 59 4.288 12.304 -44.827 437 HB ILE 59 HB ILE 59 2.207 11.218 -44.346 438 HG12 ILE 59 HG12 ILE 59 4.386 9.843 -44.891 439 HG13 ILE 59 HG11 ILE 59 2.872 9.022 -44.545 440 HG21 ILE 59 HG21 ILE 59 0.917 11.874 -46.269 441 HG22 ILE 59 HG22 ILE 59 0.829 10.125 -46.053 442 HG23 ILE 59 HG23 ILE 59 1.866 10.808 -47.306 443 HD11 ILE 59 HD11 ILE 59 2.501 8.713 -46.942 444 HD12 ILE 59 HD12 ILE 59 4.024 7.997 -46.417 445 HD13 ILE 59 HD13 ILE 59 4.022 9.536 -47.281 446 H VAL 60 HN VAL 60 6.080 12.254 -45.902 447 HA VAL 60 HA VAL 60 6.046 11.583 -48.770 448 HB VAL 60 HB VAL 60 8.228 12.899 -47.133 449 HG11 VAL 60 HG11 VAL 60 8.071 12.346 -50.090 450 HG12 VAL 60 HG12 VAL 60 9.150 11.567 -48.931 451 HG13 VAL 60 HG13 VAL 60 9.329 13.285 -49.288 452 HG21 VAL 60 HG21 VAL 60 6.380 14.081 -49.206 453 HG22 VAL 60 HG22 VAL 60 7.721 14.917 -48.424 454 HG23 VAL 60 HG23 VAL 60 6.334 14.391 -47.470 455 H SER 61 HN SER 61 6.384 9.441 -49.053 456 HA SER 61 HA SER 61 8.479 8.146 -47.497 457 HB2 SER 61 HB2 SER 61 6.520 7.929 -46.038 458 HB3 SER 61 HB1 SER 61 5.624 7.160 -47.349 459 HG SER 61 HG SER 61 7.309 6.040 -45.591 460 H ASN 62 HN ASN 62 9.066 6.079 -48.206 461 HA ASN 62 HA ASN 62 9.077 5.756 -51.017 462 HB2 ASN 62 HB2 ASN 62 9.997 3.965 -48.766 463 HB3 ASN 62 HB1 ASN 62 10.209 3.552 -50.462 464 HD21 ASN 62 HD21 ASN 62 10.786 6.182 -51.386 465 HD22 ASN 62 HD22 ASN 62 12.355 6.612 -50.799 466 H ASN 63 HN ASN 63 6.887 4.671 -48.581 467 HA ASN 63 HA ASN 63 5.973 2.337 -49.922 468 HB2 ASN 63 HB2 ASN 63 3.972 2.479 -48.446 469 HB3 ASN 63 HB1 ASN 63 5.496 2.530 -47.576 470 HD21 ASN 63 HD21 ASN 63 4.395 3.407 -45.810 471 HD22 ASN 63 HD22 ASN 63 3.940 5.072 -45.766 472 H PHE 64 HN PHE 64 5.286 5.709 -50.311 473 HA PHE 64 HA PHE 64 2.985 5.223 -52.004 474 HB2 PHE 64 HB2 PHE 64 3.137 7.251 -50.569 475 HB3 PHE 64 HB1 PHE 64 4.519 7.790 -51.516 476 HD1 PHE 64 HD2 PHE 64 1.002 6.662 -52.056 477 HD2 PHE 64 HD1 PHE 64 4.125 9.325 -53.173 478 HE1 PHE 64 HE2 PHE 64 -0.521 7.780 -53.634 479 HE2 PHE 64 HE1 PHE 64 2.610 10.448 -54.752 480 HZ PHE 64 HZ PHE 64 0.283 9.675 -54.985 481 H GLU 65 HN GLU 65 6.311 5.146 -52.287 482 HA GLU 65 HA GLU 65 6.508 6.004 -55.028 483 HB2 GLU 65 HB2 GLU 65 8.534 6.457 -54.151 484 HB3 GLU 65 HB1 GLU 65 8.268 5.389 -52.786 485 HG2 GLU 65 HG2 GLU 65 10.046 4.372 -53.723 486 HG3 GLU 65 HG1 GLU 65 8.737 3.542 -54.567 487 H ASP 66 HN ASP 66 6.042 3.117 -53.178 488 HA ASP 66 HA ASP 66 6.530 1.182 -55.199 489 HB2 ASP 66 HB2 ASP 66 5.977 1.035 -52.556 490 HB3 ASP 66 HB1 ASP 66 4.372 0.708 -53.196 491 H LYS 67 HN LYS 67 4.067 3.471 -54.607 492 HA LYS 67 HA LYS 67 2.206 4.133 -55.700 493 HB2 LYS 67 HB2 LYS 67 3.749 3.781 -57.685 494 HB3 LYS 67 HB1 LYS 67 2.967 2.223 -57.908 495 HG2 LYS 67 HG2 LYS 67 0.815 3.349 -58.213 496 HG3 LYS 67 HG1 LYS 67 1.608 4.910 -58.000 497 HD2 LYS 67 HD2 LYS 67 1.280 4.428 -60.360 498 HD3 LYS 67 HD1 LYS 67 3.000 4.461 -59.968 499 HE2 LYS 67 HE2 LYS 67 3.023 2.020 -59.863 500 HE3 LYS 67 HE1 LYS 67 1.301 1.984 -60.242 501 HZ1 LYS 67 HZ1 LYS 67 3.429 3.074 -62.004 502 HZ2 LYS 67 HZ2 LYS 67 1.774 2.993 -62.373 503 HZ3 LYS 67 HZ3 LYS 67 2.675 1.566 -62.191 504 H LYS 68 HN LYS 68 2.286 1.675 -54.001 505 HA LYS 68 HA LYS 68 0.052 0.148 -55.064 506 HB2 LYS 68 HB2 LYS 68 1.580 -0.158 -52.473 507 HB3 LYS 68 HB1 LYS 68 0.359 -1.272 -53.077 508 HG2 LYS 68 HG2 LYS 68 2.956 -0.626 -54.458 509 HG3 LYS 68 HG1 LYS 68 2.651 -2.060 -53.477 510 HD2 LYS 68 HD2 LYS 68 1.013 -1.340 -55.901 511 HD3 LYS 68 HD1 LYS 68 2.442 -2.377 -55.971 512 HE2 LYS 68 HE2 LYS 68 0.014 -2.896 -54.259 513 HE3 LYS 68 HE1 LYS 68 0.316 -3.641 -55.828 514 HZ1 LYS 68 HZ1 LYS 68 2.174 -3.870 -53.527 515 HZ2 LYS 68 HZ2 LYS 68 2.225 -4.736 -54.982 516 HZ3 LYS 68 HZ3 LYS 68 0.968 -5.013 -53.872 517 H LEU 69 HN LEU 69 -1.619 1.591 -55.033 518 HA LEU 69 HA LEU 69 -2.194 3.382 -52.956 519 HB2 LEU 69 HB2 LEU 69 -3.010 3.452 -55.347 520 HB3 LEU 69 HB1 LEU 69 -4.176 2.220 -54.913 521 HG LEU 69 HG LEU 69 -4.098 4.856 -53.463 522 HD11 LEU 69 HD11 LEU 69 -4.275 5.365 -55.838 523 HD12 LEU 69 HD12 LEU 69 -5.807 5.663 -55.017 524 HD13 LEU 69 HD13 LEU 69 -5.600 4.211 -55.997 525 HD21 LEU 69 HD21 LEU 69 -6.453 4.350 -53.054 526 HD22 LEU 69 HD22 LEU 69 -5.419 3.050 -52.464 527 HD23 LEU 69 HD23 LEU 69 -6.301 2.857 -53.980 528 H LEU 70 HN LEU 70 -3.640 0.205 -53.704 529 HA LEU 70 HA LEU 70 -5.400 0.233 -51.524 530 HB2 LEU 70 HB2 LEU 70 -5.837 -2.077 -51.950 531 HB3 LEU 70 HB1 LEU 70 -5.709 -1.228 -53.466 532 HG LEU 70 HG LEU 70 -4.727 -3.315 -53.832 533 HD11 LEU 70 HD11 LEU 70 -2.446 -1.438 -53.293 534 HD12 LEU 70 HD12 LEU 70 -3.377 -1.568 -54.785 535 HD13 LEU 70 HD13 LEU 70 -2.361 -2.911 -54.257 536 HD21 LEU 70 HD21 LEU 70 -3.011 -4.332 -52.416 537 HD22 LEU 70 HD22 LEU 70 -4.532 -4.080 -51.559 538 HD23 LEU 70 HD23 LEU 70 -3.172 -2.993 -51.279 539 H ASP 71 HN ASP 71 -2.030 -0.685 -51.703 540 HA ASP 71 HA ASP 71 -2.051 -2.082 -49.211 541 HB2 ASP 71 HB2 ASP 71 0.144 -1.134 -51.020 542 HB3 ASP 71 HB1 ASP 71 0.508 -1.755 -49.411 543 H ARG 72 HN ARG 72 -0.972 1.187 -50.182 544 HA ARG 72 HA ARG 72 -0.316 1.940 -47.520 545 HB2 ARG 72 HB2 ARG 72 -0.400 4.285 -48.370 546 HB3 ARG 72 HB1 ARG 72 0.635 3.222 -49.305 547 HG2 ARG 72 HG2 ARG 72 -0.405 4.328 -50.990 548 HG3 ARG 72 HG1 ARG 72 -1.524 2.981 -50.793 549 HD2 ARG 72 HD2 ARG 72 -3.160 4.446 -50.469 550 HD3 ARG 72 HD1 ARG 72 -2.360 4.963 -48.986 551 HE ARG 72 HE ARG 72 -1.102 6.557 -50.493 552 HH11 ARG 72 HH11 ARG 72 -4.330 5.431 -51.243 553 HH12 ARG 72 HH12 ARG 72 -4.736 6.825 -52.191 554 HH21 ARG 72 HH21 ARG 72 -1.655 8.418 -51.742 555 HH22 ARG 72 HH22 ARG 72 -3.226 8.508 -52.485 556 H HIS 73 HN HIS 73 -3.275 1.771 -49.302 557 HA HIS 73 HA HIS 73 -4.877 3.358 -47.548 558 HB2 HIS 73 HB2 HIS 73 -5.546 2.867 -49.862 559 HB3 HIS 73 HB1 HIS 73 -5.649 1.154 -49.481 560 HD1 HIS 73 HD1 HIS 73 -7.331 4.426 -48.494 561 HD2 HIS 73 HD2 HIS 73 -8.121 0.346 -48.719 562 HE1 HIS 73 HE1 HIS 73 -9.775 4.174 -47.961 563 HE2 HIS 73 HE2 HIS 73 -10.272 1.733 -48.339 564 H ARG 74 HN ARG 74 -4.306 -0.144 -47.849 565 HA ARG 74 HA ARG 74 -6.047 -0.895 -45.768 566 HB2 ARG 74 HB2 ARG 74 -5.139 -3.065 -45.963 567 HB3 ARG 74 HB1 ARG 74 -5.047 -2.382 -47.577 568 HG2 ARG 74 HG2 ARG 74 -2.629 -1.726 -46.850 569 HG3 ARG 74 HG1 ARG 74 -2.861 -2.994 -45.648 570 HD2 ARG 74 HD2 ARG 74 -3.102 -3.293 -48.637 571 HD3 ARG 74 HD1 ARG 74 -1.775 -3.873 -47.635 572 HE ARG 74 HE ARG 74 -4.277 -4.940 -46.782 573 HH11 ARG 74 HH11 ARG 74 -1.735 -5.261 -49.193 574 HH12 ARG 74 HH12 ARG 74 -2.101 -6.928 -49.524 575 HH21 ARG 74 HH21 ARG 74 -4.756 -7.128 -47.238 576 HH22 ARG 74 HH22 ARG 74 -3.819 -7.989 -48.420 577 H LEU 75 HN LEU 75 -2.658 0.052 -45.782 578 HA LEU 75 HA LEU 75 -2.116 -0.612 -43.078 579 HB2 LEU 75 HB2 LEU 75 -0.825 1.426 -44.897 580 HB3 LEU 75 HB1 LEU 75 -0.203 0.974 -43.323 581 HG LEU 75 HG LEU 75 -0.482 -0.880 -45.689 582 HD11 LEU 75 HD11 LEU 75 1.963 -0.837 -45.726 583 HD12 LEU 75 HD12 LEU 75 1.958 0.366 -44.436 584 HD13 LEU 75 HD13 LEU 75 1.279 0.762 -46.014 585 HD21 LEU 75 HD21 LEU 75 -0.769 -2.052 -43.574 586 HD22 LEU 75 HD22 LEU 75 0.722 -1.338 -42.962 587 HD23 LEU 75 HD23 LEU 75 0.776 -2.467 -44.315 588 H VAL 76 HN VAL 76 -2.971 2.456 -44.660 589 HA VAL 76 HA VAL 76 -3.127 4.039 -42.372 590 HB VAL 76 HB VAL 76 -4.589 4.240 -45.005 591 HG11 VAL 76 HG11 VAL 76 -5.985 5.311 -43.329 592 HG12 VAL 76 HG12 VAL 76 -5.229 6.518 -44.371 593 HG13 VAL 76 HG13 VAL 76 -4.602 6.238 -42.746 594 HG21 VAL 76 HG21 VAL 76 -2.306 5.807 -43.808 595 HG22 VAL 76 HG22 VAL 76 -3.044 6.103 -45.384 596 HG23 VAL 76 HG23 VAL 76 -2.185 4.592 -45.082 597 H ASN 77 HN ASN 77 -5.592 1.976 -43.877 598 HA ASN 77 HA ASN 77 -7.714 2.710 -42.185 599 HB2 ASN 77 HB2 ASN 77 -7.169 0.114 -43.633 600 HB3 ASN 77 HB1 ASN 77 -8.675 0.457 -42.793 601 HD21 ASN 77 HD21 ASN 77 -8.528 3.322 -43.667 602 HD22 ASN 77 HD22 ASN 77 -9.038 3.287 -45.310 603 H THR 78 HN THR 78 -5.265 0.167 -41.862 604 HA THR 78 HA THR 78 -6.438 -1.082 -39.613 605 HB THR 78 HB THR 78 -3.538 -1.113 -40.485 606 HG1 THR 78 HG1 THR 78 -4.886 -1.872 -42.145 607 HG21 THR 78 HG21 THR 78 -3.853 -1.936 -38.200 608 HG22 THR 78 HG22 THR 78 -3.434 -3.251 -39.296 609 HG23 THR 78 HG23 THR 78 -5.104 -3.043 -38.766 610 H ILE 79 HN ILE 79 -3.870 1.334 -39.935 611 HA ILE 79 HA ILE 79 -3.329 1.431 -37.111 612 HB ILE 79 HB ILE 79 -2.480 3.328 -39.312 613 HG12 ILE 79 HG12 ILE 79 -0.838 1.109 -38.102 614 HG13 ILE 79 HG11 ILE 79 -1.848 0.847 -39.519 615 HG21 ILE 79 HG21 ILE 79 -1.368 2.897 -36.543 616 HG22 ILE 79 HG22 ILE 79 -2.255 4.315 -37.103 617 HG23 ILE 79 HG23 ILE 79 -0.669 3.944 -37.777 618 HD11 ILE 79 HD11 ILE 79 0.400 2.835 -39.312 619 HD12 ILE 79 HD12 ILE 79 -0.601 2.537 -40.735 620 HD13 ILE 79 HD13 ILE 79 0.467 1.272 -40.127 621 H LEU 80 HN LEU 80 -4.864 3.607 -39.463 622 HA LEU 80 HA LEU 80 -5.391 5.560 -37.445 623 HB2 LEU 80 HB2 LEU 80 -6.030 5.393 -40.363 624 HB3 LEU 80 HB1 LEU 80 -6.751 6.634 -39.357 625 HG LEU 80 HG LEU 80 -4.417 7.354 -38.723 626 HD11 LEU 80 HD11 LEU 80 -3.227 5.310 -39.289 627 HD12 LEU 80 HD12 LEU 80 -2.579 6.688 -40.181 628 HD13 LEU 80 HD13 LEU 80 -3.635 5.531 -40.991 629 HD21 LEU 80 HD21 LEU 80 -4.039 8.567 -40.807 630 HD22 LEU 80 HD22 LEU 80 -5.746 8.561 -40.364 631 HD23 LEU 80 HD23 LEU 80 -5.163 7.493 -41.639 632 H LYS 81 HN LYS 81 -6.964 2.715 -38.239 633 HA LYS 81 HA LYS 81 -9.642 3.302 -37.924 634 HB2 LYS 81 HB2 LYS 81 -8.754 1.025 -38.301 635 HB3 LYS 81 HB1 LYS 81 -8.139 1.001 -36.655 636 HG2 LYS 81 HG2 LYS 81 -10.209 -0.266 -36.859 637 HG3 LYS 81 HG1 LYS 81 -10.404 1.121 -35.786 638 HD2 LYS 81 HD2 LYS 81 -11.546 2.359 -37.501 639 HD3 LYS 81 HD1 LYS 81 -11.203 1.105 -38.695 640 HE2 LYS 81 HE2 LYS 81 -12.612 -0.458 -37.526 641 HE3 LYS 81 HE1 LYS 81 -12.855 0.687 -36.209 642 HZ1 LYS 81 HZ1 LYS 81 -13.682 1.253 -38.999 643 HZ2 LYS 81 HZ2 LYS 81 -14.126 2.086 -37.590 644 HZ3 LYS 81 HZ3 LYS 81 -14.707 0.517 -37.867 645 H GLU 82 HN GLU 82 -7.495 2.370 -35.212 646 HA GLU 82 HA GLU 82 -9.189 3.658 -33.297 647 HB2 GLU 82 HB2 GLU 82 -6.391 2.545 -33.024 648 HB3 GLU 82 HB1 GLU 82 -7.343 3.167 -31.686 649 HG2 GLU 82 HG2 GLU 82 -9.086 1.442 -32.297 650 HG3 GLU 82 HG1 GLU 82 -7.868 0.737 -33.361 651 H GLU 83 HN GLU 83 -6.349 4.572 -35.128 652 HA GLU 83 HA GLU 83 -5.368 6.699 -33.653 653 HB2 GLU 83 HB2 GLU 83 -4.566 5.653 -35.853 654 HB3 GLU 83 HB1 GLU 83 -5.661 6.783 -36.635 655 HG2 GLU 83 HG2 GLU 83 -3.752 7.955 -36.704 656 HG3 GLU 83 HG1 GLU 83 -4.387 8.530 -35.166 657 H LEU 84 HN LEU 84 -7.734 6.855 -36.281 658 HA LEU 84 HA LEU 84 -8.376 9.513 -36.270 659 HB2 LEU 84 HB2 LEU 84 -10.284 7.225 -36.733 660 HB3 LEU 84 HB1 LEU 84 -10.598 8.893 -37.161 661 HG LEU 84 HG LEU 84 -8.521 7.071 -38.357 662 HD11 LEU 84 HD11 LEU 84 -10.960 8.397 -39.527 663 HD12 LEU 84 HD12 LEU 84 -10.785 6.684 -39.146 664 HD13 LEU 84 HD13 LEU 84 -9.796 7.412 -40.413 665 HD21 LEU 84 HD21 LEU 84 -7.948 8.923 -39.838 666 HD22 LEU 84 HD22 LEU 84 -7.606 9.319 -38.152 667 HD23 LEU 84 HD23 LEU 84 -9.036 9.984 -38.940 668 H GLN 85 HN GLN 85 -9.409 7.124 -33.917 669 HA GLN 85 HA GLN 85 -11.710 8.347 -32.934 670 HB2 GLN 85 HB2 GLN 85 -9.657 6.893 -31.262 671 HB3 GLN 85 HB1 GLN 85 -11.344 7.152 -30.854 672 HG2 GLN 85 HG2 GLN 85 -10.165 5.309 -32.893 673 HG3 GLN 85 HG1 GLN 85 -11.224 4.930 -31.539 674 HE21 GLN 85 HE21 GLN 85 -11.010 5.870 -34.814 675 HE22 GLN 85 HE22 GLN 85 -12.702 5.894 -35.156 676 H ASN 86 HN ASN 86 -8.373 9.237 -32.526 677 HA ASN 86 HA ASN 86 -8.960 11.032 -30.305 678 HB2 ASN 86 HB2 ASN 86 -6.358 10.509 -31.761 679 HB3 ASN 86 HB1 ASN 86 -6.538 11.499 -30.318 680 HD21 ASN 86 HD21 ASN 86 -6.411 8.294 -31.595 681 HD22 ASN 86 HD22 ASN 86 -6.350 7.470 -30.078 682 H ILE 87 HN ILE 87 -9.233 11.164 -33.589 683 HA ILE 87 HA ILE 87 -8.513 14.024 -33.722 684 HB ILE 87 HB ILE 87 -8.761 12.277 -36.157 685 HG12 ILE 87 HG12 ILE 87 -6.273 12.636 -34.466 686 HG13 ILE 87 HG11 ILE 87 -7.168 11.141 -34.698 687 HG21 ILE 87 HG21 ILE 87 -8.682 14.681 -36.486 688 HG22 ILE 87 HG22 ILE 87 -7.208 13.931 -37.100 689 HG23 ILE 87 HG23 ILE 87 -7.188 14.778 -35.554 690 HD11 ILE 87 HD11 ILE 87 -5.143 11.190 -36.036 691 HD12 ILE 87 HD12 ILE 87 -5.713 12.648 -36.849 692 HD13 ILE 87 HD13 ILE 87 -6.584 11.127 -37.049 693 H HIS 88 HN HIS 88 -10.003 15.431 -34.677 694 HA HIS 88 HA HIS 88 -12.703 14.342 -34.940 695 HB2 HIS 88 HB2 HIS 88 -12.310 16.364 -33.528 696 HB3 HIS 88 HB1 HIS 88 -11.821 17.236 -34.977 697 HD1 HIS 88 HD1 HIS 88 -14.850 15.708 -33.339 698 HD2 HIS 88 HD2 HIS 88 -13.892 18.166 -36.555 699 HE1 HIS 88 HE1 HIS 88 -17.040 16.603 -34.186 700 HE2 HIS 88 HE2 HIS 88 -16.405 18.273 -35.961 701 H ALA 89 HN ALA 89 -10.133 15.747 -36.816 702 HA ALA 89 HA ALA 89 -11.397 14.851 -39.241 703 HB1 ALA 89 HB1 ALA 89 -11.384 16.999 -40.387 704 HB2 ALA 89 HB2 ALA 89 -10.842 17.800 -38.912 705 HB3 ALA 89 HB3 ALA 89 -12.439 17.054 -38.975 706 H PHE 90 HN PHE 90 -9.603 13.562 -39.547 707 HA PHE 90 HA PHE 90 -7.014 14.889 -39.872 708 HB2 PHE 90 HB2 PHE 90 -7.078 12.815 -38.533 709 HB3 PHE 90 HB1 PHE 90 -7.716 11.944 -39.921 710 HD1 PHE 90 HD1 PHE 90 -4.759 13.716 -38.608 711 HD2 PHE 90 HD2 PHE 90 -6.290 11.132 -41.622 712 HE1 PHE 90 HE1 PHE 90 -2.466 13.225 -39.348 713 HE2 PHE 90 HE2 PHE 90 -3.998 10.636 -42.366 714 HZ PHE 90 HZ PHE 90 -2.082 11.682 -41.229 715 H SER 91 HN SER 91 -5.937 14.971 -41.802 716 HA SER 91 HA SER 91 -7.014 13.521 -44.098 717 HB2 SER 91 HB2 SER 91 -6.397 16.490 -44.136 718 HB3 SER 91 HB1 SER 91 -6.846 15.517 -45.539 719 HG SER 91 HG SER 91 -8.663 15.120 -43.635 720 H MET 92 HN MET 92 -5.419 13.063 -45.690 721 HA MET 92 HA MET 92 -2.682 13.500 -44.704 722 HB2 MET 92 HB2 MET 92 -2.039 11.358 -45.609 723 HB3 MET 92 HB1 MET 92 -3.422 11.145 -44.547 724 HG2 MET 92 HG2 MET 92 -3.616 11.300 -47.545 725 HG3 MET 92 HG1 MET 92 -3.474 9.798 -46.640 726 HE1 MET 92 HE1 MET 92 -5.244 10.339 -44.073 727 HE2 MET 92 HE2 MET 92 -5.322 8.853 -45.020 728 HE3 MET 92 HE3 MET 92 -6.804 9.715 -44.608 729 H LYS 93 HN LYS 93 -1.190 14.287 -46.021 730 HA LYS 93 HA LYS 93 -1.911 14.759 -48.845 731 HB2 LYS 93 HB2 LYS 93 -1.389 16.691 -47.168 732 HB3 LYS 93 HB1 LYS 93 0.277 16.158 -47.309 733 HG2 LYS 93 HG2 LYS 93 0.047 17.934 -48.810 734 HG3 LYS 93 HG1 LYS 93 0.025 16.477 -49.802 735 HD2 LYS 93 HD2 LYS 93 -1.688 17.897 -50.629 736 HD3 LYS 93 HD1 LYS 93 -2.482 16.592 -49.751 737 HE2 LYS 93 HE2 LYS 93 -1.868 19.206 -48.411 738 HE3 LYS 93 HE1 LYS 93 -3.304 19.022 -49.411 739 HZ1 LYS 93 HZ1 LYS 93 -3.944 18.587 -47.196 740 HZ2 LYS 93 HZ2 LYS 93 -2.632 17.562 -46.912 741 HZ3 LYS 93 HZ3 LYS 93 -3.879 17.076 -47.957 742 H CYS 94 HN CYS 94 -0.911 13.236 -50.130 743 HA CYS 94 HA CYS 94 1.391 11.856 -48.952 744 HB2 CYS 94 HB2 CYS 94 0.815 10.068 -50.668 745 HB3 CYS 94 HB1 CYS 94 -0.349 10.326 -49.373 746 HG CYS 94 HG CYS 94 -0.641 11.372 -52.624 747 H HIS 95 HN HIS 95 3.353 11.932 -49.785 748 HA HIS 95 HA HIS 95 3.708 12.651 -52.598 749 HB2 HIS 95 HB2 HIS 95 4.869 14.157 -50.264 750 HB3 HIS 95 HB1 HIS 95 5.628 14.184 -51.849 751 HD1 HIS 95 HD1 HIS 95 2.962 15.741 -49.882 752 HD2 HIS 95 HD2 HIS 95 3.960 15.370 -53.896 753 HE1 HIS 95 HE1 HIS 95 1.648 17.521 -51.070 754 HE2 HIS 95 HE2 HIS 95 2.469 17.432 -53.451 755 H THR 96 HN THR 96 5.828 12.223 -53.408 756 HA THR 96 HA THR 96 7.159 10.016 -52.023 757 HB THR 96 HB THR 96 8.272 10.027 -54.482 758 HG1 THR 96 HG1 THR 96 7.161 11.412 -55.662 759 HG21 THR 96 HG21 THR 96 7.177 8.118 -53.415 760 HG22 THR 96 HG22 THR 96 6.651 8.288 -55.089 761 HG23 THR 96 HG23 THR 96 5.597 8.813 -53.775 762 HA PRO 97 HA PRO 97 10.712 12.419 -51.040 763 HB2 PRO 97 HB2 PRO 97 12.709 10.583 -51.509 764 HB3 PRO 97 HB1 PRO 97 11.706 10.622 -50.057 765 HG2 PRO 97 HG2 PRO 97 11.440 8.919 -52.498 766 HG3 PRO 97 HG1 PRO 97 11.229 8.477 -50.794 767 HD2 PRO 97 HD2 PRO 97 9.129 8.916 -52.408 768 HD3 PRO 97 HD1 PRO 97 9.099 9.384 -50.695 769 H LEU 98 HN LEU 98 10.562 10.828 -54.150 770 HA LEU 98 HA LEU 98 12.815 11.985 -55.365 771 HB2 LEU 98 HB2 LEU 98 11.012 10.155 -56.126 772 HB3 LEU 98 HB1 LEU 98 10.344 11.539 -56.965 773 HG LEU 98 HG LEU 98 11.796 10.188 -58.409 774 HD11 LEU 98 HD11 LEU 98 12.924 12.913 -57.790 775 HD12 LEU 98 HD12 LEU 98 11.578 12.562 -58.876 776 HD13 LEU 98 HD13 LEU 98 13.200 11.992 -59.270 777 HD21 LEU 98 HD21 LEU 98 13.988 10.971 -56.492 778 HD22 LEU 98 HD22 LEU 98 14.203 10.111 -58.017 779 HD23 LEU 98 HD23 LEU 98 13.318 9.352 -56.693 780 H GLU 99 HN GLU 99 9.399 12.999 -55.421 781 HA GLU 99 HA GLU 99 9.952 15.500 -56.650 782 HB2 GLU 99 HB2 GLU 99 7.533 14.402 -55.232 783 HB3 GLU 99 HB1 GLU 99 7.579 16.041 -55.861 784 HG2 GLU 99 HG2 GLU 99 6.621 14.992 -57.624 785 HG3 GLU 99 HG1 GLU 99 8.314 14.804 -58.068 786 H TYR 100 HN TYR 100 9.688 14.407 -53.330 787 HA TYR 100 HA TYR 100 9.458 16.883 -52.053 788 HB2 TYR 100 HB2 TYR 100 9.134 14.918 -50.744 789 HB3 TYR 100 HB1 TYR 100 10.734 14.301 -51.144 790 HD1 TYR 100 HD1 TYR 100 9.146 17.271 -49.512 791 HD2 TYR 100 HD2 TYR 100 12.420 14.555 -49.582 792 HE1 TYR 100 HE1 TYR 100 10.070 18.339 -47.500 793 HE2 TYR 100 HE2 TYR 100 13.351 15.617 -47.570 794 HH TYR 100 HH TYR 100 11.581 17.824 -45.669 795 H ASP 101 HN ASP 101 12.332 15.156 -53.180 796 HA ASP 101 HA ASP 101 14.291 16.803 -52.065 797 HB2 ASP 101 HB2 ASP 101 14.834 14.688 -53.168 798 HB3 ASP 101 HB1 ASP 101 14.343 15.352 -54.722 799 H LYS 102 HN LYS 102 12.319 17.225 -54.940 800 HA LYS 102 HA LYS 102 13.776 19.455 -55.951 801 HB2 LYS 102 HB2 LYS 102 11.211 18.116 -56.601 802 HB3 LYS 102 HB1 LYS 102 11.349 19.802 -57.071 803 HG2 LYS 102 HG2 LYS 102 12.094 18.775 -58.966 804 HG3 LYS 102 HG1 LYS 102 13.616 19.014 -58.117 805 HD2 LYS 102 HD2 LYS 102 12.026 16.459 -57.978 806 HD3 LYS 102 HD1 LYS 102 13.283 16.749 -59.177 807 HE2 LYS 102 HE2 LYS 102 13.646 16.739 -56.186 808 HE3 LYS 102 HE1 LYS 102 14.131 15.457 -57.292 809 HZ1 LYS 102 HZ1 LYS 102 15.798 16.800 -58.214 810 HZ2 LYS 102 HZ2 LYS 102 15.917 17.047 -56.538 811 HZ3 LYS 102 HZ3 LYS 102 15.180 18.219 -57.520 812 H LEU 103 HN LEU 103 11.071 19.044 -53.768 813 HA LEU 103 HA LEU 103 10.216 21.733 -53.695 814 HB2 LEU 103 HB2 LEU 103 9.978 19.608 -51.564 815 HB3 LEU 103 HB1 LEU 103 9.067 21.105 -51.620 816 HG LEU 103 HG LEU 103 8.889 18.861 -53.633 817 HD11 LEU 103 HD11 LEU 103 6.649 18.529 -52.719 818 HD12 LEU 103 HD12 LEU 103 6.955 19.776 -51.510 819 HD13 LEU 103 HD13 LEU 103 7.891 18.281 -51.492 820 HD21 LEU 103 HD21 LEU 103 7.007 20.130 -54.554 821 HD22 LEU 103 HD22 LEU 103 8.519 21.032 -54.671 822 HD23 LEU 103 HD23 LEU 103 7.341 21.441 -53.422 823 H LYS 104 HN LYS 104 12.487 19.911 -51.667 824 HA LYS 104 HA LYS 104 13.093 22.179 -50.022 825 HB2 LYS 104 HB2 LYS 104 15.069 20.692 -49.308 826 HB3 LYS 104 HB1 LYS 104 13.442 20.152 -48.921 827 HG2 LYS 104 HG2 LYS 104 13.474 18.493 -50.562 828 HG3 LYS 104 HG1 LYS 104 14.843 19.223 -51.401 829 HD2 LYS 104 HD2 LYS 104 15.036 18.100 -48.614 830 HD3 LYS 104 HD1 LYS 104 15.343 17.137 -50.061 831 HE2 LYS 104 HE2 LYS 104 17.073 18.750 -50.736 832 HE3 LYS 104 HE1 LYS 104 16.794 19.650 -49.245 833 HZ1 LYS 104 HZ1 LYS 104 17.619 16.801 -49.297 834 HZ2 LYS 104 HZ2 LYS 104 17.597 17.847 -47.959 835 HZ3 LYS 104 HZ3 LYS 104 18.717 18.089 -49.211 836 H SER 105 HN SER 105 14.419 20.792 -52.944 837 HA SER 105 HA SER 105 16.865 22.235 -52.903 838 HB2 SER 105 HB2 SER 105 16.515 20.189 -54.262 839 HB3 SER 105 HB1 SER 105 15.389 21.080 -55.284 840 HG SER 105 HG SER 105 18.177 21.438 -54.991 841 H LYS 106 HN LYS 106 13.708 22.841 -54.432 842 HA LYS 106 HA LYS 106 14.503 25.310 -55.613 843 HB2 LYS 106 HB2 LYS 106 12.120 25.689 -56.004 844 HB3 LYS 106 HB1 LYS 106 12.562 24.046 -56.445 845 HG2 LYS 106 HG2 LYS 106 11.659 23.267 -54.284 846 HG3 LYS 106 HG1 LYS 106 11.142 24.914 -53.936 847 HD2 LYS 106 HD2 LYS 106 10.237 23.274 -56.296 848 HD3 LYS 106 HD1 LYS 106 9.328 23.491 -54.802 849 HE2 LYS 106 HE2 LYS 106 9.292 25.922 -55.212 850 HE3 LYS 106 HE1 LYS 106 10.137 25.658 -56.736 851 HZ1 LYS 106 HZ1 LYS 106 8.270 24.335 -57.507 852 HZ2 LYS 106 HZ2 LYS 106 7.755 25.891 -57.066 853 HZ3 LYS 106 HZ3 LYS 106 7.458 24.577 -56.034 854 H GLY 107 HN GLY 107 12.720 24.467 -52.673 855 HA2 GLY 107 HA2 GLY 107 13.145 25.588 -50.600 856 HA3 GLY 107 HA1 GLY 107 13.623 27.016 -51.510 857 H SER 108 HN SER 108 10.772 25.019 -51.979 858 HA SER 108 HA SER 108 9.026 26.889 -50.670 859 HB2 SER 108 HB2 SER 108 8.901 26.542 -53.681 860 HB3 SER 108 HB1 SER 108 7.644 27.307 -52.709 861 HG SER 108 HG SER 108 10.067 28.360 -52.144 Start of MODEL 8 1 H1 MET 1 HT1 MET 1 19.616 -2.596 -2.229 2 H2 MET 1 HT2 MET 1 18.388 -3.669 -2.700 3 H3 MET 1 HT3 MET 1 18.700 -3.403 -1.052 4 HA MET 1 HA MET 1 18.028 -1.099 -1.272 5 HB2 MET 1 HB2 MET 1 17.259 -1.948 -4.077 6 HB3 MET 1 HB1 MET 1 16.814 -0.423 -3.327 7 HG2 MET 1 HG2 MET 1 18.623 0.058 -4.732 8 HG3 MET 1 HG1 MET 1 19.284 0.043 -3.098 9 HE1 MET 1 HE1 MET 1 22.239 -1.328 -5.296 10 HE2 MET 1 HE2 MET 1 21.753 -0.117 -4.110 11 HE3 MET 1 HE3 MET 1 21.063 -0.086 -5.733 12 H GLY 2 HN GLY 2 16.191 -0.912 -0.157 13 HA2 GLY 2 HA2 GLY 2 13.858 -2.489 -0.898 14 HA3 GLY 2 HA1 GLY 2 14.550 -2.839 0.680 15 H SER 3 HN SER 3 13.878 0.129 -1.163 16 HA SER 3 HA SER 3 12.544 1.179 1.238 17 HB2 SER 3 HB2 SER 3 13.998 2.700 -0.939 18 HB3 SER 3 HB1 SER 3 13.201 3.422 0.458 19 HG SER 3 HG SER 3 14.658 2.144 1.772 20 H SER 4 HN SER 4 10.420 1.090 0.989 21 HA SER 4 HA SER 4 9.278 1.966 -1.579 22 HB2 SER 4 HB2 SER 4 9.073 -0.496 -1.322 23 HB3 SER 4 HB1 SER 4 8.209 -0.251 0.195 24 HG SER 4 HG SER 4 6.464 0.007 -0.924 25 H HIS 5 HN HIS 5 8.395 3.892 -1.191 26 HA HIS 5 HA HIS 5 6.577 4.143 1.087 27 HB2 HIS 5 HB2 HIS 5 7.483 6.429 1.586 28 HB3 HIS 5 HB1 HIS 5 8.579 5.114 1.983 29 HD1 HIS 5 HD1 HIS 5 8.163 8.008 -0.380 30 HD2 HIS 5 HD2 HIS 5 10.955 5.054 0.513 31 HE1 HIS 5 HE1 HIS 5 10.278 8.698 -1.544 32 HE2 HIS 5 HE2 HIS 5 11.927 6.855 -1.070 33 H HIS 6 HN HIS 6 4.688 4.730 0.322 34 HA HIS 6 HA HIS 6 4.613 6.582 -1.969 35 HB2 HIS 6 HB2 HIS 6 2.648 4.481 -1.059 36 HB3 HIS 6 HB1 HIS 6 2.213 5.743 -2.206 37 HD1 HIS 6 HD1 HIS 6 2.811 5.364 -4.610 38 HD2 HIS 6 HD2 HIS 6 4.711 2.683 -2.051 39 HE1 HIS 6 HE1 HIS 6 3.903 3.657 -6.100 40 HE2 HIS 6 HE2 HIS 6 4.996 2.011 -4.539 41 H HIS 7 HN HIS 7 4.461 8.575 -1.172 42 HA HIS 7 HA HIS 7 3.069 9.187 1.256 43 HB2 HIS 7 HB2 HIS 7 4.996 10.511 0.655 44 HB3 HIS 7 HB1 HIS 7 4.278 10.940 -0.892 45 HD1 HIS 7 HD1 HIS 7 3.349 11.376 2.790 46 HD2 HIS 7 HD2 HIS 7 3.215 13.415 -0.833 47 HE1 HIS 7 HE1 HIS 7 2.405 13.641 3.320 48 HE2 HIS 7 HE2 HIS 7 2.610 14.932 1.172 49 H HIS 8 HN HIS 8 0.918 9.168 1.376 50 HA HIS 8 HA HIS 8 -0.645 9.628 -1.035 51 HB2 HIS 8 HB2 HIS 8 -1.377 8.630 1.712 52 HB3 HIS 8 HB1 HIS 8 -2.593 9.024 0.501 53 HD1 HIS 8 HD1 HIS 8 -3.103 7.273 -1.223 54 HD2 HIS 8 HD2 HIS 8 0.346 6.430 0.947 55 HE1 HIS 8 HE1 HIS 8 -2.414 4.954 -1.914 56 HE2 HIS 8 HE2 HIS 8 -0.282 4.490 -0.653 57 H HIS 9 HN HIS 9 -0.273 11.785 -1.321 58 HA HIS 9 HA HIS 9 -2.306 13.463 -0.428 59 HB2 HIS 9 HB2 HIS 9 -0.948 13.560 1.677 60 HB3 HIS 9 HB1 HIS 9 0.390 14.218 0.741 61 HD1 HIS 9 HD1 HIS 9 -3.040 15.102 2.011 62 HD2 HIS 9 HD2 HIS 9 0.201 16.928 0.140 63 HE1 HIS 9 HE1 HIS 9 -3.514 17.575 2.082 64 HE2 HIS 9 HE2 HIS 9 -1.526 18.667 0.976 65 H HIS 10 HN HIS 10 -2.344 13.521 -2.694 66 HA HIS 10 HA HIS 10 -0.036 14.664 -4.053 67 HB2 HIS 10 HB2 HIS 10 -1.174 14.087 -6.134 68 HB3 HIS 10 HB1 HIS 10 -1.128 12.696 -5.059 69 HD1 HIS 10 HD1 HIS 10 -3.366 14.581 -7.162 70 HD2 HIS 10 HD2 HIS 10 -3.745 12.338 -3.674 71 HE1 HIS 10 HE1 HIS 10 -5.813 14.048 -6.955 72 HE2 HIS 10 HE2 HIS 10 -6.018 12.634 -4.881 73 H SER 11 HN SER 11 0.146 16.758 -4.361 74 HA SER 11 HA SER 11 -2.041 18.573 -4.072 75 HB2 SER 11 HB2 SER 11 0.709 19.088 -5.236 76 HB3 SER 11 HB1 SER 11 -0.411 20.294 -4.599 77 HG SER 11 HG SER 11 0.120 19.758 -2.612 78 H SER 12 HN SER 12 -2.963 19.869 -5.748 79 HA SER 12 HA SER 12 -3.156 18.341 -8.226 80 HB2 SER 12 HB2 SER 12 -4.915 20.564 -7.168 81 HB3 SER 12 HB1 SER 12 -5.245 19.563 -8.585 82 HG SER 12 HG SER 12 -6.073 19.031 -6.247 83 H GLY 13 HN GLY 13 -1.666 18.930 -9.665 84 HA2 GLY 13 HA2 GLY 13 -1.126 20.315 -11.497 85 HA3 GLY 13 HA1 GLY 13 -1.788 21.691 -10.627 86 H ARG 14 HN ARG 14 0.583 19.335 -9.487 87 HA ARG 14 HA ARG 14 2.280 21.304 -8.386 88 HB2 ARG 14 HB2 ARG 14 3.083 18.492 -9.132 89 HB3 ARG 14 HB1 ARG 14 3.801 19.515 -7.900 90 HG2 ARG 14 HG2 ARG 14 1.738 19.379 -6.592 91 HG3 ARG 14 HG1 ARG 14 1.035 18.331 -7.828 92 HD2 ARG 14 HD2 ARG 14 3.416 17.768 -6.073 93 HD3 ARG 14 HD1 ARG 14 1.860 16.939 -6.069 94 HE ARG 14 HE ARG 14 2.632 16.435 -8.548 95 HH11 ARG 14 HH11 ARG 14 4.489 16.305 -5.577 96 HH12 ARG 14 HH12 ARG 14 5.597 15.106 -6.160 97 HH21 ARG 14 HH21 ARG 14 4.111 14.850 -9.332 98 HH22 ARG 14 HH22 ARG 14 5.386 14.283 -8.288 99 H GLU 15 HN GLU 15 2.294 19.535 -11.419 100 HA GLU 15 HA GLU 15 4.883 20.584 -12.170 101 HB2 GLU 15 HB2 GLU 15 4.538 19.245 -14.236 102 HB3 GLU 15 HB1 GLU 15 4.439 18.304 -12.755 103 HG2 GLU 15 HG2 GLU 15 2.028 18.275 -12.890 104 HG3 GLU 15 HG1 GLU 15 2.072 19.315 -14.314 105 H ASN 16 HN ASN 16 2.680 22.459 -11.802 106 HA ASN 16 HA ASN 16 1.704 23.363 -14.304 107 HB2 ASN 16 HB2 ASN 16 1.132 25.446 -13.132 108 HB3 ASN 16 HB1 ASN 16 0.647 24.036 -12.194 109 HD21 ASN 16 HD21 ASN 16 1.616 23.617 -10.258 110 HD22 ASN 16 HD22 ASN 16 2.693 24.720 -9.479 111 H LEU 17 HN LEU 17 4.780 23.519 -12.888 112 HA LEU 17 HA LEU 17 5.772 25.853 -14.181 113 HB2 LEU 17 HB2 LEU 17 7.117 23.403 -13.053 114 HB3 LEU 17 HB1 LEU 17 8.021 24.681 -13.833 115 HG LEU 17 HG LEU 17 7.158 26.272 -12.114 116 HD11 LEU 17 HD11 LEU 17 6.128 23.768 -10.789 117 HD12 LEU 17 HD12 LEU 17 5.142 25.073 -11.448 118 HD13 LEU 17 HD13 LEU 17 6.191 25.372 -10.061 119 HD21 LEU 17 HD21 LEU 17 8.626 25.461 -10.335 120 HD22 LEU 17 HD22 LEU 17 9.360 25.261 -11.927 121 HD23 LEU 17 HD23 LEU 17 8.664 23.870 -11.095 122 H TYR 18 HN TYR 18 5.221 22.571 -15.098 123 HA TYR 18 HA TYR 18 6.656 22.912 -17.623 124 HB2 TYR 18 HB2 TYR 18 5.344 20.472 -16.400 125 HB3 TYR 18 HB1 TYR 18 6.195 20.490 -17.941 126 HD1 TYR 18 HD1 TYR 18 8.656 20.938 -17.973 127 HD2 TYR 18 HD2 TYR 18 6.524 20.303 -14.347 128 HE1 TYR 18 HE1 TYR 18 10.775 20.481 -16.814 129 HE2 TYR 18 HE2 TYR 18 8.638 19.846 -13.177 130 HH TYR 18 HH TYR 18 10.942 19.068 -13.766 131 H PHE 19 HN PHE 19 5.462 21.970 -19.568 132 HA PHE 19 HA PHE 19 2.861 23.300 -19.634 133 HB2 PHE 19 HB2 PHE 19 3.123 23.279 -22.073 134 HB3 PHE 19 HB1 PHE 19 4.500 24.033 -21.282 135 HD1 PHE 19 HD1 PHE 19 6.579 22.528 -20.905 136 HD2 PHE 19 HD2 PHE 19 3.453 21.626 -23.652 137 HE1 PHE 19 HE1 PHE 19 8.095 21.033 -22.136 138 HE2 PHE 19 HE2 PHE 19 4.965 20.127 -24.883 139 HZ PHE 19 HZ PHE 19 7.288 19.828 -24.126 140 H GLN 20 HN GLN 20 3.593 20.465 -18.702 141 HA GLN 20 HA GLN 20 2.584 18.435 -18.611 142 HB2 GLN 20 HB2 GLN 20 0.424 20.079 -19.893 143 HB3 GLN 20 HB1 GLN 20 0.219 18.343 -19.721 144 HG2 GLN 20 HG2 GLN 20 -0.829 19.599 -17.900 145 HG3 GLN 20 HG1 GLN 20 0.432 18.511 -17.325 146 HE21 GLN 20 HE21 GLN 20 2.348 19.364 -16.540 147 HE22 GLN 20 HE22 GLN 20 2.485 21.022 -16.055 148 H GLY 21 HN GLY 21 4.438 18.976 -20.671 149 HA2 GLY 21 HA2 GLY 21 3.364 17.478 -22.962 150 HA3 GLY 21 HA1 GLY 21 4.806 18.483 -22.985 151 H HIS 22 HN HIS 22 3.537 15.629 -21.270 152 HA HIS 22 HA HIS 22 6.199 14.509 -21.009 153 HB2 HIS 22 HB2 HIS 22 3.498 13.224 -20.494 154 HB3 HIS 22 HB1 HIS 22 5.057 12.556 -20.032 155 HD1 HIS 22 HD1 HIS 22 5.434 12.807 -17.616 156 HD2 HIS 22 HD2 HIS 22 3.282 16.005 -19.181 157 HE1 HIS 22 HE1 HIS 22 4.969 14.336 -15.671 158 HE2 HIS 22 HE2 HIS 22 3.525 16.184 -16.611 159 H MET 23 HN MET 23 3.221 13.162 -22.345 160 HA MET 23 HA MET 23 4.639 12.592 -24.856 161 HB2 MET 23 HB2 MET 23 2.661 10.809 -23.415 162 HB3 MET 23 HB1 MET 23 3.138 10.573 -25.091 163 HG2 MET 23 HG2 MET 23 5.459 10.268 -24.382 164 HG3 MET 23 HG1 MET 23 4.968 10.487 -22.703 165 HE1 MET 23 HE1 MET 23 6.168 8.169 -22.093 166 HE2 MET 23 HE2 MET 23 6.634 7.982 -23.782 167 HE3 MET 23 HE3 MET 23 5.835 6.656 -22.938 168 H CYS 24 HN CYS 24 3.846 14.445 -25.795 169 HA CYS 24 HA CYS 24 1.233 15.407 -25.608 170 HB2 CYS 24 HB2 CYS 24 3.089 16.770 -26.445 171 HB3 CYS 24 HB1 CYS 24 3.221 15.744 -27.868 172 HG CYS 24 HG CYS 24 2.035 17.902 -28.924 173 H ILE 25 HN ILE 25 -0.598 14.583 -26.292 174 HA ILE 25 HA ILE 25 -0.882 12.201 -27.644 175 HB ILE 25 HB ILE 25 -2.671 13.205 -26.322 176 HG12 ILE 25 HG12 ILE 25 -4.578 12.704 -27.857 177 HG13 ILE 25 HG11 ILE 25 -3.434 12.634 -29.195 178 HG21 ILE 25 HG21 ILE 25 -4.083 14.987 -27.236 179 HG22 ILE 25 HG22 ILE 25 -2.980 15.150 -28.603 180 HG23 ILE 25 HG23 ILE 25 -2.425 15.526 -26.971 181 HD11 ILE 25 HD11 ILE 25 -3.435 10.834 -26.782 182 HD12 ILE 25 HD12 ILE 25 -2.302 10.756 -28.131 183 HD13 ILE 25 HD13 ILE 25 -4.012 10.414 -28.395 184 H GLN 26 HN GLN 26 -0.616 15.428 -28.991 185 HA GLN 26 HA GLN 26 -1.384 14.883 -31.629 186 HB2 GLN 26 HB2 GLN 26 -1.073 17.157 -30.869 187 HB3 GLN 26 HB1 GLN 26 0.619 16.854 -30.510 188 HG2 GLN 26 HG2 GLN 26 1.064 16.535 -32.892 189 HG3 GLN 26 HG1 GLN 26 -0.633 16.859 -33.246 190 HE21 GLN 26 HE21 GLN 26 -0.098 18.635 -34.525 191 HE22 GLN 26 HE22 GLN 26 0.431 20.130 -33.842 192 H LYS 27 HN LYS 27 1.866 14.897 -30.168 193 HA LYS 27 HA LYS 27 3.091 13.870 -32.520 194 HB2 LYS 27 HB2 LYS 27 4.214 15.296 -30.740 195 HB3 LYS 27 HB1 LYS 27 4.319 13.828 -29.771 196 HG2 LYS 27 HG2 LYS 27 5.728 12.775 -31.333 197 HG3 LYS 27 HG1 LYS 27 5.395 13.991 -32.566 198 HD2 LYS 27 HD2 LYS 27 6.467 15.665 -30.988 199 HD3 LYS 27 HD1 LYS 27 7.034 14.270 -30.063 200 HE2 LYS 27 HE2 LYS 27 8.742 15.006 -31.630 201 HE3 LYS 27 HE1 LYS 27 8.147 13.403 -32.062 202 HZ1 LYS 27 HZ1 LYS 27 8.304 14.686 -34.043 203 HZ2 LYS 27 HZ2 LYS 27 7.457 15.984 -33.359 204 HZ3 LYS 27 HZ3 LYS 27 6.650 14.534 -33.692 205 H VAL 28 HN VAL 28 1.563 12.403 -29.780 206 HA VAL 28 HA VAL 28 2.691 9.838 -29.921 207 HB VAL 28 HB VAL 28 -0.141 10.640 -29.205 208 HG11 VAL 28 HG11 VAL 28 -0.092 8.301 -29.904 209 HG12 VAL 28 HG12 VAL 28 -0.336 8.426 -28.162 210 HG13 VAL 28 HG13 VAL 28 1.248 7.989 -28.802 211 HG21 VAL 28 HG21 VAL 28 2.242 9.939 -27.490 212 HG22 VAL 28 HG22 VAL 28 0.622 10.304 -26.897 213 HG23 VAL 28 HG23 VAL 28 1.564 11.551 -27.717 214 H ILE 29 HN ILE 29 -0.060 11.259 -31.654 215 HA ILE 29 HA ILE 29 -0.547 9.013 -33.309 216 HB ILE 29 HB ILE 29 -1.341 11.892 -33.399 217 HG12 ILE 29 HG12 ILE 29 -3.606 10.888 -33.503 218 HG13 ILE 29 HG11 ILE 29 -2.881 9.289 -33.530 219 HG21 ILE 29 HG21 ILE 29 -0.741 11.465 -35.713 220 HG22 ILE 29 HG22 ILE 29 -2.491 11.592 -35.540 221 HG23 ILE 29 HG23 ILE 29 -1.736 10.008 -35.720 222 HD11 ILE 29 HD11 ILE 29 -2.699 11.277 -31.283 223 HD12 ILE 29 HD12 ILE 29 -1.952 9.678 -31.307 224 HD13 ILE 29 HD13 ILE 29 -3.709 9.832 -31.327 225 H GLU 30 HN GLU 30 1.476 11.894 -33.685 226 HA GLU 30 HA GLU 30 2.351 11.589 -36.293 227 HB2 GLU 30 HB2 GLU 30 3.925 12.512 -33.884 228 HB3 GLU 30 HB1 GLU 30 4.459 12.699 -35.546 229 HG2 GLU 30 HG2 GLU 30 2.583 14.158 -36.009 230 HG3 GLU 30 HG1 GLU 30 1.982 13.928 -34.364 231 H ASP 31 HN ASP 31 3.789 10.230 -33.337 232 HA ASP 31 HA ASP 31 5.863 8.890 -34.792 233 HB2 ASP 31 HB2 ASP 31 6.124 9.724 -32.448 234 HB3 ASP 31 HB1 ASP 31 5.020 8.458 -31.919 235 H LYS 32 HN LYS 32 2.718 8.029 -33.567 236 HA LYS 32 HA LYS 32 2.965 5.237 -33.603 237 HB2 LYS 32 HB2 LYS 32 1.098 6.440 -32.544 238 HB3 LYS 32 HB1 LYS 32 0.514 6.924 -34.128 239 HG2 LYS 32 HG2 LYS 32 -0.089 4.714 -34.690 240 HG3 LYS 32 HG1 LYS 32 0.789 4.048 -33.311 241 HD2 LYS 32 HD2 LYS 32 -0.770 5.007 -31.770 242 HD3 LYS 32 HD1 LYS 32 -1.560 5.919 -33.057 243 HE2 LYS 32 HE2 LYS 32 -1.471 2.912 -32.872 244 HE3 LYS 32 HE1 LYS 32 -2.831 3.914 -32.363 245 HZ1 LYS 32 HZ1 LYS 32 -3.213 3.062 -34.570 246 HZ2 LYS 32 HZ2 LYS 32 -1.746 3.701 -35.116 247 HZ3 LYS 32 HZ3 LYS 32 -2.991 4.746 -34.652 248 H LEU 33 HN LEU 33 1.666 7.418 -36.129 249 HA LEU 33 HA LEU 33 1.541 5.288 -38.034 250 HB2 LEU 33 HB2 LEU 33 1.019 7.049 -39.681 251 HB3 LEU 33 HB1 LEU 33 -0.013 7.094 -38.269 252 HG LEU 33 HG LEU 33 1.675 8.938 -37.455 253 HD11 LEU 33 HD11 LEU 33 2.008 9.060 -40.448 254 HD12 LEU 33 HD12 LEU 33 3.268 8.678 -39.274 255 HD13 LEU 33 HD13 LEU 33 2.544 10.286 -39.299 256 HD21 LEU 33 HD21 LEU 33 -0.387 9.421 -39.600 257 HD22 LEU 33 HD22 LEU 33 0.255 10.637 -38.495 258 HD23 LEU 33 HD23 LEU 33 -0.696 9.289 -37.869 259 H SER 34 HN SER 34 3.959 7.558 -37.056 260 HA SER 34 HA SER 34 5.605 7.426 -39.354 261 HB2 SER 34 HB2 SER 34 5.761 9.159 -37.524 262 HB3 SER 34 HB1 SER 34 6.516 7.930 -36.511 263 HG SER 34 HG SER 34 7.709 9.519 -38.201 264 H SER 35 HN SER 35 5.436 5.510 -36.392 265 HA SER 35 HA SER 35 7.717 3.914 -36.970 266 HB2 SER 35 HB2 SER 35 5.360 3.282 -35.180 267 HB3 SER 35 HB1 SER 35 6.941 2.499 -35.141 268 HG SER 35 HG SER 35 6.157 5.003 -34.206 269 H ALA 36 HN ALA 36 4.400 3.822 -37.957 270 HA ALA 36 HA ALA 36 4.495 1.023 -38.699 271 HB1 ALA 36 HB1 ALA 36 2.467 1.966 -37.707 272 HB2 ALA 36 HB2 ALA 36 2.167 1.298 -39.311 273 HB3 ALA 36 HB3 ALA 36 2.298 3.043 -39.093 274 H LEU 37 HN LEU 37 4.248 4.163 -40.369 275 HA LEU 37 HA LEU 37 4.388 2.779 -42.946 276 HB2 LEU 37 HB2 LEU 37 3.974 5.708 -42.336 277 HB3 LEU 37 HB1 LEU 37 3.867 4.966 -43.921 278 HG LEU 37 HG LEU 37 2.030 4.392 -41.593 279 HD11 LEU 37 HD11 LEU 37 1.688 6.615 -42.518 280 HD12 LEU 37 HD12 LEU 37 0.346 5.550 -42.935 281 HD13 LEU 37 HD13 LEU 37 1.574 5.935 -44.141 282 HD21 LEU 37 HD21 LEU 37 0.713 3.134 -43.232 283 HD22 LEU 37 HD22 LEU 37 2.322 2.443 -43.026 284 HD23 LEU 37 HD23 LEU 37 1.958 3.419 -44.449 285 H LYS 38 HN LYS 38 6.344 4.562 -40.792 286 HA LYS 38 HA LYS 38 8.444 5.356 -40.804 287 HB2 LYS 38 HB2 LYS 38 9.013 3.030 -41.227 288 HB3 LYS 38 HB1 LYS 38 8.833 3.278 -42.959 289 HG2 LYS 38 HG2 LYS 38 10.712 4.782 -42.991 290 HG3 LYS 38 HG1 LYS 38 10.850 4.702 -41.235 291 HD2 LYS 38 HD2 LYS 38 11.147 2.325 -43.062 292 HD3 LYS 38 HD1 LYS 38 12.499 3.296 -42.481 293 HE2 LYS 38 HE2 LYS 38 11.777 2.778 -40.151 294 HE3 LYS 38 HE1 LYS 38 10.567 1.682 -40.821 295 HZ1 LYS 38 HZ1 LYS 38 13.495 1.456 -41.253 296 HZ2 LYS 38 HZ2 LYS 38 12.316 0.373 -41.808 297 HZ3 LYS 38 HZ3 LYS 38 12.605 0.534 -40.142 298 HA PRO 39 HA PRO 39 8.346 8.169 -44.348 299 HB2 PRO 39 HB2 PRO 39 7.581 10.398 -43.002 300 HB3 PRO 39 HB1 PRO 39 6.429 9.260 -43.706 301 HG2 PRO 39 HG2 PRO 39 7.049 9.767 -40.896 302 HG3 PRO 39 HG1 PRO 39 5.666 8.918 -41.602 303 HD2 PRO 39 HD2 PRO 39 8.080 7.810 -40.428 304 HD3 PRO 39 HD1 PRO 39 6.618 6.963 -40.968 305 H THR 40 HN THR 40 10.145 9.306 -44.870 306 HA THR 40 HA THR 40 12.261 9.570 -42.952 307 HB THR 40 HB THR 40 13.411 10.766 -44.907 308 HG1 THR 40 HG1 THR 40 12.236 11.135 -46.624 309 HG21 THR 40 HG21 THR 40 12.399 7.949 -45.316 310 HG22 THR 40 HG22 THR 40 13.814 8.413 -44.372 311 HG23 THR 40 HG23 THR 40 13.796 8.667 -46.118 312 H PHE 41 HN PHE 41 9.786 11.563 -44.307 313 HA PHE 41 HA PHE 41 10.497 13.678 -42.418 314 HB2 PHE 41 HB2 PHE 41 11.419 14.396 -44.587 315 HB3 PHE 41 HB1 PHE 41 9.841 14.181 -45.335 316 HD1 PHE 41 HD1 PHE 41 11.677 16.136 -42.784 317 HD2 PHE 41 HD2 PHE 41 8.249 15.899 -45.295 318 HE1 PHE 41 HE1 PHE 41 11.107 18.460 -42.219 319 HE2 PHE 41 HE2 PHE 41 7.673 18.222 -44.735 320 HZ PHE 41 HZ PHE 41 9.103 19.507 -43.194 321 H LEU 42 HN LEU 42 8.756 14.564 -41.423 322 HA LEU 42 HA LEU 42 6.090 14.014 -42.527 323 HB2 LEU 42 HB2 LEU 42 6.617 12.300 -40.821 324 HB3 LEU 42 HB1 LEU 42 6.877 13.575 -39.644 325 HG LEU 42 HG LEU 42 4.504 14.242 -39.880 326 HD11 LEU 42 HD11 LEU 42 4.300 11.779 -41.609 327 HD12 LEU 42 HD12 LEU 42 4.121 13.448 -42.153 328 HD13 LEU 42 HD13 LEU 42 2.949 12.755 -41.033 329 HD21 LEU 42 HD21 LEU 42 3.576 12.315 -38.685 330 HD22 LEU 42 HD22 LEU 42 5.185 12.737 -38.098 331 HD23 LEU 42 HD23 LEU 42 4.972 11.351 -39.166 332 H GLU 43 HN GLU 43 5.075 15.876 -42.770 333 HA GLU 43 HA GLU 43 5.760 18.095 -40.955 334 HB2 GLU 43 HB2 GLU 43 6.400 18.440 -43.321 335 HB3 GLU 43 HB1 GLU 43 4.722 18.224 -43.796 336 HG2 GLU 43 HG2 GLU 43 4.078 20.219 -42.624 337 HG3 GLU 43 HG1 GLU 43 5.707 20.403 -41.971 338 H LEU 44 HN LEU 44 4.232 18.479 -39.504 339 HA LEU 44 HA LEU 44 1.457 17.788 -40.100 340 HB2 LEU 44 HB2 LEU 44 2.898 18.516 -37.560 341 HB3 LEU 44 HB1 LEU 44 1.149 18.489 -37.643 342 HG LEU 44 HG LEU 44 1.927 16.435 -36.668 343 HD11 LEU 44 HD11 LEU 44 1.002 15.974 -39.496 344 HD12 LEU 44 HD12 LEU 44 -0.028 16.283 -38.098 345 HD13 LEU 44 HD13 LEU 44 0.929 14.803 -38.181 346 HD21 LEU 44 HD21 LEU 44 4.185 16.391 -37.556 347 HD22 LEU 44 HD22 LEU 44 3.560 16.054 -39.171 348 HD23 LEU 44 HD23 LEU 44 3.359 14.867 -37.881 349 H VAL 45 HN VAL 45 0.170 19.275 -40.921 350 HA VAL 45 HA VAL 45 0.686 22.101 -40.255 351 HB VAL 45 HB VAL 45 -0.435 20.995 -42.838 352 HG11 VAL 45 HG11 VAL 45 0.217 23.829 -42.045 353 HG12 VAL 45 HG12 VAL 45 -1.399 23.161 -42.289 354 HG13 VAL 45 HG13 VAL 45 -0.285 23.300 -43.650 355 HG21 VAL 45 HG21 VAL 45 1.957 20.584 -42.638 356 HG22 VAL 45 HG22 VAL 45 2.227 22.285 -42.257 357 HG23 VAL 45 HG23 VAL 45 1.635 21.822 -43.851 358 H ASP 46 HN ASP 46 -0.916 23.108 -39.221 359 HA ASP 46 HA ASP 46 -3.514 21.915 -38.948 360 HB2 ASP 46 HB2 ASP 46 -2.689 23.232 -37.098 361 HB3 ASP 46 HB1 ASP 46 -2.474 24.639 -38.136 362 H LYS 47 HN LYS 47 -4.668 21.783 -40.738 363 HA LYS 47 HA LYS 47 -4.709 24.060 -42.579 364 HB2 LYS 47 HB2 LYS 47 -4.073 21.702 -43.327 365 HB3 LYS 47 HB1 LYS 47 -5.763 21.282 -43.101 366 HG2 LYS 47 HG2 LYS 47 -6.453 22.502 -44.914 367 HG3 LYS 47 HG1 LYS 47 -5.079 23.608 -44.831 368 HD2 LYS 47 HD2 LYS 47 -4.871 20.702 -45.619 369 HD3 LYS 47 HD1 LYS 47 -5.007 22.035 -46.771 370 HE2 LYS 47 HE2 LYS 47 -2.941 22.990 -45.992 371 HE3 LYS 47 HE1 LYS 47 -2.838 21.811 -44.687 372 HZ1 LYS 47 HZ1 LYS 47 -2.525 20.064 -46.291 373 HZ2 LYS 47 HZ2 LYS 47 -1.375 21.281 -46.551 374 HZ3 LYS 47 HZ3 LYS 47 -2.713 21.152 -47.585 375 H SER 48 HN SER 48 -6.213 23.658 -39.989 376 HA SER 48 HA SER 48 -8.967 23.815 -40.955 377 HB2 SER 48 HB2 SER 48 -8.422 22.489 -38.893 378 HB3 SER 48 HB1 SER 48 -7.930 23.990 -38.112 379 HG SER 48 HG SER 48 -10.517 23.349 -39.103 380 H CYS 49 HN CYS 49 -10.064 25.706 -41.082 381 HA CYS 49 HA CYS 49 -8.530 28.142 -40.558 382 HB2 CYS 49 HB2 CYS 49 -10.353 29.185 -42.002 383 HB3 CYS 49 HB1 CYS 49 -9.265 28.057 -42.803 384 HG CYS 49 HG CYS 49 -12.193 26.850 -41.576 385 H GLY 50 HN GLY 50 -10.435 26.352 -38.779 386 HA2 GLY 50 HA2 GLY 50 -11.936 28.646 -37.686 387 HA3 GLY 50 HA1 GLY 50 -12.602 27.021 -37.741 388 H CYS 51 HN CYS 51 -12.286 25.708 -36.052 389 HA CYS 51 HA CYS 51 -10.985 26.888 -33.738 390 HB2 CYS 51 HB2 CYS 51 -12.618 24.355 -33.985 391 HB3 CYS 51 HB1 CYS 51 -12.108 25.110 -32.480 392 HG CYS 51 HG CYS 51 -13.652 27.447 -34.061 393 H GLY 52 HN GLY 52 -9.793 25.103 -36.170 394 HA2 GLY 52 HA2 GLY 52 -7.840 23.847 -36.320 395 HA3 GLY 52 HA1 GLY 52 -7.705 23.915 -34.565 396 H THR 53 HN THR 53 -10.273 22.760 -36.679 397 HA THR 53 HA THR 53 -10.697 20.492 -34.933 398 HB THR 53 HB THR 53 -12.263 21.092 -37.430 399 HG1 THR 53 HG1 THR 53 -13.431 22.272 -35.353 400 HG21 THR 53 HG21 THR 53 -14.123 20.214 -36.105 401 HG22 THR 53 HG22 THR 53 -13.050 20.008 -34.722 402 HG23 THR 53 HG23 THR 53 -12.803 19.049 -36.182 403 H SER 54 HN SER 54 -8.787 21.039 -37.605 404 HA SER 54 HA SER 54 -8.836 18.209 -38.330 405 HB2 SER 54 HB2 SER 54 -8.671 18.891 -40.759 406 HB3 SER 54 HB1 SER 54 -10.237 19.186 -40.002 407 HG SER 54 HG SER 54 -8.178 21.094 -40.433 408 H PHE 55 HN PHE 55 -6.899 17.334 -38.730 409 HA PHE 55 HA PHE 55 -4.575 19.140 -38.903 410 HB2 PHE 55 HB2 PHE 55 -4.836 16.342 -37.799 411 HB3 PHE 55 HB1 PHE 55 -3.276 17.031 -38.229 412 HD1 PHE 55 HD1 PHE 55 -2.425 19.005 -37.017 413 HD2 PHE 55 HD2 PHE 55 -5.938 16.945 -35.785 414 HE1 PHE 55 HE1 PHE 55 -2.251 20.048 -34.796 415 HE2 PHE 55 HE2 PHE 55 -5.772 17.987 -33.562 416 HZ PHE 55 HZ PHE 55 -3.926 19.541 -33.066 417 H ASP 56 HN ASP 56 -3.256 18.990 -40.634 418 HA ASP 56 HA ASP 56 -3.867 16.890 -42.609 419 HB2 ASP 56 HB2 ASP 56 -4.569 19.221 -43.261 420 HB3 ASP 56 HB1 ASP 56 -2.873 19.683 -43.208 421 H ALA 57 HN ALA 57 -2.232 15.534 -42.904 422 HA ALA 57 HA ALA 57 0.442 16.412 -42.038 423 HB1 ALA 57 HB1 ALA 57 0.923 14.084 -41.545 424 HB2 ALA 57 HB2 ALA 57 -0.669 13.614 -42.140 425 HB3 ALA 57 HB3 ALA 57 -0.528 14.613 -40.693 426 H VAL 58 HN VAL 58 1.898 16.682 -43.548 427 HA VAL 58 HA VAL 58 1.610 15.385 -46.145 428 HB VAL 58 HB VAL 58 3.720 17.336 -45.192 429 HG11 VAL 58 HG11 VAL 58 4.483 15.954 -47.036 430 HG12 VAL 58 HG12 VAL 58 4.227 17.617 -47.563 431 HG13 VAL 58 HG13 VAL 58 3.043 16.371 -47.963 432 HG21 VAL 58 HG21 VAL 58 2.505 19.007 -46.507 433 HG22 VAL 58 HG22 VAL 58 1.516 18.362 -45.197 434 HG23 VAL 58 HG23 VAL 58 1.250 17.818 -46.853 435 H ILE 59 HN ILE 59 2.399 13.385 -46.332 436 HA ILE 59 HA ILE 59 4.569 12.583 -44.536 437 HB ILE 59 HB ILE 59 3.913 10.332 -44.798 438 HG12 ILE 59 HG12 ILE 59 1.769 10.065 -46.464 439 HG13 ILE 59 HG11 ILE 59 2.722 11.260 -47.334 440 HG21 ILE 59 HG21 ILE 59 1.553 10.326 -44.196 441 HG22 ILE 59 HG22 ILE 59 1.391 11.974 -44.800 442 HG23 ILE 59 HG23 ILE 59 2.411 11.646 -43.398 443 HD11 ILE 59 HD11 ILE 59 4.638 9.738 -47.316 444 HD12 ILE 59 HD12 ILE 59 3.232 9.012 -48.094 445 HD13 ILE 59 HD13 ILE 59 3.674 8.541 -46.452 446 H VAL 60 HN VAL 60 6.507 11.974 -45.251 447 HA VAL 60 HA VAL 60 6.893 11.657 -48.154 448 HB VAL 60 HB VAL 60 8.857 12.835 -46.169 449 HG11 VAL 60 HG11 VAL 60 9.985 11.566 -47.909 450 HG12 VAL 60 HG12 VAL 60 10.253 13.295 -48.132 451 HG13 VAL 60 HG13 VAL 60 9.090 12.444 -49.149 452 HG21 VAL 60 HG21 VAL 60 8.570 14.922 -47.424 453 HG22 VAL 60 HG22 VAL 60 7.061 14.395 -46.679 454 HG23 VAL 60 HG23 VAL 60 7.324 14.153 -48.406 455 H SER 61 HN SER 61 6.951 9.459 -48.316 456 HA SER 61 HA SER 61 8.920 8.049 -46.662 457 HB2 SER 61 HB2 SER 61 6.869 7.696 -45.461 458 HB3 SER 61 HB1 SER 61 6.010 7.274 -46.943 459 HG SER 61 HG SER 61 7.584 5.721 -45.324 460 H ASN 62 HN ASN 62 9.812 6.226 -47.554 461 HA ASN 62 HA ASN 62 9.800 5.926 -50.375 462 HB2 ASN 62 HB2 ASN 62 11.008 4.412 -48.095 463 HB3 ASN 62 HB1 ASN 62 10.950 3.646 -49.676 464 HD21 ASN 62 HD21 ASN 62 11.307 7.094 -49.288 465 HD22 ASN 62 HD22 ASN 62 12.952 7.184 -49.831 466 H ASN 63 HN ASN 63 7.729 4.761 -47.929 467 HA ASN 63 HA ASN 63 7.054 2.214 -48.819 468 HB2 ASN 63 HB2 ASN 63 6.346 3.110 -46.656 469 HB3 ASN 63 HB1 ASN 63 5.290 4.263 -47.463 470 HD21 ASN 63 HD21 ASN 63 3.473 3.481 -46.418 471 HD22 ASN 63 HD22 ASN 63 2.760 1.959 -46.815 472 H PHE 64 HN PHE 64 5.867 5.348 -49.935 473 HA PHE 64 HA PHE 64 3.792 4.022 -51.499 474 HB2 PHE 64 HB2 PHE 64 3.312 6.036 -50.046 475 HB3 PHE 64 HB1 PHE 64 4.239 6.992 -51.194 476 HD1 PHE 64 HD2 PHE 64 1.464 4.492 -51.250 477 HD2 PHE 64 HD1 PHE 64 3.040 8.139 -52.776 478 HE1 PHE 64 HE2 PHE 64 -0.555 4.782 -52.628 479 HE2 PHE 64 HE1 PHE 64 1.025 8.436 -54.157 480 HZ PHE 64 HZ PHE 64 -0.775 6.755 -54.085 481 H GLU 65 HN GLU 65 6.935 4.546 -52.085 482 HA GLU 65 HA GLU 65 6.774 5.946 -54.588 483 HB2 GLU 65 HB2 GLU 65 9.109 5.593 -54.822 484 HB3 GLU 65 HB1 GLU 65 8.821 5.904 -53.119 485 HG2 GLU 65 HG2 GLU 65 10.258 4.165 -52.941 486 HG3 GLU 65 HG1 GLU 65 8.744 3.266 -53.019 487 H ASP 66 HN ASP 66 6.176 2.780 -53.584 488 HA ASP 66 HA ASP 66 6.540 1.528 -56.159 489 HB2 ASP 66 HB2 ASP 66 6.737 0.221 -54.074 490 HB3 ASP 66 HB1 ASP 66 5.056 0.573 -53.694 491 H LYS 67 HN LYS 67 4.304 3.572 -54.758 492 HA LYS 67 HA LYS 67 2.312 4.432 -55.387 493 HB2 LYS 67 HB2 LYS 67 2.537 2.775 -57.904 494 HB3 LYS 67 HB1 LYS 67 1.544 4.203 -57.660 495 HG2 LYS 67 HG2 LYS 67 4.552 4.107 -57.752 496 HG3 LYS 67 HG1 LYS 67 3.479 4.739 -58.997 497 HD2 LYS 67 HD2 LYS 67 3.774 5.843 -56.203 498 HD3 LYS 67 HD1 LYS 67 4.497 6.529 -57.658 499 HE2 LYS 67 HE2 LYS 67 2.178 6.771 -58.579 500 HE3 LYS 67 HE1 LYS 67 1.568 6.300 -56.992 501 HZ1 LYS 67 HZ1 LYS 67 1.578 8.634 -57.010 502 HZ2 LYS 67 HZ2 LYS 67 3.117 8.718 -57.716 503 HZ3 LYS 67 HZ3 LYS 67 2.955 8.209 -56.106 504 H LYS 68 HN LYS 68 2.434 2.082 -53.794 505 HA LYS 68 HA LYS 68 0.399 0.244 -54.567 506 HB2 LYS 68 HB2 LYS 68 1.920 0.796 -52.057 507 HB3 LYS 68 HB1 LYS 68 0.478 -0.203 -51.976 508 HG2 LYS 68 HG2 LYS 68 2.868 -0.745 -53.723 509 HG3 LYS 68 HG1 LYS 68 2.534 -1.519 -52.172 510 HD2 LYS 68 HD2 LYS 68 0.290 -2.198 -53.215 511 HD3 LYS 68 HD1 LYS 68 1.031 -1.770 -54.760 512 HE2 LYS 68 HE2 LYS 68 2.219 -3.724 -52.797 513 HE3 LYS 68 HE1 LYS 68 1.190 -4.193 -54.148 514 HZ1 LYS 68 HZ1 LYS 68 3.749 -4.229 -54.397 515 HZ2 LYS 68 HZ2 LYS 68 3.584 -2.555 -54.658 516 HZ3 LYS 68 HZ3 LYS 68 2.789 -3.659 -55.673 517 H LEU 69 HN LEU 69 -1.506 1.266 -55.040 518 HA LEU 69 HA LEU 69 -2.648 3.258 -53.329 519 HB2 LEU 69 HB2 LEU 69 -3.031 2.967 -55.833 520 HB3 LEU 69 HB1 LEU 69 -4.082 1.628 -55.427 521 HG LEU 69 HG LEU 69 -5.219 3.829 -55.930 522 HD11 LEU 69 HD11 LEU 69 -6.867 3.612 -54.142 523 HD12 LEU 69 HD12 LEU 69 -5.748 2.597 -53.231 524 HD13 LEU 69 HD13 LEU 69 -6.389 2.037 -54.776 525 HD21 LEU 69 HD21 LEU 69 -3.662 5.300 -54.787 526 HD22 LEU 69 HD22 LEU 69 -4.078 4.564 -53.239 527 HD23 LEU 69 HD23 LEU 69 -5.289 5.486 -54.130 528 H LEU 70 HN LEU 70 -3.294 -0.179 -53.944 529 HA LEU 70 HA LEU 70 -5.446 -0.313 -52.116 530 HB2 LEU 70 HB2 LEU 70 -5.443 -2.686 -52.417 531 HB3 LEU 70 HB1 LEU 70 -5.213 -1.906 -53.960 532 HG LEU 70 HG LEU 70 -3.876 -3.829 -54.002 533 HD11 LEU 70 HD11 LEU 70 -2.707 -1.936 -54.915 534 HD12 LEU 70 HD12 LEU 70 -1.576 -3.055 -54.154 535 HD13 LEU 70 HD13 LEU 70 -2.026 -1.563 -53.331 536 HD21 LEU 70 HD21 LEU 70 -2.776 -3.082 -51.303 537 HD22 LEU 70 HD22 LEU 70 -2.242 -4.443 -52.289 538 HD23 LEU 70 HD23 LEU 70 -3.889 -4.404 -51.661 539 H ASP 71 HN ASP 71 -1.989 -0.720 -51.729 540 HA ASP 71 HA ASP 71 -2.201 -1.847 -49.115 541 HB2 ASP 71 HB2 ASP 71 0.048 -0.883 -50.796 542 HB3 ASP 71 HB1 ASP 71 0.303 -0.916 -49.053 543 H ARG 72 HN ARG 72 -1.632 1.465 -50.332 544 HA ARG 72 HA ARG 72 -1.322 2.584 -47.755 545 HB2 ARG 72 HB2 ARG 72 -1.551 4.727 -48.729 546 HB3 ARG 72 HB1 ARG 72 -0.762 3.741 -49.946 547 HG2 ARG 72 HG2 ARG 72 -2.277 4.481 -51.383 548 HG3 ARG 72 HG1 ARG 72 -3.468 3.506 -50.523 549 HD2 ARG 72 HD2 ARG 72 -2.770 6.367 -49.841 550 HD3 ARG 72 HD1 ARG 72 -4.153 5.879 -50.818 551 HE ARG 72 HE ARG 72 -3.944 4.749 -48.136 552 HH11 ARG 72 HH11 ARG 72 -5.397 7.214 -50.173 553 HH12 ARG 72 HH12 ARG 72 -6.809 7.374 -49.170 554 HH21 ARG 72 HH21 ARG 72 -5.770 4.995 -46.811 555 HH22 ARG 72 HH22 ARG 72 -7.017 6.124 -47.243 556 H HIS 73 HN HIS 73 -4.096 1.648 -49.610 557 HA HIS 73 HA HIS 73 -6.085 2.965 -48.095 558 HB2 HIS 73 HB2 HIS 73 -6.534 1.969 -50.294 559 HB3 HIS 73 HB1 HIS 73 -6.212 0.366 -49.651 560 HD1 HIS 73 HD1 HIS 73 -8.764 3.135 -49.506 561 HD2 HIS 73 HD2 HIS 73 -8.352 -0.852 -48.403 562 HE1 HIS 73 HE1 HIS 73 -11.069 2.371 -48.847 563 HE2 HIS 73 HE2 HIS 73 -10.827 -0.107 -48.457 564 H ARG 74 HN ARG 74 -4.935 -0.404 -47.953 565 HA ARG 74 HA ARG 74 -6.514 -1.101 -45.727 566 HB2 ARG 74 HB2 ARG 74 -5.218 -3.156 -45.673 567 HB3 ARG 74 HB1 ARG 74 -5.610 -2.734 -47.334 568 HG2 ARG 74 HG2 ARG 74 -3.252 -1.591 -47.267 569 HG3 ARG 74 HG1 ARG 74 -2.985 -2.721 -45.940 570 HD2 ARG 74 HD2 ARG 74 -3.891 -3.472 -48.712 571 HD3 ARG 74 HD1 ARG 74 -2.238 -3.590 -48.120 572 HE ARG 74 HE ARG 74 -4.276 -5.053 -46.630 573 HH11 ARG 74 HH11 ARG 74 -1.629 -5.068 -48.926 574 HH12 ARG 74 HH12 ARG 74 -1.478 -6.801 -48.936 575 HH21 ARG 74 HH21 ARG 74 -4.049 -7.332 -46.598 576 HH22 ARG 74 HH22 ARG 74 -2.830 -8.088 -47.588 577 H LEU 75 HN LEU 75 -3.149 0.004 -45.962 578 HA LEU 75 HA LEU 75 -2.500 -0.492 -43.254 579 HB2 LEU 75 HB2 LEU 75 -1.280 1.462 -45.202 580 HB3 LEU 75 HB1 LEU 75 -0.587 1.030 -43.651 581 HG LEU 75 HG LEU 75 -0.990 -0.832 -45.994 582 HD11 LEU 75 HD11 LEU 75 0.826 0.756 -46.327 583 HD12 LEU 75 HD12 LEU 75 1.449 -0.875 -46.076 584 HD13 LEU 75 HD13 LEU 75 1.517 0.305 -44.768 585 HD21 LEU 75 HD21 LEU 75 0.231 -1.343 -43.286 586 HD22 LEU 75 HD22 LEU 75 0.231 -2.467 -44.645 587 HD23 LEU 75 HD23 LEU 75 -1.291 -2.003 -43.884 588 H VAL 76 HN VAL 76 -3.424 2.503 -44.939 589 HA VAL 76 HA VAL 76 -3.338 4.182 -42.711 590 HB VAL 76 HB VAL 76 -4.884 4.359 -45.289 591 HG11 VAL 76 HG11 VAL 76 -4.827 6.426 -43.090 592 HG12 VAL 76 HG12 VAL 76 -6.235 5.494 -43.601 593 HG13 VAL 76 HG13 VAL 76 -5.497 6.656 -44.705 594 HG21 VAL 76 HG21 VAL 76 -2.476 4.683 -45.409 595 HG22 VAL 76 HG22 VAL 76 -2.565 5.920 -44.155 596 HG23 VAL 76 HG23 VAL 76 -3.320 6.198 -45.725 597 H ASN 77 HN ASN 77 -6.038 2.252 -44.000 598 HA ASN 77 HA ASN 77 -7.963 3.302 -42.223 599 HB2 ASN 77 HB2 ASN 77 -7.894 0.645 -43.670 600 HB3 ASN 77 HB1 ASN 77 -9.283 1.239 -42.770 601 HD21 ASN 77 HD21 ASN 77 -8.800 4.026 -43.641 602 HD22 ASN 77 HD22 ASN 77 -9.342 4.089 -45.276 603 H THR 78 HN THR 78 -5.802 0.513 -41.959 604 HA THR 78 HA THR 78 -7.049 -0.588 -39.664 605 HB THR 78 HB THR 78 -4.208 -0.995 -40.618 606 HG1 THR 78 HG1 THR 78 -5.518 -1.603 -42.291 607 HG21 THR 78 HG21 THR 78 -4.593 -1.821 -38.343 608 HG22 THR 78 HG22 THR 78 -4.383 -3.160 -39.474 609 HG23 THR 78 HG23 THR 78 -5.996 -2.729 -38.906 610 H ILE 79 HN ILE 79 -4.324 1.630 -40.075 611 HA ILE 79 HA ILE 79 -3.728 1.567 -37.221 612 HB ILE 79 HB ILE 79 -2.396 3.259 -39.338 613 HG12 ILE 79 HG12 ILE 79 -1.519 0.508 -38.447 614 HG13 ILE 79 HG11 ILE 79 -2.486 0.778 -39.893 615 HG21 ILE 79 HG21 ILE 79 -1.887 3.857 -37.028 616 HG22 ILE 79 HG22 ILE 79 -0.476 3.156 -37.819 617 HG23 ILE 79 HG23 ILE 79 -1.424 2.190 -36.688 618 HD11 ILE 79 HD11 ILE 79 -0.718 2.146 -40.835 619 HD12 ILE 79 HD12 ILE 79 -0.127 0.538 -40.416 620 HD13 ILE 79 HD13 ILE 79 0.250 1.914 -39.378 621 H LEU 80 HN LEU 80 -4.559 3.994 -39.685 622 HA LEU 80 HA LEU 80 -4.880 6.088 -37.815 623 HB2 LEU 80 HB2 LEU 80 -5.674 5.782 -40.690 624 HB3 LEU 80 HB1 LEU 80 -6.168 7.183 -39.763 625 HG LEU 80 HG LEU 80 -3.748 7.651 -39.302 626 HD11 LEU 80 HD11 LEU 80 -2.855 5.414 -39.667 627 HD12 LEU 80 HD12 LEU 80 -2.065 6.592 -40.716 628 HD13 LEU 80 HD13 LEU 80 -3.292 5.509 -41.373 629 HD21 LEU 80 HD21 LEU 80 -3.290 8.563 -41.518 630 HD22 LEU 80 HD22 LEU 80 -4.965 8.839 -41.036 631 HD23 LEU 80 HD23 LEU 80 -4.578 7.568 -42.196 632 H LYS 81 HN LYS 81 -6.862 3.440 -38.640 633 HA LYS 81 HA LYS 81 -9.383 4.170 -37.886 634 HB2 LYS 81 HB2 LYS 81 -8.891 1.866 -38.325 635 HB3 LYS 81 HB1 LYS 81 -7.718 1.800 -37.019 636 HG2 LYS 81 HG2 LYS 81 -9.699 0.631 -36.363 637 HG3 LYS 81 HG1 LYS 81 -9.556 2.102 -35.402 638 HD2 LYS 81 HD2 LYS 81 -11.200 3.207 -36.813 639 HD3 LYS 81 HD1 LYS 81 -11.310 1.771 -37.835 640 HE2 LYS 81 HE2 LYS 81 -12.102 0.475 -35.904 641 HE3 LYS 81 HE1 LYS 81 -12.022 1.926 -34.909 642 HZ1 LYS 81 HZ1 LYS 81 -13.711 2.945 -36.245 643 HZ2 LYS 81 HZ2 LYS 81 -14.268 1.428 -35.731 644 HZ3 LYS 81 HZ3 LYS 81 -13.725 1.635 -37.325 645 H GLU 82 HN GLU 82 -6.718 3.371 -35.647 646 HA GLU 82 HA GLU 82 -8.214 4.302 -33.399 647 HB2 GLU 82 HB2 GLU 82 -5.341 3.438 -33.667 648 HB3 GLU 82 HB1 GLU 82 -6.064 3.942 -32.145 649 HG2 GLU 82 HG2 GLU 82 -7.776 2.152 -32.459 650 HG3 GLU 82 HG1 GLU 82 -6.840 1.588 -33.843 651 H GLU 83 HN GLU 83 -5.730 5.651 -35.505 652 HA GLU 83 HA GLU 83 -5.021 7.992 -34.160 653 HB2 GLU 83 HB2 GLU 83 -5.672 7.417 -37.018 654 HB3 GLU 83 HB1 GLU 83 -5.339 9.062 -36.522 655 HG2 GLU 83 HG2 GLU 83 -3.558 7.657 -37.527 656 HG3 GLU 83 HG1 GLU 83 -3.130 8.638 -36.133 657 H LEU 84 HN LEU 84 -7.611 7.608 -36.430 658 HA LEU 84 HA LEU 84 -8.956 9.983 -36.201 659 HB2 LEU 84 HB2 LEU 84 -10.276 7.297 -36.545 660 HB3 LEU 84 HB1 LEU 84 -11.006 8.846 -36.921 661 HG LEU 84 HG LEU 84 -8.732 7.480 -38.326 662 HD11 LEU 84 HD11 LEU 84 -10.184 7.715 -40.278 663 HD12 LEU 84 HD12 LEU 84 -11.415 8.469 -39.267 664 HD13 LEU 84 HD13 LEU 84 -10.955 6.789 -38.990 665 HD21 LEU 84 HD21 LEU 84 -9.697 10.303 -38.767 666 HD22 LEU 84 HD22 LEU 84 -8.486 9.448 -39.727 667 HD23 LEU 84 HD23 LEU 84 -8.154 9.850 -38.040 668 H GLN 85 HN GLN 85 -9.118 7.367 -33.844 669 HA GLN 85 HA GLN 85 -11.484 8.153 -32.544 670 HB2 GLN 85 HB2 GLN 85 -9.047 6.965 -31.210 671 HB3 GLN 85 HB1 GLN 85 -10.688 6.953 -30.591 672 HG2 GLN 85 HG2 GLN 85 -9.522 5.390 -32.849 673 HG3 GLN 85 HG1 GLN 85 -10.335 4.802 -31.404 674 HE21 GLN 85 HE21 GLN 85 -10.651 5.857 -34.627 675 HE22 GLN 85 HE22 GLN 85 -12.357 5.630 -34.779 676 H ASN 86 HN ASN 86 -8.352 9.576 -32.620 677 HA ASN 86 HA ASN 86 -8.942 11.273 -30.295 678 HB2 ASN 86 HB2 ASN 86 -6.353 10.937 -31.832 679 HB3 ASN 86 HB1 ASN 86 -6.568 11.903 -30.378 680 HD21 ASN 86 HD21 ASN 86 -6.279 8.704 -31.679 681 HD22 ASN 86 HD22 ASN 86 -6.080 7.892 -30.169 682 H ILE 87 HN ILE 87 -8.778 11.319 -33.736 683 HA ILE 87 HA ILE 87 -8.628 14.263 -33.747 684 HB ILE 87 HB ILE 87 -8.280 12.661 -36.245 685 HG12 ILE 87 HG12 ILE 87 -6.171 13.083 -34.123 686 HG13 ILE 87 HG11 ILE 87 -6.754 11.552 -34.756 687 HG21 ILE 87 HG21 ILE 87 -7.129 15.263 -35.248 688 HG22 ILE 87 HG22 ILE 87 -8.462 15.077 -36.387 689 HG23 ILE 87 HG23 ILE 87 -6.837 14.558 -36.837 690 HD11 ILE 87 HD11 ILE 87 -5.772 12.049 -36.911 691 HD12 ILE 87 HD12 ILE 87 -4.560 12.114 -35.632 692 HD13 ILE 87 HD13 ILE 87 -5.213 13.608 -36.306 693 H HIS 88 HN HIS 88 -10.301 15.408 -34.517 694 HA HIS 88 HA HIS 88 -12.751 14.070 -35.134 695 HB2 HIS 88 HB2 HIS 88 -12.668 16.291 -34.015 696 HB3 HIS 88 HB1 HIS 88 -12.079 16.997 -35.517 697 HD1 HIS 88 HD1 HIS 88 -15.165 15.750 -33.845 698 HD2 HIS 88 HD2 HIS 88 -14.021 17.234 -37.566 699 HE1 HIS 88 HE1 HIS 88 -17.308 16.257 -35.069 700 HE2 HIS 88 HE2 HIS 88 -16.597 17.104 -37.341 701 H ALA 89 HN ALA 89 -10.362 15.858 -37.044 702 HA ALA 89 HA ALA 89 -11.258 14.401 -39.406 703 HB1 ALA 89 HB1 ALA 89 -11.377 16.404 -40.784 704 HB2 ALA 89 HB2 ALA 89 -11.017 17.409 -39.379 705 HB3 ALA 89 HB3 ALA 89 -12.527 16.500 -39.449 706 H PHE 90 HN PHE 90 -9.403 13.323 -39.764 707 HA PHE 90 HA PHE 90 -6.919 14.874 -39.902 708 HB2 PHE 90 HB2 PHE 90 -6.893 12.873 -38.451 709 HB3 PHE 90 HB1 PHE 90 -7.302 11.874 -39.842 710 HD1 PHE 90 HD1 PHE 90 -4.713 14.191 -38.537 711 HD2 PHE 90 HD2 PHE 90 -5.632 11.013 -41.211 712 HE1 PHE 90 HE1 PHE 90 -2.321 13.940 -39.053 713 HE2 PHE 90 HE2 PHE 90 -3.243 10.755 -41.731 714 HZ PHE 90 HZ PHE 90 -1.587 12.217 -40.651 715 H SER 91 HN SER 91 -5.931 15.233 -41.774 716 HA SER 91 HA SER 91 -6.816 13.729 -44.148 717 HB2 SER 91 HB2 SER 91 -5.976 16.640 -44.065 718 HB3 SER 91 HB1 SER 91 -6.541 15.750 -45.480 719 HG SER 91 HG SER 91 -7.989 16.585 -43.208 720 H MET 92 HN MET 92 -5.175 13.210 -45.657 721 HA MET 92 HA MET 92 -2.445 13.688 -44.696 722 HB2 MET 92 HB2 MET 92 -1.824 11.394 -44.990 723 HB3 MET 92 HB1 MET 92 -3.246 11.439 -43.962 724 HG2 MET 92 HG2 MET 92 -3.273 10.828 -46.910 725 HG3 MET 92 HG1 MET 92 -3.280 9.619 -45.631 726 HE1 MET 92 HE1 MET 92 -5.301 9.232 -43.968 727 HE2 MET 92 HE2 MET 92 -6.749 10.237 -43.934 728 HE3 MET 92 HE3 MET 92 -5.192 10.917 -43.463 729 H LYS 93 HN LYS 93 -0.966 14.104 -46.199 730 HA LYS 93 HA LYS 93 -1.712 13.746 -49.028 731 HB2 LYS 93 HB2 LYS 93 0.028 15.743 -47.629 732 HB3 LYS 93 HB1 LYS 93 0.395 15.315 -49.291 733 HG2 LYS 93 HG2 LYS 93 -0.963 17.339 -49.139 734 HG3 LYS 93 HG1 LYS 93 -1.804 16.050 -49.999 735 HD2 LYS 93 HD2 LYS 93 -3.190 15.592 -48.132 736 HD3 LYS 93 HD1 LYS 93 -2.208 16.600 -47.074 737 HE2 LYS 93 HE2 LYS 93 -4.222 17.788 -47.622 738 HE3 LYS 93 HE1 LYS 93 -2.867 18.573 -48.429 739 HZ1 LYS 93 HZ1 LYS 93 -4.777 18.367 -49.888 740 HZ2 LYS 93 HZ2 LYS 93 -4.774 16.684 -49.699 741 HZ3 LYS 93 HZ3 LYS 93 -3.479 17.449 -50.478 742 H CYS 94 HN CYS 94 -0.923 11.939 -49.803 743 HA CYS 94 HA CYS 94 1.373 10.687 -48.553 744 HB2 CYS 94 HB2 CYS 94 0.887 8.837 -50.204 745 HB3 CYS 94 HB1 CYS 94 -0.418 9.203 -49.081 746 HG CYS 94 HG CYS 94 -0.379 10.554 -52.208 747 H HIS 95 HN HIS 95 3.239 11.670 -49.071 748 HA HIS 95 HA HIS 95 3.792 12.050 -51.944 749 HB2 HIS 95 HB2 HIS 95 4.709 13.692 -49.587 750 HB3 HIS 95 HB1 HIS 95 5.441 13.814 -51.181 751 HD1 HIS 95 HD1 HIS 95 4.476 16.376 -50.529 752 HD2 HIS 95 HD2 HIS 95 1.782 13.486 -51.836 753 HE1 HIS 95 HE1 HIS 95 2.457 17.644 -51.345 754 HE2 HIS 95 HE2 HIS 95 0.873 15.880 -52.213 755 H THR 96 HN THR 96 6.069 11.946 -52.534 756 HA THR 96 HA THR 96 7.535 9.984 -50.917 757 HB THR 96 HB THR 96 8.561 9.680 -53.430 758 HG1 THR 96 HG1 THR 96 7.109 10.820 -54.609 759 HG21 THR 96 HG21 THR 96 7.863 7.892 -51.908 760 HG22 THR 96 HG22 THR 96 7.223 7.628 -53.531 761 HG23 THR 96 HG23 THR 96 6.172 8.249 -52.258 762 HA PRO 97 HA PRO 97 10.954 12.673 -50.477 763 HB2 PRO 97 HB2 PRO 97 12.736 10.535 -51.504 764 HB3 PRO 97 HB1 PRO 97 12.772 11.386 -49.956 765 HG2 PRO 97 HG2 PRO 97 11.914 8.872 -50.100 766 HG3 PRO 97 HG1 PRO 97 11.124 10.044 -49.028 767 HD2 PRO 97 HD2 PRO 97 10.239 9.012 -51.694 768 HD3 PRO 97 HD1 PRO 97 9.278 9.345 -50.239 769 H LEU 98 HN LEU 98 10.724 10.953 -53.524 770 HA LEU 98 HA LEU 98 12.614 12.398 -55.003 771 HB2 LEU 98 HB2 LEU 98 10.871 10.338 -55.507 772 HB3 LEU 98 HB1 LEU 98 10.173 11.639 -56.452 773 HG LEU 98 HG LEU 98 11.654 10.280 -57.818 774 HD11 LEU 98 HD11 LEU 98 12.826 12.996 -57.250 775 HD12 LEU 98 HD12 LEU 98 11.489 12.649 -58.347 776 HD13 LEU 98 HD13 LEU 98 13.103 12.032 -58.701 777 HD21 LEU 98 HD21 LEU 98 13.124 9.462 -56.052 778 HD22 LEU 98 HD22 LEU 98 13.814 11.075 -55.869 779 HD23 LEU 98 HD23 LEU 98 14.053 10.180 -57.369 780 H GLU 99 HN GLU 99 9.106 12.894 -54.678 781 HA GLU 99 HA GLU 99 9.008 15.326 -56.098 782 HB2 GLU 99 HB2 GLU 99 7.185 14.055 -54.066 783 HB3 GLU 99 HB1 GLU 99 6.830 15.628 -54.759 784 HG2 GLU 99 HG2 GLU 99 5.633 13.796 -55.868 785 HG3 GLU 99 HG1 GLU 99 6.688 14.683 -56.964 786 H TYR 100 HN TYR 100 9.326 14.595 -52.651 787 HA TYR 100 HA TYR 100 9.163 17.212 -51.681 788 HB2 TYR 100 HB2 TYR 100 9.029 15.255 -50.217 789 HB3 TYR 100 HB1 TYR 100 10.712 14.868 -50.559 790 HD1 TYR 100 HD1 TYR 100 8.668 17.733 -49.298 791 HD2 TYR 100 HD2 TYR 100 12.293 15.524 -49.003 792 HE1 TYR 100 HE1 TYR 100 9.364 19.138 -47.404 793 HE2 TYR 100 HE2 TYR 100 12.999 16.926 -47.109 794 HH TYR 100 HH TYR 100 10.864 19.059 -45.505 795 H ASP 101 HN ASP 101 11.893 15.379 -52.931 796 HA ASP 101 HA ASP 101 13.989 17.094 -52.258 797 HB2 ASP 101 HB2 ASP 101 14.237 14.814 -53.226 798 HB3 ASP 101 HB1 ASP 101 13.701 15.441 -54.779 799 H LYS 102 HN LYS 102 11.668 17.218 -54.868 800 HA LYS 102 HA LYS 102 12.882 19.481 -56.165 801 HB2 LYS 102 HB2 LYS 102 10.459 17.823 -56.608 802 HB3 LYS 102 HB1 LYS 102 10.388 19.480 -57.183 803 HG2 LYS 102 HG2 LYS 102 11.174 18.470 -59.052 804 HG3 LYS 102 HG1 LYS 102 12.707 18.839 -58.270 805 HD2 LYS 102 HD2 LYS 102 11.304 16.197 -57.935 806 HD3 LYS 102 HD1 LYS 102 12.445 16.507 -59.242 807 HE2 LYS 102 HE2 LYS 102 13.034 16.688 -56.291 808 HE3 LYS 102 HE1 LYS 102 13.511 15.373 -57.362 809 HZ1 LYS 102 HZ1 LYS 102 14.371 18.192 -57.715 810 HZ2 LYS 102 HZ2 LYS 102 14.940 16.836 -58.561 811 HZ3 LYS 102 HZ3 LYS 102 15.284 17.014 -56.908 812 H LEU 103 HN LEU 103 10.118 18.901 -54.043 813 HA LEU 103 HA LEU 103 9.003 21.468 -54.116 814 HB2 LEU 103 HB2 LEU 103 8.928 19.442 -51.880 815 HB3 LEU 103 HB1 LEU 103 7.869 20.833 -52.023 816 HG LEU 103 HG LEU 103 7.977 18.485 -53.919 817 HD11 LEU 103 HD11 LEU 103 5.885 19.338 -51.926 818 HD12 LEU 103 HD12 LEU 103 6.950 17.939 -51.784 819 HD13 LEU 103 HD13 LEU 103 5.741 18.000 -53.067 820 HD21 LEU 103 HD21 LEU 103 7.451 20.552 -55.097 821 HD22 LEU 103 HD22 LEU 103 6.186 20.912 -53.922 822 HD23 LEU 103 HD23 LEU 103 6.030 19.513 -54.985 823 H LYS 104 HN LYS 104 11.379 20.080 -51.879 824 HA LYS 104 HA LYS 104 11.540 22.285 -50.136 825 HB2 LYS 104 HB2 LYS 104 13.660 21.298 -49.389 826 HB3 LYS 104 HB1 LYS 104 12.413 20.069 -49.557 827 HG2 LYS 104 HG2 LYS 104 13.342 19.275 -51.585 828 HG3 LYS 104 HG1 LYS 104 14.447 20.642 -51.694 829 HD2 LYS 104 HD2 LYS 104 15.153 19.636 -49.292 830 HD3 LYS 104 HD1 LYS 104 14.634 18.161 -50.115 831 HE2 LYS 104 HE2 LYS 104 16.872 18.275 -50.698 832 HE3 LYS 104 HE1 LYS 104 16.083 19.058 -52.073 833 HZ1 LYS 104 HZ1 LYS 104 17.301 20.485 -49.765 834 HZ2 LYS 104 HZ2 LYS 104 16.601 21.207 -51.126 835 HZ3 LYS 104 HZ3 LYS 104 18.024 20.299 -51.290 836 H SER 105 HN SER 105 12.996 21.656 -53.233 837 HA SER 105 HA SER 105 14.974 23.745 -52.968 838 HB2 SER 105 HB2 SER 105 15.381 21.644 -54.277 839 HB3 SER 105 HB1 SER 105 14.171 22.184 -55.438 840 HG SER 105 HG SER 105 16.747 23.158 -54.938 841 H LYS 106 HN LYS 106 12.051 23.151 -54.872 842 HA LYS 106 HA LYS 106 11.441 25.981 -54.861 843 HB2 LYS 106 HB2 LYS 106 11.100 26.028 -57.357 844 HB3 LYS 106 HB1 LYS 106 12.768 26.039 -56.819 845 HG2 LYS 106 HG2 LYS 106 11.714 23.368 -57.369 846 HG3 LYS 106 HG1 LYS 106 11.732 24.441 -58.768 847 HD2 LYS 106 HD2 LYS 106 14.124 24.938 -58.269 848 HD3 LYS 106 HD1 LYS 106 14.066 23.712 -57.003 849 HE2 LYS 106 HE2 LYS 106 15.021 22.792 -59.039 850 HE3 LYS 106 HE1 LYS 106 13.479 22.020 -58.673 851 HZ1 LYS 106 HZ1 LYS 106 13.725 24.278 -60.581 852 HZ2 LYS 106 HZ2 LYS 106 12.409 23.225 -60.380 853 HZ3 LYS 106 HZ3 LYS 106 13.856 22.658 -61.058 854 H GLY 107 HN GLY 107 10.592 22.790 -56.077 855 HA2 GLY 107 HA2 GLY 107 8.499 21.733 -55.766 856 HA3 GLY 107 HA1 GLY 107 7.791 23.303 -55.402 857 H SER 108 HN SER 108 9.873 22.786 -58.123 858 HA SER 108 HA SER 108 7.690 22.633 -60.009 859 HB2 SER 108 HB2 SER 108 8.031 25.084 -59.385 860 HB3 SER 108 HB1 SER 108 9.615 24.962 -60.146 861 HG SER 108 HG SER 108 7.056 24.901 -61.286 Start of MODEL 9 1 H1 MET 1 HT1 MET 1 -0.111 -13.637 -43.724 2 H2 MET 1 HT2 MET 1 -0.087 -11.940 -43.741 3 H3 MET 1 HT3 MET 1 1.088 -12.794 -42.874 4 HA MET 1 HA MET 1 2.063 -13.650 -44.837 5 HB2 MET 1 HB2 MET 1 1.212 -13.108 -47.052 6 HB3 MET 1 HB1 MET 1 -0.030 -13.926 -46.117 7 HG2 MET 1 HG2 MET 1 -1.152 -11.828 -45.701 8 HG3 MET 1 HG1 MET 1 0.134 -10.949 -46.528 9 HE1 MET 1 HE1 MET 1 -2.806 -13.829 -48.630 10 HE2 MET 1 HE2 MET 1 -2.862 -13.446 -46.909 11 HE3 MET 1 HE3 MET 1 -1.523 -14.390 -47.559 12 H GLY 2 HN GLY 2 3.615 -12.470 -46.070 13 HA2 GLY 2 HA2 GLY 2 3.985 -10.022 -46.850 14 HA3 GLY 2 HA1 GLY 2 3.887 -9.701 -45.123 15 H SER 3 HN SER 3 6.093 -8.818 -45.732 16 HA SER 3 HA SER 3 8.160 -10.843 -46.002 17 HB2 SER 3 HB2 SER 3 8.312 -7.824 -45.797 18 HB3 SER 3 HB1 SER 3 9.699 -8.884 -46.052 19 HG SER 3 HG SER 3 8.646 -9.616 -47.981 20 H SER 4 HN SER 4 9.958 -10.959 -44.493 21 HA SER 4 HA SER 4 8.960 -10.932 -41.781 22 HB2 SER 4 HB2 SER 4 10.362 -12.800 -42.823 23 HB3 SER 4 HB1 SER 4 11.743 -11.717 -42.653 24 HG SER 4 HG SER 4 10.382 -13.170 -40.753 25 H HIS 5 HN HIS 5 8.767 -8.549 -41.864 26 HA HIS 5 HA HIS 5 11.263 -7.314 -40.900 27 HB2 HIS 5 HB2 HIS 5 9.222 -6.180 -42.805 28 HB3 HIS 5 HB1 HIS 5 10.267 -5.132 -41.853 29 HD1 HIS 5 HD1 HIS 5 10.200 -5.689 -45.083 30 HD2 HIS 5 HD2 HIS 5 13.055 -6.883 -42.300 31 HE1 HIS 5 HE1 HIS 5 12.327 -6.028 -46.389 32 HE2 HIS 5 HE2 HIS 5 14.084 -6.533 -44.643 33 H HIS 6 HN HIS 6 9.004 -8.597 -39.513 34 HA HIS 6 HA HIS 6 7.533 -6.446 -38.267 35 HB2 HIS 6 HB2 HIS 6 6.632 -8.300 -36.791 36 HB3 HIS 6 HB1 HIS 6 6.295 -8.453 -38.508 37 HD1 HIS 6 HD1 HIS 6 6.244 -10.872 -38.964 38 HD2 HIS 6 HD2 HIS 6 9.441 -9.841 -36.501 39 HE1 HIS 6 HE1 HIS 6 7.576 -12.986 -38.651 40 HE2 HIS 6 HE2 HIS 6 9.569 -12.317 -37.260 41 H HIS 7 HN HIS 7 10.407 -6.349 -38.006 42 HA HIS 7 HA HIS 7 10.999 -7.077 -35.264 43 HB2 HIS 7 HB2 HIS 7 12.725 -7.347 -36.995 44 HB3 HIS 7 HB1 HIS 7 12.665 -5.622 -37.333 45 HD1 HIS 7 HD1 HIS 7 14.683 -4.533 -36.419 46 HD2 HIS 7 HD2 HIS 7 13.315 -7.582 -33.935 47 HE1 HIS 7 HE1 HIS 7 16.244 -4.558 -34.448 48 HE2 HIS 7 HE2 HIS 7 15.350 -6.343 -32.910 49 H HIS 8 HN HIS 8 9.587 -5.785 -34.075 50 HA HIS 8 HA HIS 8 10.399 -2.968 -33.952 51 HB2 HIS 8 HB2 HIS 8 8.028 -2.389 -33.316 52 HB3 HIS 8 HB1 HIS 8 8.256 -2.860 -34.994 53 HD1 HIS 8 HD1 HIS 8 6.972 -4.863 -35.834 54 HD2 HIS 8 HD2 HIS 8 6.606 -4.303 -31.728 55 HE1 HIS 8 HE1 HIS 8 5.158 -6.438 -35.093 56 HE2 HIS 8 HE2 HIS 8 4.791 -5.903 -32.660 57 H HIS 9 HN HIS 9 10.579 -2.087 -31.928 58 HA HIS 9 HA HIS 9 10.656 -4.094 -29.778 59 HB2 HIS 9 HB2 HIS 9 12.837 -3.139 -30.529 60 HB3 HIS 9 HB1 HIS 9 12.268 -1.546 -30.049 61 HD1 HIS 9 HD1 HIS 9 13.686 -4.695 -28.716 62 HD2 HIS 9 HD2 HIS 9 12.121 -1.140 -27.235 63 HE1 HIS 9 HE1 HIS 9 14.359 -4.614 -26.293 64 HE2 HIS 9 HE2 HIS 9 13.203 -2.573 -25.369 65 H HIS 10 HN HIS 10 9.198 -3.859 -28.215 66 HA HIS 10 HA HIS 10 7.985 -1.225 -27.765 67 HB2 HIS 10 HB2 HIS 10 6.544 -3.289 -28.059 68 HB3 HIS 10 HB1 HIS 10 7.189 -3.876 -26.534 69 HD1 HIS 10 HD1 HIS 10 4.221 -3.527 -26.685 70 HD2 HIS 10 HD2 HIS 10 6.773 -0.461 -25.505 71 HE1 HIS 10 HE1 HIS 10 2.803 -1.934 -25.359 72 HE2 HIS 10 HE2 HIS 10 4.429 -0.247 -24.436 73 H SER 11 HN SER 11 9.440 -0.098 -26.568 74 HA SER 11 HA SER 11 10.955 -1.376 -24.476 75 HB2 SER 11 HB2 SER 11 11.866 1.010 -24.230 76 HB3 SER 11 HB1 SER 11 12.173 0.178 -25.756 77 HG SER 11 HG SER 11 11.362 2.413 -25.890 78 H SER 12 HN SER 12 8.829 1.498 -24.530 79 HA SER 12 HA SER 12 8.673 1.476 -21.655 80 HB2 SER 12 HB2 SER 12 8.750 3.588 -22.979 81 HB3 SER 12 HB1 SER 12 7.154 3.205 -23.621 82 HG SER 12 HG SER 12 7.500 4.595 -21.571 83 H GLY 13 HN GLY 13 7.481 -0.066 -20.736 84 HA2 GLY 13 HA2 GLY 13 4.621 -0.049 -21.329 85 HA3 GLY 13 HA1 GLY 13 5.451 -1.589 -21.503 86 H ARG 14 HN ARG 14 6.833 0.331 -19.100 87 HA ARG 14 HA ARG 14 5.653 -1.402 -17.060 88 HB2 ARG 14 HB2 ARG 14 7.575 -0.952 -15.733 89 HB3 ARG 14 HB1 ARG 14 8.162 -1.212 -17.370 90 HG2 ARG 14 HG2 ARG 14 8.175 1.288 -17.648 91 HG3 ARG 14 HG1 ARG 14 7.862 1.402 -15.917 92 HD2 ARG 14 HD2 ARG 14 10.171 1.596 -16.066 93 HD3 ARG 14 HD1 ARG 14 9.927 -0.101 -15.655 94 HE ARG 14 HE ARG 14 10.174 0.551 -18.485 95 HH11 ARG 14 HH11 ARG 14 11.684 -0.697 -15.580 96 HH12 ARG 14 HH12 ARG 14 13.012 -1.425 -16.437 97 HH21 ARG 14 HH21 ARG 14 11.910 -0.369 -19.604 98 HH22 ARG 14 HH22 ARG 14 13.135 -1.251 -18.735 99 H GLU 15 HN GLU 15 5.703 1.880 -18.109 100 HA GLU 15 HA GLU 15 4.549 2.767 -15.550 101 HB2 GLU 15 HB2 GLU 15 5.597 5.004 -16.131 102 HB3 GLU 15 HB1 GLU 15 6.709 3.716 -15.685 103 HG2 GLU 15 HG2 GLU 15 6.987 3.286 -18.163 104 HG3 GLU 15 HG1 GLU 15 6.139 4.811 -18.420 105 H ASN 16 HN ASN 16 3.283 1.854 -18.132 106 HA ASN 16 HA ASN 16 2.088 4.195 -19.283 107 HB2 ASN 16 HB2 ASN 16 0.671 2.653 -20.538 108 HB3 ASN 16 HB1 ASN 16 2.348 2.124 -20.597 109 HD21 ASN 16 HD21 ASN 16 2.903 0.189 -19.739 110 HD22 ASN 16 HD22 ASN 16 1.771 -0.942 -19.085 111 H LEU 17 HN LEU 17 1.696 2.834 -16.353 112 HA LEU 17 HA LEU 17 -1.180 2.982 -16.140 113 HB2 LEU 17 HB2 LEU 17 0.912 2.675 -13.985 114 HB3 LEU 17 HB1 LEU 17 -0.813 2.444 -13.781 115 HG LEU 17 HG LEU 17 0.998 0.740 -15.495 116 HD11 LEU 17 HD11 LEU 17 1.362 0.412 -13.108 117 HD12 LEU 17 HD12 LEU 17 0.570 -0.989 -13.829 118 HD13 LEU 17 HD13 LEU 17 -0.367 0.158 -12.870 119 HD21 LEU 17 HD21 LEU 17 -1.937 0.452 -14.859 120 HD22 LEU 17 HD22 LEU 17 -0.954 -0.706 -15.754 121 HD23 LEU 17 HD23 LEU 17 -1.254 0.897 -16.423 122 H TYR 18 HN TYR 18 1.453 5.120 -15.894 123 HA TYR 18 HA TYR 18 -0.053 7.007 -14.237 124 HB2 TYR 18 HB2 TYR 18 2.852 7.057 -15.093 125 HB3 TYR 18 HB1 TYR 18 2.078 8.234 -14.035 126 HD1 TYR 18 HD1 TYR 18 1.375 7.577 -11.759 127 HD2 TYR 18 HD2 TYR 18 3.525 4.905 -14.278 128 HE1 TYR 18 HE1 TYR 18 1.903 6.175 -9.811 129 HE2 TYR 18 HE2 TYR 18 4.059 3.495 -12.335 130 HH TYR 18 HH TYR 18 2.492 3.786 -9.366 131 H PHE 19 HN PHE 19 -1.325 8.305 -15.358 132 HA PHE 19 HA PHE 19 -1.043 8.763 -18.140 133 HB2 PHE 19 HB2 PHE 19 -2.920 10.333 -17.879 134 HB3 PHE 19 HB1 PHE 19 -3.236 8.809 -17.063 135 HD1 PHE 19 HD1 PHE 19 -3.309 8.686 -14.638 136 HD2 PHE 19 HD2 PHE 19 -2.635 12.382 -16.638 137 HE1 PHE 19 HE1 PHE 19 -3.817 9.900 -12.559 138 HE2 PHE 19 HE2 PHE 19 -3.139 13.603 -14.561 139 HZ PHE 19 HZ PHE 19 -3.730 12.360 -12.518 140 H GLN 20 HN GLN 20 0.212 10.315 -15.365 141 HA GLN 20 HA GLN 20 0.498 12.946 -16.235 142 HB2 GLN 20 HB2 GLN 20 2.166 11.334 -14.316 143 HB3 GLN 20 HB1 GLN 20 2.317 13.075 -14.531 144 HG2 GLN 20 HG2 GLN 20 0.182 13.477 -13.656 145 HG3 GLN 20 HG1 GLN 20 -0.286 11.782 -13.798 146 HE21 GLN 20 HE21 GLN 20 0.530 10.294 -12.359 147 HE22 GLN 20 HE22 GLN 20 1.173 10.766 -10.819 148 H GLY 21 HN GLY 21 2.243 10.113 -17.140 149 HA2 GLY 21 HA2 GLY 21 4.531 11.668 -18.095 150 HA3 GLY 21 HA1 GLY 21 4.452 9.920 -17.972 151 H HIS 22 HN HIS 22 1.728 11.451 -19.425 152 HA HIS 22 HA HIS 22 2.817 11.509 -22.076 153 HB2 HIS 22 HB2 HIS 22 1.291 9.793 -23.038 154 HB3 HIS 22 HB1 HIS 22 2.524 9.125 -21.981 155 HD1 HIS 22 HD1 HIS 22 -1.184 9.838 -22.077 156 HD2 HIS 22 HD2 HIS 22 1.562 7.667 -19.837 157 HE1 HIS 22 HE1 HIS 22 -2.556 8.344 -20.592 158 HE2 HIS 22 HE2 HIS 22 -0.884 7.112 -19.170 159 H MET 23 HN MET 23 1.961 13.668 -21.274 160 HA MET 23 HA MET 23 -0.936 13.930 -21.436 161 HB2 MET 23 HB2 MET 23 1.163 16.060 -20.994 162 HB3 MET 23 HB1 MET 23 -0.573 16.252 -20.788 163 HG2 MET 23 HG2 MET 23 1.231 14.476 -19.161 164 HG3 MET 23 HG1 MET 23 0.523 16.007 -18.649 165 HE1 MET 23 HE1 MET 23 -2.400 15.817 -19.874 166 HE2 MET 23 HE2 MET 23 -2.092 16.363 -18.226 167 HE3 MET 23 HE3 MET 23 -3.299 15.113 -18.529 168 H CYS 24 HN CYS 24 1.642 13.968 -23.562 169 HA CYS 24 HA CYS 24 0.514 15.952 -25.359 170 HB2 CYS 24 HB2 CYS 24 2.958 14.196 -25.664 171 HB3 CYS 24 HB1 CYS 24 2.498 15.510 -26.744 172 HG CYS 24 HG CYS 24 2.634 17.404 -24.551 173 H ILE 25 HN ILE 25 -1.428 15.024 -25.984 174 HA ILE 25 HA ILE 25 -1.652 12.354 -26.888 175 HB ILE 25 HB ILE 25 -3.611 13.513 -26.059 176 HG12 ILE 25 HG12 ILE 25 -3.866 12.836 -28.997 177 HG13 ILE 25 HG11 ILE 25 -3.913 11.681 -27.672 178 HG21 ILE 25 HG21 ILE 25 -3.102 15.770 -26.794 179 HG22 ILE 25 HG22 ILE 25 -4.707 15.290 -27.346 180 HG23 ILE 25 HG23 ILE 25 -3.352 15.298 -28.475 181 HD11 ILE 25 HD11 ILE 25 -5.906 13.875 -28.173 182 HD12 ILE 25 HD12 ILE 25 -5.960 12.712 -26.848 183 HD13 ILE 25 HD13 ILE 25 -6.131 12.161 -28.516 184 H GLN 26 HN GLN 26 -1.017 15.409 -28.571 185 HA GLN 26 HA GLN 26 -1.429 14.432 -31.183 186 HB2 GLN 26 HB2 GLN 26 -1.183 16.849 -30.656 187 HB3 GLN 26 HB1 GLN 26 0.528 16.583 -30.344 188 HG2 GLN 26 HG2 GLN 26 0.832 15.846 -32.663 189 HG3 GLN 26 HG1 GLN 26 -0.877 16.135 -32.973 190 HE21 GLN 26 HE21 GLN 26 1.439 17.295 -34.267 191 HE22 GLN 26 HE22 GLN 26 1.325 19.003 -34.048 192 H LYS 27 HN LYS 27 1.343 14.307 -29.031 193 HA LYS 27 HA LYS 27 3.192 13.324 -30.933 194 HB2 LYS 27 HB2 LYS 27 4.121 14.228 -28.965 195 HB3 LYS 27 HB1 LYS 27 3.093 13.256 -27.926 196 HG2 LYS 27 HG2 LYS 27 5.470 12.555 -27.945 197 HG3 LYS 27 HG1 LYS 27 4.348 11.280 -28.414 198 HD2 LYS 27 HD2 LYS 27 6.228 11.188 -29.888 199 HD3 LYS 27 HD1 LYS 27 4.852 11.806 -30.800 200 HE2 LYS 27 HE2 LYS 27 5.712 14.101 -30.451 201 HE3 LYS 27 HE1 LYS 27 7.128 13.416 -29.649 202 HZ1 LYS 27 HZ1 LYS 27 6.316 13.125 -32.488 203 HZ2 LYS 27 HZ2 LYS 27 7.472 12.114 -31.768 204 HZ3 LYS 27 HZ3 LYS 27 7.756 13.783 -31.871 205 H VAL 28 HN VAL 28 1.048 11.696 -28.610 206 HA VAL 28 HA VAL 28 1.819 9.065 -29.081 207 HB VAL 28 HB VAL 28 -0.995 10.046 -28.548 208 HG11 VAL 28 HG11 VAL 28 -1.364 7.812 -27.606 209 HG12 VAL 28 HG12 VAL 28 0.257 7.337 -28.111 210 HG13 VAL 28 HG13 VAL 28 -0.961 7.739 -29.320 211 HG21 VAL 28 HG21 VAL 28 0.564 10.859 -26.871 212 HG22 VAL 28 HG22 VAL 28 1.196 9.230 -26.640 213 HG23 VAL 28 HG23 VAL 28 -0.468 9.601 -26.187 214 H ILE 29 HN ILE 29 -0.805 10.854 -30.702 215 HA ILE 29 HA ILE 29 -1.415 8.872 -32.600 216 HB ILE 29 HB ILE 29 -1.896 11.835 -32.499 217 HG12 ILE 29 HG12 ILE 29 -4.277 11.085 -32.521 218 HG13 ILE 29 HG11 ILE 29 -3.717 9.419 -32.527 219 HG21 ILE 29 HG21 ILE 29 -1.494 11.388 -34.843 220 HG22 ILE 29 HG22 ILE 29 -3.211 11.687 -34.569 221 HG23 ILE 29 HG23 ILE 29 -2.628 10.039 -34.805 222 HD11 ILE 29 HD11 ILE 29 -4.396 10.093 -30.314 223 HD12 ILE 29 HD12 ILE 29 -3.260 11.440 -30.351 224 HD13 ILE 29 HD13 ILE 29 -2.660 9.782 -30.351 225 H GLU 30 HN GLU 30 0.595 11.797 -32.923 226 HA GLU 30 HA GLU 30 1.235 11.553 -35.611 227 HB2 GLU 30 HB2 GLU 30 1.686 13.589 -34.408 228 HB3 GLU 30 HB1 GLU 30 2.799 12.761 -33.329 229 HG2 GLU 30 HG2 GLU 30 3.986 12.238 -35.670 230 HG3 GLU 30 HG1 GLU 30 3.202 13.767 -36.070 231 H ASP 31 HN ASP 31 3.082 10.371 -32.794 232 HA ASP 31 HA ASP 31 5.226 9.513 -34.484 233 HB2 ASP 31 HB2 ASP 31 5.058 10.157 -31.833 234 HB3 ASP 31 HB1 ASP 31 5.171 8.400 -31.767 235 H LYS 32 HN LYS 32 2.388 7.982 -33.111 236 HA LYS 32 HA LYS 32 3.317 5.318 -33.420 237 HB2 LYS 32 HB2 LYS 32 1.412 5.904 -31.968 238 HB3 LYS 32 HB1 LYS 32 0.466 6.324 -33.391 239 HG2 LYS 32 HG2 LYS 32 0.477 4.059 -34.152 240 HG3 LYS 32 HG1 LYS 32 1.620 3.590 -32.896 241 HD2 LYS 32 HD2 LYS 32 -0.592 2.856 -32.278 242 HD3 LYS 32 HD1 LYS 32 -0.082 4.145 -31.189 243 HE2 LYS 32 HE2 LYS 32 -1.709 4.776 -33.620 244 HE3 LYS 32 HE1 LYS 32 -2.490 4.156 -32.167 245 HZ1 LYS 32 HZ1 LYS 32 -0.747 6.555 -32.205 246 HZ2 LYS 32 HZ2 LYS 32 -1.716 6.011 -30.925 247 HZ3 LYS 32 HZ3 LYS 32 -2.434 6.613 -32.343 248 H LEU 33 HN LEU 33 1.289 7.401 -35.501 249 HA LEU 33 HA LEU 33 1.140 5.413 -37.546 250 HB2 LEU 33 HB2 LEU 33 0.157 7.201 -38.940 251 HB3 LEU 33 HB1 LEU 33 -0.643 6.990 -37.399 252 HG LEU 33 HG LEU 33 0.889 8.992 -36.657 253 HD11 LEU 33 HD11 LEU 33 1.275 10.592 -38.464 254 HD12 LEU 33 HD12 LEU 33 0.739 9.395 -39.642 255 HD13 LEU 33 HD13 LEU 33 2.205 9.113 -38.703 256 HD21 LEU 33 HD21 LEU 33 -0.893 10.532 -37.311 257 HD22 LEU 33 HD22 LEU 33 -1.543 9.009 -36.703 258 HD23 LEU 33 HD23 LEU 33 -1.520 9.328 -38.437 259 H SER 34 HN SER 34 3.342 8.020 -36.825 260 HA SER 34 HA SER 34 4.618 8.064 -39.362 261 HB2 SER 34 HB2 SER 34 5.615 8.954 -36.650 262 HB3 SER 34 HB1 SER 34 6.446 9.269 -38.174 263 HG SER 34 HG SER 34 3.999 10.290 -37.227 264 H SER 35 HN SER 35 5.138 6.200 -36.416 265 HA SER 35 HA SER 35 7.577 5.032 -37.300 266 HB2 SER 35 HB2 SER 35 5.604 4.083 -35.210 267 HB3 SER 35 HB1 SER 35 7.227 3.431 -35.446 268 HG SER 35 HG SER 35 6.421 5.915 -34.413 269 H ALA 36 HN ALA 36 4.229 4.343 -37.867 270 HA ALA 36 HA ALA 36 4.607 1.626 -38.695 271 HB1 ALA 36 HB1 ALA 36 2.266 3.466 -39.164 272 HB2 ALA 36 HB2 ALA 36 2.483 2.414 -37.765 273 HB3 ALA 36 HB3 ALA 36 2.275 1.714 -39.370 274 H LEU 37 HN LEU 37 3.960 4.673 -40.433 275 HA LEU 37 HA LEU 37 4.341 3.370 -42.992 276 HB2 LEU 37 HB2 LEU 37 3.951 6.291 -42.322 277 HB3 LEU 37 HB1 LEU 37 3.928 5.606 -43.936 278 HG LEU 37 HG LEU 37 1.936 4.997 -41.748 279 HD11 LEU 37 HD11 LEU 37 1.665 6.638 -44.262 280 HD12 LEU 37 HD12 LEU 37 1.707 7.263 -42.613 281 HD13 LEU 37 HD13 LEU 37 0.364 6.248 -43.136 282 HD21 LEU 37 HD21 LEU 37 2.274 3.095 -43.237 283 HD22 LEU 37 HD22 LEU 37 2.007 4.134 -44.638 284 HD23 LEU 37 HD23 LEU 37 0.692 3.831 -43.502 285 H LYS 38 HN LYS 38 6.101 5.335 -40.780 286 HA LYS 38 HA LYS 38 8.143 6.246 -40.688 287 HB2 LYS 38 HB2 LYS 38 8.762 3.836 -40.849 288 HB3 LYS 38 HB1 LYS 38 8.977 4.051 -42.583 289 HG2 LYS 38 HG2 LYS 38 11.100 4.161 -41.352 290 HG3 LYS 38 HG1 LYS 38 10.740 5.665 -42.205 291 HD2 LYS 38 HD2 LYS 38 9.746 6.498 -40.023 292 HD3 LYS 38 HD1 LYS 38 10.486 5.091 -39.259 293 HE2 LYS 38 HE2 LYS 38 12.684 5.826 -40.015 294 HE3 LYS 38 HE1 LYS 38 11.952 7.217 -40.815 295 HZ1 LYS 38 HZ1 LYS 38 11.121 7.909 -38.587 296 HZ2 LYS 38 HZ2 LYS 38 12.809 7.935 -38.734 297 HZ3 LYS 38 HZ3 LYS 38 12.051 6.669 -37.897 298 HA PRO 39 HA PRO 39 8.007 8.604 -44.542 299 HB2 PRO 39 HB2 PRO 39 7.561 11.005 -43.450 300 HB3 PRO 39 HB1 PRO 39 6.260 9.827 -43.655 301 HG2 PRO 39 HG2 PRO 39 7.710 10.638 -41.195 302 HG3 PRO 39 HG1 PRO 39 6.039 10.083 -41.386 303 HD2 PRO 39 HD2 PRO 39 8.262 8.549 -40.538 304 HD3 PRO 39 HD1 PRO 39 6.641 7.950 -40.936 305 H THR 40 HN THR 40 9.770 9.438 -45.500 306 HA THR 40 HA THR 40 12.179 9.953 -44.083 307 HB THR 40 HB THR 40 12.890 10.970 -46.338 308 HG1 THR 40 HG1 THR 40 10.380 11.019 -46.824 309 HG21 THR 40 HG21 THR 40 13.073 8.760 -47.400 310 HG22 THR 40 HG22 THR 40 11.898 8.116 -46.253 311 HG23 THR 40 HG23 THR 40 13.466 8.690 -45.682 312 H PHE 41 HN PHE 41 9.487 11.852 -45.180 313 HA PHE 41 HA PHE 41 10.446 14.102 -43.585 314 HB2 PHE 41 HB2 PHE 41 11.031 14.671 -45.906 315 HB3 PHE 41 HB1 PHE 41 9.374 14.361 -46.410 316 HD1 PHE 41 HD1 PHE 41 11.466 16.557 -44.285 317 HD2 PHE 41 HD2 PHE 41 7.749 16.044 -46.296 318 HE1 PHE 41 HE1 PHE 41 10.897 18.906 -43.826 319 HE2 PHE 41 HE2 PHE 41 7.174 18.393 -45.840 320 HZ PHE 41 HZ PHE 41 8.750 19.826 -44.604 321 H LEU 42 HN LEU 42 8.880 14.801 -42.263 322 HA LEU 42 HA LEU 42 6.079 14.276 -42.970 323 HB2 LEU 42 HB2 LEU 42 7.202 12.539 -41.378 324 HB3 LEU 42 HB1 LEU 42 7.087 13.806 -40.176 325 HG LEU 42 HG LEU 42 5.256 12.122 -40.070 326 HD11 LEU 42 HD11 LEU 42 4.373 14.929 -40.702 327 HD12 LEU 42 HD12 LEU 42 4.915 14.333 -39.134 328 HD13 LEU 42 HD13 LEU 42 3.424 13.716 -39.844 329 HD21 LEU 42 HD21 LEU 42 4.434 13.325 -42.705 330 HD22 LEU 42 HD22 LEU 42 3.485 12.188 -41.747 331 HD23 LEU 42 HD23 LEU 42 5.023 11.683 -42.448 332 H GLU 43 HN GLU 43 4.873 16.041 -42.705 333 HA GLU 43 HA GLU 43 5.765 18.095 -40.788 334 HB2 GLU 43 HB2 GLU 43 6.000 18.394 -43.484 335 HB3 GLU 43 HB1 GLU 43 4.382 19.026 -43.234 336 HG2 GLU 43 HG2 GLU 43 6.855 19.990 -41.818 337 HG3 GLU 43 HG1 GLU 43 6.108 20.769 -43.210 338 H LEU 44 HN LEU 44 4.190 18.694 -39.405 339 HA LEU 44 HA LEU 44 1.470 17.746 -39.920 340 HB2 LEU 44 HB2 LEU 44 2.741 18.845 -37.407 341 HB3 LEU 44 HB1 LEU 44 1.049 18.425 -37.538 342 HG LEU 44 HG LEU 44 2.091 16.633 -36.419 343 HD11 LEU 44 HD11 LEU 44 0.493 15.927 -38.094 344 HD12 LEU 44 HD12 LEU 44 1.792 14.744 -37.939 345 HD13 LEU 44 HD13 LEU 44 1.768 15.855 -39.308 346 HD21 LEU 44 HD21 LEU 44 4.158 16.585 -38.613 347 HD22 LEU 44 HD22 LEU 44 4.051 15.445 -37.272 348 HD23 LEU 44 HD23 LEU 44 4.405 17.144 -36.958 349 H VAL 45 HN VAL 45 0.096 19.085 -40.818 350 HA VAL 45 HA VAL 45 0.602 21.972 -40.632 351 HB VAL 45 HB VAL 45 -1.124 20.463 -42.608 352 HG11 VAL 45 HG11 VAL 45 -0.289 23.358 -42.541 353 HG12 VAL 45 HG12 VAL 45 -1.913 22.734 -42.251 354 HG13 VAL 45 HG13 VAL 45 -1.179 22.576 -43.848 355 HG21 VAL 45 HG21 VAL 45 0.634 20.976 -44.240 356 HG22 VAL 45 HG22 VAL 45 1.235 19.960 -42.930 357 HG23 VAL 45 HG23 VAL 45 1.613 21.682 -42.953 358 H ASP 46 HN ASP 46 -0.638 23.115 -39.338 359 HA ASP 46 HA ASP 46 -2.946 22.087 -38.048 360 HB2 ASP 46 HB2 ASP 46 -1.516 23.819 -37.030 361 HB3 ASP 46 HB1 ASP 46 -1.979 24.948 -38.298 362 H LYS 47 HN LYS 47 -4.789 21.707 -39.093 363 HA LYS 47 HA LYS 47 -5.477 23.198 -41.467 364 HB2 LYS 47 HB2 LYS 47 -6.001 20.640 -40.660 365 HB3 LYS 47 HB1 LYS 47 -7.523 21.438 -40.282 366 HG2 LYS 47 HG2 LYS 47 -7.589 20.468 -42.501 367 HG3 LYS 47 HG1 LYS 47 -7.679 22.229 -42.592 368 HD2 LYS 47 HD2 LYS 47 -5.299 22.333 -43.123 369 HD3 LYS 47 HD1 LYS 47 -5.185 20.577 -43.000 370 HE2 LYS 47 HE2 LYS 47 -6.787 20.370 -44.858 371 HE3 LYS 47 HE1 LYS 47 -6.832 22.127 -44.997 372 HZ1 LYS 47 HZ1 LYS 47 -4.429 22.080 -45.459 373 HZ2 LYS 47 HZ2 LYS 47 -5.330 21.230 -46.618 374 HZ3 LYS 47 HZ3 LYS 47 -4.463 20.382 -45.432 375 H SER 48 HN SER 48 -6.556 25.023 -41.449 376 HA SER 48 HA SER 48 -7.038 26.348 -39.040 377 HB2 SER 48 HB2 SER 48 -6.488 27.367 -41.291 378 HB3 SER 48 HB1 SER 48 -8.180 27.131 -41.724 379 HG SER 48 HG SER 48 -8.756 28.719 -40.438 380 H CYS 49 HN CYS 49 -8.565 25.918 -37.640 381 HA CYS 49 HA CYS 49 -11.306 26.327 -38.359 382 HB2 CYS 49 HB2 CYS 49 -12.146 24.190 -37.422 383 HB3 CYS 49 HB1 CYS 49 -11.198 23.954 -38.885 384 HG CYS 49 HG CYS 49 -9.640 22.204 -37.878 385 H GLY 50 HN GLY 50 -12.655 26.598 -36.450 386 HA2 GLY 50 HA2 GLY 50 -11.161 27.922 -34.400 387 HA3 GLY 50 HA1 GLY 50 -12.907 27.757 -34.474 388 H CYS 51 HN CYS 51 -13.626 25.371 -34.063 389 HA CYS 51 HA CYS 51 -12.156 24.447 -31.676 390 HB2 CYS 51 HB2 CYS 51 -14.412 23.782 -30.778 391 HB3 CYS 51 HB1 CYS 51 -14.166 25.519 -30.929 392 HG CYS 51 HG CYS 51 -15.452 24.690 -33.744 393 H GLY 52 HN GLY 52 -12.413 23.631 -34.648 394 HA2 GLY 52 HA2 GLY 52 -13.607 21.022 -34.563 395 HA3 GLY 52 HA1 GLY 52 -12.684 21.706 -35.894 396 H THR 53 HN THR 53 -10.317 22.284 -34.472 397 HA THR 53 HA THR 53 -8.302 21.341 -34.071 398 HB THR 53 HB THR 53 -9.851 19.131 -32.696 399 HG1 THR 53 HG1 THR 53 -9.731 21.724 -32.106 400 HG21 THR 53 HG21 THR 53 -7.805 18.875 -31.357 401 HG22 THR 53 HG22 THR 53 -7.018 20.122 -32.326 402 HG23 THR 53 HG23 THR 53 -7.490 18.595 -33.070 403 H SER 54 HN SER 54 -7.991 20.995 -36.300 404 HA SER 54 HA SER 54 -8.125 18.172 -37.102 405 HB2 SER 54 HB2 SER 54 -8.561 19.073 -39.453 406 HB3 SER 54 HB1 SER 54 -9.897 19.187 -38.307 407 HG SER 54 HG SER 54 -8.079 21.325 -38.657 408 H PHE 55 HN PHE 55 -6.395 17.384 -38.241 409 HA PHE 55 HA PHE 55 -4.186 19.263 -38.725 410 HB2 PHE 55 HB2 PHE 55 -4.013 16.530 -37.440 411 HB3 PHE 55 HB1 PHE 55 -2.617 17.441 -38.005 412 HD1 PHE 55 HD1 PHE 55 -2.057 19.617 -36.928 413 HD2 PHE 55 HD2 PHE 55 -5.019 16.992 -35.361 414 HE1 PHE 55 HE1 PHE 55 -1.934 20.776 -34.761 415 HE2 PHE 55 HE2 PHE 55 -4.901 18.148 -33.193 416 HZ PHE 55 HZ PHE 55 -3.358 20.044 -32.892 417 H ASP 56 HN ASP 56 -3.210 19.089 -40.620 418 HA ASP 56 HA ASP 56 -3.891 16.793 -42.348 419 HB2 ASP 56 HB2 ASP 56 -4.728 19.007 -43.123 420 HB3 ASP 56 HB1 ASP 56 -3.076 19.606 -43.135 421 H ALA 57 HN ALA 57 -2.226 15.432 -42.645 422 HA ALA 57 HA ALA 57 0.443 16.431 -41.913 423 HB1 ALA 57 HB1 ALA 57 -0.595 13.601 -41.876 424 HB2 ALA 57 HB2 ALA 57 -0.461 14.665 -40.477 425 HB3 ALA 57 HB3 ALA 57 0.992 14.138 -41.326 426 H VAL 58 HN VAL 58 1.822 16.727 -43.480 427 HA VAL 58 HA VAL 58 1.472 15.463 -46.066 428 HB VAL 58 HB VAL 58 3.689 17.299 -45.121 429 HG11 VAL 58 HG11 VAL 58 4.100 17.663 -47.511 430 HG12 VAL 58 HG12 VAL 58 2.853 16.480 -47.902 431 HG13 VAL 58 HG13 VAL 58 4.317 15.971 -47.063 432 HG21 VAL 58 HG21 VAL 58 2.476 19.073 -46.311 433 HG22 VAL 58 HG22 VAL 58 1.531 18.413 -44.975 434 HG23 VAL 58 HG23 VAL 58 1.158 17.945 -46.635 435 H ILE 59 HN ILE 59 2.165 13.455 -46.338 436 HA ILE 59 HA ILE 59 4.471 12.556 -44.761 437 HB ILE 59 HB ILE 59 2.543 11.289 -44.168 438 HG12 ILE 59 HG12 ILE 59 4.818 10.092 -44.793 439 HG13 ILE 59 HG11 ILE 59 3.409 9.167 -44.297 440 HG21 ILE 59 HG21 ILE 59 2.111 10.728 -47.090 441 HG22 ILE 59 HG22 ILE 59 1.122 11.757 -46.055 442 HG23 ILE 59 HG23 ILE 59 1.192 10.018 -45.763 443 HD11 ILE 59 HD11 ILE 59 4.331 9.611 -47.133 444 HD12 ILE 59 HD12 ILE 59 2.907 8.690 -46.648 445 HD13 ILE 59 HD13 ILE 59 4.515 8.131 -46.190 446 H VAL 60 HN VAL 60 6.231 12.714 -45.873 447 HA VAL 60 HA VAL 60 6.274 11.844 -48.684 448 HB VAL 60 HB VAL 60 8.277 13.493 -47.116 449 HG11 VAL 60 HG11 VAL 60 8.299 12.698 -50.020 450 HG12 VAL 60 HG12 VAL 60 9.396 12.113 -48.769 451 HG13 VAL 60 HG13 VAL 60 9.428 13.811 -49.247 452 HG21 VAL 60 HG21 VAL 60 6.250 14.726 -47.642 453 HG22 VAL 60 HG22 VAL 60 6.395 14.271 -49.340 454 HG23 VAL 60 HG23 VAL 60 7.605 15.320 -48.601 455 H SER 61 HN SER 61 6.813 9.744 -48.854 456 HA SER 61 HA SER 61 9.024 8.675 -47.320 457 HB2 SER 61 HB2 SER 61 7.271 8.378 -45.702 458 HB3 SER 61 HB1 SER 61 6.193 7.697 -46.921 459 HG SER 61 HG SER 61 7.888 6.399 -45.364 460 H ASN 62 HN ASN 62 9.753 6.645 -48.017 461 HA ASN 62 HA ASN 62 9.421 5.982 -50.732 462 HB2 ASN 62 HB2 ASN 62 10.542 4.409 -48.409 463 HB3 ASN 62 HB1 ASN 62 10.557 3.812 -50.062 464 HD21 ASN 62 HD21 ASN 62 11.086 6.365 -51.283 465 HD22 ASN 62 HD22 ASN 62 12.731 6.758 -50.925 466 H ASN 63 HN ASN 63 7.587 5.253 -47.941 467 HA ASN 63 HA ASN 63 6.292 2.889 -48.471 468 HB2 ASN 63 HB2 ASN 63 5.864 4.102 -46.438 469 HB3 ASN 63 HB1 ASN 63 5.221 5.477 -47.326 470 HD21 ASN 63 HD21 ASN 63 4.597 2.292 -46.133 471 HD22 ASN 63 HD22 ASN 63 2.896 2.293 -46.435 472 H PHE 64 HN PHE 64 5.540 6.090 -49.776 473 HA PHE 64 HA PHE 64 3.376 4.968 -51.377 474 HB2 PHE 64 HB2 PHE 64 2.933 6.994 -50.077 475 HB3 PHE 64 HB1 PHE 64 4.244 7.830 -50.899 476 HD1 PHE 64 HD2 PHE 64 1.092 6.000 -51.703 477 HD2 PHE 64 HD1 PHE 64 3.708 9.221 -52.641 478 HE1 PHE 64 HE2 PHE 64 -0.489 6.778 -53.421 479 HE2 PHE 64 HE1 PHE 64 2.134 10.007 -54.360 480 HZ PHE 64 HZ PHE 64 0.031 8.784 -54.751 481 H GLU 65 HN GLU 65 6.572 5.109 -51.750 482 HA GLU 65 HA GLU 65 6.721 6.333 -54.355 483 HB2 GLU 65 HB2 GLU 65 8.679 6.824 -53.332 484 HB3 GLU 65 HB1 GLU 65 8.530 5.484 -52.208 485 HG2 GLU 65 HG2 GLU 65 10.428 4.968 -53.383 486 HG3 GLU 65 HG1 GLU 65 9.164 4.030 -54.178 487 H ASP 66 HN ASP 66 6.339 3.234 -52.897 488 HA ASP 66 HA ASP 66 7.224 1.694 -55.153 489 HB2 ASP 66 HB2 ASP 66 7.198 0.962 -52.701 490 HB3 ASP 66 HB1 ASP 66 5.467 0.717 -52.902 491 H LYS 67 HN LYS 67 4.674 3.646 -54.765 492 HA LYS 67 HA LYS 67 2.854 4.107 -56.017 493 HB2 LYS 67 HB2 LYS 67 3.786 1.768 -57.674 494 HB3 LYS 67 HB1 LYS 67 2.439 2.809 -58.109 495 HG2 LYS 67 HG2 LYS 67 4.069 4.736 -58.033 496 HG3 LYS 67 HG1 LYS 67 5.349 3.526 -57.921 497 HD2 LYS 67 HD2 LYS 67 4.550 2.517 -60.017 498 HD3 LYS 67 HD1 LYS 67 3.310 3.767 -60.134 499 HE2 LYS 67 HE2 LYS 67 5.181 5.455 -60.090 500 HE3 LYS 67 HE1 LYS 67 6.297 4.102 -60.277 501 HZ1 LYS 67 HZ1 LYS 67 4.190 4.978 -62.175 502 HZ2 LYS 67 HZ2 LYS 67 5.030 3.513 -62.333 503 HZ3 LYS 67 HZ3 LYS 67 5.868 4.985 -62.419 504 H LYS 68 HN LYS 68 2.942 1.755 -53.911 505 HA LYS 68 HA LYS 68 0.608 0.259 -54.753 506 HB2 LYS 68 HB2 LYS 68 1.878 0.197 -52.021 507 HB3 LYS 68 HB1 LYS 68 0.900 -1.046 -52.789 508 HG2 LYS 68 HG2 LYS 68 3.650 -0.199 -53.670 509 HG3 LYS 68 HG1 LYS 68 3.279 -1.625 -52.705 510 HD2 LYS 68 HD2 LYS 68 2.180 -1.126 -55.469 511 HD3 LYS 68 HD1 LYS 68 3.631 -2.073 -55.140 512 HE2 LYS 68 HE2 LYS 68 0.802 -2.666 -54.295 513 HE3 LYS 68 HE1 LYS 68 1.819 -3.598 -55.394 514 HZ1 LYS 68 HZ1 LYS 68 2.053 -4.798 -53.485 515 HZ2 LYS 68 HZ2 LYS 68 1.867 -3.456 -52.470 516 HZ3 LYS 68 HZ3 LYS 68 3.343 -3.713 -53.269 517 H LEU 69 HN LEU 69 -0.983 1.845 -54.909 518 HA LEU 69 HA LEU 69 -1.578 3.575 -52.725 519 HB2 LEU 69 HB2 LEU 69 -3.660 4.085 -54.048 520 HB3 LEU 69 HB1 LEU 69 -2.136 4.410 -54.844 521 HG LEU 69 HG LEU 69 -2.525 2.024 -55.892 522 HD11 LEU 69 HD11 LEU 69 -4.879 1.564 -56.305 523 HD12 LEU 69 HD12 LEU 69 -5.334 2.903 -55.250 524 HD13 LEU 69 HD13 LEU 69 -4.509 1.494 -54.582 525 HD21 LEU 69 HD21 LEU 69 -3.638 3.095 -57.785 526 HD22 LEU 69 HD22 LEU 69 -2.343 4.105 -57.141 527 HD23 LEU 69 HD23 LEU 69 -4.025 4.486 -56.772 528 H LEU 70 HN LEU 70 -2.775 0.461 -53.794 529 HA LEU 70 HA LEU 70 -4.963 0.387 -52.013 530 HB2 LEU 70 HB2 LEU 70 -5.191 -1.942 -52.523 531 HB3 LEU 70 HB1 LEU 70 -4.869 -1.052 -53.987 532 HG LEU 70 HG LEU 70 -3.729 -3.079 -54.210 533 HD11 LEU 70 HD11 LEU 70 -1.672 -1.086 -53.314 534 HD12 LEU 70 HD12 LEU 70 -2.346 -1.260 -54.933 535 HD13 LEU 70 HD13 LEU 70 -1.350 -2.543 -54.249 536 HD21 LEU 70 HD21 LEU 70 -2.208 -4.030 -52.554 537 HD22 LEU 70 HD22 LEU 70 -3.853 -3.869 -51.939 538 HD23 LEU 70 HD23 LEU 70 -2.611 -2.720 -51.444 539 H ASP 71 HN ASP 71 -1.580 -0.416 -51.637 540 HA ASP 71 HA ASP 71 -1.955 -1.811 -49.176 541 HB2 ASP 71 HB2 ASP 71 0.489 -0.776 -50.583 542 HB3 ASP 71 HB1 ASP 71 0.580 -1.455 -48.960 543 H ARG 72 HN ARG 72 -0.823 1.484 -49.985 544 HA ARG 72 HA ARG 72 -0.511 2.298 -47.315 545 HB2 ARG 72 HB2 ARG 72 -0.729 4.610 -48.124 546 HB3 ARG 72 HB1 ARG 72 0.356 3.669 -49.135 547 HG2 ARG 72 HG2 ARG 72 -1.112 3.638 -50.913 548 HG3 ARG 72 HG1 ARG 72 -2.517 3.947 -49.891 549 HD2 ARG 72 HD2 ARG 72 -0.319 5.935 -50.448 550 HD3 ARG 72 HD1 ARG 72 -1.865 5.884 -51.294 551 HE ARG 72 HE ARG 72 -1.556 6.454 -48.417 552 HH11 ARG 72 HH11 ARG 72 -3.232 6.825 -51.453 553 HH12 ARG 72 HH12 ARG 72 -4.411 7.936 -50.835 554 HH21 ARG 72 HH21 ARG 72 -3.100 7.940 -47.576 555 HH22 ARG 72 HH22 ARG 72 -4.326 8.590 -48.622 556 H HIS 73 HN HIS 73 -3.336 2.087 -49.384 557 HA HIS 73 HA HIS 73 -5.134 3.514 -47.743 558 HB2 HIS 73 HB2 HIS 73 -5.513 2.829 -50.147 559 HB3 HIS 73 HB1 HIS 73 -5.811 1.195 -49.569 560 HD1 HIS 73 HD1 HIS 73 -7.459 4.395 -50.191 561 HD2 HIS 73 HD2 HIS 73 -8.188 1.015 -47.868 562 HE1 HIS 73 HE1 HIS 73 -9.895 4.503 -49.573 563 HE2 HIS 73 HE2 HIS 73 -10.312 2.474 -48.140 564 H ARG 74 HN ARG 74 -4.440 0.028 -48.001 565 HA ARG 74 HA ARG 74 -6.266 -0.747 -45.985 566 HB2 ARG 74 HB2 ARG 74 -5.305 -2.933 -46.149 567 HB3 ARG 74 HB1 ARG 74 -5.334 -2.252 -47.767 568 HG2 ARG 74 HG2 ARG 74 -2.891 -1.535 -47.193 569 HG3 ARG 74 HG1 ARG 74 -3.015 -2.814 -45.986 570 HD2 ARG 74 HD2 ARG 74 -3.496 -3.134 -48.944 571 HD3 ARG 74 HD1 ARG 74 -2.025 -3.596 -48.092 572 HE ARG 74 HE ARG 74 -4.536 -4.813 -47.218 573 HH11 ARG 74 HH11 ARG 74 -1.500 -5.098 -48.960 574 HH12 ARG 74 HH12 ARG 74 -1.570 -6.838 -49.043 575 HH21 ARG 74 HH21 ARG 74 -4.644 -7.070 -47.337 576 HH22 ARG 74 HH22 ARG 74 -3.381 -7.968 -48.135 577 H LEU 75 HN LEU 75 -2.845 0.125 -45.899 578 HA LEU 75 HA LEU 75 -2.381 -0.641 -43.213 579 HB2 LEU 75 HB2 LEU 75 -1.010 1.419 -44.942 580 HB3 LEU 75 HB1 LEU 75 -0.443 0.942 -43.353 581 HG LEU 75 HG LEU 75 -0.669 -0.880 -45.751 582 HD11 LEU 75 HD11 LEU 75 1.115 0.754 -45.997 583 HD12 LEU 75 HD12 LEU 75 1.776 -0.856 -45.712 584 HD13 LEU 75 HD13 LEU 75 1.743 0.328 -44.405 585 HD21 LEU 75 HD21 LEU 75 0.523 -2.500 -44.363 586 HD22 LEU 75 HD22 LEU 75 -1.030 -2.067 -43.647 587 HD23 LEU 75 HD23 LEU 75 0.462 -1.384 -43.000 588 H VAL 76 HN VAL 76 -3.058 2.541 -44.663 589 HA VAL 76 HA VAL 76 -3.177 3.990 -42.282 590 HB VAL 76 HB VAL 76 -4.541 4.473 -44.933 591 HG11 VAL 76 HG11 VAL 76 -4.971 6.762 -44.173 592 HG12 VAL 76 HG12 VAL 76 -4.368 6.345 -42.570 593 HG13 VAL 76 HG13 VAL 76 -5.838 5.587 -43.184 594 HG21 VAL 76 HG21 VAL 76 -2.805 6.191 -45.182 595 HG22 VAL 76 HG22 VAL 76 -2.110 4.584 -44.968 596 HG23 VAL 76 HG23 VAL 76 -2.127 5.723 -43.622 597 H ASN 77 HN ASN 77 -5.750 2.265 -44.029 598 HA ASN 77 HA ASN 77 -7.861 3.151 -42.389 599 HB2 ASN 77 HB2 ASN 77 -7.508 0.848 -44.262 600 HB3 ASN 77 HB1 ASN 77 -8.896 0.850 -43.182 601 HD21 ASN 77 HD21 ASN 77 -7.458 3.745 -44.545 602 HD22 ASN 77 HD22 ASN 77 -8.801 4.158 -45.562 603 H THR 78 HN THR 78 -5.696 0.355 -42.086 604 HA THR 78 HA THR 78 -7.212 -0.896 -40.029 605 HB THR 78 HB THR 78 -4.286 -1.279 -40.694 606 HG1 THR 78 HG1 THR 78 -5.426 -1.794 -42.518 607 HG21 THR 78 HG21 THR 78 -4.902 -2.203 -38.513 608 HG22 THR 78 HG22 THR 78 -4.581 -3.490 -39.675 609 HG23 THR 78 HG23 THR 78 -6.243 -3.075 -39.253 610 H ILE 79 HN ILE 79 -4.264 1.087 -39.974 611 HA ILE 79 HA ILE 79 -4.000 0.958 -37.118 612 HB ILE 79 HB ILE 79 -2.682 2.846 -39.080 613 HG12 ILE 79 HG12 ILE 79 -1.492 0.322 -37.940 614 HG13 ILE 79 HG11 ILE 79 -2.416 0.312 -39.440 615 HG21 ILE 79 HG21 ILE 79 -0.952 3.077 -37.353 616 HG22 ILE 79 HG22 ILE 79 -1.898 2.053 -36.274 617 HG23 ILE 79 HG23 ILE 79 -2.527 3.622 -36.776 618 HD11 ILE 79 HD11 ILE 79 0.079 1.912 -38.924 619 HD12 ILE 79 HD12 ILE 79 -0.841 1.871 -40.429 620 HD13 ILE 79 HD13 ILE 79 -0.027 0.417 -39.855 621 H LEU 80 HN LEU 80 -4.955 3.477 -39.434 622 HA LEU 80 HA LEU 80 -5.490 5.348 -37.338 623 HB2 LEU 80 HB2 LEU 80 -5.836 5.438 -40.313 624 HB3 LEU 80 HB1 LEU 80 -6.514 6.689 -39.291 625 HG LEU 80 HG LEU 80 -4.192 7.092 -38.395 626 HD11 LEU 80 HD11 LEU 80 -2.306 6.316 -39.736 627 HD12 LEU 80 HD12 LEU 80 -3.401 5.342 -40.717 628 HD13 LEU 80 HD13 LEU 80 -3.180 4.968 -39.008 629 HD21 LEU 80 HD21 LEU 80 -5.209 8.551 -40.045 630 HD22 LEU 80 HD22 LEU 80 -4.644 7.502 -41.345 631 HD23 LEU 80 HD23 LEU 80 -3.481 8.378 -40.347 632 H LYS 81 HN LYS 81 -7.257 2.754 -38.550 633 HA LYS 81 HA LYS 81 -9.884 3.609 -38.424 634 HB2 LYS 81 HB2 LYS 81 -9.336 1.293 -38.933 635 HB3 LYS 81 HB1 LYS 81 -8.677 1.059 -37.322 636 HG2 LYS 81 HG2 LYS 81 -10.848 0.037 -37.468 637 HG3 LYS 81 HG1 LYS 81 -10.917 1.418 -36.374 638 HD2 LYS 81 HD2 LYS 81 -12.869 1.484 -37.736 639 HD3 LYS 81 HD1 LYS 81 -11.799 2.775 -38.285 640 HE2 LYS 81 HE2 LYS 81 -11.064 1.428 -40.150 641 HE3 LYS 81 HE1 LYS 81 -12.007 0.055 -39.571 642 HZ1 LYS 81 HZ1 LYS 81 -13.063 2.645 -40.577 643 HZ2 LYS 81 HZ2 LYS 81 -14.019 1.441 -39.868 644 HZ3 LYS 81 HZ3 LYS 81 -13.198 1.129 -41.317 645 H GLU 82 HN GLU 82 -8.081 2.232 -35.691 646 HA GLU 82 HA GLU 82 -9.886 3.357 -33.781 647 HB2 GLU 82 HB2 GLU 82 -7.169 2.092 -33.341 648 HB3 GLU 82 HB1 GLU 82 -8.406 2.362 -32.116 649 HG2 GLU 82 HG2 GLU 82 -9.890 0.811 -33.223 650 HG3 GLU 82 HG1 GLU 82 -8.726 0.588 -34.526 651 H GLU 83 HN GLU 83 -6.796 4.279 -35.163 652 HA GLU 83 HA GLU 83 -5.927 6.181 -33.333 653 HB2 GLU 83 HB2 GLU 83 -4.678 5.393 -35.315 654 HB3 GLU 83 HB1 GLU 83 -5.770 6.310 -36.344 655 HG2 GLU 83 HG2 GLU 83 -3.897 7.637 -36.159 656 HG3 GLU 83 HG1 GLU 83 -5.032 8.347 -35.017 657 H LEU 84 HN LEU 84 -7.935 6.708 -36.208 658 HA LEU 84 HA LEU 84 -8.391 9.404 -36.029 659 HB2 LEU 84 HB2 LEU 84 -10.338 7.302 -36.966 660 HB3 LEU 84 HB1 LEU 84 -10.523 9.021 -37.241 661 HG LEU 84 HG LEU 84 -8.377 7.230 -38.367 662 HD11 LEU 84 HD11 LEU 84 -10.531 7.011 -39.458 663 HD12 LEU 84 HD12 LEU 84 -9.379 7.830 -40.513 664 HD13 LEU 84 HD13 LEU 84 -10.618 8.761 -39.669 665 HD21 LEU 84 HD21 LEU 84 -7.570 9.186 -39.568 666 HD22 LEU 84 HD22 LEU 84 -7.430 9.409 -37.824 667 HD23 LEU 84 HD23 LEU 84 -8.731 10.202 -38.713 668 H GLN 85 HN GLN 85 -9.867 6.909 -34.063 669 HA GLN 85 HA GLN 85 -12.205 8.200 -33.286 670 HB2 GLN 85 HB2 GLN 85 -10.497 6.459 -31.505 671 HB3 GLN 85 HB1 GLN 85 -12.203 6.808 -31.295 672 HG2 GLN 85 HG2 GLN 85 -10.873 5.050 -33.313 673 HG3 GLN 85 HG1 GLN 85 -12.148 4.658 -32.166 674 HE21 GLN 85 HE21 GLN 85 -11.378 5.790 -35.283 675 HE22 GLN 85 HE22 GLN 85 -12.988 5.974 -35.870 676 H ASN 86 HN ASN 86 -8.910 8.831 -32.325 677 HA ASN 86 HA ASN 86 -9.758 10.509 -30.085 678 HB2 ASN 86 HB2 ASN 86 -6.995 9.804 -31.097 679 HB3 ASN 86 HB1 ASN 86 -7.317 10.805 -29.688 680 HD21 ASN 86 HD21 ASN 86 -7.248 7.608 -30.975 681 HD22 ASN 86 HD22 ASN 86 -7.523 6.776 -29.486 682 H ILE 87 HN ILE 87 -9.647 10.906 -33.290 683 HA ILE 87 HA ILE 87 -8.747 13.713 -33.125 684 HB ILE 87 HB ILE 87 -8.664 12.076 -35.658 685 HG12 ILE 87 HG12 ILE 87 -6.415 12.469 -33.666 686 HG13 ILE 87 HG11 ILE 87 -7.236 10.952 -34.015 687 HG21 ILE 87 HG21 ILE 87 -8.618 14.491 -35.920 688 HG22 ILE 87 HG22 ILE 87 -7.056 13.799 -36.354 689 HG23 ILE 87 HG23 ILE 87 -7.259 14.606 -34.801 690 HD11 ILE 87 HD11 ILE 87 -5.561 12.530 -35.951 691 HD12 ILE 87 HD12 ILE 87 -6.381 11.007 -36.295 692 HD13 ILE 87 HD13 ILE 87 -5.076 11.057 -35.110 693 H HIS 88 HN HIS 88 -10.079 15.238 -34.080 694 HA HIS 88 HA HIS 88 -12.779 14.413 -34.643 695 HB2 HIS 88 HB2 HIS 88 -12.186 16.576 -33.508 696 HB3 HIS 88 HB1 HIS 88 -11.551 17.148 -35.047 697 HD1 HIS 88 HD1 HIS 88 -14.746 16.447 -33.241 698 HD2 HIS 88 HD2 HIS 88 -13.500 17.822 -36.965 699 HE1 HIS 88 HE1 HIS 88 -16.808 17.369 -34.354 700 HE2 HIS 88 HE2 HIS 88 -16.052 18.098 -36.647 701 H ALA 89 HN ALA 89 -10.089 15.779 -36.505 702 HA ALA 89 HA ALA 89 -11.036 14.420 -38.876 703 HB1 ALA 89 HB1 ALA 89 -10.763 17.426 -38.875 704 HB2 ALA 89 HB2 ALA 89 -12.280 16.531 -38.962 705 HB3 ALA 89 HB3 ALA 89 -11.110 16.412 -40.276 706 H PHE 90 HN PHE 90 -9.165 13.304 -39.115 707 HA PHE 90 HA PHE 90 -6.665 14.821 -39.302 708 HB2 PHE 90 HB2 PHE 90 -6.657 12.829 -37.843 709 HB3 PHE 90 HB1 PHE 90 -7.113 11.829 -39.215 710 HD1 PHE 90 HD1 PHE 90 -4.432 13.973 -37.852 711 HD2 PHE 90 HD2 PHE 90 -5.495 11.012 -40.712 712 HE1 PHE 90 HE1 PHE 90 -2.053 13.649 -38.392 713 HE2 PHE 90 HE2 PHE 90 -3.119 10.681 -41.260 714 HZ PHE 90 HZ PHE 90 -1.396 12.000 -40.099 715 H SER 91 HN SER 91 -5.700 15.168 -41.193 716 HA SER 91 HA SER 91 -6.662 13.699 -43.559 717 HB2 SER 91 HB2 SER 91 -7.475 15.988 -43.672 718 HB3 SER 91 HB1 SER 91 -5.869 16.617 -43.314 719 HG SER 91 HG SER 91 -5.215 16.192 -45.308 720 H MET 92 HN MET 92 -5.026 13.461 -45.268 721 HA MET 92 HA MET 92 -2.272 13.871 -44.426 722 HB2 MET 92 HB2 MET 92 -1.585 11.608 -44.703 723 HB3 MET 92 HB1 MET 92 -2.967 11.594 -43.621 724 HG2 MET 92 HG2 MET 92 -3.079 10.955 -46.562 725 HG3 MET 92 HG1 MET 92 -2.976 9.762 -45.272 726 HE1 MET 92 HE1 MET 92 -6.404 10.299 -43.427 727 HE2 MET 92 HE2 MET 92 -4.855 11.054 -43.047 728 HE3 MET 92 HE3 MET 92 -4.922 9.345 -43.483 729 H LYS 93 HN LYS 93 -0.883 14.208 -46.056 730 HA LYS 93 HA LYS 93 -1.890 13.913 -48.818 731 HB2 LYS 93 HB2 LYS 93 -0.010 16.044 -47.761 732 HB3 LYS 93 HB1 LYS 93 -0.609 15.912 -49.411 733 HG2 LYS 93 HG2 LYS 93 -2.364 16.352 -47.006 734 HG3 LYS 93 HG1 LYS 93 -1.743 17.643 -48.036 735 HD2 LYS 93 HD2 LYS 93 -2.992 16.916 -49.886 736 HD3 LYS 93 HD1 LYS 93 -3.302 15.337 -49.163 737 HE2 LYS 93 HE2 LYS 93 -5.263 16.882 -49.158 738 HE3 LYS 93 HE1 LYS 93 -4.803 16.277 -47.568 739 HZ1 LYS 93 HZ1 LYS 93 -4.001 18.934 -48.639 740 HZ2 LYS 93 HZ2 LYS 93 -3.759 18.351 -47.060 741 HZ3 LYS 93 HZ3 LYS 93 -5.329 18.672 -47.615 742 H CYS 94 HN CYS 94 -0.801 12.271 -49.746 743 HA CYS 94 HA CYS 94 1.839 11.613 -48.674 744 HB2 CYS 94 HB2 CYS 94 1.443 9.413 -49.865 745 HB3 CYS 94 HB1 CYS 94 0.366 9.772 -48.520 746 HG CYS 94 HG CYS 94 -0.851 10.807 -51.450 747 H HIS 95 HN HIS 95 3.635 11.812 -49.780 748 HA HIS 95 HA HIS 95 3.623 11.583 -52.671 749 HB2 HIS 95 HB2 HIS 95 4.145 14.126 -51.265 750 HB3 HIS 95 HB1 HIS 95 5.347 13.678 -52.473 751 HD1 HIS 95 HD1 HIS 95 3.370 16.112 -52.777 752 HD2 HIS 95 HD2 HIS 95 2.870 12.343 -54.470 753 HE1 HIS 95 HE1 HIS 95 1.886 16.455 -54.781 754 HE2 HIS 95 HE2 HIS 95 1.439 14.136 -55.670 755 H THR 96 HN THR 96 6.069 11.855 -53.410 756 HA THR 96 HA THR 96 7.517 9.975 -51.692 757 HB THR 96 HB THR 96 8.784 9.404 -53.738 758 HG1 THR 96 HG1 THR 96 7.216 10.448 -55.609 759 HG21 THR 96 HG21 THR 96 5.785 9.292 -54.068 760 HG22 THR 96 HG22 THR 96 6.770 8.141 -53.163 761 HG23 THR 96 HG23 THR 96 6.953 8.277 -54.912 762 HA PRO 97 HA PRO 97 10.872 12.768 -50.884 763 HB2 PRO 97 HB2 PRO 97 13.041 11.144 -51.387 764 HB3 PRO 97 HB1 PRO 97 12.109 11.127 -49.886 765 HG2 PRO 97 HG2 PRO 97 11.924 9.311 -52.254 766 HG3 PRO 97 HG1 PRO 97 11.840 8.915 -50.527 767 HD2 PRO 97 HD2 PRO 97 9.630 9.056 -52.042 768 HD3 PRO 97 HD1 PRO 97 9.630 9.595 -50.349 769 H LEU 98 HN LEU 98 10.779 10.979 -53.882 770 HA LEU 98 HA LEU 98 12.768 12.380 -55.304 771 HB2 LEU 98 HB2 LEU 98 11.328 10.201 -55.830 772 HB3 LEU 98 HB1 LEU 98 10.318 11.354 -56.676 773 HG LEU 98 HG LEU 98 11.906 10.216 -58.170 774 HD11 LEU 98 HD11 LEU 98 12.476 13.156 -57.840 775 HD12 LEU 98 HD12 LEU 98 11.153 12.448 -58.766 776 HD13 LEU 98 HD13 LEU 98 12.821 12.191 -59.276 777 HD21 LEU 98 HD21 LEU 98 13.704 9.847 -56.579 778 HD22 LEU 98 HD22 LEU 98 14.020 11.581 -56.515 779 HD23 LEU 98 HD23 LEU 98 14.296 10.691 -58.011 780 H GLU 99 HN GLU 99 9.246 12.795 -55.108 781 HA GLU 99 HA GLU 99 9.043 15.098 -56.692 782 HB2 GLU 99 HB2 GLU 99 7.328 14.197 -54.368 783 HB3 GLU 99 HB1 GLU 99 6.889 15.463 -55.507 784 HG2 GLU 99 HG2 GLU 99 7.398 12.589 -56.227 785 HG3 GLU 99 HG1 GLU 99 5.809 13.317 -55.996 786 H TYR 100 HN TYR 100 9.343 14.733 -53.173 787 HA TYR 100 HA TYR 100 9.264 17.454 -52.523 788 HB2 TYR 100 HB2 TYR 100 8.985 15.751 -50.818 789 HB3 TYR 100 HB1 TYR 100 10.619 15.156 -51.094 790 HD1 TYR 100 HD1 TYR 100 8.773 18.217 -50.039 791 HD2 TYR 100 HD2 TYR 100 12.372 15.961 -49.786 792 HE1 TYR 100 HE1 TYR 100 9.620 19.768 -48.329 793 HE2 TYR 100 HE2 TYR 100 13.227 17.506 -48.075 794 HH TYR 100 HH TYR 100 11.274 19.755 -46.487 795 H ASP 101 HN ASP 101 11.991 15.343 -53.310 796 HA ASP 101 HA ASP 101 14.055 17.167 -52.755 797 HB2 ASP 101 HB2 ASP 101 14.443 14.764 -53.084 798 HB3 ASP 101 HB1 ASP 101 14.005 14.920 -54.782 799 H LYS 102 HN LYS 102 12.133 16.623 -55.664 800 HA LYS 102 HA LYS 102 13.564 18.383 -57.353 801 HB2 LYS 102 HB2 LYS 102 10.974 16.989 -57.408 802 HB3 LYS 102 HB1 LYS 102 11.009 18.488 -58.321 803 HG2 LYS 102 HG2 LYS 102 11.521 16.422 -59.631 804 HG3 LYS 102 HG1 LYS 102 12.732 17.695 -59.738 805 HD2 LYS 102 HD2 LYS 102 13.088 15.593 -57.661 806 HD3 LYS 102 HD1 LYS 102 13.395 15.160 -59.344 807 HE2 LYS 102 HE2 LYS 102 14.979 17.014 -59.532 808 HE3 LYS 102 HE1 LYS 102 14.663 17.458 -57.856 809 HZ1 LYS 102 HZ1 LYS 102 16.715 16.135 -58.210 810 HZ2 LYS 102 HZ2 LYS 102 15.749 14.820 -58.677 811 HZ3 LYS 102 HZ3 LYS 102 15.634 15.446 -57.104 812 H LEU 103 HN LEU 103 10.905 18.870 -55.103 813 HA LEU 103 HA LEU 103 10.302 21.532 -55.842 814 HB2 LEU 103 HB2 LEU 103 9.930 20.267 -53.126 815 HB3 LEU 103 HB1 LEU 103 9.083 21.665 -53.757 816 HG LEU 103 HG LEU 103 8.812 18.820 -54.729 817 HD11 LEU 103 HD11 LEU 103 7.711 19.231 -52.603 818 HD12 LEU 103 HD12 LEU 103 6.526 19.021 -53.892 819 HD13 LEU 103 HD13 LEU 103 6.891 20.636 -53.285 820 HD21 LEU 103 HD21 LEU 103 7.442 21.325 -55.697 821 HD22 LEU 103 HD22 LEU 103 7.052 19.679 -56.196 822 HD23 LEU 103 HD23 LEU 103 8.624 20.373 -56.595 823 H LYS 104 HN LYS 104 12.308 20.204 -53.222 824 HA LYS 104 HA LYS 104 13.131 22.758 -52.266 825 HB2 LYS 104 HB2 LYS 104 14.888 21.396 -51.031 826 HB3 LYS 104 HB1 LYS 104 13.209 20.994 -50.695 827 HG2 LYS 104 HG2 LYS 104 13.317 19.018 -51.959 828 HG3 LYS 104 HG1 LYS 104 14.830 19.495 -52.726 829 HD2 LYS 104 HD2 LYS 104 14.566 18.979 -49.770 830 HD3 LYS 104 HD1 LYS 104 15.024 17.736 -50.937 831 HE2 LYS 104 HE2 LYS 104 16.897 19.206 -51.660 832 HE3 LYS 104 HE1 LYS 104 16.486 20.302 -50.343 833 HZ1 LYS 104 HZ1 LYS 104 18.277 18.819 -49.720 834 HZ2 LYS 104 HZ2 LYS 104 17.317 17.463 -50.048 835 HZ3 LYS 104 HZ3 LYS 104 16.909 18.505 -48.770 836 H SER 105 HN SER 105 14.351 20.586 -54.697 837 HA SER 105 HA SER 105 17.013 21.424 -54.818 838 HB2 SER 105 HB2 SER 105 16.102 19.410 -55.957 839 HB3 SER 105 HB1 SER 105 15.284 20.460 -57.111 840 HG SER 105 HG SER 105 18.088 20.239 -56.689 841 H LYS 106 HN LYS 106 14.257 22.496 -56.823 842 HA LYS 106 HA LYS 106 15.810 24.927 -57.404 843 HB2 LYS 106 HB2 LYS 106 14.636 24.951 -59.617 844 HB3 LYS 106 HB1 LYS 106 15.758 23.618 -59.392 845 HG2 LYS 106 HG2 LYS 106 13.797 22.192 -58.768 846 HG3 LYS 106 HG1 LYS 106 12.757 23.528 -59.257 847 HD2 LYS 106 HD2 LYS 106 14.816 22.334 -61.080 848 HD3 LYS 106 HD1 LYS 106 13.180 21.696 -60.961 849 HE2 LYS 106 HE2 LYS 106 13.231 23.177 -62.826 850 HE3 LYS 106 HE1 LYS 106 12.334 23.979 -61.541 851 HZ1 LYS 106 HZ1 LYS 106 14.175 25.378 -61.076 852 HZ2 LYS 106 HZ2 LYS 106 13.955 25.406 -62.757 853 HZ3 LYS 106 HZ3 LYS 106 15.206 24.486 -62.083 854 H GLY 107 HN GLY 107 12.458 23.693 -57.436 855 HA2 GLY 107 HA2 GLY 107 10.945 25.021 -55.902 856 HA3 GLY 107 HA1 GLY 107 11.582 26.424 -56.749 857 H SER 108 HN SER 108 10.418 23.242 -57.815 858 HA SER 108 HA SER 108 8.960 24.413 -59.988 859 HB2 SER 108 HB2 SER 108 8.166 21.955 -60.204 860 HB3 SER 108 HB1 SER 108 9.875 22.302 -60.479 861 HG SER 108 HG SER 108 8.666 21.235 -58.148 Start of MODEL 10 1 H1 MET 1 HT1 MET 1 7.199 13.236 -36.953 2 H2 MET 1 HT2 MET 1 7.717 12.821 -38.509 3 H3 MET 1 HT3 MET 1 7.030 14.336 -38.230 4 HA MET 1 HA MET 1 9.388 14.577 -38.438 5 HB2 MET 1 HB2 MET 1 8.384 14.834 -35.597 6 HB3 MET 1 HB1 MET 1 9.894 15.526 -36.168 7 HG2 MET 1 HG2 MET 1 7.179 16.190 -37.280 8 HG3 MET 1 HG1 MET 1 8.030 17.143 -36.065 9 HE1 MET 1 HE1 MET 1 10.199 18.540 -36.512 10 HE2 MET 1 HE2 MET 1 11.116 18.482 -38.019 11 HE3 MET 1 HE3 MET 1 11.028 17.057 -36.985 12 H GLY 2 HN GLY 2 11.438 13.831 -38.087 13 HA2 GLY 2 HA2 GLY 2 13.094 12.488 -37.094 14 HA3 GLY 2 HA1 GLY 2 11.840 11.630 -36.205 15 H SER 3 HN SER 3 14.010 10.473 -37.712 16 HA SER 3 HA SER 3 12.753 9.341 -40.071 17 HB2 SER 3 HB2 SER 3 15.178 9.928 -40.074 18 HB3 SER 3 HB1 SER 3 15.447 8.705 -38.834 19 HG SER 3 HG SER 3 14.556 8.316 -41.496 20 H SER 4 HN SER 4 11.337 7.775 -39.794 21 HA SER 4 HA SER 4 10.784 6.464 -37.431 22 HB2 SER 4 HB2 SER 4 10.170 5.341 -40.158 23 HB3 SER 4 HB1 SER 4 9.216 5.203 -38.678 24 HG SER 4 HG SER 4 8.608 7.303 -38.853 25 H HIS 5 HN HIS 5 12.020 5.123 -36.346 26 HA HIS 5 HA HIS 5 13.027 2.731 -37.702 27 HB2 HIS 5 HB2 HIS 5 14.635 4.524 -35.877 28 HB3 HIS 5 HB1 HIS 5 15.058 2.836 -36.146 29 HD1 HIS 5 HD1 HIS 5 14.936 6.160 -37.890 30 HD2 HIS 5 HD2 HIS 5 16.238 2.277 -38.593 31 HE1 HIS 5 HE1 HIS 5 16.332 6.281 -39.979 32 HE2 HIS 5 HE2 HIS 5 16.918 3.884 -40.502 33 H HIS 6 HN HIS 6 11.432 1.461 -36.830 34 HA HIS 6 HA HIS 6 10.965 1.763 -33.948 35 HB2 HIS 6 HB2 HIS 6 9.052 2.351 -35.365 36 HB3 HIS 6 HB1 HIS 6 9.079 0.742 -36.075 37 HD1 HIS 6 HD1 HIS 6 9.110 1.874 -32.424 38 HD2 HIS 6 HD2 HIS 6 6.978 -0.573 -35.028 39 HE1 HIS 6 HE1 HIS 6 7.332 0.774 -31.024 40 HE2 HIS 6 HE2 HIS 6 6.166 -0.830 -32.586 41 H HIS 7 HN HIS 7 12.420 0.314 -33.148 42 HA HIS 7 HA HIS 7 11.478 -2.462 -33.413 43 HB2 HIS 7 HB2 HIS 7 14.289 -1.442 -33.099 44 HB3 HIS 7 HB1 HIS 7 13.852 -3.032 -32.482 45 HD1 HIS 7 HD1 HIS 7 15.136 -1.466 -35.437 46 HD2 HIS 7 HD2 HIS 7 12.589 -4.659 -34.661 47 HE1 HIS 7 HE1 HIS 7 15.079 -2.820 -37.554 48 HE2 HIS 7 HE2 HIS 7 13.375 -4.629 -37.124 49 H HIS 8 HN HIS 8 9.939 -1.981 -31.862 50 HA HIS 8 HA HIS 8 9.006 -1.762 -29.817 51 HB2 HIS 8 HB2 HIS 8 10.625 -3.479 -29.078 52 HB3 HIS 8 HB1 HIS 8 11.782 -2.209 -28.695 53 HD1 HIS 8 HD1 HIS 8 11.890 -2.434 -26.197 54 HD2 HIS 8 HD2 HIS 8 7.984 -2.187 -27.607 55 HE1 HIS 8 HE1 HIS 8 10.440 -2.224 -24.152 56 HE2 HIS 8 HE2 HIS 8 8.076 -2.327 -25.025 57 H HIS 9 HN HIS 9 12.116 -0.082 -29.996 58 HA HIS 9 HA HIS 9 11.423 2.097 -28.337 59 HB2 HIS 9 HB2 HIS 9 13.749 1.420 -29.008 60 HB3 HIS 9 HB1 HIS 9 13.420 2.047 -30.617 61 HD1 HIS 9 HD1 HIS 9 13.252 3.420 -27.059 62 HD2 HIS 9 HD2 HIS 9 14.396 4.538 -30.898 63 HE1 HIS 9 HE1 HIS 9 14.196 5.742 -26.838 64 HE2 HIS 9 HE2 HIS 9 15.096 6.292 -29.125 65 H HIS 10 HN HIS 10 10.625 4.126 -28.823 66 HA HIS 10 HA HIS 10 9.012 4.326 -31.217 67 HB2 HIS 10 HB2 HIS 10 9.419 6.133 -28.834 68 HB3 HIS 10 HB1 HIS 10 8.442 6.610 -30.218 69 HD1 HIS 10 HD1 HIS 10 6.096 5.729 -30.358 70 HD2 HIS 10 HD2 HIS 10 8.323 3.939 -27.323 71 HE1 HIS 10 HE1 HIS 10 4.452 4.379 -29.001 72 HE2 HIS 10 HE2 HIS 10 5.790 3.428 -27.088 73 H SER 11 HN SER 11 9.062 6.760 -32.167 74 HA SER 11 HA SER 11 11.808 7.087 -33.143 75 HB2 SER 11 HB2 SER 11 9.214 8.278 -34.172 76 HB3 SER 11 HB1 SER 11 10.791 8.398 -34.955 77 HG SER 11 HG SER 11 8.997 6.317 -34.916 78 H SER 12 HN SER 12 10.682 7.951 -30.522 79 HA SER 12 HA SER 12 11.120 10.848 -30.725 80 HB2 SER 12 HB2 SER 12 9.498 9.293 -28.695 81 HB3 SER 12 HB1 SER 12 9.725 11.044 -28.701 82 HG SER 12 HG SER 12 8.447 9.470 -30.716 83 H GLY 13 HN GLY 13 12.198 11.846 -28.881 84 HA2 GLY 13 HA2 GLY 13 13.386 11.047 -26.710 85 HA3 GLY 13 HA1 GLY 13 14.304 10.080 -27.856 86 H ARG 14 HN ARG 14 13.118 13.389 -28.239 87 HA ARG 14 HA ARG 14 15.927 14.246 -28.561 88 HB2 ARG 14 HB2 ARG 14 13.441 15.497 -29.750 89 HB3 ARG 14 HB1 ARG 14 15.099 16.002 -30.039 90 HG2 ARG 14 HG2 ARG 14 15.568 13.896 -31.156 91 HG3 ARG 14 HG1 ARG 14 13.921 13.346 -30.831 92 HD2 ARG 14 HD2 ARG 14 14.710 15.726 -32.511 93 HD3 ARG 14 HD1 ARG 14 14.126 14.176 -33.114 94 HE ARG 14 HE ARG 14 12.059 14.814 -31.662 95 HH11 ARG 14 HH11 ARG 14 14.007 16.986 -33.606 96 HH12 ARG 14 HH12 ARG 14 12.700 18.097 -33.896 97 HH21 ARG 14 HH21 ARG 14 10.341 16.260 -32.053 98 HH22 ARG 14 HH22 ARG 14 10.606 17.685 -33.017 99 H GLU 15 HN GLU 15 12.802 14.928 -27.213 100 HA GLU 15 HA GLU 15 13.624 17.425 -26.005 101 HB2 GLU 15 HB2 GLU 15 11.263 17.332 -25.065 102 HB3 GLU 15 HB1 GLU 15 11.408 17.428 -26.813 103 HG2 GLU 15 HG2 GLU 15 11.128 14.774 -25.473 104 HG3 GLU 15 HG1 GLU 15 9.712 15.789 -25.749 105 H ASN 16 HN ASN 16 14.666 14.638 -25.216 106 HA ASN 16 HA ASN 16 13.821 14.365 -22.469 107 HB2 ASN 16 HB2 ASN 16 15.278 12.485 -22.343 108 HB3 ASN 16 HB1 ASN 16 14.557 12.427 -23.945 109 HD21 ASN 16 HD21 ASN 16 15.852 12.790 -25.748 110 HD22 ASN 16 HD22 ASN 16 17.580 12.815 -25.661 111 H LEU 17 HN LEU 17 15.967 16.286 -24.163 112 HA LEU 17 HA LEU 17 18.029 16.567 -22.200 113 HB2 LEU 17 HB2 LEU 17 17.264 18.421 -24.458 114 HB3 LEU 17 HB1 LEU 17 18.785 18.422 -23.584 115 HG LEU 17 HG LEU 17 17.817 16.133 -25.296 116 HD11 LEU 17 HD11 LEU 17 19.805 18.311 -25.917 117 HD12 LEU 17 HD12 LEU 17 18.220 18.098 -26.663 118 HD13 LEU 17 HD13 LEU 17 19.485 16.895 -26.918 119 HD21 LEU 17 HD21 LEU 17 20.132 15.365 -25.110 120 HD22 LEU 17 HD22 LEU 17 19.353 15.464 -23.530 121 HD23 LEU 17 HD23 LEU 17 20.493 16.714 -24.033 122 H TYR 18 HN TYR 18 14.919 17.947 -22.745 123 HA TYR 18 HA TYR 18 15.437 20.003 -20.704 124 HB2 TYR 18 HB2 TYR 18 13.455 20.062 -22.991 125 HB3 TYR 18 HB1 TYR 18 13.594 21.297 -21.746 126 HD1 TYR 18 HD2 TYR 18 15.157 19.836 -24.724 127 HD2 TYR 18 HD1 TYR 18 15.423 22.885 -21.770 128 HE1 TYR 18 HE2 TYR 18 16.830 21.004 -26.092 129 HE2 TYR 18 HE1 TYR 18 17.097 24.064 -23.132 130 HH TYR 18 HH TYR 18 17.712 23.274 -26.385 131 H PHE 19 HN PHE 19 13.179 20.722 -19.762 132 HA PHE 19 HA PHE 19 12.094 18.413 -18.431 133 HB2 PHE 19 HB2 PHE 19 10.846 20.028 -17.095 134 HB3 PHE 19 HB1 PHE 19 12.523 20.545 -17.239 135 HD1 PHE 19 HD1 PHE 19 13.072 22.331 -18.969 136 HD2 PHE 19 HD2 PHE 19 9.101 21.442 -17.725 137 HE1 PHE 19 HE1 PHE 19 12.322 24.508 -19.821 138 HE2 PHE 19 HE2 PHE 19 8.346 23.624 -18.575 139 HZ PHE 19 HZ PHE 19 9.958 25.158 -19.626 140 H GLN 20 HN GLN 20 11.608 19.079 -21.373 141 HA GLN 20 HA GLN 20 8.996 19.885 -21.843 142 HB2 GLN 20 HB2 GLN 20 10.763 18.020 -23.422 143 HB3 GLN 20 HB1 GLN 20 9.227 18.640 -24.008 144 HG2 GLN 20 HG2 GLN 20 11.602 20.318 -23.238 145 HG3 GLN 20 HG1 GLN 20 11.138 19.889 -24.885 146 HE21 GLN 20 HE21 GLN 20 10.409 21.838 -22.116 147 HE22 GLN 20 HE22 GLN 20 9.258 22.874 -22.894 148 H GLY 21 HN GLY 21 9.984 16.507 -22.380 149 HA2 GLY 21 HA2 GLY 21 8.742 14.571 -22.271 150 HA3 GLY 21 HA1 GLY 21 8.184 15.208 -20.729 151 H HIS 22 HN HIS 22 7.611 16.669 -23.873 152 HA HIS 22 HA HIS 22 4.834 16.913 -23.219 153 HB2 HIS 22 HB2 HIS 22 4.708 18.082 -25.488 154 HB3 HIS 22 HB1 HIS 22 5.690 18.835 -24.244 155 HD1 HIS 22 HD1 HIS 22 7.453 20.006 -25.544 156 HD2 HIS 22 HD2 HIS 22 6.885 16.102 -26.863 157 HE1 HIS 22 HE1 HIS 22 9.264 19.589 -27.240 158 HE2 HIS 22 HE2 HIS 22 9.011 17.158 -27.878 159 H MET 23 HN MET 23 4.220 14.713 -23.168 160 HA MET 23 HA MET 23 4.061 13.341 -25.728 161 HB2 MET 23 HB2 MET 23 3.155 12.546 -22.956 162 HB3 MET 23 HB1 MET 23 2.911 11.551 -24.385 163 HG2 MET 23 HG2 MET 23 5.354 11.484 -24.716 164 HG3 MET 23 HG1 MET 23 5.553 12.399 -23.222 165 HE1 MET 23 HE1 MET 23 4.922 11.468 -20.818 166 HE2 MET 23 HE2 MET 23 4.171 9.895 -20.546 167 HE3 MET 23 HE3 MET 23 3.278 11.165 -21.381 168 H CYS 24 HN CYS 24 2.804 15.543 -26.147 169 HA CYS 24 HA CYS 24 0.069 15.635 -25.397 170 HB2 CYS 24 HB2 CYS 24 1.237 17.649 -26.130 171 HB3 CYS 24 HB1 CYS 24 1.530 16.933 -27.712 172 HG CYS 24 HG CYS 24 -0.646 19.013 -27.326 173 H ILE 25 HN ILE 25 -1.763 15.223 -26.713 174 HA ILE 25 HA ILE 25 -1.835 12.726 -27.901 175 HB ILE 25 HB ILE 25 -3.815 13.918 -27.030 176 HG12 ILE 25 HG12 ILE 25 -5.397 13.214 -28.823 177 HG13 ILE 25 HG11 ILE 25 -4.020 12.984 -29.897 178 HG21 ILE 25 HG21 ILE 25 -3.383 16.132 -27.920 179 HG22 ILE 25 HG22 ILE 25 -4.976 15.564 -28.422 180 HG23 ILE 25 HG23 ILE 25 -3.630 15.539 -29.563 181 HD11 ILE 25 HD11 ILE 25 -4.509 11.509 -27.320 182 HD12 ILE 25 HD12 ILE 25 -3.141 11.272 -28.408 183 HD13 ILE 25 HD13 ILE 25 -4.774 10.881 -28.946 184 H GLN 26 HN GLN 26 -1.175 15.846 -29.330 185 HA GLN 26 HA GLN 26 -1.454 15.233 -32.043 186 HB2 GLN 26 HB2 GLN 26 -1.111 17.512 -31.165 187 HB3 GLN 26 HB1 GLN 26 0.535 17.089 -30.719 188 HG2 GLN 26 HG2 GLN 26 0.995 16.646 -33.130 189 HG3 GLN 26 HG1 GLN 26 -0.608 17.283 -33.494 190 HE21 GLN 26 HE21 GLN 26 0.171 18.993 -34.686 191 HE22 GLN 26 HE22 GLN 26 0.985 20.336 -33.971 192 H LYS 27 HN LYS 27 1.416 15.067 -29.957 193 HA LYS 27 HA LYS 27 3.072 13.979 -32.001 194 HB2 LYS 27 HB2 LYS 27 4.048 15.292 -30.208 195 HB3 LYS 27 HB1 LYS 27 3.480 14.136 -29.011 196 HG2 LYS 27 HG2 LYS 27 4.951 12.444 -29.872 197 HG3 LYS 27 HG1 LYS 27 5.441 13.496 -31.200 198 HD2 LYS 27 HD2 LYS 27 6.520 15.007 -29.681 199 HD3 LYS 27 HD1 LYS 27 5.883 14.131 -28.286 200 HE2 LYS 27 HE2 LYS 27 8.238 13.585 -28.730 201 HE3 LYS 27 HE1 LYS 27 7.184 12.179 -28.877 202 HZ1 LYS 27 HZ1 LYS 27 8.569 13.681 -30.999 203 HZ2 LYS 27 HZ2 LYS 27 7.167 12.806 -31.368 204 HZ3 LYS 27 HZ3 LYS 27 8.516 12.008 -30.729 205 H VAL 28 HN VAL 28 1.041 12.613 -29.502 206 HA VAL 28 HA VAL 28 2.024 10.003 -29.441 207 HB VAL 28 HB VAL 28 -0.842 10.934 -29.179 208 HG11 VAL 28 HG11 VAL 28 -1.264 8.801 -28.059 209 HG12 VAL 28 HG12 VAL 28 0.382 8.282 -28.422 210 HG13 VAL 28 HG13 VAL 28 -0.765 8.558 -29.733 211 HG21 VAL 28 HG21 VAL 28 0.653 11.897 -27.516 212 HG22 VAL 28 HG22 VAL 28 1.246 10.288 -27.101 213 HG23 VAL 28 HG23 VAL 28 -0.431 10.722 -26.773 214 H ILE 29 HN ILE 29 -0.495 11.391 -31.534 215 HA ILE 29 HA ILE 29 -0.827 9.078 -33.129 216 HB ILE 29 HB ILE 29 -1.624 11.949 -33.388 217 HG12 ILE 29 HG12 ILE 29 -3.875 10.929 -33.632 218 HG13 ILE 29 HG11 ILE 29 -3.143 9.335 -33.510 219 HG21 ILE 29 HG21 ILE 29 -0.868 11.445 -35.633 220 HG22 ILE 29 HG22 ILE 29 -2.628 11.552 -35.588 221 HG23 ILE 29 HG23 ILE 29 -1.842 9.974 -35.653 222 HD11 ILE 29 HD11 ILE 29 -3.161 11.455 -31.377 223 HD12 ILE 29 HD12 ILE 29 -2.392 9.875 -31.243 224 HD13 ILE 29 HD13 ILE 29 -4.144 9.991 -31.413 225 H GLU 30 HN GLU 30 1.239 11.911 -33.387 226 HA GLU 30 HA GLU 30 2.148 11.590 -36.008 227 HB2 GLU 30 HB2 GLU 30 2.453 13.502 -34.215 228 HB3 GLU 30 HB1 GLU 30 3.949 12.653 -33.864 229 HG2 GLU 30 HG2 GLU 30 3.261 13.493 -36.652 230 HG3 GLU 30 HG1 GLU 30 3.985 14.616 -35.507 231 H ASP 31 HN ASP 31 3.652 10.500 -32.959 232 HA ASP 31 HA ASP 31 5.809 9.130 -34.206 233 HB2 ASP 31 HB2 ASP 31 5.884 9.881 -31.860 234 HB3 ASP 31 HB1 ASP 31 4.604 8.747 -31.451 235 H LYS 32 HN LYS 32 2.594 8.202 -33.212 236 HA LYS 32 HA LYS 32 2.914 5.411 -33.340 237 HB2 LYS 32 HB2 LYS 32 1.089 6.535 -32.150 238 HB3 LYS 32 HB1 LYS 32 0.421 7.080 -33.680 239 HG2 LYS 32 HG2 LYS 32 -0.223 4.905 -34.293 240 HG3 LYS 32 HG1 LYS 32 0.774 4.172 -33.031 241 HD2 LYS 32 HD2 LYS 32 -0.653 5.018 -31.313 242 HD3 LYS 32 HD1 LYS 32 -1.557 5.997 -32.471 243 HE2 LYS 32 HE2 LYS 32 -1.430 2.987 -32.511 244 HE3 LYS 32 HE1 LYS 32 -2.726 3.918 -31.760 245 HZ1 LYS 32 HZ1 LYS 32 -3.185 4.922 -33.926 246 HZ2 LYS 32 HZ2 LYS 32 -3.356 3.233 -33.969 247 HZ3 LYS 32 HZ3 LYS 32 -1.984 3.966 -34.634 248 H LEU 33 HN LEU 33 1.496 7.671 -35.745 249 HA LEU 33 HA LEU 33 1.180 5.583 -37.670 250 HB2 LEU 33 HB2 LEU 33 0.604 7.350 -39.258 251 HB3 LEU 33 HB1 LEU 33 -0.276 7.512 -37.756 252 HG LEU 33 HG LEU 33 1.575 9.255 -37.156 253 HD11 LEU 33 HD11 LEU 33 3.030 8.807 -39.062 254 HD12 LEU 33 HD12 LEU 33 2.431 10.466 -39.101 255 HD13 LEU 33 HD13 LEU 33 1.730 9.249 -40.169 256 HD21 LEU 33 HD21 LEU 33 -0.781 9.772 -37.447 257 HD22 LEU 33 HD22 LEU 33 -0.572 9.806 -39.198 258 HD23 LEU 33 HD23 LEU 33 0.225 11.016 -38.190 259 H SER 34 HN SER 34 3.742 7.803 -36.872 260 HA SER 34 HA SER 34 5.270 7.560 -39.227 261 HB2 SER 34 HB2 SER 34 5.709 9.275 -37.508 262 HB3 SER 34 HB1 SER 34 6.209 8.018 -36.379 263 HG SER 34 HG SER 34 7.892 9.199 -37.644 264 H SER 35 HN SER 35 5.231 5.700 -36.225 265 HA SER 35 HA SER 35 7.377 3.998 -36.813 266 HB2 SER 35 HB2 SER 35 4.967 3.551 -35.039 267 HB3 SER 35 HB1 SER 35 6.427 2.560 -35.026 268 HG SER 35 HG SER 35 6.071 5.242 -34.209 269 H ALA 36 HN ALA 36 4.068 3.937 -37.884 270 HA ALA 36 HA ALA 36 4.282 1.168 -38.777 271 HB1 ALA 36 HB1 ALA 36 2.223 1.889 -37.667 272 HB2 ALA 36 HB2 ALA 36 1.920 1.345 -39.317 273 HB3 ALA 36 HB3 ALA 36 1.948 3.069 -38.948 274 H LEU 37 HN LEU 37 3.505 4.343 -40.216 275 HA LEU 37 HA LEU 37 3.439 3.304 -42.876 276 HB2 LEU 37 HB2 LEU 37 3.563 6.143 -41.862 277 HB3 LEU 37 HB1 LEU 37 3.296 5.697 -43.536 278 HG LEU 37 HG LEU 37 1.460 4.983 -41.248 279 HD11 LEU 37 HD11 LEU 37 -0.053 6.638 -42.224 280 HD12 LEU 37 HD12 LEU 37 1.189 7.077 -43.399 281 HD13 LEU 37 HD13 LEU 37 1.454 7.376 -41.681 282 HD21 LEU 37 HD21 LEU 37 1.147 4.658 -44.229 283 HD22 LEU 37 HD22 LEU 37 -0.087 4.309 -43.019 284 HD23 LEU 37 HD23 LEU 37 1.399 3.358 -43.065 285 H LYS 38 HN LYS 38 5.863 4.773 -40.868 286 HA LYS 38 HA LYS 38 8.070 5.173 -41.112 287 HB2 LYS 38 HB2 LYS 38 7.853 3.245 -43.428 288 HB3 LYS 38 HB1 LYS 38 9.352 3.779 -42.682 289 HG2 LYS 38 HG2 LYS 38 8.777 2.695 -40.619 290 HG3 LYS 38 HG1 LYS 38 7.178 2.280 -41.240 291 HD2 LYS 38 HD2 LYS 38 9.809 1.293 -42.345 292 HD3 LYS 38 HD1 LYS 38 8.706 0.364 -41.326 293 HE2 LYS 38 HE2 LYS 38 8.075 1.471 -44.063 294 HE3 LYS 38 HE1 LYS 38 8.453 -0.211 -43.696 295 HZ1 LYS 38 HZ1 LYS 38 6.482 -0.283 -42.269 296 HZ2 LYS 38 HZ2 LYS 38 6.078 0.099 -43.874 297 HZ3 LYS 38 HZ3 LYS 38 6.106 1.311 -42.693 298 HA PRO 39 HA PRO 39 7.714 8.110 -44.609 299 HB2 PRO 39 HB2 PRO 39 7.009 10.344 -43.293 300 HB3 PRO 39 HB1 PRO 39 5.812 9.168 -43.843 301 HG2 PRO 39 HG2 PRO 39 6.793 9.720 -41.113 302 HG3 PRO 39 HG1 PRO 39 5.240 9.054 -41.639 303 HD2 PRO 39 HD2 PRO 39 7.507 7.630 -40.650 304 HD3 PRO 39 HD1 PRO 39 5.988 6.952 -41.267 305 H THR 40 HN THR 40 9.671 8.842 -45.182 306 HA THR 40 HA THR 40 11.801 9.194 -43.364 307 HB THR 40 HB THR 40 12.915 10.339 -45.380 308 HG1 THR 40 HG1 THR 40 10.760 10.786 -46.351 309 HG21 THR 40 HG21 THR 40 13.297 7.999 -44.803 310 HG22 THR 40 HG22 THR 40 13.207 8.199 -46.553 311 HG23 THR 40 HG23 THR 40 11.834 7.533 -45.670 312 H PHE 41 HN PHE 41 9.367 11.295 -44.637 313 HA PHE 41 HA PHE 41 10.186 13.314 -42.704 314 HB2 PHE 41 HB2 PHE 41 11.083 14.055 -44.906 315 HB3 PHE 41 HB1 PHE 41 9.450 13.997 -45.562 316 HD1 PHE 41 HD1 PHE 41 11.521 15.632 -42.955 317 HD2 PHE 41 HD2 PHE 41 8.036 15.840 -45.388 318 HE1 PHE 41 HE1 PHE 41 11.143 17.946 -42.210 319 HE2 PHE 41 HE2 PHE 41 7.653 18.153 -44.649 320 HZ PHE 41 HZ PHE 41 9.207 19.210 -43.057 321 H LEU 42 HN LEU 42 8.466 14.296 -41.716 322 HA LEU 42 HA LEU 42 5.778 13.875 -42.780 323 HB2 LEU 42 HB2 LEU 42 6.537 12.059 -41.068 324 HB3 LEU 42 HB1 LEU 42 6.349 13.326 -39.876 325 HG LEU 42 HG LEU 42 4.401 11.808 -40.013 326 HD11 LEU 42 HD11 LEU 42 2.665 13.513 -40.091 327 HD12 LEU 42 HD12 LEU 42 3.795 14.638 -40.846 328 HD13 LEU 42 HD13 LEU 42 4.079 14.077 -39.198 329 HD21 LEU 42 HD21 LEU 42 4.081 12.958 -42.778 330 HD22 LEU 42 HD22 LEU 42 2.908 11.936 -41.946 331 HD23 LEU 42 HD23 LEU 42 4.491 11.290 -42.379 332 H GLU 43 HN GLU 43 5.107 15.918 -42.994 333 HA GLU 43 HA GLU 43 5.936 17.913 -41.001 334 HB2 GLU 43 HB2 GLU 43 6.316 18.338 -43.460 335 HB3 GLU 43 HB1 GLU 43 4.570 18.397 -43.651 336 HG2 GLU 43 HG2 GLU 43 4.559 20.245 -41.944 337 HG3 GLU 43 HG1 GLU 43 6.317 20.268 -42.085 338 H LEU 44 HN LEU 44 4.459 19.057 -39.804 339 HA LEU 44 HA LEU 44 1.705 18.046 -39.929 340 HB2 LEU 44 HB2 LEU 44 3.277 19.204 -37.633 341 HB3 LEU 44 HB1 LEU 44 1.542 18.971 -37.572 342 HG LEU 44 HG LEU 44 2.489 17.137 -36.444 343 HD11 LEU 44 HD11 LEU 44 1.816 16.224 -39.228 344 HD12 LEU 44 HD12 LEU 44 0.671 16.524 -37.922 345 HD13 LEU 44 HD13 LEU 44 1.840 15.209 -37.787 346 HD21 LEU 44 HD21 LEU 44 4.217 15.685 -37.394 347 HD22 LEU 44 HD22 LEU 44 4.784 17.344 -37.204 348 HD23 LEU 44 HD23 LEU 44 4.326 16.745 -38.798 349 H VAL 45 HN VAL 45 0.284 19.352 -40.802 350 HA VAL 45 HA VAL 45 0.594 22.260 -40.440 351 HB VAL 45 HB VAL 45 -1.203 20.821 -42.409 352 HG11 VAL 45 HG11 VAL 45 -1.410 23.021 -43.466 353 HG12 VAL 45 HG12 VAL 45 -0.421 23.723 -42.185 354 HG13 VAL 45 HG13 VAL 45 -2.000 23.032 -41.804 355 HG21 VAL 45 HG21 VAL 45 1.125 20.400 -42.977 356 HG22 VAL 45 HG22 VAL 45 1.472 22.127 -42.899 357 HG23 VAL 45 HG23 VAL 45 0.393 21.500 -44.145 358 H ASP 46 HN ASP 46 -0.784 23.213 -39.039 359 HA ASP 46 HA ASP 46 -2.734 21.667 -37.654 360 HB2 ASP 46 HB2 ASP 46 -1.530 23.573 -36.606 361 HB3 ASP 46 HB1 ASP 46 -2.408 24.676 -37.664 362 H LYS 47 HN LYS 47 -4.622 21.100 -38.457 363 HA LYS 47 HA LYS 47 -5.714 22.604 -40.695 364 HB2 LYS 47 HB2 LYS 47 -5.523 19.906 -40.190 365 HB3 LYS 47 HB1 LYS 47 -7.199 20.246 -39.789 366 HG2 LYS 47 HG2 LYS 47 -5.843 20.832 -42.410 367 HG3 LYS 47 HG1 LYS 47 -6.990 19.532 -42.088 368 HD2 LYS 47 HD2 LYS 47 -8.727 21.183 -41.603 369 HD3 LYS 47 HD1 LYS 47 -7.577 22.488 -41.913 370 HE2 LYS 47 HE2 LYS 47 -8.559 20.429 -43.885 371 HE3 LYS 47 HE1 LYS 47 -8.960 22.145 -43.866 372 HZ1 LYS 47 HZ1 LYS 47 -7.280 21.704 -45.509 373 HZ2 LYS 47 HZ2 LYS 47 -6.271 20.969 -44.357 374 HZ3 LYS 47 HZ3 LYS 47 -6.604 22.633 -44.260 375 H SER 48 HN SER 48 -6.280 24.415 -39.276 376 HA SER 48 HA SER 48 -8.383 24.161 -37.389 377 HB2 SER 48 HB2 SER 48 -7.569 26.585 -39.015 378 HB3 SER 48 HB1 SER 48 -8.572 26.599 -37.565 379 HG SER 48 HG SER 48 -6.237 25.293 -37.111 380 H CYS 49 HN CYS 49 -10.013 22.929 -38.279 381 HA CYS 49 HA CYS 49 -11.224 23.862 -40.774 382 HB2 CYS 49 HB2 CYS 49 -10.543 21.428 -40.408 383 HB3 CYS 49 HB1 CYS 49 -11.896 21.323 -39.287 384 HG CYS 49 HG CYS 49 -12.473 22.427 -42.447 385 H GLY 50 HN GLY 50 -11.543 24.492 -37.606 386 HA2 GLY 50 HA2 GLY 50 -13.154 25.828 -36.616 387 HA3 GLY 50 HA1 GLY 50 -14.167 25.612 -38.033 388 H CYS 51 HN CYS 51 -14.579 22.965 -38.166 389 HA CYS 51 HA CYS 51 -16.635 22.501 -36.368 390 HB2 CYS 51 HB2 CYS 51 -15.030 20.371 -37.796 391 HB3 CYS 51 HB1 CYS 51 -16.700 20.252 -37.245 392 HG CYS 51 HG CYS 51 -17.250 20.549 -39.806 393 H GLY 52 HN GLY 52 -13.424 20.932 -36.375 394 HA2 GLY 52 HA2 GLY 52 -13.262 20.997 -33.515 395 HA3 GLY 52 HA1 GLY 52 -13.623 19.389 -34.130 396 H THR 53 HN THR 53 -11.428 19.252 -32.874 397 HA THR 53 HA THR 53 -9.077 20.251 -33.973 398 HB THR 53 HB THR 53 -9.096 19.265 -31.759 399 HG1 THR 53 HG1 THR 53 -7.074 19.219 -32.615 400 HG21 THR 53 HG21 THR 53 -10.691 17.451 -32.121 401 HG22 THR 53 HG22 THR 53 -9.193 16.837 -31.420 402 HG23 THR 53 HG23 THR 53 -9.520 16.611 -33.138 403 H SER 54 HN SER 54 -8.060 19.897 -35.788 404 HA SER 54 HA SER 54 -8.260 17.310 -37.122 405 HB2 SER 54 HB2 SER 54 -8.761 19.924 -38.570 406 HB3 SER 54 HB1 SER 54 -8.866 18.298 -39.244 407 HG SER 54 HG SER 54 -10.507 19.317 -37.155 408 H PHE 55 HN PHE 55 -6.524 16.925 -38.605 409 HA PHE 55 HA PHE 55 -4.332 18.875 -38.499 410 HB2 PHE 55 HB2 PHE 55 -4.042 15.911 -37.947 411 HB3 PHE 55 HB1 PHE 55 -2.712 17.052 -38.093 412 HD1 PHE 55 HD1 PHE 55 -2.721 19.039 -36.431 413 HD2 PHE 55 HD2 PHE 55 -4.956 15.462 -35.881 414 HE1 PHE 55 HE1 PHE 55 -2.853 19.496 -34.015 415 HE2 PHE 55 HE2 PHE 55 -5.096 15.912 -33.468 416 HZ PHE 55 HZ PHE 55 -4.043 17.932 -32.531 417 H ASP 56 HN ASP 56 -3.131 19.019 -40.334 418 HA ASP 56 HA ASP 56 -3.776 17.152 -42.531 419 HB2 ASP 56 HB2 ASP 56 -3.811 19.981 -42.467 420 HB3 ASP 56 HB1 ASP 56 -2.377 19.541 -43.386 421 H ALA 57 HN ALA 57 -2.180 15.659 -42.671 422 HA ALA 57 HA ALA 57 0.517 16.474 -41.800 423 HB1 ALA 57 HB1 ALA 57 -0.505 14.665 -40.510 424 HB2 ALA 57 HB2 ALA 57 0.941 14.123 -41.362 425 HB3 ALA 57 HB3 ALA 57 -0.656 13.702 -41.980 426 H VAL 58 HN VAL 58 1.949 16.807 -43.335 427 HA VAL 58 HA VAL 58 1.575 15.762 -46.015 428 HB VAL 58 HB VAL 58 3.927 17.327 -44.942 429 HG11 VAL 58 HG11 VAL 58 4.377 16.179 -47.031 430 HG12 VAL 58 HG12 VAL 58 4.286 17.922 -47.291 431 HG13 VAL 58 HG13 VAL 58 2.932 16.889 -47.753 432 HG21 VAL 58 HG21 VAL 58 1.422 18.369 -46.261 433 HG22 VAL 58 HG22 VAL 58 2.851 19.325 -45.873 434 HG23 VAL 58 HG23 VAL 58 1.891 18.609 -44.579 435 H ILE 59 HN ILE 59 2.191 13.740 -46.460 436 HA ILE 59 HA ILE 59 4.278 12.537 -44.803 437 HB ILE 59 HB ILE 59 3.483 10.420 -45.350 438 HG12 ILE 59 HG12 ILE 59 1.689 11.397 -47.549 439 HG13 ILE 59 HG11 ILE 59 3.388 11.075 -47.879 440 HG21 ILE 59 HG21 ILE 59 1.890 11.634 -43.960 441 HG22 ILE 59 HG22 ILE 59 1.068 10.471 -45.002 442 HG23 ILE 59 HG23 ILE 59 1.045 12.187 -45.408 443 HD11 ILE 59 HD11 ILE 59 3.105 8.783 -47.113 444 HD12 ILE 59 HD12 ILE 59 2.007 9.166 -48.441 445 HD13 ILE 59 HD13 ILE 59 1.401 9.101 -46.786 446 H VAL 60 HN VAL 60 6.089 11.649 -45.620 447 HA VAL 60 HA VAL 60 6.559 11.711 -48.512 448 HB VAL 60 HB VAL 60 8.548 12.700 -46.443 449 HG11 VAL 60 HG11 VAL 60 9.634 11.538 -48.274 450 HG12 VAL 60 HG12 VAL 60 9.956 13.270 -48.365 451 HG13 VAL 60 HG13 VAL 60 8.769 12.534 -49.445 452 HG21 VAL 60 HG21 VAL 60 6.803 14.352 -46.823 453 HG22 VAL 60 HG22 VAL 60 7.057 14.241 -48.565 454 HG23 VAL 60 HG23 VAL 60 8.327 14.888 -47.529 455 H SER 61 HN SER 61 6.560 9.499 -48.781 456 HA SER 61 HA SER 61 8.444 7.979 -47.131 457 HB2 SER 61 HB2 SER 61 6.406 7.863 -45.838 458 HB3 SER 61 HB1 SER 61 5.485 7.371 -47.259 459 HG SER 61 HG SER 61 7.078 5.879 -45.581 460 H ASN 62 HN ASN 62 9.101 6.028 -47.922 461 HA ASN 62 HA ASN 62 9.011 5.527 -50.714 462 HB2 ASN 62 HB2 ASN 62 9.951 3.918 -48.343 463 HB3 ASN 62 HB1 ASN 62 9.978 3.254 -49.969 464 HD21 ASN 62 HD21 ASN 62 10.566 6.632 -49.472 465 HD22 ASN 62 HD22 ASN 62 12.261 6.585 -49.794 466 H ASN 63 HN ASN 63 6.867 4.809 -48.169 467 HA ASN 63 HA ASN 63 5.975 2.249 -48.753 468 HB2 ASN 63 HB2 ASN 63 5.416 3.641 -46.726 469 HB3 ASN 63 HB1 ASN 63 4.224 4.478 -47.716 470 HD21 ASN 63 HD21 ASN 63 2.501 3.779 -46.478 471 HD22 ASN 63 HD22 ASN 63 1.950 2.142 -46.495 472 H PHE 64 HN PHE 64 5.146 5.266 -50.356 473 HA PHE 64 HA PHE 64 2.973 3.886 -51.768 474 HB2 PHE 64 HB2 PHE 64 2.422 5.981 -50.535 475 HB3 PHE 64 HB1 PHE 64 3.492 6.859 -51.623 476 HD1 PHE 64 HD2 PHE 64 0.780 4.320 -52.012 477 HD2 PHE 64 HD1 PHE 64 2.373 8.082 -53.210 478 HE1 PHE 64 HE2 PHE 64 -1.071 4.591 -53.608 479 HE2 PHE 64 HE1 PHE 64 0.525 8.356 -54.812 480 HZ PHE 64 HZ PHE 64 -1.200 6.610 -55.013 481 H GLU 65 HN GLU 65 6.172 4.569 -52.288 482 HA GLU 65 HA GLU 65 5.963 5.585 -54.973 483 HB2 GLU 65 HB2 GLU 65 8.363 5.368 -55.111 484 HB3 GLU 65 HB1 GLU 65 7.933 6.085 -53.564 485 HG2 GLU 65 HG2 GLU 65 8.373 4.063 -52.412 486 HG3 GLU 65 HG1 GLU 65 8.520 3.163 -53.920 487 H ASP 66 HN ASP 66 5.250 2.649 -53.751 488 HA ASP 66 HA ASP 66 6.295 1.077 -55.964 489 HB2 ASP 66 HB2 ASP 66 6.154 0.143 -53.642 490 HB3 ASP 66 HB1 ASP 66 4.398 0.213 -53.771 491 H LYS 67 HN LYS 67 3.689 3.050 -55.335 492 HA LYS 67 HA LYS 67 2.036 3.778 -56.698 493 HB2 LYS 67 HB2 LYS 67 2.781 1.520 -58.559 494 HB3 LYS 67 HB1 LYS 67 1.689 2.844 -58.935 495 HG2 LYS 67 HG2 LYS 67 4.622 3.124 -58.302 496 HG3 LYS 67 HG1 LYS 67 3.912 3.155 -59.915 497 HD2 LYS 67 HD2 LYS 67 3.257 5.104 -57.707 498 HD3 LYS 67 HD1 LYS 67 4.405 5.411 -59.011 499 HE2 LYS 67 HE2 LYS 67 2.568 5.066 -60.642 500 HE3 LYS 67 HE1 LYS 67 1.446 4.893 -59.293 501 HZ1 LYS 67 HZ1 LYS 67 3.038 7.307 -59.980 502 HZ2 LYS 67 HZ2 LYS 67 2.096 7.152 -58.580 503 HZ3 LYS 67 HZ3 LYS 67 1.354 7.130 -60.105 504 H LYS 68 HN LYS 68 2.104 0.596 -55.435 505 HA LYS 68 HA LYS 68 -0.574 -0.118 -56.077 506 HB2 LYS 68 HB2 LYS 68 1.232 -1.075 -53.860 507 HB3 LYS 68 HB1 LYS 68 -0.335 -1.776 -54.235 508 HG2 LYS 68 HG2 LYS 68 0.710 -2.014 -56.631 509 HG3 LYS 68 HG1 LYS 68 2.226 -1.937 -55.728 510 HD2 LYS 68 HD2 LYS 68 -0.038 -3.844 -55.178 511 HD3 LYS 68 HD1 LYS 68 1.431 -4.244 -56.064 512 HE2 LYS 68 HE2 LYS 68 1.472 -3.200 -53.243 513 HE3 LYS 68 HE1 LYS 68 1.346 -4.918 -53.612 514 HZ1 LYS 68 HZ1 LYS 68 3.562 -3.132 -54.482 515 HZ2 LYS 68 HZ2 LYS 68 3.442 -4.798 -54.785 516 HZ3 LYS 68 HZ3 LYS 68 3.633 -4.239 -53.196 517 H LEU 69 HN LEU 69 -2.294 0.935 -55.432 518 HA LEU 69 HA LEU 69 -2.183 2.796 -53.268 519 HB2 LEU 69 HB2 LEU 69 -4.514 3.293 -53.826 520 HB3 LEU 69 HB1 LEU 69 -3.467 3.341 -55.227 521 HG LEU 69 HG LEU 69 -4.354 0.855 -55.533 522 HD11 LEU 69 HD11 LEU 69 -6.602 2.219 -54.057 523 HD12 LEU 69 HD12 LEU 69 -5.688 0.820 -53.494 524 HD13 LEU 69 HD13 LEU 69 -6.716 0.687 -54.921 525 HD21 LEU 69 HD21 LEU 69 -4.553 2.650 -57.161 526 HD22 LEU 69 HD22 LEU 69 -5.915 3.327 -56.267 527 HD23 LEU 69 HD23 LEU 69 -6.063 1.747 -57.037 528 H LEU 70 HN LEU 70 -3.360 -0.485 -53.626 529 HA LEU 70 HA LEU 70 -5.132 -0.388 -51.432 530 HB2 LEU 70 HB2 LEU 70 -5.425 -2.706 -51.620 531 HB3 LEU 70 HB1 LEU 70 -5.212 -2.110 -53.242 532 HG LEU 70 HG LEU 70 -4.134 -4.186 -53.160 533 HD11 LEU 70 HD11 LEU 70 -1.954 -2.150 -52.848 534 HD12 LEU 70 HD12 LEU 70 -2.817 -2.542 -54.334 535 HD13 LEU 70 HD13 LEU 70 -1.789 -3.750 -53.562 536 HD21 LEU 70 HD21 LEU 70 -2.743 -3.332 -50.633 537 HD22 LEU 70 HD22 LEU 70 -2.464 -4.843 -51.500 538 HD23 LEU 70 HD23 LEU 70 -4.039 -4.520 -50.774 539 H ASP 71 HN ASP 71 -1.694 -0.886 -51.592 540 HA ASP 71 HA ASP 71 -1.507 -2.037 -48.977 541 HB2 ASP 71 HB2 ASP 71 0.197 -2.142 -51.001 542 HB3 ASP 71 HB1 ASP 71 0.847 -0.697 -50.226 543 H ARG 72 HN ARG 72 -1.180 1.170 -50.374 544 HA ARG 72 HA ARG 72 -0.453 2.525 -48.007 545 HB2 ARG 72 HB2 ARG 72 -0.355 3.505 -50.307 546 HB3 ARG 72 HB1 ARG 72 -2.109 3.567 -50.322 547 HG2 ARG 72 HG2 ARG 72 -0.610 4.943 -48.141 548 HG3 ARG 72 HG1 ARG 72 -0.707 5.683 -49.738 549 HD2 ARG 72 HD2 ARG 72 -3.115 4.786 -48.159 550 HD3 ARG 72 HD1 ARG 72 -2.465 6.424 -48.101 551 HE ARG 72 HE ARG 72 -3.198 5.333 -50.717 552 HH11 ARG 72 HH11 ARG 72 -4.020 7.442 -48.039 553 HH12 ARG 72 HH12 ARG 72 -5.123 8.400 -48.969 554 HH21 ARG 72 HH21 ARG 72 -4.657 6.586 -51.930 555 HH22 ARG 72 HH22 ARG 72 -5.473 7.934 -51.190 556 H HIS 73 HN HIS 73 -3.539 1.694 -49.465 557 HA HIS 73 HA HIS 73 -5.229 3.015 -47.665 558 HB2 HIS 73 HB2 HIS 73 -5.844 2.057 -49.905 559 HB3 HIS 73 HB1 HIS 73 -5.816 0.460 -49.170 560 HD1 HIS 73 HD1 HIS 73 -7.892 3.493 -49.541 561 HD2 HIS 73 HD2 HIS 73 -7.946 -0.031 -47.334 562 HE1 HIS 73 HE1 HIS 73 -10.236 3.288 -48.643 563 HE2 HIS 73 HE2 HIS 73 -10.261 1.118 -47.360 564 H ARG 74 HN ARG 74 -4.119 -0.379 -47.699 565 HA ARG 74 HA ARG 74 -5.573 -1.198 -45.435 566 HB2 ARG 74 HB2 ARG 74 -4.175 -3.173 -45.426 567 HB3 ARG 74 HB1 ARG 74 -4.567 -2.751 -47.087 568 HG2 ARG 74 HG2 ARG 74 -2.316 -1.561 -47.139 569 HG3 ARG 74 HG1 ARG 74 -1.963 -2.422 -45.642 570 HD2 ARG 74 HD2 ARG 74 -2.776 -3.748 -48.219 571 HD3 ARG 74 HD1 ARG 74 -1.108 -3.531 -47.700 572 HE ARG 74 HE ARG 74 -2.848 -4.944 -45.843 573 HH11 ARG 74 HH11 ARG 74 -0.388 -5.072 -48.338 574 HH12 ARG 74 HH12 ARG 74 -0.034 -6.756 -48.084 575 HH21 ARG 74 HH21 ARG 74 -2.350 -7.160 -45.473 576 HH22 ARG 74 HH22 ARG 74 -1.149 -7.944 -46.462 577 H LEU 75 HN LEU 75 -2.321 0.178 -45.735 578 HA LEU 75 HA LEU 75 -1.601 -0.185 -43.018 579 HB2 LEU 75 HB2 LEU 75 -0.548 1.333 -45.323 580 HB3 LEU 75 HB1 LEU 75 -0.136 1.976 -43.747 581 HG LEU 75 HG LEU 75 1.634 0.533 -44.565 582 HD11 LEU 75 HD11 LEU 75 1.257 0.609 -42.168 583 HD12 LEU 75 HD12 LEU 75 1.813 -0.991 -42.663 584 HD13 LEU 75 HD13 LEU 75 0.109 -0.725 -42.292 585 HD21 LEU 75 HD21 LEU 75 1.285 -1.860 -44.898 586 HD22 LEU 75 HD22 LEU 75 0.319 -0.907 -46.026 587 HD23 LEU 75 HD23 LEU 75 -0.444 -1.650 -44.619 588 H VAL 76 HN VAL 76 -2.783 2.671 -44.784 589 HA VAL 76 HA VAL 76 -2.871 4.387 -42.580 590 HB VAL 76 HB VAL 76 -4.488 4.422 -45.135 591 HG11 VAL 76 HG11 VAL 76 -5.029 6.754 -44.614 592 HG12 VAL 76 HG12 VAL 76 -4.266 6.576 -43.033 593 HG13 VAL 76 HG13 VAL 76 -5.713 5.647 -43.424 594 HG21 VAL 76 HG21 VAL 76 -2.936 6.212 -45.766 595 HG22 VAL 76 HG22 VAL 76 -2.090 4.701 -45.429 596 HG23 VAL 76 HG23 VAL 76 -2.080 6.001 -44.238 597 H ASN 77 HN ASN 77 -5.441 2.339 -43.957 598 HA ASN 77 HA ASN 77 -7.482 3.243 -42.262 599 HB2 ASN 77 HB2 ASN 77 -7.086 0.723 -43.842 600 HB3 ASN 77 HB1 ASN 77 -8.455 0.867 -42.746 601 HD21 ASN 77 HD21 ASN 77 -7.136 3.604 -44.453 602 HD22 ASN 77 HD22 ASN 77 -8.476 3.834 -45.520 603 H THR 78 HN THR 78 -5.245 0.505 -41.871 604 HA THR 78 HA THR 78 -6.524 -0.587 -39.627 605 HB THR 78 HB THR 78 -3.620 -0.850 -40.418 606 HG1 THR 78 HG1 THR 78 -4.702 -1.682 -42.101 607 HG21 THR 78 HG21 THR 78 -3.705 -2.971 -39.185 608 HG22 THR 78 HG22 THR 78 -5.361 -2.619 -38.690 609 HG23 THR 78 HG23 THR 78 -4.036 -1.604 -38.121 610 H ILE 79 HN ILE 79 -3.588 1.496 -39.722 611 HA ILE 79 HA ILE 79 -3.562 1.536 -36.815 612 HB ILE 79 HB ILE 79 -1.717 2.965 -38.744 613 HG12 ILE 79 HG12 ILE 79 -0.163 1.062 -37.702 614 HG13 ILE 79 HG11 ILE 79 -1.705 0.223 -37.575 615 HG21 ILE 79 HG21 ILE 79 -1.445 2.440 -35.789 616 HG22 ILE 79 HG22 ILE 79 -1.736 4.004 -36.549 617 HG23 ILE 79 HG23 ILE 79 -0.210 3.162 -36.821 618 HD11 ILE 79 HD11 ILE 79 -2.049 0.483 -39.968 619 HD12 ILE 79 HD12 ILE 79 -0.531 -0.349 -39.624 620 HD13 ILE 79 HD13 ILE 79 -0.519 1.354 -40.096 621 H LEU 80 HN LEU 80 -3.951 3.896 -39.449 622 HA LEU 80 HA LEU 80 -4.288 6.086 -37.684 623 HB2 LEU 80 HB2 LEU 80 -4.867 5.753 -40.614 624 HB3 LEU 80 HB1 LEU 80 -5.243 7.235 -39.757 625 HG LEU 80 HG LEU 80 -2.806 7.383 -39.128 626 HD11 LEU 80 HD11 LEU 80 -2.194 5.049 -39.461 627 HD12 LEU 80 HD12 LEU 80 -1.204 6.114 -40.460 628 HD13 LEU 80 HD13 LEU 80 -2.525 5.201 -41.188 629 HD21 LEU 80 HD21 LEU 80 -3.751 8.727 -40.915 630 HD22 LEU 80 HD22 LEU 80 -3.490 7.412 -42.061 631 HD23 LEU 80 HD23 LEU 80 -2.111 8.219 -41.318 632 H LYS 81 HN LYS 81 -6.395 3.566 -38.625 633 HA LYS 81 HA LYS 81 -8.898 4.613 -38.101 634 HB2 LYS 81 HB2 LYS 81 -8.706 2.283 -38.592 635 HB3 LYS 81 HB1 LYS 81 -7.618 2.015 -37.240 636 HG2 LYS 81 HG2 LYS 81 -9.821 1.107 -36.795 637 HG3 LYS 81 HG1 LYS 81 -9.439 2.420 -35.679 638 HD2 LYS 81 HD2 LYS 81 -10.754 3.954 -37.105 639 HD3 LYS 81 HD1 LYS 81 -11.199 2.581 -38.121 640 HE2 LYS 81 HE2 LYS 81 -11.781 2.824 -35.174 641 HE3 LYS 81 HE1 LYS 81 -12.926 3.163 -36.464 642 HZ1 LYS 81 HZ1 LYS 81 -12.535 0.801 -37.207 643 HZ2 LYS 81 HZ2 LYS 81 -13.369 0.985 -35.744 644 HZ3 LYS 81 HZ3 LYS 81 -11.729 0.554 -35.734 645 H GLU 82 HN GLU 82 -6.627 3.314 -35.715 646 HA GLU 82 HA GLU 82 -7.990 4.176 -33.441 647 HB2 GLU 82 HB2 GLU 82 -5.001 3.796 -33.707 648 HB3 GLU 82 HB1 GLU 82 -5.938 3.738 -32.222 649 HG2 GLU 82 HG2 GLU 82 -7.058 1.729 -32.972 650 HG3 GLU 82 HG1 GLU 82 -6.197 1.803 -34.510 651 H GLU 83 HN GLU 83 -5.474 5.738 -35.399 652 HA GLU 83 HA GLU 83 -4.999 8.083 -33.970 653 HB2 GLU 83 HB2 GLU 83 -5.398 7.575 -36.897 654 HB3 GLU 83 HB1 GLU 83 -5.078 9.187 -36.300 655 HG2 GLU 83 HG2 GLU 83 -3.252 7.681 -37.208 656 HG3 GLU 83 HG1 GLU 83 -2.915 8.743 -35.848 657 H LEU 84 HN LEU 84 -7.374 7.573 -36.447 658 HA LEU 84 HA LEU 84 -8.858 9.873 -36.326 659 HB2 LEU 84 HB2 LEU 84 -9.987 7.111 -36.755 660 HB3 LEU 84 HB1 LEU 84 -10.790 8.610 -37.174 661 HG LEU 84 HG LEU 84 -8.305 7.461 -38.421 662 HD11 LEU 84 HD11 LEU 84 -10.384 6.467 -39.179 663 HD12 LEU 84 HD12 LEU 84 -9.668 7.458 -40.451 664 HD13 LEU 84 HD13 LEU 84 -11.040 8.068 -39.525 665 HD21 LEU 84 HD21 LEU 84 -9.615 10.121 -38.965 666 HD22 LEU 84 HD22 LEU 84 -8.283 9.414 -39.878 667 HD23 LEU 84 HD23 LEU 84 -8.048 9.879 -38.191 668 H GLN 85 HN GLN 85 -9.035 7.235 -33.989 669 HA GLN 85 HA GLN 85 -11.523 7.908 -32.838 670 HB2 GLN 85 HB2 GLN 85 -9.185 6.810 -31.282 671 HB3 GLN 85 HB1 GLN 85 -10.895 6.615 -30.935 672 HG2 GLN 85 HG2 GLN 85 -9.305 5.349 -33.131 673 HG3 GLN 85 HG1 GLN 85 -10.083 4.555 -31.768 674 HE21 GLN 85 HE21 GLN 85 -10.425 5.814 -34.921 675 HE22 GLN 85 HE22 GLN 85 -12.056 5.328 -35.182 676 H ASN 86 HN ASN 86 -8.415 9.382 -32.637 677 HA ASN 86 HA ASN 86 -9.138 10.911 -30.243 678 HB2 ASN 86 HB2 ASN 86 -6.508 10.732 -31.729 679 HB3 ASN 86 HB1 ASN 86 -6.777 11.629 -30.238 680 HD21 ASN 86 HD21 ASN 86 -6.339 8.512 -31.672 681 HD22 ASN 86 HD22 ASN 86 -6.176 7.629 -30.196 682 H ILE 87 HN ILE 87 -8.598 11.242 -33.662 683 HA ILE 87 HA ILE 87 -8.657 14.168 -33.530 684 HB ILE 87 HB ILE 87 -8.532 12.613 -36.099 685 HG12 ILE 87 HG12 ILE 87 -6.218 13.052 -34.199 686 HG13 ILE 87 HG11 ILE 87 -6.880 11.507 -34.719 687 HG21 ILE 87 HG21 ILE 87 -7.309 15.221 -35.198 688 HG22 ILE 87 HG22 ILE 87 -8.711 15.024 -36.252 689 HG23 ILE 87 HG23 ILE 87 -7.118 14.505 -36.799 690 HD11 ILE 87 HD11 ILE 87 -6.130 11.938 -36.988 691 HD12 ILE 87 HD12 ILE 87 -4.791 12.005 -35.841 692 HD13 ILE 87 HD13 ILE 87 -5.479 13.497 -36.480 693 H HIS 88 HN HIS 88 -10.164 15.271 -35.177 694 HA HIS 88 HA HIS 88 -12.705 13.834 -35.342 695 HB2 HIS 88 HB2 HIS 88 -12.768 16.197 -34.614 696 HB3 HIS 88 HB1 HIS 88 -12.051 16.682 -36.148 697 HD1 HIS 88 HD1 HIS 88 -15.171 14.923 -34.881 698 HD2 HIS 88 HD2 HIS 88 -13.889 17.261 -38.076 699 HE1 HIS 88 HE1 HIS 88 -17.224 15.361 -36.272 700 HE2 HIS 88 HE2 HIS 88 -16.455 16.905 -38.115 701 H ALA 89 HN ALA 89 -10.642 15.732 -37.533 702 HA ALA 89 HA ALA 89 -11.178 13.744 -39.625 703 HB1 ALA 89 HB1 ALA 89 -12.632 15.672 -40.038 704 HB2 ALA 89 HB2 ALA 89 -11.398 15.520 -41.290 705 HB3 ALA 89 HB3 ALA 89 -11.226 16.738 -40.026 706 H PHE 90 HN PHE 90 -9.250 12.841 -39.997 707 HA PHE 90 HA PHE 90 -6.854 14.503 -39.856 708 HB2 PHE 90 HB2 PHE 90 -6.789 12.357 -38.677 709 HB3 PHE 90 HB1 PHE 90 -7.145 11.509 -40.176 710 HD1 PHE 90 HD1 PHE 90 -4.634 13.678 -38.529 711 HD2 PHE 90 HD2 PHE 90 -5.425 10.863 -41.619 712 HE1 PHE 90 HE1 PHE 90 -2.226 13.533 -39.008 713 HE2 PHE 90 HE2 PHE 90 -3.018 10.714 -42.103 714 HZ PHE 90 HZ PHE 90 -1.417 12.049 -40.797 715 H SER 91 HN SER 91 -6.006 15.351 -41.594 716 HA SER 91 HA SER 91 -6.656 14.185 -44.214 717 HB2 SER 91 HB2 SER 91 -7.509 16.458 -43.964 718 HB3 SER 91 HB1 SER 91 -5.917 17.028 -43.467 719 HG SER 91 HG SER 91 -5.228 16.971 -45.473 720 H MET 92 HN MET 92 -4.937 14.093 -45.774 721 HA MET 92 HA MET 92 -2.244 14.344 -44.675 722 HB2 MET 92 HB2 MET 92 -1.595 12.119 -45.291 723 HB3 MET 92 HB1 MET 92 -3.028 12.000 -44.283 724 HG2 MET 92 HG2 MET 92 -3.038 11.847 -47.290 725 HG3 MET 92 HG1 MET 92 -3.009 10.451 -46.216 726 HE1 MET 92 HE1 MET 92 -6.487 10.716 -44.440 727 HE2 MET 92 HE2 MET 92 -4.938 11.339 -43.872 728 HE3 MET 92 HE3 MET 92 -5.022 9.752 -44.638 729 H LYS 93 HN LYS 93 -0.678 14.777 -46.161 730 HA LYS 93 HA LYS 93 -1.540 15.091 -48.964 731 HB2 LYS 93 HB2 LYS 93 1.024 16.154 -47.777 732 HB3 LYS 93 HB1 LYS 93 0.222 16.663 -49.252 733 HG2 LYS 93 HG2 LYS 93 -0.746 17.172 -46.447 734 HG3 LYS 93 HG1 LYS 93 0.039 18.342 -47.506 735 HD2 LYS 93 HD2 LYS 93 -1.869 17.948 -49.125 736 HD3 LYS 93 HD1 LYS 93 -2.671 17.072 -47.818 737 HE2 LYS 93 HE2 LYS 93 -2.332 19.141 -46.402 738 HE3 LYS 93 HE1 LYS 93 -1.861 19.971 -47.883 739 HZ1 LYS 93 HZ1 LYS 93 -4.490 18.832 -47.175 740 HZ2 LYS 93 HZ2 LYS 93 -4.083 19.164 -48.782 741 HZ3 LYS 93 HZ3 LYS 93 -4.121 20.419 -47.639 742 H CYS 94 HN CYS 94 -0.963 13.383 -50.220 743 HA CYS 94 HA CYS 94 1.077 11.572 -49.260 744 HB2 CYS 94 HB2 CYS 94 0.432 10.277 -51.361 745 HB3 CYS 94 HB1 CYS 94 -0.822 10.484 -50.143 746 HG CYS 94 HG CYS 94 -0.698 11.594 -53.302 747 H HIS 95 HN HIS 95 3.138 12.062 -49.583 748 HA HIS 95 HA HIS 95 3.953 12.772 -52.314 749 HB2 HIS 95 HB2 HIS 95 4.798 14.179 -49.782 750 HB3 HIS 95 HB1 HIS 95 5.727 14.279 -51.274 751 HD1 HIS 95 HD1 HIS 95 4.673 15.599 -53.243 752 HD2 HIS 95 HD2 HIS 95 2.443 15.681 -49.735 753 HE1 HIS 95 HE1 HIS 95 2.990 17.444 -53.552 754 HE2 HIS 95 HE2 HIS 95 1.488 17.283 -51.535 755 H THR 96 HN THR 96 6.222 12.372 -52.752 756 HA THR 96 HA THR 96 7.302 10.175 -51.123 757 HB THR 96 HB THR 96 8.359 9.524 -53.446 758 HG1 THR 96 HG1 THR 96 7.640 10.920 -54.897 759 HG21 THR 96 HG21 THR 96 5.459 9.009 -52.774 760 HG22 THR 96 HG22 THR 96 6.843 8.107 -52.155 761 HG23 THR 96 HG23 THR 96 6.446 8.045 -53.872 762 HA PRO 97 HA PRO 97 10.959 12.248 -50.300 763 HB2 PRO 97 HB2 PRO 97 12.955 10.506 -51.119 764 HB3 PRO 97 HB1 PRO 97 12.077 10.416 -49.591 765 HG2 PRO 97 HG2 PRO 97 11.631 8.906 -52.127 766 HG3 PRO 97 HG1 PRO 97 11.519 8.343 -50.449 767 HD2 PRO 97 HD2 PRO 97 9.328 8.885 -51.889 768 HD3 PRO 97 HD1 PRO 97 9.407 9.257 -50.154 769 H LEU 98 HN LEU 98 11.476 10.705 -53.494 770 HA LEU 98 HA LEU 98 13.569 12.420 -54.246 771 HB2 LEU 98 HB2 LEU 98 11.726 10.642 -55.810 772 HB3 LEU 98 HB1 LEU 98 12.903 11.652 -56.622 773 HG LEU 98 HG LEU 98 13.798 9.439 -56.413 774 HD11 LEU 98 HD11 LEU 98 15.855 9.874 -55.166 775 HD12 LEU 98 HD12 LEU 98 15.103 11.287 -54.427 776 HD13 LEU 98 HD13 LEU 98 15.387 11.249 -56.167 777 HD21 LEU 98 HD21 LEU 98 14.165 8.360 -54.250 778 HD22 LEU 98 HD22 LEU 98 12.450 8.633 -54.558 779 HD23 LEU 98 HD23 LEU 98 13.325 9.687 -53.447 780 H GLU 99 HN GLU 99 10.117 12.515 -55.042 781 HA GLU 99 HA GLU 99 10.290 14.817 -56.678 782 HB2 GLU 99 HB2 GLU 99 7.945 13.596 -55.213 783 HB3 GLU 99 HB1 GLU 99 7.806 14.918 -56.361 784 HG2 GLU 99 HG2 GLU 99 7.232 12.989 -57.552 785 HG3 GLU 99 HG1 GLU 99 8.868 13.385 -58.064 786 H TYR 100 HN TYR 100 9.538 14.348 -53.252 787 HA TYR 100 HA TYR 100 8.684 16.983 -52.741 788 HB2 TYR 100 HB2 TYR 100 8.188 15.108 -51.233 789 HB3 TYR 100 HB1 TYR 100 9.895 14.987 -50.818 790 HD1 TYR 100 HD1 TYR 100 6.981 17.289 -50.673 791 HD2 TYR 100 HD2 TYR 100 10.785 16.268 -49.067 792 HE1 TYR 100 HE1 TYR 100 6.652 18.928 -48.871 793 HE2 TYR 100 HE2 TYR 100 10.468 17.904 -47.259 794 HH TYR 100 HH TYR 100 7.443 19.390 -46.640 795 H ASP 101 HN ASP 101 11.875 15.523 -52.781 796 HA ASP 101 HA ASP 101 13.237 17.556 -51.390 797 HB2 ASP 101 HB2 ASP 101 14.275 15.390 -51.806 798 HB3 ASP 101 HB1 ASP 101 14.270 15.698 -53.541 799 H LYS 102 HN LYS 102 12.235 17.285 -54.738 800 HA LYS 102 HA LYS 102 13.795 19.526 -55.613 801 HB2 LYS 102 HB2 LYS 102 11.792 17.727 -56.851 802 HB3 LYS 102 HB1 LYS 102 11.929 19.333 -57.547 803 HG2 LYS 102 HG2 LYS 102 13.443 18.244 -58.836 804 HG3 LYS 102 HG1 LYS 102 14.505 18.744 -57.522 805 HD2 LYS 102 HD2 LYS 102 13.139 16.061 -57.580 806 HD3 LYS 102 HD1 LYS 102 14.712 16.341 -58.319 807 HE2 LYS 102 HE2 LYS 102 14.050 16.814 -55.417 808 HE3 LYS 102 HE1 LYS 102 14.852 15.378 -56.048 809 HZ1 LYS 102 HZ1 LYS 102 16.417 16.981 -55.125 810 HZ2 LYS 102 HZ2 LYS 102 15.906 18.153 -56.240 811 HZ3 LYS 102 HZ3 LYS 102 16.685 16.750 -56.787 812 H LEU 103 HN LEU 103 10.754 19.120 -54.063 813 HA LEU 103 HA LEU 103 9.684 21.684 -54.758 814 HB2 LEU 103 HB2 LEU 103 9.033 19.909 -52.402 815 HB3 LEU 103 HB1 LEU 103 8.079 21.270 -52.957 816 HG LEU 103 HG LEU 103 8.557 18.728 -54.516 817 HD11 LEU 103 HD11 LEU 103 6.199 18.269 -54.068 818 HD12 LEU 103 HD12 LEU 103 6.108 19.713 -53.060 819 HD13 LEU 103 HD13 LEU 103 7.132 18.361 -52.575 820 HD21 LEU 103 HD21 LEU 103 8.261 20.671 -55.963 821 HD22 LEU 103 HD22 LEU 103 6.785 21.099 -55.099 822 HD23 LEU 103 HD23 LEU 103 6.857 19.607 -56.038 823 H LYS 104 HN LYS 104 11.202 20.354 -51.822 824 HA LYS 104 HA LYS 104 11.405 22.853 -50.484 825 HB2 LYS 104 HB2 LYS 104 13.099 21.593 -49.041 826 HB3 LYS 104 HB1 LYS 104 11.455 20.973 -49.078 827 HG2 LYS 104 HG2 LYS 104 12.045 19.076 -50.179 828 HG3 LYS 104 HG1 LYS 104 13.380 19.853 -51.031 829 HD2 LYS 104 HD2 LYS 104 13.448 19.317 -48.070 830 HD3 LYS 104 HD1 LYS 104 14.003 18.137 -49.261 831 HE2 LYS 104 HE2 LYS 104 15.580 19.814 -50.146 832 HE3 LYS 104 HE1 LYS 104 15.053 20.944 -48.901 833 HZ1 LYS 104 HZ1 LYS 104 16.275 18.297 -48.332 834 HZ2 LYS 104 HZ2 LYS 104 15.923 19.521 -47.214 835 HZ3 LYS 104 HZ3 LYS 104 17.137 19.756 -48.374 836 H SER 105 HN SER 105 13.082 21.638 -53.095 837 HA SER 105 HA SER 105 15.695 22.519 -52.764 838 HB2 SER 105 HB2 SER 105 14.958 21.154 -54.657 839 HB3 SER 105 HB1 SER 105 13.985 22.488 -55.264 840 HG SER 105 HG SER 105 16.746 22.870 -54.853 841 H LYS 106 HN LYS 106 12.778 24.315 -53.539 842 HA LYS 106 HA LYS 106 14.307 26.783 -53.144 843 HB2 LYS 106 HB2 LYS 106 12.904 27.919 -54.861 844 HB3 LYS 106 HB1 LYS 106 14.003 26.723 -55.515 845 HG2 LYS 106 HG2 LYS 106 11.152 26.023 -54.947 846 HG3 LYS 106 HG1 LYS 106 11.596 26.872 -56.424 847 HD2 LYS 106 HD2 LYS 106 12.673 24.200 -55.520 848 HD3 LYS 106 HD1 LYS 106 11.480 24.461 -56.794 849 HE2 LYS 106 HE2 LYS 106 13.167 25.802 -58.027 850 HE3 LYS 106 HE1 LYS 106 14.350 25.391 -56.786 851 HZ1 LYS 106 HZ1 LYS 106 12.986 23.536 -58.661 852 HZ2 LYS 106 HZ2 LYS 106 13.919 23.018 -57.347 853 HZ3 LYS 106 HZ3 LYS 106 14.643 23.902 -58.592 854 H GLY 107 HN GLY 107 11.101 25.315 -53.287 855 HA2 GLY 107 HA2 GLY 107 10.139 25.822 -50.849 856 HA3 GLY 107 HA1 GLY 107 9.968 27.398 -51.614 857 H SER 108 HN SER 108 9.316 26.642 -54.181 858 HA SER 108 HA SER 108 7.084 24.805 -54.078 859 HB2 SER 108 HB2 SER 108 6.150 27.021 -53.355 860 HB3 SER 108 HB1 SER 108 6.656 27.692 -54.903 861 HG SER 108 HG SER 108 4.657 25.769 -54.356 Start of MODEL 11 1 H1 MET 1 HT1 MET 1 -4.016 29.396 -30.642 2 H2 MET 1 HT2 MET 1 -4.031 28.060 -31.686 3 H3 MET 1 HT3 MET 1 -5.242 28.232 -30.513 4 HA MET 1 HA MET 1 -6.034 28.804 -32.726 5 HB2 MET 1 HB2 MET 1 -5.823 31.113 -30.780 6 HB3 MET 1 HB1 MET 1 -6.911 31.076 -32.161 7 HG2 MET 1 HG2 MET 1 -8.002 29.083 -31.209 8 HG3 MET 1 HG1 MET 1 -6.951 29.211 -29.799 9 HE1 MET 1 HE1 MET 1 -10.096 29.073 -29.543 10 HE2 MET 1 HE2 MET 1 -10.396 30.339 -28.351 11 HE3 MET 1 HE3 MET 1 -9.017 29.256 -28.161 12 H GLY 2 HN GLY 2 -6.150 30.855 -34.175 13 HA2 GLY 2 HA2 GLY 2 -4.462 32.714 -34.836 14 HA3 GLY 2 HA1 GLY 2 -3.406 31.331 -35.101 15 H SER 3 HN SER 3 -3.491 32.458 -37.323 16 HA SER 3 HA SER 3 -5.800 32.006 -38.927 17 HB2 SER 3 HB2 SER 3 -2.916 32.484 -39.713 18 HB3 SER 3 HB1 SER 3 -4.278 32.492 -40.832 19 HG SER 3 HG SER 3 -5.160 34.230 -39.634 20 H SER 4 HN SER 4 -2.661 30.354 -38.722 21 HA SER 4 HA SER 4 -3.693 27.760 -38.821 22 HB2 SER 4 HB2 SER 4 -4.271 28.297 -41.159 23 HB3 SER 4 HB1 SER 4 -2.595 28.739 -41.476 24 HG SER 4 HG SER 4 -3.540 26.163 -40.702 25 H HIS 5 HN HIS 5 -2.204 26.887 -37.543 26 HA HIS 5 HA HIS 5 0.521 27.832 -37.585 27 HB2 HIS 5 HB2 HIS 5 -0.899 25.747 -35.948 28 HB3 HIS 5 HB1 HIS 5 0.845 25.968 -35.857 29 HD1 HIS 5 HD1 HIS 5 1.721 28.112 -34.721 30 HD2 HIS 5 HD2 HIS 5 -2.427 27.781 -34.775 31 HE1 HIS 5 HE1 HIS 5 0.880 29.852 -33.112 32 HE2 HIS 5 HE2 HIS 5 -1.634 29.743 -33.289 33 H HIS 6 HN HIS 6 1.451 27.310 -39.486 34 HA HIS 6 HA HIS 6 1.506 24.557 -40.408 35 HB2 HIS 6 HB2 HIS 6 3.130 26.908 -41.415 36 HB3 HIS 6 HB1 HIS 6 2.859 25.379 -42.240 37 HD1 HIS 6 HD1 HIS 6 1.455 28.739 -41.771 38 HD2 HIS 6 HD2 HIS 6 0.197 25.081 -43.287 39 HE1 HIS 6 HE1 HIS 6 -0.612 29.238 -43.113 40 HE2 HIS 6 HE2 HIS 6 -1.261 27.033 -44.152 41 H HIS 7 HN HIS 7 2.789 23.175 -39.287 42 HA HIS 7 HA HIS 7 5.438 24.190 -38.565 43 HB2 HIS 7 HB2 HIS 7 5.402 22.782 -36.511 44 HB3 HIS 7 HB1 HIS 7 4.266 24.118 -36.492 45 HD1 HIS 7 HD1 HIS 7 1.756 23.531 -36.396 46 HD2 HIS 7 HD2 HIS 7 4.263 20.224 -36.458 47 HE1 HIS 7 HE1 HIS 7 0.320 21.585 -35.720 48 HE2 HIS 7 HE2 HIS 7 1.940 19.664 -35.494 49 H HIS 8 HN HIS 8 6.492 23.337 -40.242 50 HA HIS 8 HA HIS 8 6.251 20.501 -40.825 51 HB2 HIS 8 HB2 HIS 8 7.899 20.946 -42.630 52 HB3 HIS 8 HB1 HIS 8 6.468 21.961 -42.744 53 HD1 HIS 8 HD1 HIS 8 10.152 22.118 -41.975 54 HD2 HIS 8 HD2 HIS 8 6.925 24.681 -42.540 55 HE1 HIS 8 HE1 HIS 8 11.138 24.424 -42.194 56 HE2 HIS 8 HE2 HIS 8 9.182 25.915 -42.750 57 H HIS 9 HN HIS 9 7.883 18.993 -40.579 58 HA HIS 9 HA HIS 9 10.378 19.685 -39.351 59 HB2 HIS 9 HB2 HIS 9 9.976 18.279 -37.301 60 HB3 HIS 9 HB1 HIS 9 9.092 19.797 -37.332 61 HD1 HIS 9 HD1 HIS 9 6.508 19.656 -37.623 62 HD2 HIS 9 HD2 HIS 9 8.403 15.980 -37.239 63 HE1 HIS 9 HE1 HIS 9 4.681 18.005 -37.150 64 HE2 HIS 9 HE2 HIS 9 5.883 15.865 -36.612 65 H HIS 10 HN HIS 10 11.459 17.496 -38.599 66 HA HIS 10 HA HIS 10 11.354 15.783 -40.929 67 HB2 HIS 10 HB2 HIS 10 13.079 15.576 -38.442 68 HB3 HIS 10 HB1 HIS 10 13.291 14.646 -39.920 69 HD1 HIS 10 HD1 HIS 10 13.651 16.349 -42.141 70 HD2 HIS 10 HD2 HIS 10 14.687 17.736 -38.354 71 HE1 HIS 10 HE1 HIS 10 15.239 18.262 -42.527 72 HE2 HIS 10 HE2 HIS 10 15.683 19.217 -40.235 73 H SER 11 HN SER 11 11.093 13.452 -40.759 74 HA SER 11 HA SER 11 8.715 12.812 -39.418 75 HB2 SER 11 HB2 SER 11 9.331 10.436 -40.138 76 HB3 SER 11 HB1 SER 11 9.179 11.642 -41.415 77 HG SER 11 HG SER 11 11.075 10.319 -41.596 78 H SER 12 HN SER 12 8.269 11.768 -37.552 79 HA SER 12 HA SER 12 10.250 11.696 -35.524 80 HB2 SER 12 HB2 SER 12 7.473 10.487 -35.502 81 HB3 SER 12 HB1 SER 12 8.471 10.851 -34.092 82 HG SER 12 HG SER 12 6.755 12.436 -34.924 83 H GLY 13 HN GLY 13 11.868 10.313 -36.127 84 HA2 GLY 13 HA2 GLY 13 11.197 7.462 -35.834 85 HA3 GLY 13 HA1 GLY 13 12.236 7.989 -37.154 86 H ARG 14 HN ARG 14 12.077 9.051 -33.798 87 HA ARG 14 HA ARG 14 14.845 8.135 -33.439 88 HB2 ARG 14 HB2 ARG 14 15.207 10.256 -32.084 89 HB3 ARG 14 HB1 ARG 14 15.122 10.439 -33.828 90 HG2 ARG 14 HG2 ARG 14 12.804 11.196 -33.638 91 HG3 ARG 14 HG1 ARG 14 12.894 11.015 -31.884 92 HD2 ARG 14 HD2 ARG 14 14.677 12.818 -33.516 93 HD3 ARG 14 HD1 ARG 14 13.225 13.351 -32.671 94 HE ARG 14 HE ARG 14 14.357 12.602 -30.587 95 HH11 ARG 14 HH11 ARG 14 16.271 13.348 -33.432 96 HH12 ARG 14 HH12 ARG 14 17.672 13.825 -32.523 97 HH21 ARG 14 HH21 ARG 14 16.205 13.207 -29.389 98 HH22 ARG 14 HH22 ARG 14 17.627 13.759 -30.210 99 H GLU 15 HN GLU 15 11.881 9.222 -31.812 100 HA GLU 15 HA GLU 15 12.703 7.709 -29.438 101 HB2 GLU 15 HB2 GLU 15 10.860 8.927 -28.301 102 HB3 GLU 15 HB1 GLU 15 12.092 9.992 -28.960 103 HG2 GLU 15 HG2 GLU 15 10.566 10.229 -30.983 104 HG3 GLU 15 HG1 GLU 15 9.321 9.486 -29.980 105 H ASN 16 HN ASN 16 11.209 7.165 -32.193 106 HA ASN 16 HA ASN 16 8.760 5.991 -31.653 107 HB2 ASN 16 HB2 ASN 16 8.935 4.896 -33.784 108 HB3 ASN 16 HB1 ASN 16 9.626 6.505 -33.920 109 HD21 ASN 16 HD21 ASN 16 12.157 5.708 -32.633 110 HD22 ASN 16 HD22 ASN 16 13.010 4.789 -33.823 111 H LEU 17 HN LEU 17 11.733 4.902 -30.512 112 HA LEU 17 HA LEU 17 11.020 2.102 -30.437 113 HB2 LEU 17 HB2 LEU 17 13.215 3.626 -29.031 114 HB3 LEU 17 HB1 LEU 17 12.981 1.896 -28.894 115 HG LEU 17 HG LEU 17 13.211 1.984 -31.522 116 HD11 LEU 17 HD11 LEU 17 14.823 3.679 -32.230 117 HD12 LEU 17 HD12 LEU 17 14.733 4.430 -30.638 118 HD13 LEU 17 HD13 LEU 17 13.313 4.410 -31.683 119 HD21 LEU 17 HD21 LEU 17 15.611 1.565 -31.250 120 HD22 LEU 17 HD22 LEU 17 14.654 0.736 -30.023 121 HD23 LEU 17 HD23 LEU 17 15.531 2.210 -29.610 122 H TYR 18 HN TYR 18 10.150 4.860 -28.740 123 HA TYR 18 HA TYR 18 9.386 3.277 -26.375 124 HB2 TYR 18 HB2 TYR 18 10.133 6.207 -26.342 125 HB3 TYR 18 HB1 TYR 18 9.841 5.162 -24.955 126 HD1 TYR 18 HD1 TYR 18 11.499 3.352 -24.423 127 HD2 TYR 18 HD2 TYR 18 12.264 6.338 -27.354 128 HE1 TYR 18 HE1 TYR 18 13.900 2.821 -24.330 129 HE2 TYR 18 HE2 TYR 18 14.664 5.817 -27.269 130 HH TYR 18 HH TYR 18 16.272 4.822 -25.656 131 H PHE 19 HN PHE 19 7.282 2.934 -26.846 132 HA PHE 19 HA PHE 19 5.631 4.882 -28.129 133 HB2 PHE 19 HB2 PHE 19 3.810 3.245 -27.765 134 HB3 PHE 19 HB1 PHE 19 5.230 2.519 -28.507 135 HD1 PHE 19 HD1 PHE 19 6.748 1.114 -27.112 136 HD2 PHE 19 HD2 PHE 19 2.981 2.490 -25.698 137 HE1 PHE 19 HE1 PHE 19 6.786 -0.607 -25.355 138 HE2 PHE 19 HE2 PHE 19 3.013 0.779 -23.932 139 HZ PHE 19 HZ PHE 19 4.917 -0.775 -23.760 140 H GLN 20 HN GLN 20 6.822 5.047 -25.203 141 HA GLN 20 HA GLN 20 4.418 5.785 -23.750 142 HB2 GLN 20 HB2 GLN 20 6.072 6.304 -21.903 143 HB3 GLN 20 HB1 GLN 20 5.985 4.629 -22.414 144 HG2 GLN 20 HG2 GLN 20 8.262 5.077 -22.112 145 HG3 GLN 20 HG1 GLN 20 8.014 5.090 -23.852 146 HE21 GLN 20 HE21 GLN 20 8.286 7.004 -24.992 147 HE22 GLN 20 HE22 GLN 20 8.982 8.415 -24.281 148 H GLY 21 HN GLY 21 5.612 7.266 -26.146 149 HA2 GLY 21 HA2 GLY 21 6.590 9.760 -25.135 150 HA3 GLY 21 HA1 GLY 21 6.172 9.402 -26.802 151 H HIS 22 HN HIS 22 4.558 9.839 -23.662 152 HA HIS 22 HA HIS 22 2.203 10.915 -24.960 153 HB2 HIS 22 HB2 HIS 22 1.271 11.097 -22.690 154 HB3 HIS 22 HB1 HIS 22 1.902 9.487 -23.002 155 HD1 HIS 22 HD1 HIS 22 2.370 12.476 -20.842 156 HD2 HIS 22 HD2 HIS 22 4.149 8.770 -21.445 157 HE1 HIS 22 HE1 HIS 22 3.887 12.125 -18.871 158 HE2 HIS 22 HE2 HIS 22 4.716 9.761 -19.123 159 H MET 23 HN MET 23 4.750 12.276 -25.210 160 HA MET 23 HA MET 23 4.999 14.629 -23.760 161 HB2 MET 23 HB2 MET 23 6.692 13.859 -25.318 162 HB3 MET 23 HB1 MET 23 5.581 14.031 -26.666 163 HG2 MET 23 HG2 MET 23 5.554 16.465 -26.301 164 HG3 MET 23 HG1 MET 23 6.736 16.260 -25.008 165 HE1 MET 23 HE1 MET 23 9.224 15.477 -25.364 166 HE2 MET 23 HE2 MET 23 9.871 14.932 -26.912 167 HE3 MET 23 HE3 MET 23 8.626 13.988 -26.095 168 H CYS 24 HN CYS 24 2.984 13.859 -26.527 169 HA CYS 24 HA CYS 24 1.069 15.862 -25.852 170 HB2 CYS 24 HB2 CYS 24 2.665 17.300 -27.041 171 HB3 CYS 24 HB1 CYS 24 2.665 16.195 -28.410 172 HG CYS 24 HG CYS 24 0.065 18.164 -27.372 173 H ILE 25 HN ILE 25 -0.909 15.439 -26.865 174 HA ILE 25 HA ILE 25 -1.400 12.844 -27.716 175 HB ILE 25 HB ILE 25 -3.185 14.235 -26.869 176 HG12 ILE 25 HG12 ILE 25 -4.931 13.778 -28.585 177 HG13 ILE 25 HG11 ILE 25 -3.656 13.388 -29.735 178 HG21 ILE 25 HG21 ILE 25 -2.884 15.869 -29.382 179 HG22 ILE 25 HG22 ILE 25 -2.513 16.388 -27.738 180 HG23 ILE 25 HG23 ILE 25 -4.179 16.042 -28.200 181 HD11 ILE 25 HD11 ILE 25 -4.615 11.377 -28.797 182 HD12 ILE 25 HD12 ILE 25 -4.237 11.933 -27.166 183 HD13 ILE 25 HD13 ILE 25 -2.934 11.549 -28.290 184 H GLN 26 HN GLN 26 -0.851 15.764 -29.673 185 HA GLN 26 HA GLN 26 -1.245 14.512 -32.180 186 HB2 GLN 26 HB2 GLN 26 -1.323 16.948 -31.898 187 HB3 GLN 26 HB1 GLN 26 0.385 16.963 -31.482 188 HG2 GLN 26 HG2 GLN 26 0.992 16.268 -33.690 189 HG3 GLN 26 HG1 GLN 26 -0.699 16.026 -34.126 190 HE21 GLN 26 HE21 GLN 26 -0.573 17.447 -35.832 191 HE22 GLN 26 HE22 GLN 26 -0.492 19.157 -35.610 192 H LYS 27 HN LYS 27 1.533 14.906 -30.084 193 HA LYS 27 HA LYS 27 3.543 14.078 -31.863 194 HB2 LYS 27 HB2 LYS 27 3.965 15.170 -29.677 195 HB3 LYS 27 HB1 LYS 27 3.435 13.708 -28.861 196 HG2 LYS 27 HG2 LYS 27 5.820 13.757 -28.865 197 HG3 LYS 27 HG1 LYS 27 5.292 12.483 -29.967 198 HD2 LYS 27 HD2 LYS 27 5.629 14.010 -31.867 199 HD3 LYS 27 HD1 LYS 27 6.186 15.259 -30.751 200 HE2 LYS 27 HE2 LYS 27 7.483 12.583 -31.248 201 HE3 LYS 27 HE1 LYS 27 8.077 14.152 -31.788 202 HZ1 LYS 27 HZ1 LYS 27 8.251 14.784 -29.408 203 HZ2 LYS 27 HZ2 LYS 27 9.273 13.503 -29.844 204 HZ3 LYS 27 HZ3 LYS 27 7.852 13.191 -28.988 205 H VAL 28 HN VAL 28 1.402 12.284 -29.708 206 HA VAL 28 HA VAL 28 2.521 9.734 -30.028 207 HB VAL 28 HB VAL 28 -0.385 10.447 -29.569 208 HG11 VAL 28 HG11 VAL 28 -0.577 8.201 -28.604 209 HG12 VAL 28 HG12 VAL 28 1.094 7.866 -29.058 210 HG13 VAL 28 HG13 VAL 28 -0.120 8.141 -30.307 211 HG21 VAL 28 HG21 VAL 28 1.811 9.847 -27.586 212 HG22 VAL 28 HG22 VAL 28 0.111 10.113 -27.194 213 HG23 VAL 28 HG23 VAL 28 1.074 11.424 -27.878 214 H ILE 29 HN ILE 29 -0.134 11.334 -31.783 215 HA ILE 29 HA ILE 29 -0.683 9.295 -33.607 216 HB ILE 29 HB ILE 29 -1.073 12.271 -33.698 217 HG12 ILE 29 HG12 ILE 29 -3.461 11.624 -33.849 218 HG13 ILE 29 HG11 ILE 29 -2.991 9.931 -33.819 219 HG21 ILE 29 HG21 ILE 29 -0.494 11.710 -35.986 220 HG22 ILE 29 HG22 ILE 29 -2.211 12.089 -35.863 221 HG23 ILE 29 HG23 ILE 29 -1.687 10.410 -35.992 222 HD11 ILE 29 HD11 ILE 29 -3.796 10.640 -31.657 223 HD12 ILE 29 HD12 ILE 29 -2.594 11.930 -31.604 224 HD13 ILE 29 HD13 ILE 29 -2.080 10.243 -31.566 225 H GLU 30 HN GLU 30 1.562 12.045 -33.907 226 HA GLU 30 HA GLU 30 2.363 11.566 -36.534 227 HB2 GLU 30 HB2 GLU 30 3.840 12.872 -34.256 228 HB3 GLU 30 HB1 GLU 30 4.430 12.853 -35.910 229 HG2 GLU 30 HG2 GLU 30 2.290 13.974 -36.579 230 HG3 GLU 30 HG1 GLU 30 1.947 14.175 -34.860 231 H ASP 31 HN ASP 31 3.933 10.506 -33.506 232 HA ASP 31 HA ASP 31 6.088 9.254 -34.888 233 HB2 ASP 31 HB2 ASP 31 6.201 10.101 -32.528 234 HB3 ASP 31 HB1 ASP 31 5.196 8.738 -32.047 235 H LYS 32 HN LYS 32 2.984 8.164 -33.688 236 HA LYS 32 HA LYS 32 3.432 5.399 -33.782 237 HB2 LYS 32 HB2 LYS 32 1.489 6.556 -32.705 238 HB3 LYS 32 HB1 LYS 32 0.825 6.826 -34.310 239 HG2 LYS 32 HG2 LYS 32 0.737 4.394 -34.661 240 HG3 LYS 32 HG1 LYS 32 1.342 4.154 -33.019 241 HD2 LYS 32 HD2 LYS 32 -1.239 5.508 -33.805 242 HD3 LYS 32 HD1 LYS 32 -1.074 3.915 -33.062 243 HE2 LYS 32 HE2 LYS 32 -0.178 4.901 -31.051 244 HE3 LYS 32 HE1 LYS 32 -0.173 6.500 -31.795 245 HZ1 LYS 32 HZ1 LYS 32 -2.608 4.875 -31.305 246 HZ2 LYS 32 HZ2 LYS 32 -2.558 6.470 -31.893 247 HZ3 LYS 32 HZ3 LYS 32 -2.075 6.129 -30.300 248 H LEU 33 HN LEU 33 2.045 7.592 -36.236 249 HA LEU 33 HA LEU 33 1.829 5.496 -38.167 250 HB2 LEU 33 HB2 LEU 33 1.268 7.273 -39.770 251 HB3 LEU 33 HB1 LEU 33 0.303 7.343 -38.312 252 HG LEU 33 HG LEU 33 2.066 9.145 -37.576 253 HD11 LEU 33 HD11 LEU 33 3.574 8.848 -39.464 254 HD12 LEU 33 HD12 LEU 33 2.890 10.474 -39.450 255 HD13 LEU 33 HD13 LEU 33 2.275 9.267 -40.580 256 HD21 LEU 33 HD21 LEU 33 -0.065 9.684 -39.638 257 HD22 LEU 33 HD22 LEU 33 0.639 10.874 -38.543 258 HD23 LEU 33 HD23 LEU 33 -0.314 9.538 -37.900 259 H SER 34 HN SER 34 4.320 7.717 -37.244 260 HA SER 34 HA SER 34 5.884 7.442 -39.614 261 HB2 SER 34 HB2 SER 34 6.654 8.325 -36.823 262 HB3 SER 34 HB1 SER 34 7.718 8.413 -38.229 263 HG SER 34 HG SER 34 5.360 9.855 -37.674 264 H SER 35 HN SER 35 5.710 5.730 -36.542 265 HA SER 35 HA SER 35 7.956 4.068 -36.953 266 HB2 SER 35 HB2 SER 35 5.440 3.619 -35.329 267 HB3 SER 35 HB1 SER 35 6.879 2.605 -35.240 268 HG SER 35 HG SER 35 6.580 5.320 -34.481 269 H ALA 36 HN ALA 36 4.727 4.009 -38.198 270 HA ALA 36 HA ALA 36 4.890 1.219 -38.997 271 HB1 ALA 36 HB1 ALA 36 2.787 2.106 -38.114 272 HB2 ALA 36 HB2 ALA 36 2.603 1.503 -39.761 273 HB3 ALA 36 HB3 ALA 36 2.703 3.238 -39.463 274 H LEU 37 HN LEU 37 4.418 4.358 -40.639 275 HA LEU 37 HA LEU 37 4.758 3.099 -43.227 276 HB2 LEU 37 HB2 LEU 37 4.428 6.015 -42.517 277 HB3 LEU 37 HB1 LEU 37 4.324 5.330 -44.127 278 HG LEU 37 HG LEU 37 2.423 4.730 -41.860 279 HD11 LEU 37 HD11 LEU 37 2.202 7.021 -42.670 280 HD12 LEU 37 HD12 LEU 37 0.813 6.043 -43.143 281 HD13 LEU 37 HD13 LEU 37 2.063 6.429 -44.325 282 HD21 LEU 37 HD21 LEU 37 1.083 3.624 -43.580 283 HD22 LEU 37 HD22 LEU 37 2.661 2.858 -43.404 284 HD23 LEU 37 HD23 LEU 37 2.350 3.931 -44.768 285 H LYS 38 HN LYS 38 6.615 4.954 -40.987 286 HA LYS 38 HA LYS 38 8.700 5.811 -40.941 287 HB2 LYS 38 HB2 LYS 38 8.950 3.223 -41.740 288 HB3 LYS 38 HB1 LYS 38 9.774 4.057 -43.051 289 HG2 LYS 38 HG2 LYS 38 11.400 3.479 -41.406 290 HG3 LYS 38 HG1 LYS 38 11.162 5.228 -41.344 291 HD2 LYS 38 HD2 LYS 38 9.592 4.890 -39.444 292 HD3 LYS 38 HD1 LYS 38 9.987 3.172 -39.471 293 HE2 LYS 38 HE2 LYS 38 11.869 5.458 -38.902 294 HE3 LYS 38 HE1 LYS 38 11.273 4.265 -37.750 295 HZ1 LYS 38 HZ1 LYS 38 13.364 3.487 -38.292 296 HZ2 LYS 38 HZ2 LYS 38 13.232 3.921 -39.925 297 HZ3 LYS 38 HZ3 LYS 38 12.375 2.583 -39.334 298 HA PRO 39 HA PRO 39 8.359 8.276 -44.779 299 HB2 PRO 39 HB2 PRO 39 7.620 10.606 -43.674 300 HB3 PRO 39 HB1 PRO 39 6.453 9.319 -43.998 301 HG2 PRO 39 HG2 PRO 39 7.638 10.198 -41.425 302 HG3 PRO 39 HG1 PRO 39 6.044 9.498 -41.753 303 HD2 PRO 39 HD2 PRO 39 8.321 8.146 -40.757 304 HD3 PRO 39 HD1 PRO 39 6.803 7.413 -41.307 305 H THR 40 HN THR 40 9.503 10.343 -45.331 306 HA THR 40 HA THR 40 11.957 10.642 -43.736 307 HB THR 40 HB THR 40 12.797 11.834 -45.840 308 HG1 THR 40 HG1 THR 40 11.433 10.680 -47.673 309 HG21 THR 40 HG21 THR 40 13.521 9.584 -45.213 310 HG22 THR 40 HG22 THR 40 13.346 9.723 -46.962 311 HG23 THR 40 HG23 THR 40 12.108 8.896 -46.015 312 H PHE 41 HN PHE 41 9.163 12.277 -44.992 313 HA PHE 41 HA PHE 41 9.859 14.602 -43.347 314 HB2 PHE 41 HB2 PHE 41 10.369 15.204 -45.679 315 HB3 PHE 41 HB1 PHE 41 8.736 14.756 -46.158 316 HD1 PHE 41 HD1 PHE 41 10.611 17.080 -43.948 317 HD2 PHE 41 HD2 PHE 41 7.036 16.337 -46.137 318 HE1 PHE 41 HE1 PHE 41 9.856 19.376 -43.484 319 HE2 PHE 41 HE2 PHE 41 6.274 18.630 -45.677 320 HZ PHE 41 HZ PHE 41 7.683 20.152 -44.349 321 H LEU 42 HN LEU 42 8.169 15.456 -42.222 322 HA LEU 42 HA LEU 42 5.466 14.515 -42.803 323 HB2 LEU 42 HB2 LEU 42 6.482 12.932 -41.177 324 HB3 LEU 42 HB1 LEU 42 6.743 14.271 -40.076 325 HG LEU 42 HG LEU 42 4.289 14.624 -39.980 326 HD11 LEU 42 HD11 LEU 42 4.189 12.071 -41.582 327 HD12 LEU 42 HD12 LEU 42 3.694 13.668 -42.141 328 HD13 LEU 42 HD13 LEU 42 2.807 12.876 -40.839 329 HD21 LEU 42 HD21 LEU 42 5.430 13.308 -38.274 330 HD22 LEU 42 HD22 LEU 42 5.226 11.852 -39.248 331 HD23 LEU 42 HD23 LEU 42 3.814 12.675 -38.587 332 H GLU 43 HN GLU 43 4.272 16.290 -42.940 333 HA GLU 43 HA GLU 43 4.758 18.441 -40.988 334 HB2 GLU 43 HB2 GLU 43 5.535 19.238 -43.132 335 HB3 GLU 43 HB1 GLU 43 4.044 18.728 -43.913 336 HG2 GLU 43 HG2 GLU 43 2.804 20.368 -42.553 337 HG3 GLU 43 HG1 GLU 43 4.330 20.908 -41.855 338 H LEU 44 HN LEU 44 3.105 18.282 -39.595 339 HA LEU 44 HA LEU 44 0.414 17.881 -40.650 340 HB2 LEU 44 HB2 LEU 44 1.542 17.892 -37.865 341 HB3 LEU 44 HB1 LEU 44 -0.182 18.044 -38.139 342 HG LEU 44 HG LEU 44 -0.042 15.865 -39.434 343 HD11 LEU 44 HD11 LEU 44 2.638 15.715 -38.074 344 HD12 LEU 44 HD12 LEU 44 2.359 15.840 -39.810 345 HD13 LEU 44 HD13 LEU 44 1.836 14.401 -38.935 346 HD21 LEU 44 HD21 LEU 44 -0.993 16.005 -37.206 347 HD22 LEU 44 HD22 LEU 44 0.613 15.842 -36.494 348 HD23 LEU 44 HD23 LEU 44 -0.088 14.503 -37.404 349 H VAL 45 HN VAL 45 -0.879 19.514 -41.064 350 HA VAL 45 HA VAL 45 -0.008 22.188 -40.231 351 HB VAL 45 HB VAL 45 -1.872 21.347 -42.462 352 HG11 VAL 45 HG11 VAL 45 -1.793 23.685 -43.175 353 HG12 VAL 45 HG12 VAL 45 -0.832 24.087 -41.752 354 HG13 VAL 45 HG13 VAL 45 -2.493 23.526 -41.564 355 HG21 VAL 45 HG21 VAL 45 0.443 20.765 -42.917 356 HG22 VAL 45 HG22 VAL 45 0.949 22.413 -42.541 357 HG23 VAL 45 HG23 VAL 45 -0.071 22.101 -43.946 358 H ASP 46 HN ASP 46 -1.198 23.387 -38.917 359 HA ASP 46 HA ASP 46 -3.506 22.433 -37.614 360 HB2 ASP 46 HB2 ASP 46 -2.273 24.020 -36.416 361 HB3 ASP 46 HB1 ASP 46 -2.137 25.099 -37.797 362 H LYS 47 HN LYS 47 -5.376 22.120 -38.518 363 HA LYS 47 HA LYS 47 -6.176 23.820 -40.784 364 HB2 LYS 47 HB2 LYS 47 -5.670 21.342 -41.177 365 HB3 LYS 47 HB1 LYS 47 -7.116 21.001 -40.239 366 HG2 LYS 47 HG2 LYS 47 -8.473 22.205 -41.857 367 HG3 LYS 47 HG1 LYS 47 -7.027 22.609 -42.785 368 HD2 LYS 47 HD2 LYS 47 -6.608 20.153 -43.038 369 HD3 LYS 47 HD1 LYS 47 -8.186 19.868 -42.300 370 HE2 LYS 47 HE2 LYS 47 -9.279 21.072 -44.087 371 HE3 LYS 47 HE1 LYS 47 -7.722 21.504 -44.789 372 HZ1 LYS 47 HZ1 LYS 47 -8.532 19.701 -46.030 373 HZ2 LYS 47 HZ2 LYS 47 -8.968 18.815 -44.650 374 HZ3 LYS 47 HZ3 LYS 47 -7.327 19.044 -45.031 375 H SER 48 HN SER 48 -6.683 24.782 -38.312 376 HA SER 48 HA SER 48 -9.188 24.042 -37.240 377 HB2 SER 48 HB2 SER 48 -7.643 26.638 -37.040 378 HB3 SER 48 HB1 SER 48 -9.086 26.268 -36.099 379 HG SER 48 HG SER 48 -6.584 24.896 -36.049 380 H CYS 49 HN CYS 49 -10.528 23.838 -39.094 381 HA CYS 49 HA CYS 49 -11.192 26.156 -40.665 382 HB2 CYS 49 HB2 CYS 49 -11.263 23.765 -41.500 383 HB3 CYS 49 HB1 CYS 49 -12.689 23.531 -40.494 384 HG CYS 49 HG CYS 49 -14.157 25.558 -41.855 385 H GLY 50 HN GLY 50 -12.020 27.732 -39.374 386 HA2 GLY 50 HA2 GLY 50 -13.581 28.848 -38.102 387 HA3 GLY 50 HA1 GLY 50 -14.666 27.482 -38.344 388 H CYS 51 HN CYS 51 -15.175 26.365 -36.602 389 HA CYS 51 HA CYS 51 -13.355 26.480 -34.291 390 HB2 CYS 51 HB2 CYS 51 -16.357 26.089 -34.301 391 HB3 CYS 51 HB1 CYS 51 -15.331 26.143 -32.871 392 HG CYS 51 HG CYS 51 -14.592 28.813 -33.212 393 H GLY 52 HN GLY 52 -12.208 24.640 -34.273 394 HA2 GLY 52 HA2 GLY 52 -13.134 22.212 -33.504 395 HA3 GLY 52 HA1 GLY 52 -13.314 22.158 -35.252 396 H THR 53 HN THR 53 -11.484 20.861 -33.134 397 HA THR 53 HA THR 53 -8.848 21.651 -34.018 398 HB THR 53 HB THR 53 -9.588 19.244 -32.345 399 HG1 THR 53 HG1 THR 53 -10.129 20.632 -30.844 400 HG21 THR 53 HG21 THR 53 -7.058 20.888 -32.534 401 HG22 THR 53 HG22 THR 53 -7.290 19.270 -33.194 402 HG23 THR 53 HG23 THR 53 -7.319 19.522 -31.449 403 H SER 54 HN SER 54 -8.554 21.160 -36.142 404 HA SER 54 HA SER 54 -8.565 18.311 -36.826 405 HB2 SER 54 HB2 SER 54 -9.249 19.239 -39.208 406 HB3 SER 54 HB1 SER 54 -10.472 18.884 -37.990 407 HG SER 54 HG SER 54 -9.392 21.415 -38.700 408 H PHE 55 HN PHE 55 -7.029 17.702 -38.447 409 HA PHE 55 HA PHE 55 -4.984 19.731 -39.012 410 HB2 PHE 55 HB2 PHE 55 -4.481 16.992 -37.836 411 HB3 PHE 55 HB1 PHE 55 -3.221 18.025 -38.498 412 HD1 PHE 55 HD1 PHE 55 -2.836 20.281 -37.427 413 HD2 PHE 55 HD2 PHE 55 -5.202 17.237 -35.628 414 HE1 PHE 55 HE1 PHE 55 -2.582 21.382 -35.241 415 HE2 PHE 55 HE2 PHE 55 -4.957 18.333 -33.439 416 HZ PHE 55 HZ PHE 55 -3.646 20.408 -33.242 417 H ASP 56 HN ASP 56 -3.906 19.513 -40.907 418 HA ASP 56 HA ASP 56 -4.638 17.237 -42.641 419 HB2 ASP 56 HB2 ASP 56 -5.326 19.686 -43.271 420 HB3 ASP 56 HB1 ASP 56 -3.625 19.874 -43.683 421 H ALA 57 HN ALA 57 -2.963 15.862 -42.882 422 HA ALA 57 HA ALA 57 -0.272 16.913 -42.292 423 HB1 ALA 57 HB1 ALA 57 -1.310 14.111 -41.920 424 HB2 ALA 57 HB2 ALA 57 -1.141 15.322 -40.651 425 HB3 ALA 57 HB3 ALA 57 0.291 14.701 -41.474 426 H VAL 58 HN VAL 58 1.187 16.889 -43.813 427 HA VAL 58 HA VAL 58 0.775 15.308 -46.235 428 HB VAL 58 HB VAL 58 2.957 17.309 -45.611 429 HG11 VAL 58 HG11 VAL 58 3.334 17.322 -48.027 430 HG12 VAL 58 HG12 VAL 58 2.099 16.081 -48.228 431 HG13 VAL 58 HG13 VAL 58 3.583 15.714 -47.349 432 HG21 VAL 58 HG21 VAL 58 1.688 18.860 -47.035 433 HG22 VAL 58 HG22 VAL 58 0.784 18.394 -45.593 434 HG23 VAL 58 HG23 VAL 58 0.391 17.669 -47.153 435 H ILE 59 HN ILE 59 1.672 13.365 -46.417 436 HA ILE 59 HA ILE 59 3.958 12.708 -44.686 437 HB ILE 59 HB ILE 59 2.083 11.361 -44.087 438 HG12 ILE 59 HG12 ILE 59 4.438 10.266 -44.548 439 HG13 ILE 59 HG11 ILE 59 3.060 9.283 -44.082 440 HG21 ILE 59 HG21 ILE 59 1.814 10.621 -46.989 441 HG22 ILE 59 HG22 ILE 59 0.721 11.641 -46.054 442 HG23 ILE 59 HG23 ILE 59 0.879 9.929 -45.665 443 HD11 ILE 59 HD11 ILE 59 4.308 8.229 -45.865 444 HD12 ILE 59 HD12 ILE 59 4.116 9.659 -46.880 445 HD13 ILE 59 HD13 ILE 59 2.706 8.693 -46.441 446 H VAL 60 HN VAL 60 5.829 12.452 -45.631 447 HA VAL 60 HA VAL 60 5.923 11.721 -48.489 448 HB VAL 60 HB VAL 60 7.944 13.280 -46.859 449 HG11 VAL 60 HG11 VAL 60 7.940 12.585 -49.791 450 HG12 VAL 60 HG12 VAL 60 9.029 11.935 -48.565 451 HG13 VAL 60 HG13 VAL 60 9.097 13.645 -48.986 452 HG21 VAL 60 HG21 VAL 60 5.955 14.591 -47.336 453 HG22 VAL 60 HG22 VAL 60 6.078 14.185 -49.048 454 HG23 VAL 60 HG23 VAL 60 7.323 15.175 -48.284 455 H SER 61 HN SER 61 6.389 9.599 -48.663 456 HA SER 61 HA SER 61 8.613 8.476 -47.161 457 HB2 SER 61 HB2 SER 61 6.837 8.104 -45.579 458 HB3 SER 61 HB1 SER 61 5.772 7.485 -46.840 459 HG SER 61 HG SER 61 7.617 6.168 -45.362 460 H ASN 62 HN ASN 62 9.359 6.468 -47.948 461 HA ASN 62 HA ASN 62 8.996 5.962 -50.724 462 HB2 ASN 62 HB2 ASN 62 10.384 4.483 -48.510 463 HB3 ASN 62 HB1 ASN 62 10.167 3.718 -50.078 464 HD21 ASN 62 HD21 ASN 62 10.771 7.128 -49.490 465 HD22 ASN 62 HD22 ASN 62 12.331 7.171 -50.242 466 H ASN 63 HN ASN 63 7.260 5.046 -47.944 467 HA ASN 63 HA ASN 63 6.339 2.505 -48.515 468 HB2 ASN 63 HB2 ASN 63 5.935 3.801 -46.412 469 HB3 ASN 63 HB1 ASN 63 4.702 4.721 -47.266 470 HD21 ASN 63 HD21 ASN 63 2.754 3.751 -47.759 471 HD22 ASN 63 HD22 ASN 63 2.270 2.227 -47.105 472 H PHE 64 HN PHE 64 5.527 5.472 -50.132 473 HA PHE 64 HA PHE 64 3.199 4.208 -51.386 474 HB2 PHE 64 HB2 PHE 64 2.896 6.431 -50.303 475 HB3 PHE 64 HB1 PHE 64 4.034 7.114 -51.456 476 HD1 PHE 64 HD2 PHE 64 0.862 5.161 -51.368 477 HD2 PHE 64 HD1 PHE 64 3.211 8.086 -53.378 478 HE1 PHE 64 HE2 PHE 64 -0.985 5.552 -52.944 479 HE2 PHE 64 HE1 PHE 64 1.367 8.484 -54.960 480 HZ PHE 64 HZ PHE 64 -0.734 7.215 -54.746 481 H GLU 65 HN GLU 65 6.458 4.658 -52.036 482 HA GLU 65 HA GLU 65 6.259 5.549 -54.760 483 HB2 GLU 65 HB2 GLU 65 8.628 5.243 -54.914 484 HB3 GLU 65 HB1 GLU 65 8.280 5.923 -53.334 485 HG2 GLU 65 HG2 GLU 65 9.671 4.339 -52.595 486 HG3 GLU 65 HG1 GLU 65 8.275 3.277 -52.762 487 H ASP 66 HN ASP 66 5.721 2.596 -53.254 488 HA ASP 66 HA ASP 66 6.663 0.884 -55.357 489 HB2 ASP 66 HB2 ASP 66 6.406 0.334 -52.846 490 HB3 ASP 66 HB1 ASP 66 4.702 0.094 -53.212 491 H LYS 67 HN LYS 67 4.175 2.980 -55.218 492 HA LYS 67 HA LYS 67 2.449 3.426 -56.623 493 HB2 LYS 67 HB2 LYS 67 3.902 2.368 -58.364 494 HB3 LYS 67 HB1 LYS 67 3.121 0.831 -58.027 495 HG2 LYS 67 HG2 LYS 67 0.954 1.842 -58.693 496 HG3 LYS 67 HG1 LYS 67 1.826 3.309 -59.145 497 HD2 LYS 67 HD2 LYS 67 3.103 2.083 -60.795 498 HD3 LYS 67 HD1 LYS 67 2.343 0.569 -60.299 499 HE2 LYS 67 HE2 LYS 67 0.152 1.493 -60.975 500 HE3 LYS 67 HE1 LYS 67 0.968 2.947 -61.545 501 HZ1 LYS 67 HZ1 LYS 67 1.473 0.206 -62.577 502 HZ2 LYS 67 HZ2 LYS 67 2.156 1.643 -63.167 503 HZ3 LYS 67 HZ3 LYS 67 0.495 1.363 -63.334 504 H LYS 68 HN LYS 68 2.537 1.056 -54.436 505 HA LYS 68 HA LYS 68 0.026 -0.239 -54.984 506 HB2 LYS 68 HB2 LYS 68 1.707 -0.225 -52.469 507 HB3 LYS 68 HB1 LYS 68 0.355 -1.301 -52.793 508 HG2 LYS 68 HG2 LYS 68 2.803 -1.199 -54.529 509 HG3 LYS 68 HG1 LYS 68 2.663 -2.258 -53.125 510 HD2 LYS 68 HD2 LYS 68 0.639 -2.249 -55.350 511 HD3 LYS 68 HD1 LYS 68 2.081 -3.267 -55.382 512 HE2 LYS 68 HE2 LYS 68 0.022 -3.272 -53.180 513 HE3 LYS 68 HE1 LYS 68 0.062 -4.423 -54.514 514 HZ1 LYS 68 HZ1 LYS 68 2.274 -4.040 -52.560 515 HZ2 LYS 68 HZ2 LYS 68 2.190 -5.218 -53.775 516 HZ3 LYS 68 HZ3 LYS 68 1.106 -5.269 -52.469 517 H LEU 69 HN LEU 69 -1.449 1.447 -55.130 518 HA LEU 69 HA LEU 69 -1.762 3.422 -53.107 519 HB2 LEU 69 HB2 LEU 69 -2.499 3.565 -55.532 520 HB3 LEU 69 HB1 LEU 69 -3.837 2.520 -55.108 521 HG LEU 69 HG LEU 69 -3.399 5.172 -53.741 522 HD11 LEU 69 HD11 LEU 69 -5.027 4.610 -56.216 523 HD12 LEU 69 HD12 LEU 69 -3.560 5.585 -56.138 524 HD13 LEU 69 HD13 LEU 69 -5.022 6.121 -55.308 525 HD21 LEU 69 HD21 LEU 69 -5.833 3.422 -54.109 526 HD22 LEU 69 HD22 LEU 69 -5.811 4.993 -53.306 527 HD23 LEU 69 HD23 LEU 69 -4.919 3.637 -52.615 528 H LEU 70 HN LEU 70 -3.545 0.471 -53.928 529 HA LEU 70 HA LEU 70 -5.403 0.622 -51.845 530 HB2 LEU 70 HB2 LEU 70 -5.960 -1.663 -52.303 531 HB3 LEU 70 HB1 LEU 70 -5.737 -0.787 -53.795 532 HG LEU 70 HG LEU 70 -4.874 -2.934 -54.168 533 HD11 LEU 70 HD11 LEU 70 -2.500 -1.195 -53.568 534 HD12 LEU 70 HD12 LEU 70 -3.422 -1.238 -55.071 535 HD13 LEU 70 HD13 LEU 70 -2.491 -2.649 -54.566 536 HD21 LEU 70 HD21 LEU 70 -4.751 -3.744 -51.909 537 HD22 LEU 70 HD22 LEU 70 -3.351 -2.724 -51.583 538 HD23 LEU 70 HD23 LEU 70 -3.226 -4.051 -52.740 539 H ASP 71 HN ASP 71 -2.130 -0.622 -51.860 540 HA ASP 71 HA ASP 71 -2.380 -1.927 -49.324 541 HB2 ASP 71 HB2 ASP 71 -0.660 -2.571 -50.998 542 HB3 ASP 71 HB1 ASP 71 0.143 -1.026 -50.728 543 H ARG 72 HN ARG 72 -0.923 1.130 -50.405 544 HA ARG 72 HA ARG 72 -0.188 2.104 -47.890 545 HB2 ARG 72 HB2 ARG 72 0.394 3.047 -50.185 546 HB3 ARG 72 HB1 ARG 72 -1.194 3.797 -50.184 547 HG2 ARG 72 HG2 ARG 72 0.321 4.383 -47.770 548 HG3 ARG 72 HG1 ARG 72 1.143 4.905 -49.239 549 HD2 ARG 72 HD2 ARG 72 -0.182 6.733 -48.538 550 HD3 ARG 72 HD1 ARG 72 -1.021 6.016 -49.911 551 HE ARG 72 HE ARG 72 -1.952 4.946 -47.445 552 HH11 ARG 72 HH11 ARG 72 -2.208 7.762 -49.527 553 HH12 ARG 72 HH12 ARG 72 -3.789 8.189 -48.956 554 HH21 ARG 72 HH21 ARG 72 -4.016 5.507 -46.704 555 HH22 ARG 72 HH22 ARG 72 -4.828 6.911 -47.332 556 H HIS 73 HN HIS 73 -3.227 2.157 -49.622 557 HA HIS 73 HA HIS 73 -4.655 3.878 -47.912 558 HB2 HIS 73 HB2 HIS 73 -5.397 3.244 -50.189 559 HB3 HIS 73 HB1 HIS 73 -5.697 1.605 -49.626 560 HD1 HIS 73 HD1 HIS 73 -7.110 5.063 -49.569 561 HD2 HIS 73 HD2 HIS 73 -8.050 1.272 -48.129 562 HE1 HIS 73 HE1 HIS 73 -9.509 5.190 -48.817 563 HE2 HIS 73 HE2 HIS 73 -10.110 2.835 -48.149 564 H ARG 74 HN ARG 74 -4.552 0.302 -48.026 565 HA ARG 74 HA ARG 74 -6.310 -0.032 -45.842 566 HB2 ARG 74 HB2 ARG 74 -5.530 -2.392 -45.834 567 HB3 ARG 74 HB1 ARG 74 -6.051 -1.821 -47.412 568 HG2 ARG 74 HG2 ARG 74 -3.703 -1.490 -48.049 569 HG3 ARG 74 HG1 ARG 74 -3.205 -2.120 -46.477 570 HD2 ARG 74 HD2 ARG 74 -4.879 -3.636 -48.468 571 HD3 ARG 74 HD1 ARG 74 -3.125 -3.783 -48.334 572 HE ARG 74 HE ARG 74 -3.879 -4.304 -45.821 573 HH11 ARG 74 HH11 ARG 74 -5.155 -5.504 -48.854 574 HH12 ARG 74 HH12 ARG 74 -5.563 -7.069 -48.207 575 HH21 ARG 74 HH21 ARG 74 -4.411 -6.342 -44.971 576 HH22 ARG 74 HH22 ARG 74 -5.133 -7.550 -45.992 577 H LEU 75 HN LEU 75 -2.758 0.048 -45.997 578 HA LEU 75 HA LEU 75 -2.276 -0.762 -43.356 579 HB2 LEU 75 HB2 LEU 75 -0.689 1.091 -45.130 580 HB3 LEU 75 HB1 LEU 75 -0.119 0.498 -43.583 581 HG LEU 75 HG LEU 75 -0.702 -1.151 -46.040 582 HD11 LEU 75 HD11 LEU 75 1.386 0.096 -46.138 583 HD12 LEU 75 HD12 LEU 75 1.693 -1.632 -45.955 584 HD13 LEU 75 HD13 LEU 75 1.860 -0.554 -44.569 585 HD21 LEU 75 HD21 LEU 75 -1.371 -2.358 -44.031 586 HD22 LEU 75 HD22 LEU 75 0.204 -2.038 -43.304 587 HD23 LEU 75 HD23 LEU 75 0.086 -3.061 -44.734 588 H VAL 76 HN VAL 76 -2.501 2.528 -44.685 589 HA VAL 76 HA VAL 76 -2.274 3.873 -42.235 590 HB VAL 76 HB VAL 76 -3.641 4.742 -44.793 591 HG11 VAL 76 HG11 VAL 76 -2.846 6.414 -42.410 592 HG12 VAL 76 HG12 VAL 76 -4.496 6.037 -42.904 593 HG13 VAL 76 HG13 VAL 76 -3.469 7.029 -43.940 594 HG21 VAL 76 HG21 VAL 76 -1.585 6.022 -45.160 595 HG22 VAL 76 HG22 VAL 76 -1.257 4.293 -45.034 596 HG23 VAL 76 HG23 VAL 76 -0.909 5.359 -43.673 597 H ASN 77 HN ASN 77 -5.110 2.696 -43.999 598 HA ASN 77 HA ASN 77 -7.045 3.890 -42.331 599 HB2 ASN 77 HB2 ASN 77 -7.085 1.689 -44.344 600 HB3 ASN 77 HB1 ASN 77 -8.472 1.877 -43.278 601 HD21 ASN 77 HD21 ASN 77 -6.556 4.602 -44.316 602 HD22 ASN 77 HD22 ASN 77 -7.752 5.291 -45.357 603 H THR 78 HN THR 78 -5.330 0.815 -42.082 604 HA THR 78 HA THR 78 -7.127 -0.296 -40.158 605 HB THR 78 HB THR 78 -4.278 -1.085 -40.798 606 HG1 THR 78 HG1 THR 78 -5.603 -1.325 -42.606 607 HG21 THR 78 HG21 THR 78 -4.998 -1.950 -38.625 608 HG22 THR 78 HG22 THR 78 -4.873 -3.250 -39.809 609 HG23 THR 78 HG23 THR 78 -6.455 -2.612 -39.363 610 H ILE 79 HN ILE 79 -3.985 1.329 -39.940 611 HA ILE 79 HA ILE 79 -3.816 1.060 -37.083 612 HB ILE 79 HB ILE 79 -2.257 2.874 -38.933 613 HG12 ILE 79 HG12 ILE 79 -1.417 0.178 -37.867 614 HG13 ILE 79 HG11 ILE 79 -2.217 0.371 -39.422 615 HG21 ILE 79 HG21 ILE 79 -2.105 3.537 -36.584 616 HG22 ILE 79 HG22 ILE 79 -0.571 2.881 -37.155 617 HG23 ILE 79 HG23 ILE 79 -1.630 1.895 -36.146 618 HD11 ILE 79 HD11 ILE 79 0.186 0.201 -39.673 619 HD12 ILE 79 HD12 ILE 79 0.407 1.606 -38.631 620 HD13 ILE 79 HD13 ILE 79 -0.396 1.782 -40.192 621 H LEU 80 HN LEU 80 -4.428 3.742 -39.325 622 HA LEU 80 HA LEU 80 -4.838 5.599 -37.203 623 HB2 LEU 80 HB2 LEU 80 -5.114 5.752 -40.174 624 HB3 LEU 80 HB1 LEU 80 -5.773 7.028 -39.169 625 HG LEU 80 HG LEU 80 -3.480 7.325 -38.179 626 HD11 LEU 80 HD11 LEU 80 -1.572 6.439 -39.414 627 HD12 LEU 80 HD12 LEU 80 -2.665 5.522 -40.451 628 HD13 LEU 80 HD13 LEU 80 -2.554 5.141 -38.732 629 HD21 LEU 80 HD21 LEU 80 -3.758 7.735 -41.150 630 HD22 LEU 80 HD22 LEU 80 -2.608 8.560 -40.098 631 HD23 LEU 80 HD23 LEU 80 -4.340 8.822 -39.889 632 H LYS 81 HN LYS 81 -6.840 3.236 -38.583 633 HA LYS 81 HA LYS 81 -9.379 4.321 -38.339 634 HB2 LYS 81 HB2 LYS 81 -9.090 2.029 -39.082 635 HB3 LYS 81 HB1 LYS 81 -8.421 1.570 -37.521 636 HG2 LYS 81 HG2 LYS 81 -10.806 2.562 -36.746 637 HG3 LYS 81 HG1 LYS 81 -11.220 1.938 -38.345 638 HD2 LYS 81 HD2 LYS 81 -10.290 -0.239 -37.739 639 HD3 LYS 81 HD1 LYS 81 -9.849 0.393 -36.152 640 HE2 LYS 81 HE2 LYS 81 -12.678 0.334 -37.174 641 HE3 LYS 81 HE1 LYS 81 -11.961 -0.979 -36.241 642 HZ1 LYS 81 HZ1 LYS 81 -11.494 0.672 -34.468 643 HZ2 LYS 81 HZ2 LYS 81 -13.148 0.431 -34.762 644 HZ3 LYS 81 HZ3 LYS 81 -12.382 1.819 -35.348 645 H GLU 82 HN GLU 82 -7.604 2.555 -35.815 646 HA GLU 82 HA GLU 82 -9.400 3.375 -33.766 647 HB2 GLU 82 HB2 GLU 82 -7.414 1.424 -34.049 648 HB3 GLU 82 HB1 GLU 82 -6.845 2.477 -32.757 649 HG2 GLU 82 HG2 GLU 82 -8.236 0.533 -32.017 650 HG3 GLU 82 HG1 GLU 82 -8.806 2.115 -31.478 651 H GLU 83 HN GLU 83 -6.363 4.495 -35.015 652 HA GLU 83 HA GLU 83 -5.545 6.299 -33.073 653 HB2 GLU 83 HB2 GLU 83 -4.317 5.721 -35.122 654 HB3 GLU 83 HB1 GLU 83 -5.493 6.622 -36.071 655 HG2 GLU 83 HG2 GLU 83 -3.791 8.106 -35.863 656 HG3 GLU 83 HG1 GLU 83 -4.851 8.590 -34.548 657 H LEU 84 HN LEU 84 -7.746 6.807 -35.767 658 HA LEU 84 HA LEU 84 -8.339 9.454 -35.613 659 HB2 LEU 84 HB2 LEU 84 -10.133 7.135 -36.284 660 HB3 LEU 84 HB1 LEU 84 -10.656 8.804 -36.452 661 HG LEU 84 HG LEU 84 -8.355 7.520 -37.925 662 HD11 LEU 84 HD11 LEU 84 -10.525 6.765 -38.713 663 HD12 LEU 84 HD12 LEU 84 -9.764 7.826 -39.898 664 HD13 LEU 84 HD13 LEU 84 -11.064 8.436 -38.875 665 HD21 LEU 84 HD21 LEU 84 -8.238 9.613 -39.178 666 HD22 LEU 84 HD22 LEU 84 -7.910 9.873 -37.465 667 HD23 LEU 84 HD23 LEU 84 -9.481 10.309 -38.138 668 H GLN 85 HN GLN 85 -9.582 6.979 -33.444 669 HA GLN 85 HA GLN 85 -11.787 8.289 -32.399 670 HB2 GLN 85 HB2 GLN 85 -9.898 6.233 -31.377 671 HB3 GLN 85 HB1 GLN 85 -11.009 6.973 -30.236 672 HG2 GLN 85 HG2 GLN 85 -11.648 4.783 -31.461 673 HG3 GLN 85 HG1 GLN 85 -12.859 6.036 -31.211 674 HE21 GLN 85 HE21 GLN 85 -10.854 4.398 -33.522 675 HE22 GLN 85 HE22 GLN 85 -11.648 4.976 -34.935 676 H ASN 86 HN ASN 86 -8.477 9.153 -32.033 677 HA ASN 86 HA ASN 86 -8.919 10.653 -29.582 678 HB2 ASN 86 HB2 ASN 86 -6.488 10.508 -31.380 679 HB3 ASN 86 HB1 ASN 86 -6.555 11.333 -29.827 680 HD21 ASN 86 HD21 ASN 86 -6.285 8.314 -31.454 681 HD22 ASN 86 HD22 ASN 86 -6.009 7.341 -30.049 682 H ILE 87 HN ILE 87 -9.543 11.158 -32.805 683 HA ILE 87 HA ILE 87 -9.513 14.084 -32.472 684 HB ILE 87 HB ILE 87 -9.072 13.146 -35.234 685 HG12 ILE 87 HG12 ILE 87 -6.889 12.877 -33.152 686 HG13 ILE 87 HG11 ILE 87 -7.570 11.593 -34.144 687 HG21 ILE 87 HG21 ILE 87 -7.794 15.294 -33.546 688 HG22 ILE 87 HG22 ILE 87 -9.161 15.502 -34.641 689 HG23 ILE 87 HG23 ILE 87 -7.573 15.081 -35.283 690 HD11 ILE 87 HD11 ILE 87 -5.977 13.925 -35.167 691 HD12 ILE 87 HD12 ILE 87 -6.632 12.604 -36.135 692 HD13 ILE 87 HD13 ILE 87 -5.379 12.283 -34.936 693 H HIS 88 HN HIS 88 -10.912 15.087 -34.342 694 HA HIS 88 HA HIS 88 -13.155 13.261 -34.911 695 HB2 HIS 88 HB2 HIS 88 -14.689 15.088 -34.871 696 HB3 HIS 88 HB1 HIS 88 -13.705 15.216 -33.421 697 HD1 HIS 88 HD1 HIS 88 -14.691 17.033 -36.479 698 HD2 HIS 88 HD2 HIS 88 -11.842 17.392 -33.465 699 HE1 HIS 88 HE1 HIS 88 -13.800 19.378 -36.657 700 HE2 HIS 88 HE2 HIS 88 -12.224 19.620 -34.708 701 H ALA 89 HN ALA 89 -10.639 15.030 -36.293 702 HA ALA 89 HA ALA 89 -11.470 14.339 -38.945 703 HB1 ALA 89 HB1 ALA 89 -12.785 16.376 -38.646 704 HB2 ALA 89 HB2 ALA 89 -11.530 16.600 -39.865 705 HB3 ALA 89 HB3 ALA 89 -11.319 17.270 -38.248 706 H PHE 90 HN PHE 90 -9.588 13.395 -39.431 707 HA PHE 90 HA PHE 90 -7.223 15.134 -39.556 708 HB2 PHE 90 HB2 PHE 90 -6.921 13.567 -37.703 709 HB3 PHE 90 HB1 PHE 90 -7.294 12.215 -38.759 710 HD1 PHE 90 HD1 PHE 90 -4.839 14.913 -38.143 711 HD2 PHE 90 HD2 PHE 90 -5.617 11.174 -40.021 712 HE1 PHE 90 HE1 PHE 90 -2.449 14.683 -38.669 713 HE2 PHE 90 HE2 PHE 90 -3.227 10.939 -40.550 714 HZ PHE 90 HZ PHE 90 -1.641 12.694 -39.874 715 H SER 91 HN SER 91 -6.561 15.362 -41.599 716 HA SER 91 HA SER 91 -7.174 13.205 -43.511 717 HB2 SER 91 HB2 SER 91 -7.001 15.155 -45.219 718 HB3 SER 91 HB1 SER 91 -8.457 15.030 -44.233 719 HG SER 91 HG SER 91 -6.540 16.990 -44.294 720 H MET 92 HN MET 92 -5.581 12.584 -44.981 721 HA MET 92 HA MET 92 -2.900 13.671 -44.448 722 HB2 MET 92 HB2 MET 92 -1.941 11.477 -44.638 723 HB3 MET 92 HB1 MET 92 -3.227 11.414 -43.445 724 HG2 MET 92 HG2 MET 92 -3.513 10.520 -46.305 725 HG3 MET 92 HG1 MET 92 -3.134 9.453 -44.957 726 HE1 MET 92 HE1 MET 92 -4.925 10.648 -42.628 727 HE2 MET 92 HE2 MET 92 -4.796 8.923 -42.971 728 HE3 MET 92 HE3 MET 92 -6.384 9.670 -42.793 729 H LYS 93 HN LYS 93 -1.504 13.875 -46.145 730 HA LYS 93 HA LYS 93 -2.549 13.300 -48.848 731 HB2 LYS 93 HB2 LYS 93 -0.789 15.651 -48.110 732 HB3 LYS 93 HB1 LYS 93 -1.585 15.359 -49.650 733 HG2 LYS 93 HG2 LYS 93 -3.036 15.889 -47.067 734 HG3 LYS 93 HG1 LYS 93 -2.648 17.123 -48.266 735 HD2 LYS 93 HD2 LYS 93 -4.077 16.156 -49.872 736 HD3 LYS 93 HD1 LYS 93 -4.214 14.651 -48.960 737 HE2 LYS 93 HE2 LYS 93 -6.230 16.101 -48.817 738 HE3 LYS 93 HE1 LYS 93 -5.505 15.724 -47.256 739 HZ1 LYS 93 HZ1 LYS 93 -4.401 17.906 -47.324 740 HZ2 LYS 93 HZ2 LYS 93 -6.084 18.030 -47.330 741 HZ3 LYS 93 HZ3 LYS 93 -5.222 18.271 -48.767 742 H CYS 94 HN CYS 94 -1.220 11.942 -49.952 743 HA CYS 94 HA CYS 94 1.380 11.398 -48.707 744 HB2 CYS 94 HB2 CYS 94 1.210 9.228 -50.029 745 HB3 CYS 94 HB1 CYS 94 0.071 9.444 -48.706 746 HG CYS 94 HG CYS 94 -1.228 10.570 -51.534 747 H HIS 95 HN HIS 95 3.246 11.628 -49.719 748 HA HIS 95 HA HIS 95 3.393 11.625 -52.627 749 HB2 HIS 95 HB2 HIS 95 3.976 14.008 -50.934 750 HB3 HIS 95 HB1 HIS 95 5.082 13.664 -52.261 751 HD1 HIS 95 HD1 HIS 95 1.804 15.143 -51.518 752 HD2 HIS 95 HD2 HIS 95 3.795 13.672 -54.859 753 HE1 HIS 95 HE1 HIS 95 0.548 16.035 -53.499 754 HE2 HIS 95 HE2 HIS 95 1.853 15.259 -55.510 755 H THR 96 HN THR 96 5.854 11.792 -53.243 756 HA THR 96 HA THR 96 7.229 10.023 -51.337 757 HB THR 96 HB THR 96 8.567 9.578 -53.657 758 HG1 THR 96 HG1 THR 96 6.990 10.880 -54.822 759 HG21 THR 96 HG21 THR 96 7.701 7.883 -52.131 760 HG22 THR 96 HG22 THR 96 7.278 7.499 -53.799 761 HG23 THR 96 HG23 THR 96 6.064 8.178 -52.715 762 HA PRO 97 HA PRO 97 10.584 12.727 -50.679 763 HB2 PRO 97 HB2 PRO 97 12.504 10.591 -51.356 764 HB3 PRO 97 HB1 PRO 97 12.270 11.454 -49.832 765 HG2 PRO 97 HG2 PRO 97 11.507 8.908 -50.131 766 HG3 PRO 97 HG1 PRO 97 10.576 10.048 -49.144 767 HD2 PRO 97 HD2 PRO 97 10.035 9.035 -51.901 768 HD3 PRO 97 HD1 PRO 97 8.902 9.347 -50.569 769 H LEU 98 HN LEU 98 10.476 10.973 -53.648 770 HA LEU 98 HA LEU 98 12.531 12.240 -55.060 771 HB2 LEU 98 HB2 LEU 98 9.876 11.157 -55.997 772 HB3 LEU 98 HB1 LEU 98 11.082 11.792 -57.095 773 HG LEU 98 HG LEU 98 11.306 9.441 -57.147 774 HD11 LEU 98 HD11 LEU 98 13.436 10.539 -55.324 775 HD12 LEU 98 HD12 LEU 98 13.420 10.626 -57.085 776 HD13 LEU 98 HD13 LEU 98 13.559 9.062 -56.281 777 HD21 LEU 98 HD21 LEU 98 11.601 8.046 -55.176 778 HD22 LEU 98 HD22 LEU 98 10.068 8.915 -55.104 779 HD23 LEU 98 HD23 LEU 98 11.436 9.460 -54.134 780 H GLU 99 HN GLU 99 9.072 13.108 -54.851 781 HA GLU 99 HA GLU 99 9.259 15.594 -56.135 782 HB2 GLU 99 HB2 GLU 99 7.379 14.748 -53.920 783 HB3 GLU 99 HB1 GLU 99 7.165 16.166 -54.925 784 HG2 GLU 99 HG2 GLU 99 5.790 14.728 -56.001 785 HG3 GLU 99 HG1 GLU 99 7.292 14.388 -56.862 786 H TYR 100 HN TYR 100 9.566 14.695 -52.743 787 HA TYR 100 HA TYR 100 9.842 17.237 -51.633 788 HB2 TYR 100 HB2 TYR 100 9.483 15.284 -50.254 789 HB3 TYR 100 HB1 TYR 100 11.016 14.591 -50.767 790 HD1 TYR 100 HD1 TYR 100 9.664 17.636 -49.075 791 HD2 TYR 100 HD2 TYR 100 12.855 14.840 -49.388 792 HE1 TYR 100 HE1 TYR 100 10.768 18.682 -47.139 793 HE2 TYR 100 HE2 TYR 100 13.968 15.880 -47.461 794 HH TYR 100 HH TYR 100 13.972 18.106 -46.314 795 H ASP 101 HN ASP 101 12.286 15.100 -53.042 796 HA ASP 101 HA ASP 101 14.567 16.506 -52.259 797 HB2 ASP 101 HB2 ASP 101 14.746 14.281 -53.177 798 HB3 ASP 101 HB1 ASP 101 14.094 14.821 -54.721 799 H LYS 102 HN LYS 102 12.477 16.976 -55.072 800 HA LYS 102 HA LYS 102 14.133 18.886 -56.349 801 HB2 LYS 102 HB2 LYS 102 11.285 18.059 -56.603 802 HB3 LYS 102 HB1 LYS 102 11.733 19.618 -57.270 803 HG2 LYS 102 HG2 LYS 102 11.979 18.248 -59.092 804 HG3 LYS 102 HG1 LYS 102 13.620 18.273 -58.455 805 HD2 LYS 102 HD2 LYS 102 11.675 16.123 -57.680 806 HD3 LYS 102 HD1 LYS 102 12.610 16.017 -59.169 807 HE2 LYS 102 HE2 LYS 102 13.786 16.345 -56.412 808 HE3 LYS 102 HE1 LYS 102 13.633 14.810 -57.263 809 HZ1 LYS 102 HZ1 LYS 102 15.853 15.853 -57.429 810 HZ2 LYS 102 HZ2 LYS 102 15.162 17.128 -58.301 811 HZ3 LYS 102 HZ3 LYS 102 15.129 15.560 -58.936 812 H LEU 103 HN LEU 103 11.617 19.101 -53.924 813 HA LEU 103 HA LEU 103 11.303 21.904 -53.927 814 HB2 LEU 103 HB2 LEU 103 10.877 19.996 -51.627 815 HB3 LEU 103 HB1 LEU 103 10.207 21.608 -51.777 816 HG LEU 103 HG LEU 103 9.525 19.243 -53.525 817 HD11 LEU 103 HD11 LEU 103 7.926 20.684 -51.418 818 HD12 LEU 103 HD12 LEU 103 8.610 19.065 -51.278 819 HD13 LEU 103 HD13 LEU 103 7.337 19.385 -52.456 820 HD21 LEU 103 HD21 LEU 103 9.426 21.325 -54.781 821 HD22 LEU 103 HD22 LEU 103 8.437 22.056 -53.519 822 HD23 LEU 103 HD23 LEU 103 7.802 20.713 -54.467 823 H LYS 104 HN LYS 104 13.235 19.767 -51.826 824 HA LYS 104 HA LYS 104 14.379 21.897 -50.342 825 HB2 LYS 104 HB2 LYS 104 16.176 20.033 -49.848 826 HB3 LYS 104 HB1 LYS 104 14.562 19.938 -49.160 827 HG2 LYS 104 HG2 LYS 104 14.133 18.031 -50.203 828 HG3 LYS 104 HG1 LYS 104 14.687 18.665 -51.750 829 HD2 LYS 104 HD2 LYS 104 16.547 17.678 -49.592 830 HD3 LYS 104 HD1 LYS 104 15.941 16.657 -50.899 831 HE2 LYS 104 HE2 LYS 104 16.862 18.446 -52.475 832 HE3 LYS 104 HE1 LYS 104 17.732 19.062 -51.072 833 HZ1 LYS 104 HZ1 LYS 104 17.984 16.365 -52.289 834 HZ2 LYS 104 HZ2 LYS 104 18.718 16.819 -50.825 835 HZ3 LYS 104 HZ3 LYS 104 19.152 17.596 -52.269 836 H SER 105 HN SER 105 15.343 20.242 -53.285 837 HA SER 105 HA SER 105 17.997 21.182 -53.383 838 HB2 SER 105 HB2 SER 105 17.136 19.311 -54.759 839 HB3 SER 105 HB1 SER 105 16.174 20.457 -55.690 840 HG SER 105 HG SER 105 19.013 20.399 -55.478 841 H LYS 106 HN LYS 106 15.027 22.436 -54.925 842 HA LYS 106 HA LYS 106 16.040 25.130 -54.664 843 HB2 LYS 106 HB2 LYS 106 15.634 25.693 -57.061 844 HB3 LYS 106 HB1 LYS 106 17.032 24.672 -56.787 845 HG2 LYS 106 HG2 LYS 106 14.420 23.431 -57.518 846 HG3 LYS 106 HG1 LYS 106 15.400 24.207 -58.763 847 HD2 LYS 106 HD2 LYS 106 16.330 22.005 -56.920 848 HD3 LYS 106 HD1 LYS 106 15.836 21.792 -58.601 849 HE2 LYS 106 HE2 LYS 106 17.651 23.255 -59.328 850 HE3 LYS 106 HE1 LYS 106 18.134 23.504 -57.651 851 HZ1 LYS 106 HZ1 LYS 106 19.513 21.843 -58.748 852 HZ2 LYS 106 HZ2 LYS 106 18.146 20.900 -59.079 853 HZ3 LYS 106 HZ3 LYS 106 18.630 21.152 -57.475 854 H GLY 107 HN GLY 107 13.543 23.043 -55.990 855 HA2 GLY 107 HA2 GLY 107 11.374 23.504 -54.658 856 HA3 GLY 107 HA1 GLY 107 11.523 25.094 -55.400 857 H SER 108 HN SER 108 12.578 24.127 -57.881 858 HA SER 108 HA SER 108 10.094 23.536 -59.180 859 HB2 SER 108 HB2 SER 108 11.966 25.063 -60.050 860 HB3 SER 108 HB1 SER 108 12.820 23.583 -60.480 861 HG SER 108 HG SER 108 10.385 24.601 -61.495 Start of MODEL 12 1 H1 MET 1 HT1 MET 1 15.302 40.094 12.125 2 H2 MET 1 HT2 MET 1 15.646 39.150 10.758 3 H3 MET 1 HT3 MET 1 16.699 40.402 11.207 4 HA MET 1 HA MET 1 17.661 38.331 11.831 5 HB2 MET 1 HB2 MET 1 18.024 40.220 13.348 6 HB3 MET 1 HB1 MET 1 16.538 39.834 14.205 7 HG2 MET 1 HG2 MET 1 17.514 37.664 14.852 8 HG3 MET 1 HG1 MET 1 19.019 38.141 14.072 9 HE1 MET 1 HE1 MET 1 16.522 40.367 16.171 10 HE2 MET 1 HE2 MET 1 17.231 40.229 17.780 11 HE3 MET 1 HE3 MET 1 16.518 38.814 17.006 12 H GLY 2 HN GLY 2 17.123 36.269 11.822 13 HA2 GLY 2 HA2 GLY 2 15.441 35.136 13.823 14 HA3 GLY 2 HA1 GLY 2 14.615 35.191 12.272 15 H SER 3 HN SER 3 14.609 33.141 11.590 16 HA SER 3 HA SER 3 17.155 31.670 11.609 17 HB2 SER 3 HB2 SER 3 14.346 30.561 11.347 18 HB3 SER 3 HB1 SER 3 15.832 29.627 11.519 19 HG SER 3 HG SER 3 16.090 30.754 13.580 20 H SER 4 HN SER 4 17.742 30.488 9.720 21 HA SER 4 HA SER 4 16.224 31.064 7.287 22 HB2 SER 4 HB2 SER 4 19.223 31.457 7.461 23 HB3 SER 4 HB1 SER 4 18.190 31.777 6.068 24 HG SER 4 HG SER 4 18.595 33.263 8.384 25 H HIS 5 HN HIS 5 15.613 28.920 7.089 26 HA HIS 5 HA HIS 5 17.524 26.795 7.312 27 HB2 HIS 5 HB2 HIS 5 14.901 26.742 7.587 28 HB3 HIS 5 HB1 HIS 5 14.929 26.465 5.848 29 HD1 HIS 5 HD1 HIS 5 15.324 24.101 5.092 30 HD2 HIS 5 HD2 HIS 5 16.353 24.712 9.083 31 HE1 HIS 5 HE1 HIS 5 15.862 21.824 6.019 32 HE2 HIS 5 HE2 HIS 5 16.459 22.209 8.442 33 H HIS 6 HN HIS 6 19.167 26.910 5.896 34 HA HIS 6 HA HIS 6 18.745 27.955 3.249 35 HB2 HIS 6 HB2 HIS 6 21.218 27.493 2.968 36 HB3 HIS 6 HB1 HIS 6 20.783 28.619 4.244 37 HD1 HIS 6 HD1 HIS 6 21.696 28.154 6.506 38 HD2 HIS 6 HD2 HIS 6 21.955 24.846 3.996 39 HE1 HIS 6 HE1 HIS 6 23.017 26.434 7.781 40 HE2 HIS 6 HE2 HIS 6 23.173 24.441 6.245 41 H HIS 7 HN HIS 7 18.506 26.928 1.407 42 HA HIS 7 HA HIS 7 18.837 24.003 1.379 43 HB2 HIS 7 HB2 HIS 7 17.067 23.827 -0.215 44 HB3 HIS 7 HB1 HIS 7 16.475 24.898 1.047 45 HD1 HIS 7 HD1 HIS 7 16.007 27.366 0.390 46 HD2 HIS 7 HD2 HIS 7 17.459 25.022 -2.732 47 HE1 HIS 7 HE1 HIS 7 15.687 28.732 -1.701 48 HE2 HIS 7 HE2 HIS 7 16.669 27.339 -3.561 49 H HIS 8 HN HIS 8 20.032 23.093 -0.278 50 HA HIS 8 HA HIS 8 20.651 24.479 -2.682 51 HB2 HIS 8 HB2 HIS 8 22.179 25.662 -1.070 52 HB3 HIS 8 HB1 HIS 8 22.983 24.122 -0.787 53 HD1 HIS 8 HD1 HIS 8 24.641 23.308 -2.547 54 HD2 HIS 8 HD2 HIS 8 22.618 26.782 -3.640 55 HE1 HIS 8 HE1 HIS 8 25.821 24.170 -4.595 56 HE2 HIS 8 HE2 HIS 8 24.653 26.333 -5.177 57 H HIS 9 HN HIS 9 20.596 22.860 -4.082 58 HA HIS 9 HA HIS 9 22.460 20.678 -3.742 59 HB2 HIS 9 HB2 HIS 9 20.764 18.913 -4.214 60 HB3 HIS 9 HB1 HIS 9 20.579 19.669 -2.641 61 HD1 HIS 9 HD1 HIS 9 18.309 20.537 -2.083 62 HD2 HIS 9 HD2 HIS 9 18.757 19.804 -6.153 63 HE1 HIS 9 HE1 HIS 9 16.029 20.873 -3.091 64 HE2 HIS 9 HE2 HIS 9 16.283 20.188 -5.502 65 H HIS 10 HN HIS 10 23.488 20.455 -5.582 66 HA HIS 10 HA HIS 10 22.265 21.315 -8.077 67 HB2 HIS 10 HB2 HIS 10 24.700 21.746 -7.451 68 HB3 HIS 10 HB1 HIS 10 24.977 20.028 -7.692 69 HD1 HIS 10 HD1 HIS 10 24.529 23.227 -9.503 70 HD2 HIS 10 HD2 HIS 10 24.857 19.183 -10.405 71 HE1 HIS 10 HE1 HIS 10 25.036 23.122 -11.961 72 HE2 HIS 10 HE2 HIS 10 25.014 20.666 -12.521 73 H SER 11 HN SER 11 20.707 19.875 -8.642 74 HA SER 11 HA SER 11 21.466 17.028 -8.736 75 HB2 SER 11 HB2 SER 11 18.709 18.037 -8.019 76 HB3 SER 11 HB1 SER 11 19.319 16.388 -7.894 77 HG SER 11 HG SER 11 20.914 17.390 -6.363 78 H SER 12 HN SER 12 21.404 16.300 -10.744 79 HA SER 12 HA SER 12 19.377 17.408 -12.574 80 HB2 SER 12 HB2 SER 12 21.043 16.818 -14.402 81 HB3 SER 12 HB1 SER 12 21.505 18.159 -13.354 82 HG SER 12 HG SER 12 22.312 15.528 -12.747 83 H GLY 13 HN GLY 13 17.814 15.924 -12.818 84 HA2 GLY 13 HA2 GLY 13 17.536 13.805 -14.191 85 HA3 GLY 13 HA1 GLY 13 18.619 13.091 -13.007 86 H ARG 14 HN ARG 14 15.510 14.769 -13.292 87 HA ARG 14 HA ARG 14 14.477 12.964 -11.202 88 HB2 ARG 14 HB2 ARG 14 12.985 14.781 -10.407 89 HB3 ARG 14 HB1 ARG 14 14.687 15.131 -10.158 90 HG2 ARG 14 HG2 ARG 14 13.321 16.155 -12.604 91 HG3 ARG 14 HG1 ARG 14 13.079 16.971 -11.058 92 HD2 ARG 14 HD2 ARG 14 15.097 17.914 -11.144 93 HD3 ARG 14 HD1 ARG 14 15.874 16.382 -11.544 94 HE ARG 14 HE ARG 14 14.914 16.945 -13.901 95 HH11 ARG 14 HH11 ARG 14 16.288 19.215 -11.610 96 HH12 ARG 14 HH12 ARG 14 16.879 20.287 -12.839 97 HH21 ARG 14 HH21 ARG 14 15.668 18.349 -15.507 98 HH22 ARG 14 HH22 ARG 14 16.520 19.808 -15.057 99 H GLU 15 HN GLU 15 14.128 14.283 -14.317 100 HA GLU 15 HA GLU 15 11.273 13.822 -14.491 101 HB2 GLU 15 HB2 GLU 15 11.591 14.591 -16.866 102 HB3 GLU 15 HB1 GLU 15 12.041 15.763 -15.638 103 HG2 GLU 15 HG2 GLU 15 14.124 13.977 -16.812 104 HG3 GLU 15 HG1 GLU 15 13.557 15.378 -17.719 105 H ASN 16 HN ASN 16 13.667 11.728 -14.382 106 HA ASN 16 HA ASN 16 13.326 10.239 -16.802 107 HB2 ASN 16 HB2 ASN 16 14.767 8.573 -15.814 108 HB3 ASN 16 HB1 ASN 16 15.419 10.163 -15.445 109 HD21 ASN 16 HD21 ASN 16 15.454 10.877 -13.332 110 HD22 ASN 16 HD22 ASN 16 15.122 9.840 -11.985 111 H LEU 17 HN LEU 17 11.507 10.558 -13.992 112 HA LEU 17 HA LEU 17 10.366 7.931 -13.906 113 HB2 LEU 17 HB2 LEU 17 9.574 10.562 -12.667 114 HB3 LEU 17 HB1 LEU 17 8.594 9.122 -12.492 115 HG LEU 17 HG LEU 17 10.580 8.001 -11.425 116 HD11 LEU 17 HD11 LEU 17 12.337 9.453 -12.288 117 HD12 LEU 17 HD12 LEU 17 12.342 9.428 -10.525 118 HD13 LEU 17 HD13 LEU 17 11.667 10.812 -11.386 119 HD21 LEU 17 HD21 LEU 17 9.491 10.473 -10.092 120 HD22 LEU 17 HD22 LEU 17 10.258 9.113 -9.273 121 HD23 LEU 17 HD23 LEU 17 8.728 8.883 -10.119 122 H TYR 18 HN TYR 18 9.977 10.591 -15.939 123 HA TYR 18 HA TYR 18 7.206 9.904 -16.608 124 HB2 TYR 18 HB2 TYR 18 8.845 12.289 -17.504 125 HB3 TYR 18 HB1 TYR 18 7.123 12.039 -17.779 126 HD1 TYR 18 HD2 TYR 18 9.679 12.881 -15.291 127 HD2 TYR 18 HD1 TYR 18 5.512 12.399 -15.997 128 HE1 TYR 18 HE2 TYR 18 9.197 14.018 -13.168 129 HE2 TYR 18 HE1 TYR 18 5.015 13.535 -13.870 130 HH TYR 18 HH TYR 18 7.561 15.055 -11.961 131 H PHE 19 HN PHE 19 6.763 8.804 -18.402 132 HA PHE 19 HA PHE 19 9.013 8.110 -20.143 133 HB2 PHE 19 HB2 PHE 19 7.707 6.168 -20.806 134 HB3 PHE 19 HB1 PHE 19 7.786 6.259 -19.053 135 HD1 PHE 19 HD1 PHE 19 5.753 7.378 -17.876 136 HD2 PHE 19 HD2 PHE 19 5.672 5.869 -21.855 137 HE1 PHE 19 HE1 PHE 19 3.302 7.205 -17.759 138 HE2 PHE 19 HE2 PHE 19 3.223 5.699 -21.744 139 HZ PHE 19 HZ PHE 19 2.034 6.368 -19.694 140 H GLN 20 HN GLN 20 7.123 10.538 -20.202 141 HA GLN 20 HA GLN 20 6.321 11.957 -21.782 142 HB2 GLN 20 HB2 GLN 20 7.797 10.029 -23.565 143 HB3 GLN 20 HB1 GLN 20 6.872 11.362 -24.235 144 HG2 GLN 20 HG2 GLN 20 9.215 11.936 -24.087 145 HG3 GLN 20 HG1 GLN 20 8.266 12.951 -23.003 146 HE21 GLN 20 HE21 GLN 20 8.564 12.783 -20.808 147 HE22 GLN 20 HE22 GLN 20 9.852 11.875 -20.096 148 H GLY 21 HN GLY 21 4.682 9.915 -20.716 149 HA2 GLY 21 HA2 GLY 21 3.162 8.495 -22.585 150 HA3 GLY 21 HA1 GLY 21 2.598 9.005 -21.001 151 H HIS 22 HN HIS 22 2.632 11.741 -21.249 152 HA HIS 22 HA HIS 22 1.064 12.346 -23.638 153 HB2 HIS 22 HB2 HIS 22 -0.666 13.523 -22.349 154 HB3 HIS 22 HB1 HIS 22 -0.619 11.814 -21.946 155 HD1 HIS 22 HD1 HIS 22 -0.542 15.143 -20.458 156 HD2 HIS 22 HD2 HIS 22 0.648 11.311 -19.358 157 HE1 HIS 22 HE1 HIS 22 -0.254 15.211 -17.963 158 HE2 HIS 22 HE2 HIS 22 0.678 12.950 -17.356 159 H MET 23 HN MET 23 2.542 13.666 -24.511 160 HA MET 23 HA MET 23 3.442 15.958 -22.897 161 HB2 MET 23 HB2 MET 23 4.634 14.980 -25.498 162 HB3 MET 23 HB1 MET 23 5.305 16.189 -24.413 163 HG2 MET 23 HG2 MET 23 5.009 13.244 -23.863 164 HG3 MET 23 HG1 MET 23 6.506 14.114 -24.192 165 HE1 MET 23 HE1 MET 23 6.159 16.778 -22.532 166 HE2 MET 23 HE2 MET 23 7.634 15.813 -22.523 167 HE3 MET 23 HE3 MET 23 6.907 16.324 -21.000 168 H CYS 24 HN CYS 24 2.272 15.000 -26.081 169 HA CYS 24 HA CYS 24 0.619 17.333 -26.278 170 HB2 CYS 24 HB2 CYS 24 2.758 18.259 -27.056 171 HB3 CYS 24 HB1 CYS 24 2.907 16.955 -28.227 172 HG CYS 24 HG CYS 24 2.165 18.788 -29.941 173 H ILE 25 HN ILE 25 -1.152 16.860 -27.472 174 HA ILE 25 HA ILE 25 -1.639 14.220 -28.280 175 HB ILE 25 HB ILE 25 -3.424 15.772 -27.627 176 HG12 ILE 25 HG12 ILE 25 -5.057 15.173 -29.417 177 HG13 ILE 25 HG11 ILE 25 -3.710 14.617 -30.406 178 HG21 ILE 25 HG21 ILE 25 -2.627 17.801 -28.678 179 HG22 ILE 25 HG22 ILE 25 -4.274 17.444 -29.200 180 HG23 ILE 25 HG23 ILE 25 -2.916 17.112 -30.276 181 HD11 ILE 25 HD11 ILE 25 -4.506 13.496 -27.730 182 HD12 ILE 25 HD12 ILE 25 -3.173 12.928 -28.736 183 HD13 ILE 25 HD13 ILE 25 -4.837 12.768 -29.302 184 H GLN 26 HN GLN 26 -0.492 17.009 -30.064 185 HA GLN 26 HA GLN 26 -0.791 15.986 -32.671 186 HB2 GLN 26 HB2 GLN 26 -0.328 18.350 -32.198 187 HB3 GLN 26 HB1 GLN 26 1.262 17.923 -31.582 188 HG2 GLN 26 HG2 GLN 26 1.880 17.097 -33.815 189 HG3 GLN 26 HG1 GLN 26 0.300 17.597 -34.418 190 HE21 GLN 26 HE21 GLN 26 2.987 18.480 -35.194 191 HE22 GLN 26 HE22 GLN 26 3.021 20.191 -34.951 192 H LYS 27 HN LYS 27 1.774 15.700 -30.273 193 HA LYS 27 HA LYS 27 3.615 14.307 -31.913 194 HB2 LYS 27 HB2 LYS 27 4.497 15.328 -29.975 195 HB3 LYS 27 HB1 LYS 27 3.290 14.594 -28.933 196 HG2 LYS 27 HG2 LYS 27 5.448 13.574 -28.575 197 HG3 LYS 27 HG1 LYS 27 4.332 12.404 -29.273 198 HD2 LYS 27 HD2 LYS 27 6.406 12.107 -30.383 199 HD3 LYS 27 HD1 LYS 27 5.349 12.946 -31.518 200 HE2 LYS 27 HE2 LYS 27 6.424 15.053 -31.016 201 HE3 LYS 27 HE1 LYS 27 7.410 14.285 -29.770 202 HZ1 LYS 27 HZ1 LYS 27 8.403 12.897 -31.514 203 HZ2 LYS 27 HZ2 LYS 27 8.690 14.545 -31.776 204 HZ3 LYS 27 HZ3 LYS 27 7.512 13.734 -32.692 205 H VAL 28 HN VAL 28 0.913 13.284 -29.910 206 HA VAL 28 HA VAL 28 1.452 10.541 -29.792 207 HB VAL 28 HB VAL 28 -1.253 11.891 -29.923 208 HG11 VAL 28 HG11 VAL 28 -0.488 9.147 -28.940 209 HG12 VAL 28 HG12 VAL 28 -1.424 9.513 -30.389 210 HG13 VAL 28 HG13 VAL 28 -2.087 9.878 -28.796 211 HG21 VAL 28 HG21 VAL 28 0.098 12.746 -28.092 212 HG22 VAL 28 HG22 VAL 28 0.436 11.101 -27.553 213 HG23 VAL 28 HG23 VAL 28 -1.208 11.735 -27.473 214 H ILE 29 HN ILE 29 -0.642 12.295 -32.081 215 HA ILE 29 HA ILE 29 -1.105 10.095 -33.779 216 HB ILE 29 HB ILE 29 -1.346 13.070 -34.183 217 HG12 ILE 29 HG12 ILE 29 -3.775 12.438 -34.456 218 HG13 ILE 29 HG11 ILE 29 -3.331 10.801 -33.990 219 HG21 ILE 29 HG21 ILE 29 -0.701 12.181 -36.344 220 HG22 ILE 29 HG22 ILE 29 -2.398 12.663 -36.356 221 HG23 ILE 29 HG23 ILE 29 -1.966 10.957 -36.240 222 HD11 ILE 29 HD11 ILE 29 -3.027 13.267 -32.295 223 HD12 ILE 29 HD12 ILE 29 -2.585 11.627 -31.820 224 HD13 ILE 29 HD13 ILE 29 -4.274 12.031 -32.128 225 H GLU 30 HN GLU 30 1.259 12.724 -33.906 226 HA GLU 30 HA GLU 30 2.493 12.218 -36.324 227 HB2 GLU 30 HB2 GLU 30 2.995 14.150 -34.884 228 HB3 GLU 30 HB1 GLU 30 3.782 13.088 -33.727 229 HG2 GLU 30 HG2 GLU 30 5.333 12.454 -35.670 230 HG3 GLU 30 HG1 GLU 30 4.689 13.893 -36.462 231 H ASP 31 HN ASP 31 3.248 10.841 -33.150 232 HA ASP 31 HA ASP 31 5.485 9.340 -34.080 233 HB2 ASP 31 HB2 ASP 31 5.199 10.206 -31.755 234 HB3 ASP 31 HB1 ASP 31 3.919 9.027 -31.510 235 H LYS 32 HN LYS 32 2.096 8.608 -33.479 236 HA LYS 32 HA LYS 32 2.245 5.807 -33.462 237 HB2 LYS 32 HB2 LYS 32 0.279 6.962 -32.672 238 HB3 LYS 32 HB1 LYS 32 0.006 7.676 -34.253 239 HG2 LYS 32 HG2 LYS 32 -1.570 5.947 -34.027 240 HG3 LYS 32 HG1 LYS 32 -0.333 5.338 -35.125 241 HD2 LYS 32 HD2 LYS 32 -0.991 3.627 -33.523 242 HD3 LYS 32 HD1 LYS 32 0.690 4.099 -33.276 243 HE2 LYS 32 HE2 LYS 32 0.172 5.332 -31.343 244 HE3 LYS 32 HE1 LYS 32 -1.553 5.334 -31.706 245 HZ1 LYS 32 HZ1 LYS 32 -0.605 3.721 -29.925 246 HZ2 LYS 32 HZ2 LYS 32 -0.186 2.766 -31.262 247 HZ3 LYS 32 HZ3 LYS 32 -1.806 3.186 -30.993 248 H LEU 33 HN LEU 33 1.306 7.964 -36.169 249 HA LEU 33 HA LEU 33 1.303 5.778 -38.019 250 HB2 LEU 33 HB2 LEU 33 1.011 7.567 -39.750 251 HB3 LEU 33 HB1 LEU 33 -0.203 7.526 -38.490 252 HG LEU 33 HG LEU 33 1.219 9.402 -37.386 253 HD11 LEU 33 HD11 LEU 33 2.132 9.625 -40.249 254 HD12 LEU 33 HD12 LEU 33 3.148 9.238 -38.860 255 HD13 LEU 33 HD13 LEU 33 2.390 10.825 -38.983 256 HD21 LEU 33 HD21 LEU 33 -1.040 9.670 -38.273 257 HD22 LEU 33 HD22 LEU 33 -0.376 9.911 -39.891 258 HD23 LEU 33 HD23 LEU 33 -0.035 11.083 -38.614 259 H SER 34 HN SER 34 3.729 8.010 -36.919 260 HA SER 34 HA SER 34 5.454 7.781 -39.163 261 HB2 SER 34 HB2 SER 34 5.566 9.550 -37.327 262 HB3 SER 34 HB1 SER 34 6.361 8.326 -36.337 263 HG SER 34 HG SER 34 8.138 8.712 -37.379 264 H SER 35 HN SER 35 5.094 5.912 -36.184 265 HA SER 35 HA SER 35 7.384 4.283 -36.620 266 HB2 SER 35 HB2 SER 35 4.891 3.742 -34.987 267 HB3 SER 35 HB1 SER 35 6.391 2.818 -34.896 268 HG SER 35 HG SER 35 7.163 5.257 -34.575 269 H ALA 36 HN ALA 36 4.137 4.236 -37.835 270 HA ALA 36 HA ALA 36 4.236 1.451 -38.612 271 HB1 ALA 36 HB1 ALA 36 1.997 1.816 -39.470 272 HB2 ALA 36 HB2 ALA 36 2.164 3.552 -39.207 273 HB3 ALA 36 HB3 ALA 36 2.146 2.449 -37.831 274 H LEU 37 HN LEU 37 3.950 4.562 -40.365 275 HA LEU 37 HA LEU 37 4.392 3.191 -42.884 276 HB2 LEU 37 HB2 LEU 37 3.995 6.125 -42.281 277 HB3 LEU 37 HB1 LEU 37 4.090 5.431 -43.888 278 HG LEU 37 HG LEU 37 1.950 4.837 -41.846 279 HD11 LEU 37 HD11 LEU 37 0.478 6.057 -43.374 280 HD12 LEU 37 HD12 LEU 37 1.865 6.452 -44.389 281 HD13 LEU 37 HD13 LEU 37 1.764 7.086 -42.747 282 HD21 LEU 37 HD21 LEU 37 0.845 3.639 -43.669 283 HD22 LEU 37 HD22 LEU 37 2.407 2.920 -43.281 284 HD23 LEU 37 HD23 LEU 37 2.237 3.938 -44.711 285 H LYS 38 HN LYS 38 6.088 5.324 -40.714 286 HA LYS 38 HA LYS 38 8.227 5.992 -40.521 287 HB2 LYS 38 HB2 LYS 38 8.526 3.507 -40.549 288 HB3 LYS 38 HB1 LYS 38 8.894 3.624 -42.264 289 HG2 LYS 38 HG2 LYS 38 10.979 4.346 -41.889 290 HG3 LYS 38 HG1 LYS 38 10.482 5.404 -40.566 291 HD2 LYS 38 HD2 LYS 38 10.727 2.403 -40.357 292 HD3 LYS 38 HD1 LYS 38 11.971 3.546 -39.843 293 HE2 LYS 38 HE2 LYS 38 10.530 4.482 -38.185 294 HE3 LYS 38 HE1 LYS 38 9.141 3.593 -38.805 295 HZ1 LYS 38 HZ1 LYS 38 10.032 1.566 -38.028 296 HZ2 LYS 38 HZ2 LYS 38 10.179 2.670 -36.746 297 HZ3 LYS 38 HZ3 LYS 38 11.539 2.261 -37.674 298 HA PRO 39 HA PRO 39 8.578 8.094 -44.519 299 HB2 PRO 39 HB2 PRO 39 7.945 10.558 -43.686 300 HB3 PRO 39 HB1 PRO 39 6.703 9.339 -43.989 301 HG2 PRO 39 HG2 PRO 39 7.716 10.396 -41.419 302 HG3 PRO 39 HG1 PRO 39 6.134 9.705 -41.807 303 HD2 PRO 39 HD2 PRO 39 8.358 8.409 -40.557 304 HD3 PRO 39 HD1 PRO 39 6.795 7.698 -40.999 305 H THR 40 HN THR 40 10.132 9.632 -45.259 306 HA THR 40 HA THR 40 12.414 9.991 -43.486 307 HB THR 40 HB THR 40 13.488 10.986 -45.540 308 HG1 THR 40 HG1 THR 40 11.967 11.603 -46.922 309 HG21 THR 40 HG21 THR 40 13.740 8.842 -46.710 310 HG22 THR 40 HG22 THR 40 12.348 8.204 -45.835 311 HG23 THR 40 HG23 THR 40 13.816 8.633 -44.959 312 H PHE 41 HN PHE 41 9.719 11.668 -44.747 313 HA PHE 41 HA PHE 41 10.446 13.997 -43.144 314 HB2 PHE 41 HB2 PHE 41 11.040 14.616 -45.444 315 HB3 PHE 41 HB1 PHE 41 9.431 14.160 -45.995 316 HD1 PHE 41 HD1 PHE 41 11.219 16.508 -43.742 317 HD2 PHE 41 HD2 PHE 41 7.701 15.715 -46.001 318 HE1 PHE 41 HE1 PHE 41 10.425 18.795 -43.303 319 HE2 PHE 41 HE2 PHE 41 6.900 18.000 -45.568 320 HZ PHE 41 HZ PHE 41 8.264 19.544 -44.217 321 H LEU 42 HN LEU 42 8.783 14.696 -41.943 322 HA LEU 42 HA LEU 42 6.058 13.934 -42.678 323 HB2 LEU 42 HB2 LEU 42 6.900 12.173 -41.185 324 HB3 LEU 42 HB1 LEU 42 7.323 13.383 -39.990 325 HG LEU 42 HG LEU 42 4.914 13.957 -39.771 326 HD11 LEU 42 HD11 LEU 42 3.251 12.417 -40.693 327 HD12 LEU 42 HD12 LEU 42 4.526 11.559 -41.556 328 HD13 LEU 42 HD13 LEU 42 4.157 13.234 -41.967 329 HD21 LEU 42 HD21 LEU 42 4.305 11.942 -38.520 330 HD22 LEU 42 HD22 LEU 42 5.974 12.421 -38.210 331 HD23 LEU 42 HD23 LEU 42 5.630 11.068 -39.287 332 H GLU 43 HN GLU 43 4.719 15.601 -42.443 333 HA GLU 43 HA GLU 43 5.256 17.558 -40.334 334 HB2 GLU 43 HB2 GLU 43 6.214 18.518 -42.372 335 HB3 GLU 43 HB1 GLU 43 4.687 18.287 -43.214 336 HG2 GLU 43 HG2 GLU 43 3.600 19.879 -41.756 337 HG3 GLU 43 HG1 GLU 43 5.075 20.060 -40.811 338 H LEU 44 HN LEU 44 3.516 17.842 -39.150 339 HA LEU 44 HA LEU 44 0.895 17.177 -40.254 340 HB2 LEU 44 HB2 LEU 44 1.881 17.603 -37.442 341 HB3 LEU 44 HB1 LEU 44 0.170 17.583 -37.817 342 HG LEU 44 HG LEU 44 0.514 15.269 -38.775 343 HD11 LEU 44 HD11 LEU 44 2.478 14.028 -38.039 344 HD12 LEU 44 HD12 LEU 44 3.159 15.504 -37.354 345 HD13 LEU 44 HD13 LEU 44 2.925 15.366 -39.097 346 HD21 LEU 44 HD21 LEU 44 0.510 14.200 -36.577 347 HD22 LEU 44 HD22 LEU 44 -0.499 15.646 -36.602 348 HD23 LEU 44 HD23 LEU 44 1.096 15.697 -35.852 349 H VAL 45 HN VAL 45 -0.304 18.712 -41.052 350 HA VAL 45 HA VAL 45 0.332 21.506 -40.407 351 HB VAL 45 HB VAL 45 -1.251 20.445 -42.759 352 HG11 VAL 45 HG11 VAL 45 -0.850 22.664 -43.720 353 HG12 VAL 45 HG12 VAL 45 -0.036 23.155 -42.235 354 HG13 VAL 45 HG13 VAL 45 -1.755 22.760 -42.209 355 HG21 VAL 45 HG21 VAL 45 0.767 20.852 -44.100 356 HG22 VAL 45 HG22 VAL 45 1.036 19.616 -42.870 357 HG23 VAL 45 HG23 VAL 45 1.656 21.250 -42.629 358 H ASP 46 HN ASP 46 -1.114 22.751 -39.398 359 HA ASP 46 HA ASP 46 -3.576 21.585 -38.454 360 HB2 ASP 46 HB2 ASP 46 -2.208 23.035 -36.994 361 HB3 ASP 46 HB1 ASP 46 -2.472 24.384 -38.095 362 H LYS 47 HN LYS 47 -5.133 21.389 -39.947 363 HA LYS 47 HA LYS 47 -5.444 23.464 -41.976 364 HB2 LYS 47 HB2 LYS 47 -6.902 20.822 -41.755 365 HB3 LYS 47 HB1 LYS 47 -6.844 21.886 -43.154 366 HG2 LYS 47 HG2 LYS 47 -4.480 20.435 -41.977 367 HG3 LYS 47 HG1 LYS 47 -5.393 19.921 -43.396 368 HD2 LYS 47 HD2 LYS 47 -4.141 22.642 -43.270 369 HD3 LYS 47 HD1 LYS 47 -3.192 21.230 -43.733 370 HE2 LYS 47 HE2 LYS 47 -5.763 22.044 -45.080 371 HE3 LYS 47 HE1 LYS 47 -4.163 22.524 -45.645 372 HZ1 LYS 47 HZ1 LYS 47 -4.920 20.595 -46.844 373 HZ2 LYS 47 HZ2 LYS 47 -5.177 19.739 -45.403 374 HZ3 LYS 47 HZ3 LYS 47 -3.599 20.163 -45.868 375 H SER 48 HN SER 48 -6.126 24.715 -39.904 376 HA SER 48 HA SER 48 -8.808 24.250 -38.980 377 HB2 SER 48 HB2 SER 48 -8.286 26.530 -37.816 378 HB3 SER 48 HB1 SER 48 -7.434 25.075 -37.301 379 HG SER 48 HG SER 48 -5.630 25.928 -37.935 380 H CYS 49 HN CYS 49 -8.052 25.135 -41.846 381 HA CYS 49 HA CYS 49 -9.153 27.646 -42.374 382 HB2 CYS 49 HB2 CYS 49 -7.855 26.361 -44.017 383 HB3 CYS 49 HB1 CYS 49 -9.142 25.168 -44.113 384 HG CYS 49 HG CYS 49 -8.708 27.654 -46.041 385 H GLY 50 HN GLY 50 -10.681 24.455 -42.170 386 HA2 GLY 50 HA2 GLY 50 -13.246 25.792 -41.714 387 HA3 GLY 50 HA1 GLY 50 -13.151 24.635 -43.037 388 H CYS 51 HN CYS 51 -11.205 24.024 -40.272 389 HA CYS 51 HA CYS 51 -13.175 22.292 -39.029 390 HB2 CYS 51 HB2 CYS 51 -10.592 21.207 -40.184 391 HB3 CYS 51 HB1 CYS 51 -11.686 20.309 -39.138 392 HG CYS 51 HG CYS 51 -13.537 21.376 -41.545 393 H GLY 52 HN GLY 52 -12.569 21.628 -36.914 394 HA2 GLY 52 HA2 GLY 52 -10.178 23.002 -35.857 395 HA3 GLY 52 HA1 GLY 52 -11.686 22.866 -34.958 396 H THR 53 HN THR 53 -9.040 21.970 -34.181 397 HA THR 53 HA THR 53 -7.911 20.201 -33.338 398 HB THR 53 HB THR 53 -9.416 18.430 -32.225 399 HG1 THR 53 HG1 THR 53 -11.263 19.714 -33.654 400 HG21 THR 53 HG21 THR 53 -10.000 19.974 -30.404 401 HG22 THR 53 HG22 THR 53 -9.679 21.340 -31.471 402 HG23 THR 53 HG23 THR 53 -8.367 20.258 -31.007 403 H SER 54 HN SER 54 -8.001 20.057 -36.041 404 HA SER 54 HA SER 54 -7.840 17.184 -36.476 405 HB2 SER 54 HB2 SER 54 -9.455 19.004 -38.289 406 HB3 SER 54 HB1 SER 54 -9.107 17.300 -38.588 407 HG SER 54 HG SER 54 -10.601 18.380 -36.423 408 H PHE 55 HN PHE 55 -6.197 16.640 -37.871 409 HA PHE 55 HA PHE 55 -4.677 18.910 -38.971 410 HB2 PHE 55 HB2 PHE 55 -3.581 16.387 -37.712 411 HB3 PHE 55 HB1 PHE 55 -2.615 17.660 -38.447 412 HD1 PHE 55 HD1 PHE 55 -2.475 19.877 -37.373 413 HD2 PHE 55 HD2 PHE 55 -4.439 16.593 -35.512 414 HE1 PHE 55 HE1 PHE 55 -2.360 21.040 -35.207 415 HE2 PHE 55 HE2 PHE 55 -4.331 17.748 -33.343 416 HZ PHE 55 HZ PHE 55 -3.289 19.976 -33.190 417 H ASP 56 HN ASP 56 -3.295 18.416 -40.769 418 HA ASP 56 HA ASP 56 -4.032 15.980 -42.268 419 HB2 ASP 56 HB2 ASP 56 -4.766 18.059 -43.394 420 HB3 ASP 56 HB1 ASP 56 -3.115 18.662 -43.346 421 H ALA 57 HN ALA 57 -2.362 14.608 -42.672 422 HA ALA 57 HA ALA 57 0.267 15.535 -41.737 423 HB1 ALA 57 HB1 ALA 57 -0.722 13.691 -40.464 424 HB2 ALA 57 HB2 ALA 57 0.777 13.209 -41.259 425 HB3 ALA 57 HB3 ALA 57 -0.777 12.714 -41.931 426 H VAL 58 HN VAL 58 1.636 16.028 -43.279 427 HA VAL 58 HA VAL 58 1.511 14.803 -45.895 428 HB VAL 58 HB VAL 58 3.638 16.625 -44.742 429 HG11 VAL 58 HG11 VAL 58 4.403 15.385 -46.684 430 HG12 VAL 58 HG12 VAL 58 4.189 17.089 -47.085 431 HG13 VAL 58 HG13 VAL 58 2.985 15.905 -47.595 432 HG21 VAL 58 HG21 VAL 58 1.472 17.718 -44.687 433 HG22 VAL 58 HG22 VAL 58 1.206 17.314 -46.383 434 HG23 VAL 58 HG23 VAL 58 2.492 18.435 -45.934 435 H ILE 59 HN ILE 59 2.234 12.795 -46.129 436 HA ILE 59 HA ILE 59 4.495 11.909 -44.482 437 HB ILE 59 HB ILE 59 2.533 10.576 -44.091 438 HG12 ILE 59 HG12 ILE 59 4.883 9.474 -44.451 439 HG13 ILE 59 HG11 ILE 59 3.462 8.463 -44.237 440 HG21 ILE 59 HG21 ILE 59 1.411 9.291 -45.852 441 HG22 ILE 59 HG22 ILE 59 2.419 10.090 -47.058 442 HG23 ILE 59 HG23 ILE 59 1.283 11.034 -46.096 443 HD11 ILE 59 HD11 ILE 59 4.776 9.134 -46.864 444 HD12 ILE 59 HD12 ILE 59 3.345 8.126 -46.660 445 HD13 ILE 59 HD13 ILE 59 4.894 7.602 -45.997 446 H VAL 60 HN VAL 60 6.360 11.982 -45.475 447 HA VAL 60 HA VAL 60 6.471 11.428 -48.367 448 HB VAL 60 HB VAL 60 8.443 12.923 -46.624 449 HG11 VAL 60 HG11 VAL 60 9.575 11.731 -48.415 450 HG12 VAL 60 HG12 VAL 60 9.586 13.468 -48.728 451 HG13 VAL 60 HG13 VAL 60 8.463 12.422 -49.598 452 HG21 VAL 60 HG21 VAL 60 6.392 14.178 -47.025 453 HG22 VAL 60 HG22 VAL 60 6.554 13.911 -48.760 454 HG23 VAL 60 HG23 VAL 60 7.745 14.891 -47.905 455 H SER 61 HN SER 61 6.866 9.300 -48.607 456 HA SER 61 HA SER 61 9.282 8.193 -47.467 457 HB2 SER 61 HB2 SER 61 7.674 7.784 -45.662 458 HB3 SER 61 HB1 SER 61 6.583 6.991 -46.799 459 HG SER 61 HG SER 61 8.422 5.836 -45.389 460 H ASN 62 HN ASN 62 10.022 6.365 -48.512 461 HA ASN 62 HA ASN 62 9.180 5.956 -51.189 462 HB2 ASN 62 HB2 ASN 62 11.142 4.528 -49.420 463 HB3 ASN 62 HB1 ASN 62 10.750 3.920 -51.024 464 HD21 ASN 62 HD21 ASN 62 12.294 6.434 -49.212 465 HD22 ASN 62 HD22 ASN 62 13.134 7.150 -50.542 466 H ASN 63 HN ASN 63 8.120 4.671 -48.226 467 HA ASN 63 HA ASN 63 7.307 2.107 -48.723 468 HB2 ASN 63 HB2 ASN 63 7.041 3.266 -46.569 469 HB3 ASN 63 HB1 ASN 63 5.740 4.235 -47.248 470 HD21 ASN 63 HD21 ASN 63 3.715 3.325 -47.513 471 HD22 ASN 63 HD22 ASN 63 3.286 1.791 -46.845 472 H PHE 64 HN PHE 64 6.005 4.986 -50.198 473 HA PHE 64 HA PHE 64 3.871 3.354 -51.410 474 HB2 PHE 64 HB2 PHE 64 3.877 6.312 -50.798 475 HB3 PHE 64 HB1 PHE 64 2.624 5.492 -51.723 476 HD1 PHE 64 HD2 PHE 64 1.491 3.469 -50.522 477 HD2 PHE 64 HD1 PHE 64 3.617 6.570 -48.528 478 HE1 PHE 64 HE2 PHE 64 0.295 2.944 -48.438 479 HE2 PHE 64 HE1 PHE 64 2.427 6.049 -46.440 480 HZ PHE 64 HZ PHE 64 0.761 4.234 -46.392 481 H GLU 65 HN GLU 65 6.778 4.098 -52.294 482 HA GLU 65 HA GLU 65 6.451 5.863 -54.505 483 HB2 GLU 65 HB2 GLU 65 8.718 5.237 -55.180 484 HB3 GLU 65 HB1 GLU 65 8.635 5.628 -53.474 485 HG2 GLU 65 HG2 GLU 65 10.062 3.784 -53.627 486 HG3 GLU 65 HG1 GLU 65 8.534 3.138 -53.044 487 H ASP 66 HN ASP 66 5.684 2.594 -54.110 488 HA ASP 66 HA ASP 66 5.912 1.889 -56.913 489 HB2 ASP 66 HB2 ASP 66 6.264 0.246 -55.050 490 HB3 ASP 66 HB1 ASP 66 4.555 0.387 -54.658 491 H LYS 67 HN LYS 67 4.112 4.083 -55.750 492 HA LYS 67 HA LYS 67 2.043 4.977 -56.026 493 HB2 LYS 67 HB2 LYS 67 1.956 3.042 -58.350 494 HB3 LYS 67 HB1 LYS 67 0.780 4.316 -58.073 495 HG2 LYS 67 HG2 LYS 67 2.695 5.948 -58.208 496 HG3 LYS 67 HG1 LYS 67 3.684 4.602 -58.775 497 HD2 LYS 67 HD2 LYS 67 1.091 5.392 -60.086 498 HD3 LYS 67 HD1 LYS 67 2.643 6.072 -60.562 499 HE2 LYS 67 HE2 LYS 67 2.084 4.268 -62.051 500 HE3 LYS 67 HE1 LYS 67 3.454 3.789 -61.055 501 HZ1 LYS 67 HZ1 LYS 67 2.080 2.395 -59.763 502 HZ2 LYS 67 HZ2 LYS 67 1.684 2.066 -61.375 503 HZ3 LYS 67 HZ3 LYS 67 0.654 3.025 -60.425 504 H LYS 68 HN LYS 68 2.058 3.317 -54.005 505 HA LYS 68 HA LYS 68 0.254 1.106 -54.315 506 HB2 LYS 68 HB2 LYS 68 1.234 2.374 -51.754 507 HB3 LYS 68 HB1 LYS 68 0.544 0.770 -51.943 508 HG2 LYS 68 HG2 LYS 68 3.152 1.685 -53.136 509 HG3 LYS 68 HG1 LYS 68 2.979 0.730 -51.663 510 HD2 LYS 68 HD2 LYS 68 2.008 -0.122 -54.389 511 HD3 LYS 68 HD1 LYS 68 3.535 -0.626 -53.664 512 HE2 LYS 68 HE2 LYS 68 2.275 -1.618 -51.785 513 HE3 LYS 68 HE1 LYS 68 0.770 -1.169 -52.584 514 HZ1 LYS 68 HZ1 LYS 68 1.433 -2.569 -54.470 515 HZ2 LYS 68 HZ2 LYS 68 1.289 -3.461 -53.034 516 HZ3 LYS 68 HZ3 LYS 68 2.826 -3.047 -53.627 517 H LEU 69 HN LEU 69 -1.644 2.066 -55.095 518 HA LEU 69 HA LEU 69 -3.027 4.095 -53.639 519 HB2 LEU 69 HB2 LEU 69 -3.298 3.661 -56.078 520 HB3 LEU 69 HB1 LEU 69 -4.086 2.144 -55.695 521 HG LEU 69 HG LEU 69 -5.223 4.715 -54.648 522 HD11 LEU 69 HD11 LEU 69 -6.601 4.876 -56.668 523 HD12 LEU 69 HD12 LEU 69 -5.684 3.556 -57.394 524 HD13 LEU 69 HD13 LEU 69 -4.889 5.088 -57.034 525 HD21 LEU 69 HD21 LEU 69 -7.317 3.460 -54.808 526 HD22 LEU 69 HD22 LEU 69 -6.132 2.599 -53.824 527 HD23 LEU 69 HD23 LEU 69 -6.444 2.084 -55.481 528 H LEU 70 HN LEU 70 -3.575 0.622 -54.086 529 HA LEU 70 HA LEU 70 -5.661 0.501 -52.187 530 HB2 LEU 70 HB2 LEU 70 -5.626 -1.880 -52.451 531 HB3 LEU 70 HB1 LEU 70 -5.462 -1.125 -54.014 532 HG LEU 70 HG LEU 70 -4.089 -3.029 -54.058 533 HD11 LEU 70 HD11 LEU 70 -1.826 -2.220 -54.347 534 HD12 LEU 70 HD12 LEU 70 -2.233 -0.735 -53.496 535 HD13 LEU 70 HD13 LEU 70 -2.996 -1.100 -55.041 536 HD21 LEU 70 HD21 LEU 70 -2.896 -2.186 -51.429 537 HD22 LEU 70 HD22 LEU 70 -2.393 -3.576 -52.391 538 HD23 LEU 70 HD23 LEU 70 -4.014 -3.524 -51.696 539 H ASP 71 HN ASP 71 -2.203 0.195 -51.944 540 HA ASP 71 HA ASP 71 -2.221 -1.005 -49.360 541 HB2 ASP 71 HB2 ASP 71 -0.314 -1.149 -50.990 542 HB3 ASP 71 HB1 ASP 71 0.045 0.533 -50.615 543 H ARG 72 HN ARG 72 -2.021 2.291 -50.595 544 HA ARG 72 HA ARG 72 -1.602 3.603 -48.142 545 HB2 ARG 72 HB2 ARG 72 -1.503 4.614 -50.481 546 HB3 ARG 72 HB1 ARG 72 -3.257 4.662 -50.445 547 HG2 ARG 72 HG2 ARG 72 -2.050 5.906 -48.106 548 HG3 ARG 72 HG1 ARG 72 -1.552 6.656 -49.621 549 HD2 ARG 72 HD2 ARG 72 -3.478 7.828 -48.940 550 HD3 ARG 72 HD1 ARG 72 -4.015 6.748 -50.224 551 HE ARG 72 HE ARG 72 -4.361 5.491 -47.726 552 HH11 ARG 72 HH11 ARG 72 -5.724 8.102 -49.655 553 HH12 ARG 72 HH12 ARG 72 -7.299 7.957 -48.934 554 HH21 ARG 72 HH21 ARG 72 -6.441 5.333 -46.793 555 HH22 ARG 72 HH22 ARG 72 -7.708 6.398 -47.325 556 H HIS 73 HN HIS 73 -4.498 2.454 -49.772 557 HA HIS 73 HA HIS 73 -6.383 3.567 -47.989 558 HB2 HIS 73 HB2 HIS 73 -6.885 2.683 -50.278 559 HB3 HIS 73 HB1 HIS 73 -6.673 1.055 -49.651 560 HD1 HIS 73 HD1 HIS 73 -9.040 3.942 -49.652 561 HD2 HIS 73 HD2 HIS 73 -8.799 0.093 -48.097 562 HE1 HIS 73 HE1 HIS 73 -11.356 3.388 -48.849 563 HE2 HIS 73 HE2 HIS 73 -11.232 0.961 -48.181 564 H ARG 74 HN ARG 74 -4.942 0.313 -48.159 565 HA ARG 74 HA ARG 74 -6.376 -0.694 -45.941 566 HB2 ARG 74 HB2 ARG 74 -4.843 -2.607 -46.057 567 HB3 ARG 74 HB1 ARG 74 -5.453 -2.170 -47.646 568 HG2 ARG 74 HG2 ARG 74 -3.304 -0.858 -47.938 569 HG3 ARG 74 HG1 ARG 74 -2.722 -1.697 -46.504 570 HD2 ARG 74 HD2 ARG 74 -3.708 -3.050 -49.011 571 HD3 ARG 74 HD1 ARG 74 -2.014 -2.765 -48.619 572 HE ARG 74 HE ARG 74 -3.833 -4.595 -47.198 573 HH11 ARG 74 HH11 ARG 74 -0.582 -3.428 -47.888 574 HH12 ARG 74 HH12 ARG 74 0.184 -4.798 -47.142 575 HH21 ARG 74 HH21 ARG 74 -2.822 -6.376 -46.236 576 HH22 ARG 74 HH22 ARG 74 -1.091 -6.487 -46.203 577 H LEU 75 HN LEU 75 -3.027 0.547 -46.201 578 HA LEU 75 HA LEU 75 -2.286 -0.044 -43.558 579 HB2 LEU 75 HB2 LEU 75 -1.230 1.646 -45.728 580 HB3 LEU 75 HB1 LEU 75 -0.744 2.114 -44.110 581 HG LEU 75 HG LEU 75 0.885 0.626 -45.240 582 HD11 LEU 75 HD11 LEU 75 -0.435 -0.533 -42.792 583 HD12 LEU 75 HD12 LEU 75 0.804 0.723 -42.816 584 HD13 LEU 75 HD13 LEU 75 1.191 -0.910 -43.360 585 HD21 LEU 75 HD21 LEU 75 0.357 -1.747 -45.496 586 HD22 LEU 75 HD22 LEU 75 -0.671 -0.744 -46.518 587 HD23 LEU 75 HD23 LEU 75 -1.312 -1.429 -45.024 588 H VAL 76 HN VAL 76 -3.622 2.933 -44.953 589 HA VAL 76 HA VAL 76 -3.577 4.456 -42.604 590 HB VAL 76 HB VAL 76 -5.365 4.612 -45.029 591 HG11 VAL 76 HG11 VAL 76 -6.132 6.791 -44.220 592 HG12 VAL 76 HG12 VAL 76 -5.272 6.529 -42.703 593 HG13 VAL 76 HG13 VAL 76 -6.629 5.492 -43.138 594 HG21 VAL 76 HG21 VAL 76 -4.040 6.626 -45.489 595 HG22 VAL 76 HG22 VAL 76 -3.023 5.190 -45.362 596 HG23 VAL 76 HG23 VAL 76 -3.103 6.337 -44.023 597 H ASN 77 HN ASN 77 -6.039 2.230 -43.864 598 HA ASN 77 HA ASN 77 -7.945 2.781 -41.843 599 HB2 ASN 77 HB2 ASN 77 -7.558 0.521 -43.782 600 HB3 ASN 77 HB1 ASN 77 -8.770 0.393 -42.513 601 HD21 ASN 77 HD21 ASN 77 -8.003 3.482 -43.893 602 HD22 ASN 77 HD22 ASN 77 -9.468 3.673 -44.789 603 H THR 78 HN THR 78 -5.383 0.341 -42.104 604 HA THR 78 HA THR 78 -6.088 -1.149 -39.839 605 HB THR 78 HB THR 78 -3.319 -0.790 -41.005 606 HG1 THR 78 HG1 THR 78 -5.224 -2.844 -41.553 607 HG21 THR 78 HG21 THR 78 -2.887 -3.008 -40.046 608 HG22 THR 78 HG22 THR 78 -4.500 -3.015 -39.334 609 HG23 THR 78 HG23 THR 78 -3.302 -1.840 -38.790 610 H ILE 79 HN ILE 79 -3.563 1.397 -40.122 611 HA ILE 79 HA ILE 79 -3.096 1.286 -37.279 612 HB ILE 79 HB ILE 79 -1.996 3.136 -39.395 613 HG12 ILE 79 HG12 ILE 79 0.148 1.906 -38.461 614 HG13 ILE 79 HG11 ILE 79 -1.029 0.687 -37.987 615 HG21 ILE 79 HG21 ILE 79 -0.452 3.985 -37.692 616 HG22 ILE 79 HG22 ILE 79 -1.309 3.058 -36.461 617 HG23 ILE 79 HG23 ILE 79 -2.129 4.371 -37.306 618 HD11 ILE 79 HD11 ILE 79 -0.050 0.156 -40.125 619 HD12 ILE 79 HD12 ILE 79 -0.557 1.719 -40.766 620 HD13 ILE 79 HD13 ILE 79 -1.767 0.518 -40.310 621 H LEU 80 HN LEU 80 -4.570 3.646 -39.502 622 HA LEU 80 HA LEU 80 -4.975 5.527 -37.394 623 HB2 LEU 80 HB2 LEU 80 -5.876 5.469 -40.255 624 HB3 LEU 80 HB1 LEU 80 -6.442 6.700 -39.144 625 HG LEU 80 HG LEU 80 -4.024 7.310 -38.734 626 HD11 LEU 80 HD11 LEU 80 -3.575 5.549 -41.138 627 HD12 LEU 80 HD12 LEU 80 -2.991 5.240 -39.504 628 HD13 LEU 80 HD13 LEU 80 -2.385 6.628 -40.411 629 HD21 LEU 80 HD21 LEU 80 -5.472 8.628 -40.178 630 HD22 LEU 80 HD22 LEU 80 -5.086 7.578 -41.541 631 HD23 LEU 80 HD23 LEU 80 -3.828 8.578 -40.816 632 H LYS 81 HN LYS 81 -6.687 2.741 -38.282 633 HA LYS 81 HA LYS 81 -9.272 3.258 -37.484 634 HB2 LYS 81 HB2 LYS 81 -8.755 1.027 -38.062 635 HB3 LYS 81 HB1 LYS 81 -7.423 0.948 -36.921 636 HG2 LYS 81 HG2 LYS 81 -9.292 -0.407 -36.184 637 HG3 LYS 81 HG1 LYS 81 -8.991 0.918 -35.063 638 HD2 LYS 81 HD2 LYS 81 -10.845 2.175 -36.067 639 HD3 LYS 81 HD1 LYS 81 -11.146 0.835 -37.177 640 HE2 LYS 81 HE2 LYS 81 -11.635 -0.635 -35.308 641 HE3 LYS 81 HE1 LYS 81 -11.264 0.657 -34.169 642 HZ1 LYS 81 HZ1 LYS 81 -13.667 0.295 -34.602 643 HZ2 LYS 81 HZ2 LYS 81 -13.429 0.831 -36.192 644 HZ3 LYS 81 HZ3 LYS 81 -13.143 1.876 -34.885 645 H GLU 82 HN GLU 82 -6.516 2.523 -35.378 646 HA GLU 82 HA GLU 82 -7.900 3.254 -32.976 647 HB2 GLU 82 HB2 GLU 82 -6.111 1.554 -33.035 648 HB3 GLU 82 HB1 GLU 82 -4.956 2.779 -33.535 649 HG2 GLU 82 HG2 GLU 82 -5.343 3.943 -31.382 650 HG3 GLU 82 HG1 GLU 82 -6.370 2.595 -30.891 651 H GLU 83 HN GLU 83 -5.555 4.758 -35.113 652 HA GLU 83 HA GLU 83 -4.729 6.946 -33.642 653 HB2 GLU 83 HB2 GLU 83 -3.836 6.226 -35.832 654 HB3 GLU 83 HB1 GLU 83 -5.294 6.835 -36.603 655 HG2 GLU 83 HG2 GLU 83 -3.804 8.527 -36.938 656 HG3 GLU 83 HG1 GLU 83 -4.664 9.071 -35.501 657 H LEU 84 HN LEU 84 -7.426 6.774 -35.912 658 HA LEU 84 HA LEU 84 -8.329 9.350 -35.882 659 HB2 LEU 84 HB2 LEU 84 -9.954 6.824 -36.091 660 HB3 LEU 84 HB1 LEU 84 -10.604 8.421 -36.398 661 HG LEU 84 HG LEU 84 -8.430 7.035 -37.960 662 HD11 LEU 84 HD11 LEU 84 -10.664 6.182 -38.402 663 HD12 LEU 84 HD12 LEU 84 -10.053 7.091 -39.784 664 HD13 LEU 84 HD13 LEU 84 -11.242 7.821 -38.706 665 HD21 LEU 84 HD21 LEU 84 -8.498 8.970 -39.454 666 HD22 LEU 84 HD22 LEU 84 -7.976 9.424 -37.831 667 HD23 LEU 84 HD23 LEU 84 -9.621 9.776 -38.356 668 H GLN 85 HN GLN 85 -8.780 6.988 -33.337 669 HA GLN 85 HA GLN 85 -11.076 7.950 -32.112 670 HB2 GLN 85 HB2 GLN 85 -8.637 6.888 -30.680 671 HB3 GLN 85 HB1 GLN 85 -10.264 6.976 -30.030 672 HG2 GLN 85 HG2 GLN 85 -9.127 5.108 -32.054 673 HG3 GLN 85 HG1 GLN 85 -10.059 4.757 -30.602 674 HE21 GLN 85 HE21 GLN 85 -10.131 5.406 -33.943 675 HE22 GLN 85 HE22 GLN 85 -11.829 5.252 -34.170 676 H ASN 86 HN ASN 86 -7.906 9.384 -32.200 677 HA ASN 86 HA ASN 86 -8.601 11.231 -30.023 678 HB2 ASN 86 HB2 ASN 86 -5.951 10.908 -31.451 679 HB3 ASN 86 HB1 ASN 86 -6.250 11.860 -30.002 680 HD21 ASN 86 HD21 ASN 86 -5.701 8.727 -31.307 681 HD22 ASN 86 HD22 ASN 86 -5.583 7.885 -29.801 682 H ILE 87 HN ILE 87 -9.139 11.115 -33.206 683 HA ILE 87 HA ILE 87 -8.742 14.012 -33.589 684 HB ILE 87 HB ILE 87 -8.582 12.384 -36.040 685 HG12 ILE 87 HG12 ILE 87 -6.246 12.397 -34.112 686 HG13 ILE 87 HG11 ILE 87 -7.260 10.998 -34.444 687 HG21 ILE 87 HG21 ILE 87 -8.304 14.802 -36.045 688 HG22 ILE 87 HG22 ILE 87 -6.821 14.009 -36.578 689 HG23 ILE 87 HG23 ILE 87 -6.935 14.662 -34.944 690 HD11 ILE 87 HD11 ILE 87 -5.525 12.434 -36.435 691 HD12 ILE 87 HD12 ILE 87 -6.540 11.031 -36.772 692 HD13 ILE 87 HD13 ILE 87 -5.174 10.885 -35.668 693 H HIS 88 HN HIS 88 -10.071 14.693 -35.651 694 HA HIS 88 HA HIS 88 -12.602 13.173 -35.701 695 HB2 HIS 88 HB2 HIS 88 -12.414 16.150 -36.164 696 HB3 HIS 88 HB1 HIS 88 -13.862 15.187 -35.903 697 HD1 HIS 88 HD1 HIS 88 -13.950 14.074 -33.365 698 HD2 HIS 88 HD2 HIS 88 -11.534 17.399 -33.986 699 HE1 HIS 88 HE1 HIS 88 -13.516 15.027 -31.074 700 HE2 HIS 88 HE2 HIS 88 -12.218 17.152 -31.490 701 H ALA 89 HN ALA 89 -11.242 15.879 -37.533 702 HA ALA 89 HA ALA 89 -11.996 14.492 -40.009 703 HB1 ALA 89 HB1 ALA 89 -13.108 16.609 -39.672 704 HB2 ALA 89 HB2 ALA 89 -11.958 16.768 -41.002 705 HB3 ALA 89 HB3 ALA 89 -11.564 17.417 -39.406 706 H PHE 90 HN PHE 90 -9.805 13.384 -39.242 707 HA PHE 90 HA PHE 90 -7.406 14.840 -39.808 708 HB2 PHE 90 HB2 PHE 90 -7.513 12.963 -38.179 709 HB3 PHE 90 HB1 PHE 90 -7.795 11.854 -39.514 710 HD1 PHE 90 HD1 PHE 90 -5.344 14.268 -38.138 711 HD2 PHE 90 HD2 PHE 90 -6.008 10.942 -40.708 712 HE1 PHE 90 HE1 PHE 90 -2.915 14.009 -38.425 713 HE2 PHE 90 HE2 PHE 90 -3.581 10.678 -41.001 714 HZ PHE 90 HZ PHE 90 -2.031 12.213 -39.858 715 H SER 91 HN SER 91 -6.048 14.666 -41.559 716 HA SER 91 HA SER 91 -6.909 13.055 -43.843 717 HB2 SER 91 HB2 SER 91 -7.905 15.245 -44.237 718 HB3 SER 91 HB1 SER 91 -6.364 16.038 -43.918 719 HG SER 91 HG SER 91 -5.624 15.459 -45.833 720 H MET 92 HN MET 92 -5.114 13.100 -45.577 721 HA MET 92 HA MET 92 -2.464 13.578 -44.491 722 HB2 MET 92 HB2 MET 92 -1.673 11.327 -44.759 723 HB3 MET 92 HB1 MET 92 -3.097 11.280 -43.732 724 HG2 MET 92 HG2 MET 92 -3.105 10.661 -46.678 725 HG3 MET 92 HG1 MET 92 -2.968 9.452 -45.407 726 HE1 MET 92 HE1 MET 92 -4.943 10.619 -43.191 727 HE2 MET 92 HE2 MET 92 -4.918 8.919 -43.657 728 HE3 MET 92 HE3 MET 92 -6.446 9.799 -43.610 729 H LYS 93 HN LYS 93 -0.836 13.665 -46.063 730 HA LYS 93 HA LYS 93 -1.759 13.478 -48.861 731 HB2 LYS 93 HB2 LYS 93 0.153 15.528 -47.717 732 HB3 LYS 93 HB1 LYS 93 -0.297 15.383 -49.410 733 HG2 LYS 93 HG2 LYS 93 -2.148 16.077 -47.139 734 HG3 LYS 93 HG1 LYS 93 -1.493 17.200 -48.331 735 HD2 LYS 93 HD2 LYS 93 -2.711 16.155 -50.096 736 HD3 LYS 93 HD1 LYS 93 -3.183 14.811 -49.051 737 HE2 LYS 93 HE2 LYS 93 -4.490 16.360 -47.668 738 HE3 LYS 93 HE1 LYS 93 -4.028 17.690 -48.729 739 HZ1 LYS 93 HZ1 LYS 93 -5.217 16.705 -50.525 740 HZ2 LYS 93 HZ2 LYS 93 -6.257 16.744 -49.187 741 HZ3 LYS 93 HZ3 LYS 93 -5.518 15.288 -49.642 742 H CYS 94 HN CYS 94 -0.766 11.791 -49.752 743 HA CYS 94 HA CYS 94 1.724 10.809 -48.667 744 HB2 CYS 94 HB2 CYS 94 1.357 9.012 -50.458 745 HB3 CYS 94 HB1 CYS 94 0.183 9.105 -49.148 746 HG CYS 94 HG CYS 94 -0.303 9.321 -52.394 747 H HIS 95 HN HIS 95 3.666 11.177 -49.417 748 HA HIS 95 HA HIS 95 4.082 11.844 -52.235 749 HB2 HIS 95 HB2 HIS 95 5.028 13.521 -49.903 750 HB3 HIS 95 HB1 HIS 95 5.745 13.622 -51.505 751 HD1 HIS 95 HD1 HIS 95 3.083 15.010 -49.475 752 HD2 HIS 95 HD2 HIS 95 3.788 14.466 -53.534 753 HE1 HIS 95 HE1 HIS 95 1.510 16.581 -50.650 754 HE2 HIS 95 HE2 HIS 95 2.103 16.379 -53.099 755 H THR 96 HN THR 96 6.385 11.647 -52.845 756 HA THR 96 HA THR 96 7.784 9.741 -51.090 757 HB THR 96 HB THR 96 9.032 9.143 -53.261 758 HG1 THR 96 HG1 THR 96 6.679 9.998 -54.571 759 HG21 THR 96 HG21 THR 96 7.271 7.554 -53.912 760 HG22 THR 96 HG22 THR 96 6.111 8.456 -52.938 761 HG23 THR 96 HG23 THR 96 7.467 7.640 -52.162 762 HA PRO 97 HA PRO 97 11.159 12.465 -50.413 763 HB2 PRO 97 HB2 PRO 97 12.995 10.263 -51.186 764 HB3 PRO 97 HB1 PRO 97 12.907 11.181 -49.679 765 HG2 PRO 97 HG2 PRO 97 12.029 8.672 -49.786 766 HG3 PRO 97 HG1 PRO 97 11.159 9.901 -48.846 767 HD2 PRO 97 HD2 PRO 97 10.508 8.762 -51.537 768 HD3 PRO 97 HD1 PRO 97 9.422 9.162 -50.190 769 H LEU 98 HN LEU 98 11.147 10.610 -53.372 770 HA LEU 98 HA LEU 98 13.136 11.990 -54.787 771 HB2 LEU 98 HB2 LEU 98 10.639 10.597 -55.750 772 HB3 LEU 98 HB1 LEU 98 11.837 11.265 -56.837 773 HG LEU 98 HG LEU 98 12.261 8.948 -56.722 774 HD11 LEU 98 HD11 LEU 98 14.205 10.336 -54.891 775 HD12 LEU 98 HD12 LEU 98 14.265 10.300 -56.653 776 HD13 LEU 98 HD13 LEU 98 14.493 8.812 -55.734 777 HD21 LEU 98 HD21 LEU 98 12.246 9.154 -53.715 778 HD22 LEU 98 HD22 LEU 98 12.574 7.701 -54.658 779 HD23 LEU 98 HD23 LEU 98 10.974 8.442 -54.706 780 H GLU 99 HN GLU 99 9.650 12.549 -54.537 781 HA GLU 99 HA GLU 99 9.637 14.884 -56.166 782 HB2 GLU 99 HB2 GLU 99 7.667 13.816 -54.141 783 HB3 GLU 99 HB1 GLU 99 7.357 15.209 -55.168 784 HG2 GLU 99 HG2 GLU 99 8.125 12.582 -56.361 785 HG3 GLU 99 HG1 GLU 99 6.463 12.896 -55.866 786 H TYR 100 HN TYR 100 9.790 14.279 -52.695 787 HA TYR 100 HA TYR 100 9.433 16.878 -51.774 788 HB2 TYR 100 HB2 TYR 100 9.395 15.033 -50.229 789 HB3 TYR 100 HB1 TYR 100 11.071 14.631 -50.592 790 HD1 TYR 100 HD1 TYR 100 9.047 17.524 -49.361 791 HD2 TYR 100 HD2 TYR 100 12.698 15.352 -49.119 792 HE1 TYR 100 HE1 TYR 100 9.797 19.000 -47.544 793 HE2 TYR 100 HE2 TYR 100 13.457 16.822 -47.300 794 HH TYR 100 HH TYR 100 11.366 18.999 -45.697 795 H ASP 101 HN ASP 101 12.397 15.268 -52.853 796 HA ASP 101 HA ASP 101 14.237 17.211 -52.039 797 HB2 ASP 101 HB2 ASP 101 14.917 14.997 -52.844 798 HB3 ASP 101 HB1 ASP 101 14.368 15.406 -54.467 799 H LYS 102 HN LYS 102 12.189 17.062 -54.899 800 HA LYS 102 HA LYS 102 13.434 19.309 -56.167 801 HB2 LYS 102 HB2 LYS 102 11.044 17.625 -56.708 802 HB3 LYS 102 HB1 LYS 102 11.051 19.241 -57.395 803 HG2 LYS 102 HG2 LYS 102 11.993 18.109 -59.119 804 HG3 LYS 102 HG1 LYS 102 13.454 18.495 -58.216 805 HD2 LYS 102 HD2 LYS 102 11.957 15.910 -57.849 806 HD3 LYS 102 HD1 LYS 102 13.215 16.110 -59.068 807 HE2 LYS 102 HE2 LYS 102 13.572 16.522 -56.102 808 HE3 LYS 102 HE1 LYS 102 14.041 15.075 -56.990 809 HZ1 LYS 102 HZ1 LYS 102 15.121 17.798 -57.503 810 HZ2 LYS 102 HZ2 LYS 102 15.623 16.353 -58.241 811 HZ3 LYS 102 HZ3 LYS 102 15.897 16.602 -56.582 812 H LEU 103 HN LEU 103 10.783 18.819 -53.950 813 HA LEU 103 HA LEU 103 9.669 21.424 -54.174 814 HB2 LEU 103 HB2 LEU 103 9.550 19.483 -51.863 815 HB3 LEU 103 HB1 LEU 103 8.527 20.891 -52.062 816 HG LEU 103 HG LEU 103 8.559 18.466 -53.862 817 HD11 LEU 103 HD11 LEU 103 7.553 18.021 -51.689 818 HD12 LEU 103 HD12 LEU 103 6.328 18.055 -52.957 819 HD13 LEU 103 HD13 LEU 103 6.511 19.433 -51.872 820 HD21 LEU 103 HD21 LEU 103 6.616 19.493 -54.933 821 HD22 LEU 103 HD22 LEU 103 8.054 20.499 -55.107 822 HD23 LEU 103 HD23 LEU 103 6.816 20.927 -53.926 823 H LYS 104 HN LYS 104 11.844 19.945 -51.778 824 HA LYS 104 HA LYS 104 12.243 22.332 -50.298 825 HB2 LYS 104 HB2 LYS 104 14.195 21.079 -49.305 826 HB3 LYS 104 HB1 LYS 104 12.636 20.279 -49.168 827 HG2 LYS 104 HG2 LYS 104 13.350 18.505 -50.290 828 HG3 LYS 104 HG1 LYS 104 14.014 19.499 -51.586 829 HD2 LYS 104 HD2 LYS 104 15.391 19.009 -48.948 830 HD3 LYS 104 HD1 LYS 104 15.697 18.075 -50.416 831 HE2 LYS 104 HE2 LYS 104 16.305 20.183 -51.565 832 HE3 LYS 104 HE1 LYS 104 16.119 21.035 -50.033 833 HZ1 LYS 104 HZ1 LYS 104 18.387 20.597 -50.237 834 HZ2 LYS 104 HZ2 LYS 104 18.144 19.007 -50.767 835 HZ3 LYS 104 HZ3 LYS 104 17.835 19.417 -49.149 836 H SER 105 HN SER 105 13.479 21.312 -53.279 837 HA SER 105 HA SER 105 16.050 22.407 -53.290 838 HB2 SER 105 HB2 SER 105 14.855 20.956 -55.068 839 HB3 SER 105 HB1 SER 105 14.220 22.477 -55.686 840 HG SER 105 HG SER 105 16.438 23.176 -55.875 841 H LYS 106 HN LYS 106 12.890 23.876 -53.721 842 HA LYS 106 HA LYS 106 14.190 26.516 -53.749 843 HB2 LYS 106 HB2 LYS 106 11.972 27.356 -54.615 844 HB3 LYS 106 HB1 LYS 106 12.911 26.380 -55.730 845 HG2 LYS 106 HG2 LYS 106 10.892 24.975 -54.087 846 HG3 LYS 106 HG1 LYS 106 10.297 26.059 -55.347 847 HD2 LYS 106 HD2 LYS 106 11.752 24.864 -56.973 848 HD3 LYS 106 HD1 LYS 106 12.172 23.722 -55.695 849 HE2 LYS 106 HE2 LYS 106 9.894 22.991 -55.513 850 HE3 LYS 106 HE1 LYS 106 9.350 24.257 -56.613 851 HZ1 LYS 106 HZ1 LYS 106 11.196 22.054 -57.367 852 HZ2 LYS 106 HZ2 LYS 106 10.534 23.220 -58.403 853 HZ3 LYS 106 HZ3 LYS 106 9.528 22.064 -57.681 854 H GLY 107 HN GLY 107 11.515 24.647 -52.423 855 HA2 GLY 107 HA2 GLY 107 11.070 24.752 -50.045 856 HA3 GLY 107 HA1 GLY 107 11.532 26.448 -50.089 857 H SER 108 HN SER 108 9.440 24.739 -52.341 858 HA SER 108 HA SER 108 7.324 26.672 -51.755 859 HB2 SER 108 HB2 SER 108 6.392 25.879 -53.955 860 HB3 SER 108 HB1 SER 108 7.988 26.620 -54.080 861 HG SER 108 HG SER 108 7.537 23.828 -53.858 Start of MODEL 13 1 H1 MET 1 HT1 MET 1 3.488 49.717 -62.511 2 H2 MET 1 HT2 MET 1 4.970 48.922 -62.272 3 H3 MET 1 HT3 MET 1 4.362 49.963 -61.078 4 HA MET 1 HA MET 1 2.533 48.512 -60.643 5 HB2 MET 1 HB2 MET 1 3.776 46.808 -62.813 6 HB3 MET 1 HB1 MET 1 2.520 46.248 -61.719 7 HG2 MET 1 HG2 MET 1 1.025 48.001 -62.573 8 HG3 MET 1 HG1 MET 1 2.283 48.497 -63.701 9 HE1 MET 1 HE1 MET 1 1.299 44.836 -62.588 10 HE2 MET 1 HE2 MET 1 0.137 44.408 -63.845 11 HE3 MET 1 HE3 MET 1 -0.246 45.679 -62.685 12 H GLY 2 HN GLY 2 2.730 46.617 -59.229 13 HA2 GLY 2 HA2 GLY 2 5.374 45.584 -58.708 14 HA3 GLY 2 HA1 GLY 2 4.810 46.712 -57.487 15 H SER 3 HN SER 3 5.401 43.813 -57.387 16 HA SER 3 HA SER 3 2.882 43.043 -56.092 17 HB2 SER 3 HB2 SER 3 3.203 41.779 -58.228 18 HB3 SER 3 HB1 SER 3 4.717 41.146 -57.585 19 HG SER 3 HG SER 3 2.109 40.441 -57.011 20 H SER 4 HN SER 4 3.442 43.406 -54.020 21 HA SER 4 HA SER 4 6.090 43.193 -53.046 22 HB2 SER 4 HB2 SER 4 3.487 43.382 -51.514 23 HB3 SER 4 HB1 SER 4 5.095 43.690 -50.858 24 HG SER 4 HG SER 4 5.301 45.419 -52.320 25 H HIS 5 HN HIS 5 7.141 41.660 -52.025 26 HA HIS 5 HA HIS 5 7.776 39.493 -51.705 27 HB2 HIS 5 HB2 HIS 5 7.176 38.735 -49.510 28 HB3 HIS 5 HB1 HIS 5 7.391 40.472 -49.501 29 HD1 HIS 5 HD1 HIS 5 6.080 39.823 -47.136 30 HD2 HIS 5 HD2 HIS 5 3.847 39.924 -50.640 31 HE1 HIS 5 HE1 HIS 5 3.680 40.032 -46.407 32 HE2 HIS 5 HE2 HIS 5 2.370 40.293 -48.548 33 H HIS 6 HN HIS 6 6.173 39.212 -53.822 34 HA HIS 6 HA HIS 6 4.261 37.096 -53.183 35 HB2 HIS 6 HB2 HIS 6 3.959 39.122 -54.873 36 HB3 HIS 6 HB1 HIS 6 4.748 38.009 -55.982 37 HD1 HIS 6 HD1 HIS 6 3.477 35.648 -56.313 38 HD2 HIS 6 HD2 HIS 6 1.301 38.690 -54.504 39 HE1 HIS 6 HE1 HIS 6 1.067 34.950 -56.489 40 HE2 HIS 6 HE2 HIS 6 -0.240 36.893 -55.544 41 H HIS 7 HN HIS 7 7.452 37.191 -53.593 42 HA HIS 7 HA HIS 7 7.591 34.758 -55.247 43 HB2 HIS 7 HB2 HIS 7 9.731 36.738 -54.438 44 HB3 HIS 7 HB1 HIS 7 10.075 35.222 -55.260 45 HD1 HIS 7 HD1 HIS 7 9.426 35.047 -57.759 46 HD2 HIS 7 HD2 HIS 7 8.664 38.762 -56.044 47 HE1 HIS 7 HE1 HIS 7 8.986 36.611 -59.685 48 HE2 HIS 7 HE2 HIS 7 8.747 38.891 -58.632 49 H HIS 8 HN HIS 8 6.761 35.006 -52.370 50 HA HIS 8 HA HIS 8 8.803 33.226 -51.209 51 HB2 HIS 8 HB2 HIS 8 6.927 35.109 -49.763 52 HB3 HIS 8 HB1 HIS 8 8.003 33.963 -48.977 53 HD1 HIS 8 HD1 HIS 8 8.024 37.143 -48.713 54 HD2 HIS 8 HD2 HIS 8 10.651 34.808 -50.935 55 HE1 HIS 8 HE1 HIS 8 10.107 38.531 -48.981 56 HE2 HIS 8 HE2 HIS 8 11.763 36.993 -50.098 57 H HIS 9 HN HIS 9 8.196 31.236 -50.766 58 HA HIS 9 HA HIS 9 5.733 30.465 -49.661 59 HB2 HIS 9 HB2 HIS 9 5.007 30.968 -52.067 60 HB3 HIS 9 HB1 HIS 9 5.990 29.587 -52.544 61 HD1 HIS 9 HD1 HIS 9 5.226 27.208 -51.470 62 HD2 HIS 9 HD2 HIS 9 2.500 30.353 -51.203 63 HE1 HIS 9 HE1 HIS 9 3.000 26.151 -50.965 64 HE2 HIS 9 HE2 HIS 9 1.345 28.052 -50.954 65 H HIS 10 HN HIS 10 6.386 28.813 -48.456 66 HA HIS 10 HA HIS 10 7.739 26.567 -49.658 67 HB2 HIS 10 HB2 HIS 10 9.196 28.489 -47.961 68 HB3 HIS 10 HB1 HIS 10 9.376 26.803 -47.490 69 HD1 HIS 10 HD1 HIS 10 10.355 25.179 -49.386 70 HD2 HIS 10 HD2 HIS 10 10.699 29.260 -50.114 71 HE1 HIS 10 HE1 HIS 10 12.096 25.404 -51.185 72 HE2 HIS 10 HE2 HIS 10 12.115 27.858 -51.761 73 H SER 11 HN SER 11 8.147 24.844 -47.965 74 HA SER 11 HA SER 11 5.814 24.510 -46.330 75 HB2 SER 11 HB2 SER 11 8.324 22.819 -46.389 76 HB3 SER 11 HB1 SER 11 6.715 22.324 -45.866 77 HG SER 11 HG SER 11 6.221 23.068 -48.214 78 H SER 12 HN SER 12 5.957 24.014 -44.005 79 HA SER 12 HA SER 12 6.422 24.608 -41.867 80 HB2 SER 12 HB2 SER 12 9.273 24.969 -42.815 81 HB3 SER 12 HB1 SER 12 8.734 24.687 -41.160 82 HG SER 12 HG SER 12 7.834 22.773 -42.918 83 H GLY 13 HN GLY 13 5.284 26.481 -41.643 84 HA2 GLY 13 HA2 GLY 13 6.815 28.980 -42.029 85 HA3 GLY 13 HA1 GLY 13 5.156 28.847 -42.592 86 H ARG 14 HN ARG 14 3.706 27.845 -40.669 87 HA ARG 14 HA ARG 14 4.261 29.541 -38.315 88 HB2 ARG 14 HB2 ARG 14 1.985 30.293 -38.236 89 HB3 ARG 14 HB1 ARG 14 2.588 30.592 -39.857 90 HG2 ARG 14 HG2 ARG 14 0.943 28.177 -39.146 91 HG3 ARG 14 HG1 ARG 14 0.241 29.698 -39.693 92 HD2 ARG 14 HD2 ARG 14 1.379 29.535 -41.798 93 HD3 ARG 14 HD1 ARG 14 2.298 28.136 -41.244 94 HE ARG 14 HE ARG 14 -0.379 27.441 -41.030 95 HH11 ARG 14 HH11 ARG 14 1.838 28.366 -43.591 96 HH12 ARG 14 HH12 ARG 14 1.033 27.428 -44.800 97 HH21 ARG 14 HH21 ARG 14 -1.437 26.223 -42.603 98 HH22 ARG 14 HH22 ARG 14 -0.846 26.199 -44.235 99 H GLU 15 HN GLU 15 3.616 26.513 -39.460 100 HA GLU 15 HA GLU 15 2.186 25.627 -37.055 101 HB2 GLU 15 HB2 GLU 15 1.571 23.645 -38.334 102 HB3 GLU 15 HB1 GLU 15 1.120 25.094 -39.217 103 HG2 GLU 15 HG2 GLU 15 3.516 23.348 -39.763 104 HG3 GLU 15 HG1 GLU 15 2.031 23.412 -40.708 105 H ASN 16 HN ASN 16 5.184 25.613 -38.629 106 HA ASN 16 HA ASN 16 6.272 23.182 -37.723 107 HB2 ASN 16 HB2 ASN 16 8.382 23.994 -38.450 108 HB3 ASN 16 HB1 ASN 16 7.188 24.643 -39.564 109 HD21 ASN 16 HD21 ASN 16 6.292 26.724 -37.697 110 HD22 ASN 16 HD22 ASN 16 7.562 27.899 -37.642 111 H LEU 17 HN LEU 17 5.176 25.536 -35.783 112 HA LEU 17 HA LEU 17 7.240 25.748 -33.846 113 HB2 LEU 17 HB2 LEU 17 4.276 26.205 -33.789 114 HB3 LEU 17 HB1 LEU 17 5.193 26.214 -32.296 115 HG LEU 17 HG LEU 17 6.623 28.034 -33.276 116 HD11 LEU 17 HD11 LEU 17 6.147 27.623 -35.635 117 HD12 LEU 17 HD12 LEU 17 5.761 29.282 -35.177 118 HD13 LEU 17 HD13 LEU 17 4.468 28.100 -35.380 119 HD21 LEU 17 HD21 LEU 17 4.849 28.518 -31.688 120 HD22 LEU 17 HD22 LEU 17 3.672 28.588 -33.001 121 HD23 LEU 17 HD23 LEU 17 4.958 29.791 -32.904 122 H TYR 18 HN TYR 18 4.836 23.356 -34.596 123 HA TYR 18 HA TYR 18 5.339 21.854 -32.177 124 HB2 TYR 18 HB2 TYR 18 3.791 21.113 -34.673 125 HB3 TYR 18 HB1 TYR 18 3.857 20.157 -33.195 126 HD1 TYR 18 HD1 TYR 18 2.842 21.061 -31.100 127 HD2 TYR 18 HD2 TYR 18 2.328 22.985 -34.860 128 HE1 TYR 18 HE1 TYR 18 0.955 22.340 -30.180 129 HE2 TYR 18 HE2 TYR 18 0.437 24.268 -33.950 130 HH TYR 18 HH TYR 18 -0.229 24.444 -30.621 131 H PHE 19 HN PHE 19 7.471 21.445 -32.197 132 HA PHE 19 HA PHE 19 8.750 20.379 -34.586 133 HB2 PHE 19 HB2 PHE 19 10.851 20.867 -33.420 134 HB3 PHE 19 HB1 PHE 19 9.798 22.278 -33.427 135 HD1 PHE 19 HD1 PHE 19 8.395 22.703 -31.311 136 HD2 PHE 19 HD2 PHE 19 11.734 20.069 -31.434 137 HE1 PHE 19 HE1 PHE 19 8.586 22.838 -28.869 138 HE2 PHE 19 HE2 PHE 19 11.936 20.206 -28.987 139 HZ PHE 19 HZ PHE 19 10.359 21.592 -27.699 140 H GLN 20 HN GLN 20 6.970 18.862 -32.615 141 HA GLN 20 HA GLN 20 6.773 16.674 -32.008 142 HB2 GLN 20 HB2 GLN 20 9.452 16.481 -33.383 143 HB3 GLN 20 HB1 GLN 20 8.707 15.099 -32.600 144 HG2 GLN 20 HG2 GLN 20 8.321 15.052 -34.982 145 HG3 GLN 20 HG1 GLN 20 6.804 15.259 -34.117 146 HE21 GLN 20 HE21 GLN 20 5.602 17.069 -34.452 147 HE22 GLN 20 HE22 GLN 20 6.016 18.300 -35.595 148 H GLY 21 HN GLY 21 8.224 18.813 -30.388 149 HA2 GLY 21 HA2 GLY 21 10.033 17.211 -28.765 150 HA3 GLY 21 HA1 GLY 21 9.755 18.937 -28.612 151 H HIS 22 HN HIS 22 7.471 19.498 -27.853 152 HA HIS 22 HA HIS 22 7.196 18.358 -25.273 153 HB2 HIS 22 HB2 HIS 22 6.703 20.746 -25.828 154 HB3 HIS 22 HB1 HIS 22 5.274 20.211 -26.705 155 HD1 HIS 22 HD1 HIS 22 6.537 20.935 -23.295 156 HD2 HIS 22 HD2 HIS 22 3.159 19.252 -25.047 157 HE1 HIS 22 HE1 HIS 22 4.818 20.789 -21.463 158 HE2 HIS 22 HE2 HIS 22 2.849 19.606 -22.502 159 H MET 23 HN MET 23 5.890 16.821 -24.516 160 HA MET 23 HA MET 23 4.568 14.977 -26.117 161 HB2 MET 23 HB2 MET 23 5.238 14.452 -23.847 162 HB3 MET 23 HB1 MET 23 4.137 15.661 -23.204 163 HG2 MET 23 HG2 MET 23 2.234 14.367 -24.012 164 HG3 MET 23 HG1 MET 23 3.333 13.159 -24.677 165 HE1 MET 23 HE1 MET 23 1.910 11.307 -23.312 166 HE2 MET 23 HE2 MET 23 0.894 12.587 -22.644 167 HE3 MET 23 HE3 MET 23 1.635 11.398 -21.572 168 H CYS 24 HN CYS 24 2.729 15.040 -27.188 169 HA CYS 24 HA CYS 24 0.474 16.606 -26.244 170 HB2 CYS 24 HB2 CYS 24 1.739 18.225 -27.583 171 HB3 CYS 24 HB1 CYS 24 1.797 17.097 -28.930 172 HG CYS 24 HG CYS 24 -0.047 19.362 -29.197 173 H ILE 25 HN ILE 25 -1.507 16.085 -27.458 174 HA ILE 25 HA ILE 25 -1.829 13.375 -28.026 175 HB ILE 25 HB ILE 25 -3.718 14.838 -27.499 176 HG12 ILE 25 HG12 ILE 25 -5.317 14.005 -29.229 177 HG13 ILE 25 HG11 ILE 25 -3.942 13.463 -30.184 178 HG21 ILE 25 HG21 ILE 25 -3.072 16.835 -28.699 179 HG22 ILE 25 HG22 ILE 25 -4.685 16.324 -29.195 180 HG23 ILE 25 HG23 ILE 25 -3.301 16.011 -30.243 181 HD11 ILE 25 HD11 ILE 25 -4.671 12.486 -27.429 182 HD12 ILE 25 HD12 ILE 25 -3.299 11.936 -28.392 183 HD13 ILE 25 HD13 ILE 25 -4.945 11.629 -28.945 184 H GLN 26 HN GLN 26 -1.038 16.067 -30.139 185 HA GLN 26 HA GLN 26 -1.194 14.812 -32.624 186 HB2 GLN 26 HB2 GLN 26 -0.869 17.194 -32.467 187 HB3 GLN 26 HB1 GLN 26 0.652 16.980 -31.611 188 HG2 GLN 26 HG2 GLN 26 1.588 15.923 -33.642 189 HG3 GLN 26 HG1 GLN 26 0.084 16.291 -34.482 190 HE21 GLN 26 HE21 GLN 26 2.879 17.165 -34.896 191 HE22 GLN 26 HE22 GLN 26 2.797 18.899 -34.930 192 H LYS 27 HN LYS 27 1.475 14.977 -30.306 193 HA LYS 27 HA LYS 27 3.439 13.697 -31.817 194 HB2 LYS 27 HB2 LYS 27 3.881 14.899 -29.708 195 HB3 LYS 27 HB1 LYS 27 3.047 13.637 -28.817 196 HG2 LYS 27 HG2 LYS 27 5.259 13.080 -28.507 197 HG3 LYS 27 HG1 LYS 27 4.804 12.058 -29.870 198 HD2 LYS 27 HD2 LYS 27 6.122 14.748 -30.196 199 HD3 LYS 27 HD1 LYS 27 7.027 13.243 -30.064 200 HE2 LYS 27 HE2 LYS 27 4.923 13.772 -32.154 201 HE3 LYS 27 HE1 LYS 27 6.647 14.040 -32.403 202 HZ1 LYS 27 HZ1 LYS 27 7.049 11.703 -32.025 203 HZ2 LYS 27 HZ2 LYS 27 5.911 11.895 -33.258 204 HZ3 LYS 27 HZ3 LYS 27 5.407 11.423 -31.708 205 H VAL 28 HN VAL 28 0.987 12.377 -29.640 206 HA VAL 28 HA VAL 28 1.788 9.700 -29.655 207 HB VAL 28 HB VAL 28 -1.042 10.759 -29.460 208 HG11 VAL 28 HG11 VAL 28 0.140 8.145 -28.528 209 HG12 VAL 28 HG12 VAL 28 -0.958 8.360 -29.892 210 HG13 VAL 28 HG13 VAL 28 -1.515 8.689 -28.251 211 HG21 VAL 28 HG21 VAL 28 0.400 11.814 -27.814 212 HG22 VAL 28 HG22 VAL 28 1.003 10.239 -27.301 213 HG23 VAL 28 HG23 VAL 28 -0.686 10.669 -27.027 214 H ILE 29 HN ILE 29 -0.578 11.368 -31.719 215 HA ILE 29 HA ILE 29 -1.221 9.204 -33.370 216 HB ILE 29 HB ILE 29 -1.417 12.172 -33.667 217 HG12 ILE 29 HG12 ILE 29 -3.814 11.604 -34.000 218 HG13 ILE 29 HG11 ILE 29 -3.411 9.903 -33.842 219 HG21 ILE 29 HG21 ILE 29 -0.671 11.465 -35.879 220 HG22 ILE 29 HG22 ILE 29 -2.357 11.975 -35.913 221 HG23 ILE 29 HG23 ILE 29 -1.957 10.258 -35.936 222 HD11 ILE 29 HD11 ILE 29 -4.354 10.773 -31.789 223 HD12 ILE 29 HD12 ILE 29 -3.085 11.997 -31.708 224 HD13 ILE 29 HD13 ILE 29 -2.675 10.288 -31.549 225 H GLU 30 HN GLU 30 1.265 11.715 -33.732 226 HA GLU 30 HA GLU 30 2.353 10.961 -36.158 227 HB2 GLU 30 HB2 GLU 30 3.728 12.032 -33.698 228 HB3 GLU 30 HB1 GLU 30 4.520 11.855 -35.253 229 HG2 GLU 30 HG2 GLU 30 2.901 13.414 -36.236 230 HG3 GLU 30 HG1 GLU 30 2.162 13.621 -34.644 231 H ASP 31 HN ASP 31 3.212 9.773 -32.916 232 HA ASP 31 HA ASP 31 5.311 8.101 -33.726 233 HB2 ASP 31 HB2 ASP 31 3.580 8.236 -31.291 234 HB3 ASP 31 HB1 ASP 31 4.641 6.848 -31.509 235 H LYS 32 HN LYS 32 1.846 7.534 -33.621 236 HA LYS 32 HA LYS 32 2.055 4.701 -33.876 237 HB2 LYS 32 HB2 LYS 32 -0.284 6.487 -34.574 238 HB3 LYS 32 HB1 LYS 32 -0.340 4.743 -34.350 239 HG2 LYS 32 HG2 LYS 32 0.212 6.837 -32.259 240 HG3 LYS 32 HG1 LYS 32 -1.197 5.782 -32.381 241 HD2 LYS 32 HD2 LYS 32 1.629 4.830 -31.931 242 HD3 LYS 32 HD1 LYS 32 0.433 5.059 -30.656 243 HE2 LYS 32 HE2 LYS 32 0.116 3.197 -33.006 244 HE3 LYS 32 HE1 LYS 32 0.644 2.707 -31.398 245 HZ1 LYS 32 HZ1 LYS 32 -1.674 2.271 -31.608 246 HZ2 LYS 32 HZ2 LYS 32 -1.995 3.847 -32.131 247 HZ3 LYS 32 HZ3 LYS 32 -1.492 3.573 -30.539 248 H LEU 33 HN LEU 33 1.155 7.236 -36.240 249 HA LEU 33 HA LEU 33 1.068 5.378 -38.379 250 HB2 LEU 33 HB2 LEU 33 0.939 7.386 -39.842 251 HB3 LEU 33 HB1 LEU 33 -0.263 7.322 -38.574 252 HG LEU 33 HG LEU 33 1.366 8.893 -37.284 253 HD11 LEU 33 HD11 LEU 33 3.243 8.711 -38.829 254 HD12 LEU 33 HD12 LEU 33 2.655 10.371 -38.733 255 HD13 LEU 33 HD13 LEU 33 2.247 9.371 -40.127 256 HD21 LEU 33 HD21 LEU 33 -0.206 9.850 -39.669 257 HD22 LEU 33 HD22 LEU 33 0.270 10.825 -38.278 258 HD23 LEU 33 HD23 LEU 33 -0.865 9.489 -38.074 259 H SER 34 HN SER 34 3.666 7.289 -37.031 260 HA SER 34 HA SER 34 5.365 7.054 -39.313 261 HB2 SER 34 HB2 SER 34 7.192 7.751 -37.749 262 HB3 SER 34 HB1 SER 34 5.807 8.841 -37.762 263 HG SER 34 HG SER 34 5.175 8.091 -35.808 264 H SER 35 HN SER 35 4.808 5.093 -36.459 265 HA SER 35 HA SER 35 7.026 3.367 -36.825 266 HB2 SER 35 HB2 SER 35 4.377 2.854 -35.448 267 HB3 SER 35 HB1 SER 35 5.816 1.843 -35.299 268 HG SER 35 HG SER 35 5.433 4.518 -34.418 269 H ALA 36 HN ALA 36 3.778 3.438 -38.139 270 HA ALA 36 HA ALA 36 4.007 0.765 -39.240 271 HB1 ALA 36 HB1 ALA 36 1.882 1.543 -38.307 272 HB2 ALA 36 HB2 ALA 36 1.732 1.088 -40.004 273 HB3 ALA 36 HB3 ALA 36 1.800 2.792 -39.550 274 H LEU 37 HN LEU 37 3.522 4.043 -40.573 275 HA LEU 37 HA LEU 37 3.857 3.072 -43.276 276 HB2 LEU 37 HB2 LEU 37 3.593 5.890 -42.222 277 HB3 LEU 37 HB1 LEU 37 3.522 5.425 -43.910 278 HG LEU 37 HG LEU 37 1.543 4.537 -41.810 279 HD11 LEU 37 HD11 LEU 37 -0.001 6.103 -42.869 280 HD12 LEU 37 HD12 LEU 37 1.289 6.664 -43.933 281 HD13 LEU 37 HD13 LEU 37 1.397 6.942 -42.195 282 HD21 LEU 37 HD21 LEU 37 0.217 3.818 -43.742 283 HD22 LEU 37 HD22 LEU 37 1.760 2.968 -43.654 284 HD23 LEU 37 HD23 LEU 37 1.539 4.278 -44.814 285 H LYS 38 HN LYS 38 5.800 4.457 -40.817 286 HA LYS 38 HA LYS 38 7.927 5.217 -40.682 287 HB2 LYS 38 HB2 LYS 38 8.254 3.076 -42.784 288 HB3 LYS 38 HB1 LYS 38 9.599 3.863 -41.969 289 HG2 LYS 38 HG2 LYS 38 8.769 3.028 -39.816 290 HG3 LYS 38 HG1 LYS 38 7.445 2.213 -40.653 291 HD2 LYS 38 HD2 LYS 38 9.036 0.846 -41.881 292 HD3 LYS 38 HD1 LYS 38 10.381 1.696 -41.121 293 HE2 LYS 38 HE2 LYS 38 10.011 -0.448 -40.042 294 HE3 LYS 38 HE1 LYS 38 9.658 0.871 -38.930 295 HZ1 LYS 38 HZ1 LYS 38 8.017 -0.977 -38.910 296 HZ2 LYS 38 HZ2 LYS 38 7.578 -0.556 -40.495 297 HZ3 LYS 38 HZ3 LYS 38 7.338 0.543 -39.225 298 HA PRO 39 HA PRO 39 7.885 7.919 -44.426 299 HB2 PRO 39 HB2 PRO 39 7.224 10.248 -43.244 300 HB3 PRO 39 HB1 PRO 39 6.007 9.090 -43.791 301 HG2 PRO 39 HG2 PRO 39 6.988 9.650 -41.037 302 HG3 PRO 39 HG1 PRO 39 5.364 9.205 -41.589 303 HD2 PRO 39 HD2 PRO 39 7.227 7.469 -40.444 304 HD3 PRO 39 HD1 PRO 39 5.804 6.984 -41.383 305 H THR 40 HN THR 40 9.759 8.805 -45.041 306 HA THR 40 HA THR 40 11.947 9.057 -43.264 307 HB THR 40 HB THR 40 13.055 10.190 -45.254 308 HG1 THR 40 HG1 THR 40 11.757 10.825 -46.788 309 HG21 THR 40 HG21 THR 40 11.763 7.498 -45.716 310 HG22 THR 40 HG22 THR 40 13.254 7.787 -44.819 311 HG23 THR 40 HG23 THR 40 13.187 8.118 -46.550 312 H PHE 41 HN PHE 41 9.551 11.257 -44.525 313 HA PHE 41 HA PHE 41 10.437 13.241 -42.569 314 HB2 PHE 41 HB2 PHE 41 11.380 13.937 -44.752 315 HB3 PHE 41 HB1 PHE 41 9.762 13.925 -45.443 316 HD1 PHE 41 HD1 PHE 41 11.890 15.557 -42.890 317 HD2 PHE 41 HD2 PHE 41 8.354 15.788 -45.248 318 HE1 PHE 41 HE1 PHE 41 11.583 17.897 -42.194 319 HE2 PHE 41 HE2 PHE 41 8.041 18.128 -44.556 320 HZ PHE 41 HZ PHE 41 9.655 19.186 -43.027 321 H LEU 42 HN LEU 42 8.781 14.269 -41.559 322 HA LEU 42 HA LEU 42 6.072 13.912 -42.624 323 HB2 LEU 42 HB2 LEU 42 6.453 12.191 -40.910 324 HB3 LEU 42 HB1 LEU 42 6.913 13.432 -39.761 325 HG LEU 42 HG LEU 42 4.615 14.358 -39.891 326 HD11 LEU 42 HD11 LEU 42 4.032 13.580 -42.126 327 HD12 LEU 42 HD12 LEU 42 2.851 13.031 -40.936 328 HD13 LEU 42 HD13 LEU 42 4.061 11.911 -41.560 329 HD21 LEU 42 HD21 LEU 42 4.809 11.443 -39.149 330 HD22 LEU 42 HD22 LEU 42 3.548 12.556 -38.617 331 HD23 LEU 42 HD23 LEU 42 5.219 12.812 -38.116 332 H GLU 43 HN GLU 43 5.104 15.823 -42.808 333 HA GLU 43 HA GLU 43 5.908 17.965 -40.950 334 HB2 GLU 43 HB2 GLU 43 6.692 18.412 -43.228 335 HB3 GLU 43 HB1 GLU 43 5.056 18.223 -43.841 336 HG2 GLU 43 HG2 GLU 43 4.331 20.181 -42.651 337 HG3 GLU 43 HG1 GLU 43 5.903 20.332 -41.869 338 H LEU 44 HN LEU 44 4.348 18.417 -39.569 339 HA LEU 44 HA LEU 44 1.571 17.854 -40.250 340 HB2 LEU 44 HB2 LEU 44 2.906 18.688 -37.673 341 HB3 LEU 44 HB1 LEU 44 1.171 18.551 -37.845 342 HG LEU 44 HG LEU 44 1.949 16.584 -36.759 343 HD11 LEU 44 HD11 LEU 44 1.372 15.978 -39.649 344 HD12 LEU 44 HD12 LEU 44 0.187 16.211 -38.364 345 HD13 LEU 44 HD13 LEU 44 1.273 14.823 -38.320 346 HD21 LEU 44 HD21 LEU 44 3.883 16.231 -39.043 347 HD22 LEU 44 HD22 LEU 44 3.624 15.089 -37.723 348 HD23 LEU 44 HD23 LEU 44 4.294 16.686 -37.390 349 H VAL 45 HN VAL 45 0.409 19.379 -41.186 350 HA VAL 45 HA VAL 45 1.073 22.203 -40.638 351 HB VAL 45 HB VAL 45 -0.247 21.084 -43.123 352 HG11 VAL 45 HG11 VAL 45 0.829 23.831 -42.511 353 HG12 VAL 45 HG12 VAL 45 -0.870 23.382 -42.666 354 HG13 VAL 45 HG13 VAL 45 0.195 23.300 -44.070 355 HG21 VAL 45 HG21 VAL 45 1.861 21.525 -44.272 356 HG22 VAL 45 HG22 VAL 45 2.065 20.334 -42.986 357 HG23 VAL 45 HG23 VAL 45 2.599 21.997 -42.741 358 H ASP 46 HN ASP 46 -0.476 23.605 -40.177 359 HA ASP 46 HA ASP 46 -2.865 22.567 -39.045 360 HB2 ASP 46 HB2 ASP 46 -3.110 24.640 -38.115 361 HB3 ASP 46 HB1 ASP 46 -1.394 24.669 -38.426 362 H LYS 47 HN LYS 47 -4.794 22.313 -39.975 363 HA LYS 47 HA LYS 47 -4.814 22.324 -42.811 364 HB2 LYS 47 HB2 LYS 47 -5.925 20.637 -41.290 365 HB3 LYS 47 HB1 LYS 47 -7.181 21.837 -41.013 366 HG2 LYS 47 HG2 LYS 47 -7.923 21.741 -43.229 367 HG3 LYS 47 HG1 LYS 47 -6.451 20.932 -43.777 368 HD2 LYS 47 HD2 LYS 47 -7.079 18.963 -42.411 369 HD3 LYS 47 HD1 LYS 47 -8.591 19.772 -41.996 370 HE2 LYS 47 HE2 LYS 47 -8.826 18.136 -43.836 371 HE3 LYS 47 HE1 LYS 47 -9.285 19.773 -44.297 372 HZ1 LYS 47 HZ1 LYS 47 -7.302 20.044 -45.508 373 HZ2 LYS 47 HZ2 LYS 47 -7.879 18.511 -45.939 374 HZ3 LYS 47 HZ3 LYS 47 -6.589 18.654 -44.849 375 H SER 48 HN SER 48 -5.134 24.003 -44.029 376 HA SER 48 HA SER 48 -6.106 26.480 -43.202 377 HB2 SER 48 HB2 SER 48 -5.993 25.390 -46.022 378 HB3 SER 48 HB1 SER 48 -6.024 27.091 -45.556 379 HG SER 48 HG SER 48 -4.029 26.356 -44.255 380 H CYS 49 HN CYS 49 -8.059 26.965 -42.593 381 HA CYS 49 HA CYS 49 -10.292 27.319 -42.597 382 HB2 CYS 49 HB2 CYS 49 -10.207 26.146 -45.383 383 HB3 CYS 49 HB1 CYS 49 -11.585 26.978 -44.669 384 HG CYS 49 HG CYS 49 -10.875 29.137 -45.864 385 H GLY 50 HN GLY 50 -8.998 24.683 -41.858 386 HA2 GLY 50 HA2 GLY 50 -11.005 22.686 -42.243 387 HA3 GLY 50 HA1 GLY 50 -9.707 22.642 -41.055 388 H CYS 51 HN CYS 51 -12.938 22.570 -41.309 389 HA CYS 51 HA CYS 51 -13.714 24.415 -39.278 390 HB2 CYS 51 HB2 CYS 51 -15.201 22.011 -40.353 391 HB3 CYS 51 HB1 CYS 51 -15.897 23.312 -39.392 392 HG CYS 51 HG CYS 51 -14.661 25.008 -41.704 393 H GLY 52 HN GLY 52 -12.524 24.062 -37.451 394 HA2 GLY 52 HA2 GLY 52 -12.709 23.098 -35.252 395 HA3 GLY 52 HA1 GLY 52 -13.118 21.564 -36.012 396 H THR 53 HN THR 53 -11.260 21.280 -34.224 397 HA THR 53 HA THR 53 -8.605 21.848 -34.991 398 HB THR 53 HB THR 53 -9.552 19.576 -33.231 399 HG1 THR 53 HG1 THR 53 -9.294 22.350 -32.820 400 HG21 THR 53 HG21 THR 53 -7.196 19.410 -33.873 401 HG22 THR 53 HG22 THR 53 -7.349 19.827 -32.167 402 HG23 THR 53 HG23 THR 53 -6.925 21.070 -33.343 403 H SER 54 HN SER 54 -8.043 21.255 -37.002 404 HA SER 54 HA SER 54 -8.227 18.407 -37.675 405 HB2 SER 54 HB2 SER 54 -8.483 19.303 -40.101 406 HB3 SER 54 HB1 SER 54 -9.893 19.325 -39.041 407 HG SER 54 HG SER 54 -9.465 21.530 -38.626 408 H PHE 55 HN PHE 55 -6.459 17.516 -38.626 409 HA PHE 55 HA PHE 55 -4.124 19.288 -38.915 410 HB2 PHE 55 HB2 PHE 55 -4.215 16.356 -38.157 411 HB3 PHE 55 HB1 PHE 55 -2.741 17.278 -38.425 412 HD1 PHE 55 HD1 PHE 55 -2.225 19.204 -36.895 413 HD2 PHE 55 HD2 PHE 55 -5.308 16.383 -36.088 414 HE1 PHE 55 HE1 PHE 55 -2.206 19.869 -34.526 415 HE2 PHE 55 HE2 PHE 55 -5.298 17.044 -33.717 416 HZ PHE 55 HZ PHE 55 -3.746 18.788 -32.933 417 H ASP 56 HN ASP 56 -3.147 19.362 -40.837 418 HA ASP 56 HA ASP 56 -3.857 17.287 -42.804 419 HB2 ASP 56 HB2 ASP 56 -4.500 19.794 -43.210 420 HB3 ASP 56 HB1 ASP 56 -2.791 19.985 -43.589 421 H ALA 57 HN ALA 57 -2.240 15.897 -43.019 422 HA ALA 57 HA ALA 57 0.438 16.811 -42.234 423 HB1 ALA 57 HB1 ALA 57 0.905 14.504 -41.647 424 HB2 ALA 57 HB2 ALA 57 -0.683 14.017 -42.240 425 HB3 ALA 57 HB3 ALA 57 -0.553 15.069 -40.831 426 H VAL 58 HN VAL 58 1.838 17.093 -43.777 427 HA VAL 58 HA VAL 58 1.604 15.841 -46.361 428 HB VAL 58 HB VAL 58 3.885 17.459 -45.194 429 HG11 VAL 58 HG11 VAL 58 3.288 16.690 -48.051 430 HG12 VAL 58 HG12 VAL 58 4.606 16.068 -47.060 431 HG13 VAL 58 HG13 VAL 58 4.583 17.768 -47.528 432 HG21 VAL 58 HG21 VAL 58 1.827 18.758 -45.282 433 HG22 VAL 58 HG22 VAL 58 1.603 18.316 -46.974 434 HG23 VAL 58 HG23 VAL 58 2.968 19.326 -46.500 435 H ILE 59 HN ILE 59 2.181 13.774 -46.655 436 HA ILE 59 HA ILE 59 4.087 12.598 -44.771 437 HB ILE 59 HB ILE 59 3.254 10.467 -45.293 438 HG12 ILE 59 HG12 ILE 59 1.331 10.554 -47.249 439 HG13 ILE 59 HG11 ILE 59 2.539 11.669 -47.886 440 HG21 ILE 59 HG21 ILE 59 0.846 10.635 -45.001 441 HG22 ILE 59 HG22 ILE 59 0.901 12.329 -45.486 442 HG23 ILE 59 HG23 ILE 59 1.693 11.812 -43.996 443 HD11 ILE 59 HD11 ILE 59 2.879 9.415 -48.719 444 HD12 ILE 59 HD12 ILE 59 3.022 8.810 -47.067 445 HD13 ILE 59 HD13 ILE 59 4.232 9.922 -47.709 446 H VAL 60 HN VAL 60 6.029 11.896 -45.351 447 HA VAL 60 HA VAL 60 6.709 11.786 -48.208 448 HB VAL 60 HB VAL 60 8.439 12.917 -45.993 449 HG11 VAL 60 HG11 VAL 60 10.047 13.441 -47.759 450 HG12 VAL 60 HG12 VAL 60 9.030 12.600 -48.929 451 HG13 VAL 60 HG13 VAL 60 9.780 11.706 -47.606 452 HG21 VAL 60 HG21 VAL 60 8.278 15.032 -47.210 453 HG22 VAL 60 HG22 VAL 60 6.694 14.469 -46.677 454 HG23 VAL 60 HG23 VAL 60 7.174 14.286 -48.364 455 H SER 61 HN SER 61 6.762 9.587 -48.416 456 HA SER 61 HA SER 61 8.624 8.125 -46.708 457 HB2 SER 61 HB2 SER 61 6.519 7.927 -45.516 458 HB3 SER 61 HB1 SER 61 5.697 7.416 -46.990 459 HG SER 61 HG SER 61 6.874 5.877 -45.215 460 H ASN 62 HN ASN 62 9.403 6.214 -47.549 461 HA ASN 62 HA ASN 62 9.317 5.802 -50.360 462 HB2 ASN 62 HB2 ASN 62 10.296 4.046 -48.099 463 HB3 ASN 62 HB1 ASN 62 10.453 3.618 -49.799 464 HD21 ASN 62 HD21 ASN 62 11.018 6.247 -50.743 465 HD22 ASN 62 HD22 ASN 62 12.609 6.653 -50.208 466 H ASN 63 HN ASN 63 7.262 4.899 -47.793 467 HA ASN 63 HA ASN 63 6.227 2.459 -48.734 468 HB2 ASN 63 HB2 ASN 63 5.929 3.455 -46.441 469 HB3 ASN 63 HB1 ASN 63 4.756 4.566 -47.134 470 HD21 ASN 63 HD21 ASN 63 2.727 3.818 -47.674 471 HD22 ASN 63 HD22 ASN 63 2.149 2.261 -47.205 472 H PHE 64 HN PHE 64 6.025 5.487 -50.149 473 HA PHE 64 HA PHE 64 3.496 4.811 -51.494 474 HB2 PHE 64 HB2 PHE 64 3.333 6.829 -50.120 475 HB3 PHE 64 HB1 PHE 64 4.699 7.538 -50.972 476 HD1 PHE 64 HD2 PHE 64 1.386 6.009 -51.781 477 HD2 PHE 64 HD1 PHE 64 4.213 9.088 -52.582 478 HE1 PHE 64 HE2 PHE 64 -0.156 6.993 -53.426 479 HE2 PHE 64 HE1 PHE 64 2.676 10.077 -54.229 480 HZ PHE 64 HZ PHE 64 0.489 9.028 -54.652 481 H GLU 65 HN GLU 65 6.832 5.018 -52.016 482 HA GLU 65 HA GLU 65 6.735 6.397 -54.529 483 HB2 GLU 65 HB2 GLU 65 9.145 5.687 -54.744 484 HB3 GLU 65 HB1 GLU 65 8.752 6.695 -53.365 485 HG2 GLU 65 HG2 GLU 65 10.271 5.048 -52.632 486 HG3 GLU 65 HG1 GLU 65 8.693 4.632 -51.970 487 H ASP 66 HN ASP 66 6.106 3.188 -53.651 488 HA ASP 66 HA ASP 66 6.759 2.159 -56.298 489 HB2 ASP 66 HB2 ASP 66 7.051 0.854 -54.089 490 HB3 ASP 66 HB1 ASP 66 5.307 0.625 -54.151 491 H LYS 67 HN LYS 67 4.494 4.111 -55.319 492 HA LYS 67 HA LYS 67 2.491 4.771 -56.196 493 HB2 LYS 67 HB2 LYS 67 3.732 3.871 -58.297 494 HB3 LYS 67 HB1 LYS 67 2.662 2.491 -58.154 495 HG2 LYS 67 HG2 LYS 67 0.727 3.948 -58.423 496 HG3 LYS 67 HG1 LYS 67 1.796 5.352 -58.537 497 HD2 LYS 67 HD2 LYS 67 1.665 3.001 -60.429 498 HD3 LYS 67 HD1 LYS 67 1.185 4.666 -60.766 499 HE2 LYS 67 HE2 LYS 67 3.410 5.432 -60.726 500 HE3 LYS 67 HE1 LYS 67 3.988 3.961 -59.944 501 HZ1 LYS 67 HZ1 LYS 67 3.359 2.762 -62.022 502 HZ2 LYS 67 HZ2 LYS 67 4.628 3.868 -62.201 503 HZ3 LYS 67 HZ3 LYS 67 3.074 4.270 -62.751 504 H LYS 68 HN LYS 68 2.545 3.100 -54.001 505 HA LYS 68 HA LYS 68 0.862 0.809 -54.375 506 HB2 LYS 68 HB2 LYS 68 2.091 2.091 -51.949 507 HB3 LYS 68 HB1 LYS 68 0.999 0.718 -51.832 508 HG2 LYS 68 HG2 LYS 68 3.663 0.818 -53.216 509 HG3 LYS 68 HG1 LYS 68 3.234 -0.089 -51.761 510 HD2 LYS 68 HD2 LYS 68 1.501 -1.268 -53.203 511 HD3 LYS 68 HD1 LYS 68 2.330 -0.558 -54.591 512 HE2 LYS 68 HE2 LYS 68 4.433 -1.600 -53.781 513 HE3 LYS 68 HE1 LYS 68 3.493 -2.402 -52.525 514 HZ1 LYS 68 HZ1 LYS 68 3.949 -3.742 -54.572 515 HZ2 LYS 68 HZ2 LYS 68 2.897 -2.709 -55.408 516 HZ3 LYS 68 HZ3 LYS 68 2.319 -3.648 -54.113 517 H LEU 69 HN LEU 69 -1.170 1.346 -54.964 518 HA LEU 69 HA LEU 69 -2.755 3.248 -53.532 519 HB2 LEU 69 HB2 LEU 69 -3.430 2.766 -55.752 520 HB3 LEU 69 HB1 LEU 69 -3.400 1.037 -55.468 521 HG LEU 69 HG LEU 69 -5.353 1.276 -53.958 522 HD11 LEU 69 HD11 LEU 69 -6.635 3.351 -53.979 523 HD12 LEU 69 HD12 LEU 69 -5.373 4.128 -54.935 524 HD13 LEU 69 HD13 LEU 69 -5.031 3.596 -53.289 525 HD21 LEU 69 HD21 LEU 69 -5.663 0.644 -56.279 526 HD22 LEU 69 HD22 LEU 69 -5.723 2.343 -56.752 527 HD23 LEU 69 HD23 LEU 69 -6.992 1.666 -55.732 528 H LEU 70 HN LEU 70 -2.724 -0.317 -53.636 529 HA LEU 70 HA LEU 70 -4.782 -0.477 -51.690 530 HB2 LEU 70 HB2 LEU 70 -4.612 -2.853 -51.833 531 HB3 LEU 70 HB1 LEU 70 -4.527 -2.170 -53.435 532 HG LEU 70 HG LEU 70 -3.053 -3.976 -53.449 533 HD11 LEU 70 HD11 LEU 70 -0.812 -3.067 -53.738 534 HD12 LEU 70 HD12 LEU 70 -1.330 -1.563 -52.978 535 HD13 LEU 70 HD13 LEU 70 -2.044 -2.068 -54.509 536 HD21 LEU 70 HD21 LEU 70 -1.321 -4.395 -51.778 537 HD22 LEU 70 HD22 LEU 70 -2.942 -4.421 -51.086 538 HD23 LEU 70 HD23 LEU 70 -1.901 -3.018 -50.842 539 H ASP 71 HN ASP 71 -1.297 -0.559 -51.477 540 HA ASP 71 HA ASP 71 -1.266 -1.680 -48.855 541 HB2 ASP 71 HB2 ASP 71 0.864 -0.379 -50.533 542 HB3 ASP 71 HB1 ASP 71 1.166 -0.903 -48.877 543 H ARG 72 HN ARG 72 -0.923 1.649 -50.104 544 HA ARG 72 HA ARG 72 -0.571 2.790 -47.541 545 HB2 ARG 72 HB2 ARG 72 -1.072 4.926 -48.526 546 HB3 ARG 72 HB1 ARG 72 -0.095 4.012 -49.663 547 HG2 ARG 72 HG2 ARG 72 -2.056 3.500 -50.988 548 HG3 ARG 72 HG1 ARG 72 -3.085 4.328 -49.816 549 HD2 ARG 72 HD2 ARG 72 -2.030 6.435 -50.304 550 HD3 ARG 72 HD1 ARG 72 -0.846 5.647 -51.347 551 HE ARG 72 HE ARG 72 -3.251 5.000 -52.455 552 HH11 ARG 72 HH11 ARG 72 -1.721 8.020 -51.574 553 HH12 ARG 72 HH12 ARG 72 -2.420 8.908 -52.892 554 HH21 ARG 72 HH21 ARG 72 -4.201 6.186 -54.188 555 HH22 ARG 72 HH22 ARG 72 -3.842 7.873 -54.350 556 H HIS 73 HN HIS 73 -3.385 1.888 -49.406 557 HA HIS 73 HA HIS 73 -5.340 3.126 -47.793 558 HB2 HIS 73 HB2 HIS 73 -5.775 2.295 -50.076 559 HB3 HIS 73 HB1 HIS 73 -5.561 0.644 -49.513 560 HD1 HIS 73 HD1 HIS 73 -8.022 3.407 -49.679 561 HD2 HIS 73 HD2 HIS 73 -7.701 -0.349 -47.919 562 HE1 HIS 73 HE1 HIS 73 -10.354 2.784 -48.972 563 HE2 HIS 73 HE2 HIS 73 -10.160 0.417 -48.139 564 H ARG 74 HN ARG 74 -4.104 -0.218 -47.843 565 HA ARG 74 HA ARG 74 -5.768 -1.110 -45.751 566 HB2 ARG 74 HB2 ARG 74 -4.533 -3.140 -45.806 567 HB3 ARG 74 HB1 ARG 74 -4.619 -2.556 -47.458 568 HG2 ARG 74 HG2 ARG 74 -2.297 -1.488 -46.853 569 HG3 ARG 74 HG1 ARG 74 -2.288 -2.762 -45.634 570 HD2 ARG 74 HD2 ARG 74 -2.550 -3.093 -48.616 571 HD3 ARG 74 HD1 ARG 74 -1.170 -3.539 -47.616 572 HE ARG 74 HE ARG 74 -3.619 -4.862 -46.870 573 HH11 ARG 74 HH11 ARG 74 -0.759 -4.943 -48.889 574 HH12 ARG 74 HH12 ARG 74 -0.873 -6.647 -49.214 575 HH21 ARG 74 HH21 ARG 74 -3.804 -7.111 -47.325 576 HH22 ARG 74 HH22 ARG 74 -2.614 -7.877 -48.345 577 H LEU 75 HN LEU 75 -2.410 0.081 -45.730 578 HA LEU 75 HA LEU 75 -1.942 -0.467 -42.997 579 HB2 LEU 75 HB2 LEU 75 -0.609 1.144 -45.091 580 HB3 LEU 75 HB1 LEU 75 -0.261 1.589 -43.433 581 HG LEU 75 HG LEU 75 0.453 -0.773 -43.015 582 HD11 LEU 75 HD11 LEU 75 0.201 -1.008 -46.007 583 HD12 LEU 75 HD12 LEU 75 -0.776 -1.858 -44.810 584 HD13 LEU 75 HD13 LEU 75 0.951 -2.193 -44.937 585 HD21 LEU 75 HD21 LEU 75 2.600 -0.550 -44.182 586 HD22 LEU 75 HD22 LEU 75 2.088 0.967 -43.441 587 HD23 LEU 75 HD23 LEU 75 1.914 0.733 -45.180 588 H VAL 76 HN VAL 76 -2.940 2.518 -44.660 589 HA VAL 76 HA VAL 76 -3.077 4.116 -42.365 590 HB VAL 76 HB VAL 76 -4.510 4.312 -45.013 591 HG11 VAL 76 HG11 VAL 76 -4.637 6.290 -42.734 592 HG12 VAL 76 HG12 VAL 76 -5.977 5.322 -43.347 593 HG13 VAL 76 HG13 VAL 76 -5.245 6.560 -44.367 594 HG21 VAL 76 HG21 VAL 76 -2.112 4.739 -45.022 595 HG22 VAL 76 HG22 VAL 76 -2.306 5.936 -43.741 596 HG23 VAL 76 HG23 VAL 76 -3.009 6.224 -45.332 597 H ASN 77 HN ASN 77 -5.541 2.053 -43.883 598 HA ASN 77 HA ASN 77 -7.655 2.855 -42.192 599 HB2 ASN 77 HB2 ASN 77 -7.192 0.407 -43.876 600 HB3 ASN 77 HB1 ASN 77 -8.603 0.524 -42.833 601 HD21 ASN 77 HD21 ASN 77 -7.213 3.315 -44.403 602 HD22 ASN 77 HD22 ASN 77 -8.501 3.571 -45.533 603 H THR 78 HN THR 78 -5.358 0.146 -41.942 604 HA THR 78 HA THR 78 -6.487 -1.043 -39.672 605 HB THR 78 HB THR 78 -3.591 -1.088 -40.532 606 HG1 THR 78 HG1 THR 78 -4.165 -2.610 -41.929 607 HG21 THR 78 HG21 THR 78 -5.151 -2.999 -38.783 608 HG22 THR 78 HG22 THR 78 -3.901 -1.883 -38.232 609 HG23 THR 78 HG23 THR 78 -3.482 -3.214 -39.311 610 H ILE 79 HN ILE 79 -3.675 1.187 -39.836 611 HA ILE 79 HA ILE 79 -3.448 1.226 -36.974 612 HB ILE 79 HB ILE 79 -2.055 2.830 -39.113 613 HG12 ILE 79 HG12 ILE 79 -0.057 1.567 -38.106 614 HG13 ILE 79 HG11 ILE 79 -1.250 0.556 -37.302 615 HG21 ILE 79 HG21 ILE 79 -2.262 4.251 -37.153 616 HG22 ILE 79 HG22 ILE 79 -0.591 3.728 -37.366 617 HG23 ILE 79 HG23 ILE 79 -1.602 2.971 -36.134 618 HD11 ILE 79 HD11 ILE 79 -0.981 0.923 -40.274 619 HD12 ILE 79 HD12 ILE 79 -2.147 -0.120 -39.456 620 HD13 ILE 79 HD13 ILE 79 -0.421 -0.469 -39.343 621 H LEU 80 HN LEU 80 -4.471 3.621 -39.403 622 HA LEU 80 HA LEU 80 -5.052 5.576 -37.422 623 HB2 LEU 80 HB2 LEU 80 -5.680 5.407 -40.354 624 HB3 LEU 80 HB1 LEU 80 -6.297 6.710 -39.357 625 HG LEU 80 HG LEU 80 -3.902 7.255 -38.758 626 HD11 LEU 80 HD11 LEU 80 -2.884 5.121 -39.357 627 HD12 LEU 80 HD12 LEU 80 -2.151 6.457 -40.245 628 HD13 LEU 80 HD13 LEU 80 -3.304 5.392 -41.049 629 HD21 LEU 80 HD21 LEU 80 -3.480 8.426 -40.860 630 HD22 LEU 80 HD22 LEU 80 -5.169 8.557 -40.369 631 HD23 LEU 80 HD23 LEU 80 -4.710 7.441 -41.654 632 H LYS 81 HN LYS 81 -6.722 2.782 -38.323 633 HA LYS 81 HA LYS 81 -9.378 3.419 -38.003 634 HB2 LYS 81 HB2 LYS 81 -8.778 1.132 -38.351 635 HB3 LYS 81 HB1 LYS 81 -7.796 1.097 -36.894 636 HG2 LYS 81 HG2 LYS 81 -9.868 -0.118 -36.573 637 HG3 LYS 81 HG1 LYS 81 -9.803 1.298 -35.524 638 HD2 LYS 81 HD2 LYS 81 -11.184 2.514 -37.216 639 HD3 LYS 81 HD1 LYS 81 -11.361 0.988 -38.085 640 HE2 LYS 81 HE2 LYS 81 -12.230 1.523 -35.248 641 HE3 LYS 81 HE1 LYS 81 -13.290 1.413 -36.651 642 HZ1 LYS 81 HZ1 LYS 81 -11.606 -0.779 -35.557 643 HZ2 LYS 81 HZ2 LYS 81 -12.569 -0.891 -36.947 644 HZ3 LYS 81 HZ3 LYS 81 -13.293 -0.652 -35.431 645 H GLU 82 HN GLU 82 -7.253 2.490 -35.290 646 HA GLU 82 HA GLU 82 -9.003 3.709 -33.380 647 HB2 GLU 82 HB2 GLU 82 -7.212 3.159 -31.742 648 HB3 GLU 82 HB1 GLU 82 -7.711 1.775 -32.706 649 HG2 GLU 82 HG2 GLU 82 -5.736 1.768 -33.939 650 HG3 GLU 82 HG1 GLU 82 -5.334 3.422 -33.482 651 H GLU 83 HN GLU 83 -6.134 4.674 -35.129 652 HA GLU 83 HA GLU 83 -5.256 6.757 -33.497 653 HB2 GLU 83 HB2 GLU 83 -4.021 5.802 -35.417 654 HB3 GLU 83 HB1 GLU 83 -5.135 6.611 -36.509 655 HG2 GLU 83 HG2 GLU 83 -4.398 8.767 -35.715 656 HG3 GLU 83 HG1 GLU 83 -3.332 7.993 -34.540 657 H LEU 84 HN LEU 84 -7.625 6.790 -36.134 658 HA LEU 84 HA LEU 84 -8.156 9.522 -36.218 659 HB2 LEU 84 HB2 LEU 84 -10.031 7.219 -36.744 660 HB3 LEU 84 HB1 LEU 84 -10.382 8.889 -37.138 661 HG LEU 84 HG LEU 84 -8.221 7.166 -38.343 662 HD11 LEU 84 HD11 LEU 84 -10.720 8.379 -39.508 663 HD12 LEU 84 HD12 LEU 84 -10.441 6.671 -39.171 664 HD13 LEU 84 HD13 LEU 84 -9.491 7.491 -40.409 665 HD21 LEU 84 HD21 LEU 84 -8.865 10.058 -38.895 666 HD22 LEU 84 HD22 LEU 84 -7.717 9.061 -39.789 667 HD23 LEU 84 HD23 LEU 84 -7.416 9.453 -38.095 668 H GLN 85 HN GLN 85 -9.219 7.118 -33.921 669 HA GLN 85 HA GLN 85 -11.512 8.389 -32.916 670 HB2 GLN 85 HB2 GLN 85 -9.610 6.749 -31.242 671 HB3 GLN 85 HB1 GLN 85 -11.325 7.000 -30.974 672 HG2 GLN 85 HG2 GLN 85 -9.997 5.306 -33.061 673 HG3 GLN 85 HG1 GLN 85 -11.065 4.800 -31.758 674 HE21 GLN 85 HE21 GLN 85 -10.826 5.930 -34.959 675 HE22 GLN 85 HE22 GLN 85 -12.507 5.898 -35.330 676 H ASN 86 HN ASN 86 -8.231 9.265 -32.657 677 HA ASN 86 HA ASN 86 -8.693 10.833 -30.214 678 HB2 ASN 86 HB2 ASN 86 -6.073 10.287 -31.627 679 HB3 ASN 86 HB1 ASN 86 -6.278 11.030 -30.047 680 HD21 ASN 86 HD21 ASN 86 -6.278 8.089 -31.852 681 HD22 ASN 86 HD22 ASN 86 -6.318 7.006 -30.502 682 H ILE 87 HN ILE 87 -9.142 11.286 -33.372 683 HA ILE 87 HA ILE 87 -8.087 14.044 -33.347 684 HB ILE 87 HB ILE 87 -8.413 12.442 -35.880 685 HG12 ILE 87 HG12 ILE 87 -5.898 12.698 -34.208 686 HG13 ILE 87 HG11 ILE 87 -6.844 11.229 -34.419 687 HG21 ILE 87 HG21 ILE 87 -6.763 14.876 -35.192 688 HG22 ILE 87 HG22 ILE 87 -8.274 14.867 -36.102 689 HG23 ILE 87 HG23 ILE 87 -6.837 14.094 -36.771 690 HD11 ILE 87 HD11 ILE 87 -6.322 11.240 -36.801 691 HD12 ILE 87 HD12 ILE 87 -4.868 11.192 -35.806 692 HD13 ILE 87 HD13 ILE 87 -5.359 12.699 -36.579 693 H HIS 88 HN HIS 88 -9.423 15.641 -34.240 694 HA HIS 88 HA HIS 88 -12.223 14.995 -34.434 695 HB2 HIS 88 HB2 HIS 88 -11.482 17.144 -33.452 696 HB3 HIS 88 HB1 HIS 88 -10.812 17.615 -35.011 697 HD1 HIS 88 HD1 HIS 88 -14.048 17.209 -33.183 698 HD2 HIS 88 HD2 HIS 88 -12.690 18.478 -36.908 699 HE1 HIS 88 HE1 HIS 88 -16.023 18.304 -34.292 700 HE2 HIS 88 HE2 HIS 88 -15.201 19.016 -36.568 701 H ALA 89 HN ALA 89 -9.684 16.079 -36.658 702 HA ALA 89 HA ALA 89 -10.923 14.660 -38.832 703 HB1 ALA 89 HB1 ALA 89 -11.175 16.578 -40.317 704 HB2 ALA 89 HB2 ALA 89 -10.678 17.664 -39.019 705 HB3 ALA 89 HB3 ALA 89 -12.189 16.763 -38.884 706 H PHE 90 HN PHE 90 -9.139 13.560 -39.373 707 HA PHE 90 HA PHE 90 -6.623 15.040 -39.718 708 HB2 PHE 90 HB2 PHE 90 -6.596 13.025 -38.264 709 HB3 PHE 90 HB1 PHE 90 -7.100 12.053 -39.642 710 HD1 PHE 90 HD1 PHE 90 -4.378 14.236 -38.398 711 HD2 PHE 90 HD2 PHE 90 -5.527 11.184 -41.130 712 HE1 PHE 90 HE1 PHE 90 -2.019 13.908 -39.017 713 HE2 PHE 90 HE2 PHE 90 -3.171 10.852 -41.756 714 HZ PHE 90 HZ PHE 90 -1.414 12.215 -40.699 715 H SER 91 HN SER 91 -5.684 15.256 -41.679 716 HA SER 91 HA SER 91 -6.647 13.614 -43.903 717 HB2 SER 91 HB2 SER 91 -6.399 16.633 -44.009 718 HB3 SER 91 HB1 SER 91 -6.778 15.585 -45.378 719 HG SER 91 HG SER 91 -8.430 15.076 -43.302 720 H MET 92 HN MET 92 -5.072 13.254 -45.520 721 HA MET 92 HA MET 92 -2.376 14.150 -44.755 722 HB2 MET 92 HB2 MET 92 -1.488 11.975 -45.333 723 HB3 MET 92 HB1 MET 92 -2.758 11.787 -44.136 724 HG2 MET 92 HG2 MET 92 -3.168 11.388 -47.087 725 HG3 MET 92 HG1 MET 92 -2.750 10.093 -45.970 726 HE1 MET 92 HE1 MET 92 -4.336 9.147 -44.125 727 HE2 MET 92 HE2 MET 92 -5.884 9.868 -43.686 728 HE3 MET 92 HE3 MET 92 -4.385 10.746 -43.381 729 H LYS 93 HN LYS 93 -0.870 14.452 -46.375 730 HA LYS 93 HA LYS 93 -1.891 14.435 -49.146 731 HB2 LYS 93 HB2 LYS 93 0.198 16.226 -47.880 732 HB3 LYS 93 HB1 LYS 93 -0.191 16.208 -49.593 733 HG2 LYS 93 HG2 LYS 93 -2.104 16.932 -47.380 734 HG3 LYS 93 HG1 LYS 93 -1.235 18.080 -48.400 735 HD2 LYS 93 HD2 LYS 93 -2.343 17.056 -50.384 736 HD3 LYS 93 HD1 LYS 93 -3.297 16.061 -49.283 737 HE2 LYS 93 HE2 LYS 93 -3.266 19.077 -49.327 738 HE3 LYS 93 HE1 LYS 93 -4.512 18.064 -50.053 739 HZ1 LYS 93 HZ1 LYS 93 -5.183 18.883 -47.884 740 HZ2 LYS 93 HZ2 LYS 93 -3.830 18.173 -47.155 741 HZ3 LYS 93 HZ3 LYS 93 -5.030 17.196 -47.854 742 H CYS 94 HN CYS 94 -0.919 12.959 -50.419 743 HA CYS 94 HA CYS 94 1.188 11.370 -49.222 744 HB2 CYS 94 HB2 CYS 94 -0.345 10.999 -51.801 745 HB3 CYS 94 HB1 CYS 94 0.782 9.834 -51.114 746 HG CYS 94 HG CYS 94 -1.901 10.853 -49.288 747 H HIS 95 HN HIS 95 3.251 11.835 -49.517 748 HA HIS 95 HA HIS 95 4.161 12.459 -52.235 749 HB2 HIS 95 HB2 HIS 95 5.013 13.987 -49.762 750 HB3 HIS 95 HB1 HIS 95 5.776 14.128 -51.340 751 HD1 HIS 95 HD1 HIS 95 2.934 15.341 -49.341 752 HD2 HIS 95 HD2 HIS 95 4.140 15.427 -53.317 753 HE1 HIS 95 HE1 HIS 95 1.539 17.125 -50.431 754 HE2 HIS 95 HE2 HIS 95 2.401 17.274 -52.792 755 H THR 96 HN THR 96 6.456 12.020 -52.544 756 HA THR 96 HA THR 96 7.496 10.053 -50.618 757 HB THR 96 HB THR 96 8.798 9.094 -52.399 758 HG1 THR 96 HG1 THR 96 7.816 10.595 -54.489 759 HG21 THR 96 HG21 THR 96 6.471 8.359 -52.308 760 HG22 THR 96 HG22 THR 96 7.064 8.363 -53.969 761 HG23 THR 96 HG23 THR 96 6.010 9.660 -53.406 762 HA PRO 97 HA PRO 97 11.091 12.587 -49.785 763 HB2 PRO 97 HB2 PRO 97 13.174 10.904 -50.533 764 HB3 PRO 97 HB1 PRO 97 12.393 10.921 -48.949 765 HG2 PRO 97 HG2 PRO 97 11.953 9.097 -51.263 766 HG3 PRO 97 HG1 PRO 97 11.927 8.740 -49.527 767 HD2 PRO 97 HD2 PRO 97 9.668 8.965 -50.969 768 HD3 PRO 97 HD1 PRO 97 9.756 9.498 -49.277 769 H LEU 98 HN LEU 98 10.850 10.945 -52.866 770 HA LEU 98 HA LEU 98 12.767 12.571 -54.222 771 HB2 LEU 98 HB2 LEU 98 10.533 10.847 -55.307 772 HB3 LEU 98 HB1 LEU 98 11.758 11.619 -56.292 773 HG LEU 98 HG LEU 98 12.456 9.400 -56.122 774 HD11 LEU 98 HD11 LEU 98 14.501 9.448 -54.780 775 HD12 LEU 98 HD12 LEU 98 13.930 10.908 -53.973 776 HD13 LEU 98 HD13 LEU 98 14.276 10.934 -55.703 777 HD21 LEU 98 HD21 LEU 98 10.910 8.704 -54.359 778 HD22 LEU 98 HD22 LEU 98 11.937 9.485 -53.154 779 HD23 LEU 98 HD23 LEU 98 12.546 8.106 -54.070 780 H GLU 99 HN GLU 99 9.211 12.445 -54.190 781 HA GLU 99 HA GLU 99 8.749 14.666 -55.815 782 HB2 GLU 99 HB2 GLU 99 7.167 13.170 -53.792 783 HB3 GLU 99 HB1 GLU 99 6.590 14.772 -54.225 784 HG2 GLU 99 HG2 GLU 99 5.490 13.083 -55.552 785 HG3 GLU 99 HG1 GLU 99 6.492 14.110 -56.572 786 H TYR 100 HN TYR 100 8.982 14.495 -52.255 787 HA TYR 100 HA TYR 100 8.379 17.227 -51.853 788 HB2 TYR 100 HB2 TYR 100 8.103 15.602 -50.058 789 HB3 TYR 100 HB1 TYR 100 9.840 15.301 -50.036 790 HD1 TYR 100 HD1 TYR 100 7.365 18.058 -49.607 791 HD2 TYR 100 HD2 TYR 100 11.189 16.509 -48.568 792 HE1 TYR 100 HE1 TYR 100 7.653 19.876 -47.977 793 HE2 TYR 100 HE2 TYR 100 11.485 18.323 -46.935 794 HH TYR 100 HH TYR 100 8.916 20.368 -45.976 795 H ASP 101 HN ASP 101 11.483 15.510 -52.104 796 HA ASP 101 HA ASP 101 13.089 17.705 -51.365 797 HB2 ASP 101 HB2 ASP 101 13.938 15.390 -51.407 798 HB3 ASP 101 HB1 ASP 101 13.831 15.391 -53.165 799 H LYS 102 HN LYS 102 11.682 16.747 -54.428 800 HA LYS 102 HA LYS 102 13.197 18.691 -55.911 801 HB2 LYS 102 HB2 LYS 102 11.156 16.656 -56.566 802 HB3 LYS 102 HB1 LYS 102 11.186 18.069 -57.607 803 HG2 LYS 102 HG2 LYS 102 12.652 16.773 -58.749 804 HG3 LYS 102 HG1 LYS 102 13.785 17.534 -57.638 805 HD2 LYS 102 HD2 LYS 102 12.475 14.895 -57.034 806 HD3 LYS 102 HD1 LYS 102 13.964 15.009 -57.967 807 HE2 LYS 102 HE2 LYS 102 13.629 16.165 -55.207 808 HE3 LYS 102 HE1 LYS 102 14.252 14.546 -55.515 809 HZ1 LYS 102 HZ1 LYS 102 16.100 15.468 -56.693 810 HZ2 LYS 102 HZ2 LYS 102 15.996 16.233 -55.181 811 HZ3 LYS 102 HZ3 LYS 102 15.474 17.036 -56.578 812 H LEU 103 HN LEU 103 10.387 18.776 -53.981 813 HA LEU 103 HA LEU 103 9.193 21.088 -55.202 814 HB2 LEU 103 HB2 LEU 103 8.852 19.946 -52.425 815 HB3 LEU 103 HB1 LEU 103 7.873 21.226 -53.110 816 HG LEU 103 HG LEU 103 8.006 18.382 -54.110 817 HD11 LEU 103 HD11 LEU 103 5.819 19.863 -52.661 818 HD12 LEU 103 HD12 LEU 103 6.837 18.595 -51.980 819 HD13 LEU 103 HD13 LEU 103 5.718 18.218 -53.290 820 HD21 LEU 103 HD21 LEU 103 7.631 19.946 -55.929 821 HD22 LEU 103 HD22 LEU 103 6.329 20.713 -55.024 822 HD23 LEU 103 HD23 LEU 103 6.157 19.046 -55.574 823 H LYS 104 HN LYS 104 11.076 20.527 -52.247 824 HA LYS 104 HA LYS 104 11.471 23.248 -51.589 825 HB2 LYS 104 HB2 LYS 104 13.545 22.187 -50.354 826 HB3 LYS 104 HB1 LYS 104 11.907 21.875 -49.792 827 HG2 LYS 104 HG2 LYS 104 11.896 19.717 -50.595 828 HG3 LYS 104 HG1 LYS 104 13.168 20.036 -51.770 829 HD2 LYS 104 HD2 LYS 104 13.626 20.033 -48.797 830 HD3 LYS 104 HD1 LYS 104 13.822 18.603 -49.812 831 HE2 LYS 104 HE2 LYS 104 15.365 20.116 -51.233 832 HE3 LYS 104 HE1 LYS 104 15.407 21.144 -49.800 833 HZ1 LYS 104 HZ1 LYS 104 17.249 19.635 -49.757 834 HZ2 LYS 104 HZ2 LYS 104 16.229 18.296 -49.963 835 HZ3 LYS 104 HZ3 LYS 104 16.166 19.196 -48.524 836 H SER 105 HN SER 105 12.672 21.457 -54.132 837 HA SER 105 HA SER 105 15.273 22.587 -54.370 838 HB2 SER 105 HB2 SER 105 14.627 20.446 -55.428 839 HB3 SER 105 HB1 SER 105 13.514 21.315 -56.483 840 HG SER 105 HG SER 105 16.302 21.858 -56.359 841 H LYS 106 HN LYS 106 12.106 23.741 -55.015 842 HA LYS 106 HA LYS 106 13.314 26.170 -56.116 843 HB2 LYS 106 HB2 LYS 106 11.556 26.503 -57.728 844 HB3 LYS 106 HB1 LYS 106 12.267 24.923 -58.002 845 HG2 LYS 106 HG2 LYS 106 9.806 25.148 -56.332 846 HG3 LYS 106 HG1 LYS 106 9.685 25.256 -58.087 847 HD2 LYS 106 HD2 LYS 106 11.031 23.000 -56.630 848 HD3 LYS 106 HD1 LYS 106 9.345 22.971 -57.143 849 HE2 LYS 106 HE2 LYS 106 10.127 23.378 -59.480 850 HE3 LYS 106 HE1 LYS 106 11.784 23.201 -58.906 851 HZ1 LYS 106 HZ1 LYS 106 9.659 21.126 -58.790 852 HZ2 LYS 106 HZ2 LYS 106 11.230 20.950 -58.178 853 HZ3 LYS 106 HZ3 LYS 106 10.990 21.142 -59.845 854 H GLY 107 HN GLY 107 10.432 27.168 -56.352 855 HA2 GLY 107 HA2 GLY 107 10.357 28.074 -53.559 856 HA3 GLY 107 HA1 GLY 107 9.687 28.943 -54.932 857 H SER 108 HN SER 108 9.315 25.631 -53.711 858 HA SER 108 HA SER 108 6.406 26.034 -53.764 859 HB2 SER 108 HB2 SER 108 7.998 23.456 -53.798 860 HB3 SER 108 HB1 SER 108 6.238 23.578 -53.870 861 HG SER 108 HG SER 108 7.508 25.123 -55.736 Start of MODEL 14 1 H1 MET 1 HT1 MET 1 10.277 39.092 -46.393 2 H2 MET 1 HT2 MET 1 10.805 40.228 -45.252 3 H3 MET 1 HT3 MET 1 9.177 40.205 -45.735 4 HA MET 1 HA MET 1 9.428 39.233 -43.559 5 HB2 MET 1 HB2 MET 1 8.282 37.126 -43.969 6 HB3 MET 1 HB1 MET 1 7.678 38.355 -45.072 7 HG2 MET 1 HG2 MET 1 8.923 37.433 -46.890 8 HG3 MET 1 HG1 MET 1 9.765 36.320 -45.816 9 HE1 MET 1 HE1 MET 1 6.333 37.257 -47.471 10 HE2 MET 1 HE2 MET 1 5.938 37.268 -45.753 11 HE3 MET 1 HE3 MET 1 5.265 36.022 -46.805 12 H GLY 2 HN GLY 2 10.360 37.706 -42.184 13 HA2 GLY 2 HA2 GLY 2 12.874 36.541 -43.178 14 HA3 GLY 2 HA1 GLY 2 12.468 36.827 -41.489 15 H SER 3 HN SER 3 12.415 34.604 -44.067 16 HA SER 3 HA SER 3 10.546 32.796 -42.802 17 HB2 SER 3 HB2 SER 3 12.342 32.341 -45.196 18 HB3 SER 3 HB1 SER 3 10.958 31.357 -44.716 19 HG SER 3 HG SER 3 9.727 32.695 -45.749 20 H SER 4 HN SER 4 11.100 30.713 -42.026 21 HA SER 4 HA SER 4 13.590 30.699 -40.573 22 HB2 SER 4 HB2 SER 4 11.403 28.610 -40.660 23 HB3 SER 4 HB1 SER 4 12.669 28.758 -39.441 24 HG SER 4 HG SER 4 11.514 30.209 -38.458 25 H HIS 5 HN HIS 5 13.954 30.523 -43.370 26 HA HIS 5 HA HIS 5 14.267 27.954 -44.415 27 HB2 HIS 5 HB2 HIS 5 14.364 30.004 -45.776 28 HB3 HIS 5 HB1 HIS 5 15.882 30.448 -45.009 29 HD1 HIS 5 HD1 HIS 5 14.431 28.283 -47.661 30 HD2 HIS 5 HD2 HIS 5 18.130 28.938 -45.866 31 HE1 HIS 5 HE1 HIS 5 16.123 27.160 -49.151 32 HE2 HIS 5 HE2 HIS 5 18.327 27.417 -47.947 33 H HIS 6 HN HIS 6 15.320 26.391 -43.425 34 HA HIS 6 HA HIS 6 16.969 25.138 -42.532 35 HB2 HIS 6 HB2 HIS 6 18.319 26.114 -44.401 36 HB3 HIS 6 HB1 HIS 6 18.867 27.366 -43.292 37 HD1 HIS 6 HD1 HIS 6 18.900 23.564 -43.509 38 HD2 HIS 6 HD2 HIS 6 21.150 26.715 -41.986 39 HE1 HIS 6 HE1 HIS 6 20.992 22.518 -42.567 40 HE2 HIS 6 HE2 HIS 6 22.391 24.459 -41.765 41 H HIS 7 HN HIS 7 15.817 27.780 -41.176 42 HA HIS 7 HA HIS 7 17.734 28.007 -38.979 43 HB2 HIS 7 HB2 HIS 7 16.679 30.032 -40.077 44 HB3 HIS 7 HB1 HIS 7 15.145 29.526 -39.383 45 HD1 HIS 7 HD1 HIS 7 18.594 30.696 -38.298 46 HD2 HIS 7 HD2 HIS 7 14.716 30.368 -36.820 47 HE1 HIS 7 HE1 HIS 7 18.609 31.867 -36.074 48 HE2 HIS 7 HE2 HIS 7 16.247 31.695 -35.212 49 H HIS 8 HN HIS 8 16.029 25.635 -39.536 50 HA HIS 8 HA HIS 8 14.966 25.310 -36.853 51 HB2 HIS 8 HB2 HIS 8 13.192 26.135 -38.687 52 HB3 HIS 8 HB1 HIS 8 13.158 24.412 -39.050 53 HD1 HIS 8 HD1 HIS 8 11.011 23.653 -38.065 54 HD2 HIS 8 HD2 HIS 8 13.176 26.072 -35.458 55 HE1 HIS 8 HE1 HIS 8 9.719 23.656 -35.902 56 HE2 HIS 8 HE2 HIS 8 10.971 25.238 -34.389 57 H HIS 9 HN HIS 9 14.088 22.904 -36.725 58 HA HIS 9 HA HIS 9 16.272 21.256 -37.702 59 HB2 HIS 9 HB2 HIS 9 15.440 21.256 -35.300 60 HB3 HIS 9 HB1 HIS 9 13.994 20.446 -35.886 61 HD1 HIS 9 HD1 HIS 9 14.254 18.182 -34.897 62 HD2 HIS 9 HD2 HIS 9 17.713 19.467 -36.817 63 HE1 HIS 9 HE1 HIS 9 15.807 16.196 -34.904 64 HE2 HIS 9 HE2 HIS 9 17.829 16.957 -36.198 65 H HIS 10 HN HIS 10 16.067 19.585 -39.139 66 HA HIS 10 HA HIS 10 13.635 19.641 -40.760 67 HB2 HIS 10 HB2 HIS 10 15.920 19.932 -41.768 68 HB3 HIS 10 HB1 HIS 10 16.283 18.277 -41.310 69 HD1 HIS 10 HD1 HIS 10 15.687 16.505 -42.964 70 HD2 HIS 10 HD2 HIS 10 13.785 20.119 -43.759 71 HE1 HIS 10 HE1 HIS 10 14.581 16.213 -45.202 72 HE2 HIS 10 HE2 HIS 10 13.667 18.491 -45.771 73 H SER 11 HN SER 11 12.405 17.845 -41.218 74 HA SER 11 HA SER 11 11.614 15.723 -41.253 75 HB2 SER 11 HB2 SER 11 14.186 14.936 -39.874 76 HB3 SER 11 HB1 SER 11 13.010 13.826 -40.580 77 HG SER 11 HG SER 11 14.096 14.093 -42.359 78 H SER 12 HN SER 12 13.183 16.442 -38.125 79 HA SER 12 HA SER 12 11.060 15.044 -36.708 80 HB2 SER 12 HB2 SER 12 13.387 16.600 -35.560 81 HB3 SER 12 HB1 SER 12 12.400 15.388 -34.738 82 HG SER 12 HG SER 12 13.489 13.834 -35.679 83 H GLY 13 HN GLY 13 10.708 17.642 -38.225 84 HA2 GLY 13 HA2 GLY 13 10.234 19.642 -36.188 85 HA3 GLY 13 HA1 GLY 13 10.021 19.843 -37.923 86 H ARG 14 HN ARG 14 8.703 17.423 -35.758 87 HA ARG 14 HA ARG 14 5.997 18.325 -36.477 88 HB2 ARG 14 HB2 ARG 14 5.279 16.012 -36.404 89 HB3 ARG 14 HB1 ARG 14 6.646 16.151 -37.500 90 HG2 ARG 14 HG2 ARG 14 8.102 15.398 -35.573 91 HG3 ARG 14 HG1 ARG 14 6.608 15.000 -34.723 92 HD2 ARG 14 HD2 ARG 14 7.251 12.989 -35.717 93 HD3 ARG 14 HD1 ARG 14 6.019 13.630 -36.804 94 HE ARG 14 HE ARG 14 8.442 14.547 -37.760 95 HH11 ARG 14 HH11 ARG 14 6.902 11.454 -37.224 96 HH12 ARG 14 HH12 ARG 14 7.782 10.651 -38.480 97 HH21 ARG 14 HH21 ARG 14 9.634 13.491 -39.400 98 HH22 ARG 14 HH22 ARG 14 9.346 11.808 -39.724 99 H GLU 15 HN GLU 15 8.198 17.213 -34.029 100 HA GLU 15 HA GLU 15 6.072 17.226 -32.003 101 HB2 GLU 15 HB2 GLU 15 7.827 16.143 -30.559 102 HB3 GLU 15 HB1 GLU 15 7.341 15.210 -31.968 103 HG2 GLU 15 HG2 GLU 15 9.339 15.678 -33.105 104 HG3 GLU 15 HG1 GLU 15 9.758 16.983 -31.997 105 H ASN 16 HN ASN 16 8.218 19.353 -33.253 106 HA ASN 16 HA ASN 16 9.463 20.347 -30.893 107 HB2 ASN 16 HB2 ASN 16 10.162 22.260 -32.353 108 HB3 ASN 16 HB1 ASN 16 10.630 20.671 -32.934 109 HD21 ASN 16 HD21 ASN 16 7.439 22.203 -33.239 110 HD22 ASN 16 HD22 ASN 16 7.468 22.274 -34.964 111 H LEU 17 HN LEU 17 6.320 20.530 -31.769 112 HA LEU 17 HA LEU 17 5.836 23.250 -30.911 113 HB2 LEU 17 HB2 LEU 17 3.929 20.974 -31.468 114 HB3 LEU 17 HB1 LEU 17 3.423 22.582 -30.999 115 HG LEU 17 HG LEU 17 4.747 23.335 -33.121 116 HD11 LEU 17 HD11 LEU 17 4.712 21.689 -34.920 117 HD12 LEU 17 HD12 LEU 17 4.168 20.453 -33.785 118 HD13 LEU 17 HD13 LEU 17 5.767 21.177 -33.602 119 HD21 LEU 17 HD21 LEU 17 2.103 21.895 -33.294 120 HD22 LEU 17 HD22 LEU 17 2.721 23.061 -34.464 121 HD23 LEU 17 HD23 LEU 17 2.345 23.577 -32.820 122 H TYR 18 HN TYR 18 6.381 20.260 -29.426 123 HA TYR 18 HA TYR 18 5.182 21.237 -26.924 124 HB2 TYR 18 HB2 TYR 18 5.118 18.395 -27.964 125 HB3 TYR 18 HB1 TYR 18 4.600 18.887 -26.355 126 HD1 TYR 18 HD1 TYR 18 2.530 20.120 -26.035 127 HD2 TYR 18 HD2 TYR 18 3.782 18.938 -29.923 128 HE1 TYR 18 HE1 TYR 18 0.284 20.617 -26.904 129 HE2 TYR 18 HE2 TYR 18 1.542 19.434 -30.803 130 HH TYR 18 HH TYR 18 -0.708 19.698 -30.079 131 H PHE 19 HN PHE 19 6.072 20.027 -24.989 132 HA PHE 19 HA PHE 19 8.978 20.036 -25.243 133 HB2 PHE 19 HB2 PHE 19 8.994 20.205 -22.782 134 HB3 PHE 19 HB1 PHE 19 8.037 21.478 -23.527 135 HD1 PHE 19 HD1 PHE 19 5.532 21.284 -23.493 136 HD2 PHE 19 HD2 PHE 19 8.062 18.736 -21.212 137 HE1 PHE 19 HE1 PHE 19 3.632 20.703 -22.046 138 HE2 PHE 19 HE2 PHE 19 6.165 18.146 -19.763 139 HZ PHE 19 HZ PHE 19 3.946 19.130 -20.177 140 H GLN 20 HN GLN 20 6.844 17.743 -25.691 141 HA GLN 20 HA GLN 20 7.080 15.504 -25.949 142 HB2 GLN 20 HB2 GLN 20 9.813 16.117 -24.898 143 HB3 GLN 20 HB1 GLN 20 9.289 14.448 -25.034 144 HG2 GLN 20 HG2 GLN 20 10.555 15.057 -26.974 145 HG3 GLN 20 HG1 GLN 20 8.877 14.792 -27.432 146 HE21 GLN 20 HE21 GLN 20 7.678 16.477 -28.201 147 HE22 GLN 20 HE22 GLN 20 8.354 18.014 -28.612 148 H GLY 21 HN GLY 21 8.289 16.491 -22.733 149 HA2 GLY 21 HA2 GLY 21 7.691 13.949 -21.573 150 HA3 GLY 21 HA1 GLY 21 8.209 15.385 -20.716 151 H HIS 22 HN HIS 22 5.319 14.238 -22.460 152 HA HIS 22 HA HIS 22 3.671 14.261 -20.152 153 HB2 HIS 22 HB2 HIS 22 4.025 16.805 -21.128 154 HB3 HIS 22 HB1 HIS 22 2.586 16.289 -22.001 155 HD1 HIS 22 HD1 HIS 22 0.466 16.798 -20.808 156 HD2 HIS 22 HD2 HIS 22 3.666 16.303 -18.190 157 HE1 HIS 22 HE1 HIS 22 -0.444 17.289 -18.513 158 HE2 HIS 22 HE2 HIS 22 1.550 17.158 -16.975 159 H MET 23 HN MET 23 1.462 13.539 -20.709 160 HA MET 23 HA MET 23 1.462 11.895 -23.053 161 HB2 MET 23 HB2 MET 23 -0.693 12.485 -21.026 162 HB3 MET 23 HB1 MET 23 -0.931 11.409 -22.395 163 HG2 MET 23 HG2 MET 23 0.944 10.021 -21.567 164 HG3 MET 23 HG1 MET 23 1.040 11.066 -20.149 165 HE1 MET 23 HE1 MET 23 -1.184 8.513 -22.148 166 HE2 MET 23 HE2 MET 23 -2.216 9.940 -22.046 167 HE3 MET 23 HE3 MET 23 -2.647 8.477 -21.163 168 H CYS 24 HN CYS 24 1.801 13.480 -24.637 169 HA CYS 24 HA CYS 24 -0.330 15.387 -25.157 170 HB2 CYS 24 HB2 CYS 24 2.202 14.883 -26.738 171 HB3 CYS 24 HB1 CYS 24 1.145 16.286 -26.851 172 HG CYS 24 HG CYS 24 3.002 15.483 -24.090 173 H ILE 25 HN ILE 25 -1.962 14.954 -26.486 174 HA ILE 25 HA ILE 25 -2.350 12.493 -27.735 175 HB ILE 25 HB ILE 25 -4.184 14.004 -27.139 176 HG12 ILE 25 HG12 ILE 25 -4.296 12.271 -29.098 177 HG13 ILE 25 HG11 ILE 25 -5.635 13.376 -28.821 178 HG21 ILE 25 HG21 ILE 25 -4.743 15.946 -28.525 179 HG22 ILE 25 HG22 ILE 25 -3.238 15.727 -29.417 180 HG23 ILE 25 HG23 ILE 25 -3.195 16.129 -27.700 181 HD11 ILE 25 HD11 ILE 25 -5.130 13.161 -31.189 182 HD12 ILE 25 HD12 ILE 25 -3.474 13.699 -30.896 183 HD13 ILE 25 HD13 ILE 25 -4.822 14.804 -30.627 184 H GLN 26 HN GLN 26 -0.964 15.488 -28.923 185 HA GLN 26 HA GLN 26 -0.771 14.921 -31.644 186 HB2 GLN 26 HB2 GLN 26 -0.258 17.116 -30.780 187 HB3 GLN 26 HB1 GLN 26 1.070 16.480 -29.820 188 HG2 GLN 26 HG2 GLN 26 1.927 17.632 -31.748 189 HG3 GLN 26 HG1 GLN 26 2.267 15.908 -31.888 190 HE21 GLN 26 HE21 GLN 26 2.504 16.011 -34.101 191 HE22 GLN 26 HE22 GLN 26 1.151 16.238 -35.161 192 H LYS 27 HN LYS 27 1.576 14.257 -29.055 193 HA LYS 27 HA LYS 27 3.556 13.186 -30.748 194 HB2 LYS 27 HB2 LYS 27 3.861 14.071 -28.382 195 HB3 LYS 27 HB1 LYS 27 3.227 12.530 -27.820 196 HG2 LYS 27 HG2 LYS 27 5.563 12.328 -27.732 197 HG3 LYS 27 HG1 LYS 27 5.066 11.435 -29.172 198 HD2 LYS 27 HD2 LYS 27 5.460 13.922 -30.196 199 HD3 LYS 27 HD1 LYS 27 6.680 13.879 -28.922 200 HE2 LYS 27 HE2 LYS 27 7.676 13.087 -30.956 201 HE3 LYS 27 HE1 LYS 27 7.488 11.717 -29.859 202 HZ1 LYS 27 HZ1 LYS 27 6.811 11.225 -32.167 203 HZ2 LYS 27 HZ2 LYS 27 5.585 12.397 -32.040 204 HZ3 LYS 27 HZ3 LYS 27 5.552 11.013 -31.051 205 H VAL 28 HN VAL 28 0.971 11.688 -28.861 206 HA VAL 28 HA VAL 28 1.740 9.007 -29.169 207 HB VAL 28 HB VAL 28 -1.059 10.117 -28.876 208 HG11 VAL 28 HG11 VAL 28 -1.076 7.808 -29.667 209 HG12 VAL 28 HG12 VAL 28 -1.630 7.901 -27.995 210 HG13 VAL 28 HG13 VAL 28 0.003 7.340 -28.354 211 HG21 VAL 28 HG21 VAL 28 0.407 10.827 -27.064 212 HG22 VAL 28 HG22 VAL 28 0.904 9.157 -26.795 213 HG23 VAL 28 HG23 VAL 28 -0.763 9.641 -26.487 214 H ILE 29 HN ILE 29 -0.454 11.013 -31.107 215 HA ILE 29 HA ILE 29 -1.206 9.068 -32.970 216 HB ILE 29 HB ILE 29 -1.203 12.049 -32.934 217 HG12 ILE 29 HG12 ILE 29 -3.574 11.759 -33.358 218 HG13 ILE 29 HG11 ILE 29 -3.343 10.046 -33.676 219 HG21 ILE 29 HG21 ILE 29 -1.664 10.483 -35.467 220 HG22 ILE 29 HG22 ILE 29 -0.346 11.615 -35.165 221 HG23 ILE 29 HG23 ILE 29 -2.010 12.197 -35.239 222 HD11 ILE 29 HD11 ILE 29 -4.306 10.405 -31.484 223 HD12 ILE 29 HD12 ILE 29 -2.936 11.420 -31.033 224 HD13 ILE 29 HD13 ILE 29 -2.694 9.703 -31.348 225 H GLU 30 HN GLU 30 1.463 11.407 -33.048 226 HA GLU 30 HA GLU 30 2.509 10.787 -35.544 227 HB2 GLU 30 HB2 GLU 30 4.077 11.518 -33.070 228 HB3 GLU 30 HB1 GLU 30 4.626 11.678 -34.732 229 HG2 GLU 30 HG2 GLU 30 2.991 13.376 -35.164 230 HG3 GLU 30 HG1 GLU 30 2.277 13.143 -33.567 231 H ASP 31 HN ASP 31 3.307 9.370 -32.386 232 HA ASP 31 HA ASP 31 5.431 7.801 -33.354 233 HB2 ASP 31 HB2 ASP 31 3.832 7.753 -30.822 234 HB3 ASP 31 HB1 ASP 31 5.016 6.491 -31.154 235 H LYS 32 HN LYS 32 1.993 7.053 -33.026 236 HA LYS 32 HA LYS 32 2.405 4.253 -33.405 237 HB2 LYS 32 HB2 LYS 32 -0.108 5.917 -33.565 238 HB3 LYS 32 HB1 LYS 32 -0.082 4.164 -33.730 239 HG2 LYS 32 HG2 LYS 32 1.052 4.110 -31.464 240 HG3 LYS 32 HG1 LYS 32 0.624 5.812 -31.323 241 HD2 LYS 32 HD2 LYS 32 -1.341 3.560 -31.753 242 HD3 LYS 32 HD1 LYS 32 -0.986 4.311 -30.198 243 HE2 LYS 32 HE2 LYS 32 -2.856 5.477 -30.794 244 HE3 LYS 32 HE1 LYS 32 -1.610 6.512 -31.490 245 HZ1 LYS 32 HZ1 LYS 32 -3.478 4.683 -32.850 246 HZ2 LYS 32 HZ2 LYS 32 -1.992 5.067 -33.574 247 HZ3 LYS 32 HZ3 LYS 32 -3.087 6.301 -33.208 248 H LEU 33 HN LEU 33 1.274 6.856 -35.591 249 HA LEU 33 HA LEU 33 1.078 5.032 -37.788 250 HB2 LEU 33 HB2 LEU 33 0.707 7.023 -39.180 251 HB3 LEU 33 HB1 LEU 33 -0.341 6.962 -37.781 252 HG LEU 33 HG LEU 33 1.441 8.562 -36.720 253 HD11 LEU 33 HD11 LEU 33 2.459 10.071 -38.351 254 HD12 LEU 33 HD12 LEU 33 1.878 9.047 -39.664 255 HD13 LEU 33 HD13 LEU 33 3.072 8.426 -38.524 256 HD21 LEU 33 HD21 LEU 33 -0.871 9.147 -37.121 257 HD22 LEU 33 HD22 LEU 33 -0.526 9.438 -38.825 258 HD23 LEU 33 HD23 LEU 33 0.182 10.481 -37.591 259 H SER 34 HN SER 34 3.641 7.097 -36.560 260 HA SER 34 HA SER 34 5.208 7.079 -38.928 261 HB2 SER 34 HB2 SER 34 6.040 7.535 -36.056 262 HB3 SER 34 HB1 SER 34 7.082 7.798 -37.454 263 HG SER 34 HG SER 34 4.750 9.186 -36.677 264 H SER 35 HN SER 35 4.985 4.889 -36.188 265 HA SER 35 HA SER 35 7.312 3.388 -36.783 266 HB2 SER 35 HB2 SER 35 4.806 2.513 -35.324 267 HB3 SER 35 HB1 SER 35 6.377 1.712 -35.260 268 HG SER 35 HG SER 35 5.513 4.060 -34.043 269 H ALA 36 HN ALA 36 4.092 3.406 -38.072 270 HA ALA 36 HA ALA 36 4.401 0.801 -39.324 271 HB1 ALA 36 HB1 ALA 36 2.242 1.413 -38.346 272 HB2 ALA 36 HB2 ALA 36 2.109 1.097 -40.076 273 HB3 ALA 36 HB3 ALA 36 2.113 2.757 -39.481 274 H LEU 37 HN LEU 37 3.873 4.171 -40.379 275 HA LEU 37 HA LEU 37 4.177 3.384 -43.150 276 HB2 LEU 37 HB2 LEU 37 3.783 6.125 -41.955 277 HB3 LEU 37 HB1 LEU 37 3.641 5.710 -43.652 278 HG LEU 37 HG LEU 37 1.836 4.739 -41.433 279 HD11 LEU 37 HD11 LEU 37 0.132 6.085 -42.554 280 HD12 LEU 37 HD12 LEU 37 1.343 6.665 -43.696 281 HD13 LEU 37 HD13 LEU 37 1.477 7.076 -41.987 282 HD21 LEU 37 HD21 LEU 37 1.714 4.223 -44.403 283 HD22 LEU 37 HD22 LEU 37 0.495 3.745 -43.219 284 HD23 LEU 37 HD23 LEU 37 2.110 3.039 -43.158 285 H LYS 38 HN LYS 38 6.042 5.014 -40.698 286 HA LYS 38 HA LYS 38 8.119 5.900 -40.617 287 HB2 LYS 38 HB2 LYS 38 8.540 3.808 -42.744 288 HB3 LYS 38 HB1 LYS 38 9.853 4.756 -42.060 289 HG2 LYS 38 HG2 LYS 38 8.000 3.005 -40.459 290 HG3 LYS 38 HG1 LYS 38 9.596 2.520 -41.036 291 HD2 LYS 38 HD2 LYS 38 9.042 4.851 -39.201 292 HD3 LYS 38 HD1 LYS 38 9.620 3.267 -38.686 293 HE2 LYS 38 HE2 LYS 38 11.058 5.146 -40.560 294 HE3 LYS 38 HE1 LYS 38 11.449 4.889 -38.860 295 HZ1 LYS 38 HZ1 LYS 38 11.615 2.872 -41.037 296 HZ2 LYS 38 HZ2 LYS 38 11.882 2.540 -39.395 297 HZ3 LYS 38 HZ3 LYS 38 12.914 3.598 -40.227 298 HA PRO 39 HA PRO 39 7.728 8.748 -44.201 299 HB2 PRO 39 HB2 PRO 39 7.052 10.965 -42.843 300 HB3 PRO 39 HB1 PRO 39 5.848 9.769 -43.335 301 HG2 PRO 39 HG2 PRO 39 7.072 10.242 -40.660 302 HG3 PRO 39 HG1 PRO 39 5.418 9.759 -41.071 303 HD2 PRO 39 HD2 PRO 39 7.439 8.047 -40.209 304 HD3 PRO 39 HD1 PRO 39 5.954 7.550 -41.041 305 H THR 40 HN THR 40 9.515 9.760 -44.896 306 HA THR 40 HA THR 40 11.793 10.045 -43.191 307 HB THR 40 HB THR 40 12.846 11.071 -45.233 308 HG1 THR 40 HG1 THR 40 11.543 11.753 -46.743 309 HG21 THR 40 HG21 THR 40 11.430 8.432 -45.638 310 HG22 THR 40 HG22 THR 40 12.990 8.666 -44.851 311 HG23 THR 40 HG23 THR 40 12.812 9.002 -46.573 312 H PHE 41 HN PHE 41 9.297 12.094 -44.460 313 HA PHE 41 HA PHE 41 10.127 14.213 -42.632 314 HB2 PHE 41 HB2 PHE 41 11.031 14.831 -44.860 315 HB3 PHE 41 HB1 PHE 41 9.411 14.708 -45.536 316 HD1 PHE 41 HD1 PHE 41 11.508 16.597 -43.148 317 HD2 PHE 41 HD2 PHE 41 7.893 16.500 -45.392 318 HE1 PHE 41 HE1 PHE 41 11.099 18.957 -42.586 319 HE2 PHE 41 HE2 PHE 41 7.481 18.860 -44.837 320 HZ PHE 41 HZ PHE 41 9.085 20.091 -43.431 321 H LEU 42 HN LEU 42 8.419 15.048 -41.560 322 HA LEU 42 HA LEU 42 5.734 14.743 -42.669 323 HB2 LEU 42 HB2 LEU 42 6.578 12.860 -40.954 324 HB3 LEU 42 HB1 LEU 42 6.082 14.069 -39.789 325 HG LEU 42 HG LEU 42 4.319 12.773 -41.873 326 HD11 LEU 42 HD11 LEU 42 4.375 12.531 -38.871 327 HD12 LEU 42 HD12 LEU 42 4.880 11.300 -40.028 328 HD13 LEU 42 HD13 LEU 42 3.188 11.789 -39.943 329 HD21 LEU 42 HD21 LEU 42 3.619 14.812 -39.761 330 HD22 LEU 42 HD22 LEU 42 2.472 13.967 -40.800 331 HD23 LEU 42 HD23 LEU 42 3.641 15.085 -41.504 332 H GLU 43 HN GLU 43 4.827 16.692 -42.570 333 HA GLU 43 HA GLU 43 5.605 18.473 -40.356 334 HB2 GLU 43 HB2 GLU 43 6.395 19.243 -42.582 335 HB3 GLU 43 HB1 GLU 43 4.727 19.279 -43.137 336 HG2 GLU 43 HG2 GLU 43 4.185 21.009 -41.558 337 HG3 GLU 43 HG1 GLU 43 5.794 20.912 -40.846 338 H LEU 44 HN LEU 44 4.047 18.855 -38.969 339 HA LEU 44 HA LEU 44 1.281 18.298 -39.654 340 HB2 LEU 44 HB2 LEU 44 2.727 18.906 -37.098 341 HB3 LEU 44 HB1 LEU 44 0.983 19.055 -37.175 342 HG LEU 44 HG LEU 44 1.568 16.917 -36.234 343 HD11 LEU 44 HD11 LEU 44 -0.416 16.989 -37.633 344 HD12 LEU 44 HD12 LEU 44 0.386 15.424 -37.764 345 HD13 LEU 44 HD13 LEU 44 0.557 16.613 -39.056 346 HD21 LEU 44 HD21 LEU 44 3.111 16.417 -38.773 347 HD22 LEU 44 HD22 LEU 44 2.812 15.234 -37.500 348 HD23 LEU 44 HD23 LEU 44 3.797 16.659 -37.166 349 H VAL 45 HN VAL 45 -0.043 19.803 -40.385 350 HA VAL 45 HA VAL 45 0.628 22.629 -39.884 351 HB VAL 45 HB VAL 45 -1.130 21.503 -42.074 352 HG11 VAL 45 HG11 VAL 45 -0.941 23.740 -43.055 353 HG12 VAL 45 HG12 VAL 45 -0.001 24.271 -41.660 354 HG13 VAL 45 HG13 VAL 45 -1.687 23.795 -41.458 355 HG21 VAL 45 HG21 VAL 45 0.727 22.011 -43.596 356 HG22 VAL 45 HG22 VAL 45 1.175 20.793 -42.401 357 HG23 VAL 45 HG23 VAL 45 1.730 22.456 -42.215 358 H ASP 46 HN ASP 46 -0.627 23.658 -38.477 359 HA ASP 46 HA ASP 46 -3.038 22.579 -37.442 360 HB2 ASP 46 HB2 ASP 46 -1.556 24.175 -36.195 361 HB3 ASP 46 HB1 ASP 46 -2.091 25.454 -37.280 362 H LYS 47 HN LYS 47 -4.671 22.286 -38.820 363 HA LYS 47 HA LYS 47 -5.267 24.253 -40.875 364 HB2 LYS 47 HB2 LYS 47 -5.295 21.700 -41.173 365 HB3 LYS 47 HB1 LYS 47 -6.806 21.728 -40.275 366 HG2 LYS 47 HG2 LYS 47 -7.770 23.214 -41.979 367 HG3 LYS 47 HG1 LYS 47 -6.259 23.118 -42.889 368 HD2 LYS 47 HD2 LYS 47 -6.542 20.676 -43.052 369 HD3 LYS 47 HD1 LYS 47 -8.083 20.813 -42.205 370 HE2 LYS 47 HE2 LYS 47 -7.375 22.004 -44.883 371 HE3 LYS 47 HE1 LYS 47 -8.476 20.660 -44.583 372 HZ1 LYS 47 HZ1 LYS 47 -9.821 22.537 -44.886 373 HZ2 LYS 47 HZ2 LYS 47 -8.851 23.519 -43.901 374 HZ3 LYS 47 HZ3 LYS 47 -9.799 22.297 -43.205 375 H SER 48 HN SER 48 -5.534 25.313 -38.405 376 HA SER 48 HA SER 48 -6.888 26.490 -37.049 377 HB2 SER 48 HB2 SER 48 -9.081 25.841 -39.036 378 HB3 SER 48 HB1 SER 48 -9.139 27.094 -37.795 379 HG SER 48 HG SER 48 -7.050 27.067 -39.681 380 H CYS 49 HN CYS 49 -6.416 24.708 -35.618 381 HA CYS 49 HA CYS 49 -8.005 22.479 -35.204 382 HB2 CYS 49 HB2 CYS 49 -7.234 22.759 -32.752 383 HB3 CYS 49 HB1 CYS 49 -6.006 22.534 -33.994 384 HG CYS 49 HG CYS 49 -4.827 24.853 -33.791 385 H GLY 50 HN GLY 50 -8.222 25.526 -33.368 386 HA2 GLY 50 HA2 GLY 50 -10.001 26.593 -32.403 387 HA3 GLY 50 HA1 GLY 50 -10.945 25.941 -33.731 388 H CYS 51 HN CYS 51 -12.735 25.142 -32.904 389 HA CYS 51 HA CYS 51 -12.779 23.932 -30.273 390 HB2 CYS 51 HB2 CYS 51 -15.031 24.215 -32.271 391 HB3 CYS 51 HB1 CYS 51 -15.180 23.907 -30.543 392 HG CYS 51 HG CYS 51 -14.009 26.802 -31.951 393 H GLY 52 HN GLY 52 -11.418 22.660 -32.649 394 HA2 GLY 52 HA2 GLY 52 -10.979 20.330 -32.819 395 HA3 GLY 52 HA1 GLY 52 -12.628 20.012 -32.296 396 H THR 53 HN THR 53 -10.952 21.714 -34.944 397 HA THR 53 HA THR 53 -13.117 20.952 -36.732 398 HB THR 53 HB THR 53 -10.697 22.574 -37.492 399 HG1 THR 53 HG1 THR 53 -11.451 23.905 -35.987 400 HG21 THR 53 HG21 THR 53 -12.249 23.524 -39.141 401 HG22 THR 53 HG22 THR 53 -13.531 22.477 -38.532 402 HG23 THR 53 HG23 THR 53 -12.116 21.774 -39.315 403 H SER 54 HN SER 54 -9.711 21.213 -37.672 404 HA SER 54 HA SER 54 -9.524 18.383 -38.254 405 HB2 SER 54 HB2 SER 54 -9.514 20.409 -40.510 406 HB3 SER 54 HB1 SER 54 -9.227 18.677 -40.668 407 HG SER 54 HG SER 54 -11.531 18.994 -39.395 408 H PHE 55 HN PHE 55 -7.422 17.738 -38.897 409 HA PHE 55 HA PHE 55 -5.354 19.832 -38.785 410 HB2 PHE 55 HB2 PHE 55 -5.273 17.059 -37.582 411 HB3 PHE 55 HB1 PHE 55 -3.829 18.030 -37.848 412 HD1 PHE 55 HD1 PHE 55 -3.478 20.100 -36.582 413 HD2 PHE 55 HD2 PHE 55 -6.769 17.521 -35.786 414 HE1 PHE 55 HE1 PHE 55 -3.805 21.198 -34.404 415 HE2 PHE 55 HE2 PHE 55 -7.103 18.614 -33.607 416 HZ PHE 55 HZ PHE 55 -5.621 20.454 -32.914 417 H ASP 56 HN ASP 56 -3.827 19.764 -40.369 418 HA ASP 56 HA ASP 56 -4.184 17.650 -42.391 419 HB2 ASP 56 HB2 ASP 56 -4.818 20.065 -42.988 420 HB3 ASP 56 HB1 ASP 56 -3.093 20.412 -42.941 421 H ALA 57 HN ALA 57 -2.490 16.356 -42.703 422 HA ALA 57 HA ALA 57 0.125 17.270 -41.681 423 HB1 ALA 57 HB1 ALA 57 0.598 14.968 -41.043 424 HB2 ALA 57 HB2 ALA 57 -0.979 14.464 -41.652 425 HB3 ALA 57 HB3 ALA 57 -0.875 15.545 -40.263 426 H VAL 58 HN VAL 58 1.640 17.447 -43.172 427 HA VAL 58 HA VAL 58 1.345 16.126 -45.746 428 HB VAL 58 HB VAL 58 3.566 17.936 -44.764 429 HG11 VAL 58 HG11 VAL 58 2.864 17.011 -47.550 430 HG12 VAL 58 HG12 VAL 58 4.270 16.512 -46.610 431 HG13 VAL 58 HG13 VAL 58 4.114 18.186 -47.143 432 HG21 VAL 58 HG21 VAL 58 1.427 19.100 -44.788 433 HG22 VAL 58 HG22 VAL 58 1.147 18.578 -46.448 434 HG23 VAL 58 HG23 VAL 58 2.469 19.688 -46.083 435 H ILE 59 HN ILE 59 1.992 14.087 -45.925 436 HA ILE 59 HA ILE 59 4.231 13.191 -44.244 437 HB ILE 59 HB ILE 59 2.206 12.057 -43.630 438 HG12 ILE 59 HG12 ILE 59 4.446 10.754 -43.959 439 HG13 ILE 59 HG11 ILE 59 2.969 9.871 -43.604 440 HG21 ILE 59 HG21 ILE 59 1.912 11.266 -46.519 441 HG22 ILE 59 HG22 ILE 59 0.885 12.383 -45.619 442 HG23 ILE 59 HG23 ILE 59 0.914 10.672 -45.191 443 HD11 ILE 59 HD11 ILE 59 2.736 9.305 -45.969 444 HD12 ILE 59 HD12 ILE 59 4.284 8.759 -45.321 445 HD13 ILE 59 HD13 ILE 59 4.211 10.204 -46.329 446 H VAL 60 HN VAL 60 6.041 12.970 -45.271 447 HA VAL 60 HA VAL 60 6.047 12.156 -48.103 448 HB VAL 60 HB VAL 60 8.305 13.397 -46.509 449 HG11 VAL 60 HG11 VAL 60 9.074 12.062 -48.385 450 HG12 VAL 60 HG12 VAL 60 9.333 13.778 -48.702 451 HG13 VAL 60 HG13 VAL 60 7.990 12.931 -49.471 452 HG21 VAL 60 HG21 VAL 60 6.428 14.961 -46.751 453 HG22 VAL 60 HG22 VAL 60 6.475 14.730 -48.499 454 HG23 VAL 60 HG23 VAL 60 7.840 15.476 -47.670 455 H SER 61 HN SER 61 6.439 10.009 -48.372 456 HA SER 61 HA SER 61 8.495 8.777 -46.692 457 HB2 SER 61 HB2 SER 61 7.092 6.898 -46.040 458 HB3 SER 61 HB1 SER 61 6.364 8.407 -45.490 459 HG SER 61 HG SER 61 4.887 8.289 -47.143 460 H ASN 62 HN ASN 62 9.551 7.075 -47.590 461 HA ASN 62 HA ASN 62 9.376 6.540 -50.357 462 HB2 ASN 62 HB2 ASN 62 11.173 5.982 -48.312 463 HB3 ASN 62 HB1 ASN 62 10.557 4.399 -48.775 464 HD21 ASN 62 HD21 ASN 62 10.976 7.197 -50.849 465 HD22 ASN 62 HD22 ASN 62 12.166 6.484 -51.868 466 H ASN 63 HN ASN 63 7.643 5.351 -47.648 467 HA ASN 63 HA ASN 63 7.209 2.691 -48.431 468 HB2 ASN 63 HB2 ASN 63 6.853 3.429 -46.141 469 HB3 ASN 63 HB1 ASN 63 5.526 4.466 -46.655 470 HD21 ASN 63 HD21 ASN 63 3.532 3.604 -46.949 471 HD22 ASN 63 HD22 ASN 63 3.143 1.948 -46.645 472 H PHE 64 HN PHE 64 5.534 5.645 -49.328 473 HA PHE 64 HA PHE 64 3.453 4.069 -50.662 474 HB2 PHE 64 HB2 PHE 64 3.669 7.053 -50.213 475 HB3 PHE 64 HB1 PHE 64 2.322 6.247 -51.010 476 HD1 PHE 64 HD2 PHE 64 1.651 4.023 -49.402 477 HD2 PHE 64 HD1 PHE 64 3.048 7.844 -48.165 478 HE1 PHE 64 HE2 PHE 64 0.553 3.713 -47.223 479 HE2 PHE 64 HE1 PHE 64 1.954 7.544 -45.983 480 HZ PHE 64 HZ PHE 64 0.703 5.476 -45.509 481 H GLU 65 HN GLU 65 6.444 5.052 -51.422 482 HA GLU 65 HA GLU 65 6.023 6.527 -53.821 483 HB2 GLU 65 HB2 GLU 65 8.309 6.705 -53.943 484 HB3 GLU 65 HB1 GLU 65 8.116 6.358 -52.238 485 HG2 GLU 65 HG2 GLU 65 9.733 4.863 -52.628 486 HG3 GLU 65 HG1 GLU 65 8.400 3.860 -53.200 487 H ASP 66 HN ASP 66 5.862 3.184 -53.124 488 HA ASP 66 HA ASP 66 6.652 2.330 -55.776 489 HB2 ASP 66 HB2 ASP 66 7.046 1.038 -53.576 490 HB3 ASP 66 HB1 ASP 66 5.357 0.559 -53.713 491 H LYS 67 HN LYS 67 3.839 3.439 -54.303 492 HA LYS 67 HA LYS 67 1.844 4.021 -55.214 493 HB2 LYS 67 HB2 LYS 67 3.370 4.250 -57.286 494 HB3 LYS 67 HB1 LYS 67 2.638 2.743 -57.815 495 HG2 LYS 67 HG2 LYS 67 0.397 3.896 -57.538 496 HG3 LYS 67 HG1 LYS 67 1.307 5.398 -57.368 497 HD2 LYS 67 HD2 LYS 67 0.725 5.273 -59.650 498 HD3 LYS 67 HD1 LYS 67 2.422 4.794 -59.574 499 HE2 LYS 67 HE2 LYS 67 1.621 2.406 -59.495 500 HE3 LYS 67 HE1 LYS 67 0.009 3.016 -59.868 501 HZ1 LYS 67 HZ1 LYS 67 2.434 3.064 -61.555 502 HZ2 LYS 67 HZ2 LYS 67 1.138 4.109 -61.865 503 HZ3 LYS 67 HZ3 LYS 67 0.903 2.430 -61.921 504 H LYS 68 HN LYS 68 2.433 1.157 -54.188 505 HA LYS 68 HA LYS 68 0.535 -0.474 -55.608 506 HB2 LYS 68 HB2 LYS 68 1.563 -0.942 -52.807 507 HB3 LYS 68 HB1 LYS 68 0.908 -2.134 -53.921 508 HG2 LYS 68 HG2 LYS 68 3.505 -0.645 -54.224 509 HG3 LYS 68 HG1 LYS 68 3.310 -2.337 -53.772 510 HD2 LYS 68 HD2 LYS 68 2.395 -1.164 -56.396 511 HD3 LYS 68 HD1 LYS 68 3.942 -1.975 -56.158 512 HE2 LYS 68 HE2 LYS 68 2.663 -3.984 -55.383 513 HE3 LYS 68 HE1 LYS 68 1.187 -3.159 -55.884 514 HZ1 LYS 68 HZ1 LYS 68 1.830 -4.552 -57.658 515 HZ2 LYS 68 HZ2 LYS 68 3.442 -4.041 -57.590 516 HZ3 LYS 68 HZ3 LYS 68 2.241 -2.976 -58.141 517 H LEU 69 HN LEU 69 -1.604 -0.179 -55.516 518 HA LEU 69 HA LEU 69 -2.625 1.868 -53.844 519 HB2 LEU 69 HB2 LEU 69 -4.767 1.468 -54.918 520 HB3 LEU 69 HB1 LEU 69 -3.468 1.555 -56.086 521 HG LEU 69 HG LEU 69 -3.613 -1.127 -55.728 522 HD11 LEU 69 HD11 LEU 69 -5.518 -0.984 -54.218 523 HD12 LEU 69 HD12 LEU 69 -5.972 -1.770 -55.731 524 HD13 LEU 69 HD13 LEU 69 -6.431 -0.093 -55.435 525 HD21 LEU 69 HD21 LEU 69 -5.263 0.535 -57.623 526 HD22 LEU 69 HD22 LEU 69 -4.850 -1.166 -57.834 527 HD23 LEU 69 HD23 LEU 69 -3.581 0.059 -57.852 528 H LEU 70 HN LEU 70 -3.195 -1.654 -53.836 529 HA LEU 70 HA LEU 70 -5.026 -1.497 -51.680 530 HB2 LEU 70 HB2 LEU 70 -5.015 -3.878 -51.592 531 HB3 LEU 70 HB1 LEU 70 -5.021 -3.384 -53.263 532 HG LEU 70 HG LEU 70 -3.658 -5.281 -53.161 533 HD11 LEU 70 HD11 LEU 70 -1.418 -4.532 -53.757 534 HD12 LEU 70 HD12 LEU 70 -1.805 -2.921 -53.152 535 HD13 LEU 70 HD13 LEU 70 -2.678 -3.576 -54.536 536 HD21 LEU 70 HD21 LEU 70 -2.206 -4.073 -50.819 537 HD22 LEU 70 HD22 LEU 70 -1.797 -5.594 -51.613 538 HD23 LEU 70 HD23 LEU 70 -3.338 -5.425 -50.771 539 H ASP 71 HN ASP 71 -1.586 -1.673 -51.859 540 HA ASP 71 HA ASP 71 -1.178 -2.648 -49.207 541 HB2 ASP 71 HB2 ASP 71 0.431 -2.809 -51.192 542 HB3 ASP 71 HB1 ASP 71 0.840 -1.129 -50.852 543 H ARG 72 HN ARG 72 -0.903 0.557 -50.744 544 HA ARG 72 HA ARG 72 -0.353 1.931 -48.329 545 HB2 ARG 72 HB2 ARG 72 -1.072 3.982 -49.605 546 HB3 ARG 72 HB1 ARG 72 0.217 3.047 -50.346 547 HG2 ARG 72 HG2 ARG 72 -1.380 2.062 -51.902 548 HG3 ARG 72 HG1 ARG 72 -2.687 2.974 -51.144 549 HD2 ARG 72 HD2 ARG 72 -1.924 5.001 -51.975 550 HD3 ARG 72 HD1 ARG 72 -0.285 4.399 -52.220 551 HE ARG 72 HE ARG 72 -1.096 3.194 -54.150 552 HH11 ARG 72 HH11 ARG 72 -3.303 5.574 -52.828 553 HH12 ARG 72 HH12 ARG 72 -4.164 5.782 -54.325 554 HH21 ARG 72 HH21 ARG 72 -2.216 3.493 -56.133 555 HH22 ARG 72 HH22 ARG 72 -3.535 4.627 -56.199 556 H HIS 73 HN HIS 73 -3.331 0.999 -49.928 557 HA HIS 73 HA HIS 73 -5.070 2.597 -48.368 558 HB2 HIS 73 HB2 HIS 73 -5.754 1.571 -50.507 559 HB3 HIS 73 HB1 HIS 73 -5.653 -0.023 -49.770 560 HD1 HIS 73 HD1 HIS 73 -7.764 3.078 -49.829 561 HD2 HIS 73 HD2 HIS 73 -7.819 -0.737 -48.165 562 HE1 HIS 73 HE1 HIS 73 -10.086 2.771 -48.898 563 HE2 HIS 73 HE2 HIS 73 -10.049 0.510 -47.779 564 H ARG 74 HN ARG 74 -4.055 -0.813 -48.053 565 HA ARG 74 HA ARG 74 -5.667 -1.319 -45.787 566 HB2 ARG 74 HB2 ARG 74 -4.518 -3.407 -45.589 567 HB3 ARG 74 HB1 ARG 74 -4.739 -3.078 -47.299 568 HG2 ARG 74 HG2 ARG 74 -2.384 -2.250 -47.366 569 HG3 ARG 74 HG1 ARG 74 -2.208 -2.807 -45.701 570 HD2 ARG 74 HD2 ARG 74 -2.851 -4.491 -48.117 571 HD3 ARG 74 HD1 ARG 74 -1.343 -4.480 -47.206 572 HE ARG 74 HE ARG 74 -3.399 -5.111 -45.427 573 HH11 ARG 74 HH11 ARG 74 -1.727 -6.489 -48.177 574 HH12 ARG 74 HH12 ARG 74 -2.120 -8.132 -47.761 575 HH21 ARG 74 HH21 ARG 74 -3.912 -7.277 -44.863 576 HH22 ARG 74 HH22 ARG 74 -3.346 -8.580 -45.877 577 H LEU 75 HN LEU 75 -2.327 -0.226 -46.130 578 HA LEU 75 HA LEU 75 -1.615 -0.406 -43.412 579 HB2 LEU 75 HB2 LEU 75 -0.625 1.330 -45.661 580 HB3 LEU 75 HB1 LEU 75 0.045 1.436 -44.045 581 HG LEU 75 HG LEU 75 0.030 -1.085 -45.705 582 HD11 LEU 75 HD11 LEU 75 2.409 -0.653 -46.045 583 HD12 LEU 75 HD12 LEU 75 2.249 0.895 -45.215 584 HD13 LEU 75 HD13 LEU 75 1.419 0.625 -46.747 585 HD21 LEU 75 HD21 LEU 75 1.449 -0.355 -43.146 586 HD22 LEU 75 HD22 LEU 75 1.644 -1.863 -44.039 587 HD23 LEU 75 HD23 LEU 75 0.092 -1.470 -43.300 588 H VAL 76 HN VAL 76 -2.664 2.429 -45.298 589 HA VAL 76 HA VAL 76 -2.675 4.229 -43.173 590 HB VAL 76 HB VAL 76 -4.279 4.244 -45.735 591 HG11 VAL 76 HG11 VAL 76 -3.941 6.478 -43.731 592 HG12 VAL 76 HG12 VAL 76 -5.438 5.612 -44.076 593 HG13 VAL 76 HG13 VAL 76 -4.697 6.624 -45.317 594 HG21 VAL 76 HG21 VAL 76 -1.787 5.724 -44.890 595 HG22 VAL 76 HG22 VAL 76 -2.625 5.921 -46.429 596 HG23 VAL 76 HG23 VAL 76 -1.867 4.379 -46.030 597 H ASN 77 HN ASN 77 -5.374 2.273 -44.459 598 HA ASN 77 HA ASN 77 -7.308 3.488 -42.773 599 HB2 ASN 77 HB2 ASN 77 -7.305 0.925 -44.364 600 HB3 ASN 77 HB1 ASN 77 -8.672 1.385 -43.359 601 HD21 ASN 77 HD21 ASN 77 -6.722 3.719 -45.071 602 HD22 ASN 77 HD22 ASN 77 -7.924 4.166 -46.236 603 H THR 78 HN THR 78 -5.386 0.508 -42.433 604 HA THR 78 HA THR 78 -6.762 -0.476 -40.185 605 HB THR 78 HB THR 78 -3.885 -0.978 -40.969 606 HG1 THR 78 HG1 THR 78 -4.968 -1.829 -42.611 607 HG21 THR 78 HG21 THR 78 -5.739 -2.562 -39.182 608 HG22 THR 78 HG22 THR 78 -4.337 -1.632 -38.653 609 HG23 THR 78 HG23 THR 78 -4.118 -3.051 -39.676 610 H ILE 79 HN ILE 79 -3.673 1.351 -40.333 611 HA ILE 79 HA ILE 79 -3.548 1.481 -37.461 612 HB ILE 79 HB ILE 79 -1.873 2.879 -39.555 613 HG12 ILE 79 HG12 ILE 79 -0.125 1.298 -38.391 614 HG13 ILE 79 HG11 ILE 79 -1.557 0.388 -37.919 615 HG21 ILE 79 HG21 ILE 79 -0.356 3.491 -37.726 616 HG22 ILE 79 HG22 ILE 79 -1.510 2.840 -36.562 617 HG23 ILE 79 HG23 ILE 79 -1.943 4.239 -37.544 618 HD11 ILE 79 HD11 ILE 79 -0.784 1.081 -40.742 619 HD12 ILE 79 HD12 ILE 79 -2.167 0.104 -40.244 620 HD13 ILE 79 HD13 ILE 79 -0.526 -0.478 -39.958 621 H LEU 80 HN LEU 80 -4.200 3.840 -40.049 622 HA LEU 80 HA LEU 80 -4.322 5.996 -38.201 623 HB2 LEU 80 HB2 LEU 80 -4.742 5.723 -41.125 624 HB3 LEU 80 HB1 LEU 80 -5.402 7.139 -40.329 625 HG LEU 80 HG LEU 80 -2.502 6.340 -40.106 626 HD11 LEU 80 HD11 LEU 80 -3.771 8.319 -41.993 627 HD12 LEU 80 HD12 LEU 80 -3.036 6.782 -42.447 628 HD13 LEU 80 HD13 LEU 80 -2.039 8.067 -41.766 629 HD21 LEU 80 HD21 LEU 80 -2.218 8.646 -39.381 630 HD22 LEU 80 HD22 LEU 80 -3.341 7.779 -38.333 631 HD23 LEU 80 HD23 LEU 80 -3.954 8.915 -39.536 632 H LYS 81 HN LYS 81 -6.727 3.699 -39.155 633 HA LYS 81 HA LYS 81 -8.993 5.358 -38.733 634 HB2 LYS 81 HB2 LYS 81 -9.065 3.029 -39.708 635 HB3 LYS 81 HB1 LYS 81 -8.840 2.414 -38.073 636 HG2 LYS 81 HG2 LYS 81 -10.898 3.925 -37.537 637 HG3 LYS 81 HG1 LYS 81 -11.189 3.792 -39.273 638 HD2 LYS 81 HD2 LYS 81 -11.062 1.314 -39.022 639 HD3 LYS 81 HD1 LYS 81 -10.979 1.550 -37.276 640 HE2 LYS 81 HE2 LYS 81 -13.213 2.411 -39.097 641 HE3 LYS 81 HE1 LYS 81 -13.257 1.063 -37.964 642 HZ1 LYS 81 HZ1 LYS 81 -12.937 2.689 -36.155 643 HZ2 LYS 81 HZ2 LYS 81 -14.375 2.944 -37.016 644 HZ3 LYS 81 HZ3 LYS 81 -13.038 3.950 -37.286 645 H GLU 82 HN GLU 82 -7.432 3.026 -36.569 646 HA GLU 82 HA GLU 82 -8.705 3.744 -34.188 647 HB2 GLU 82 HB2 GLU 82 -7.267 1.714 -34.624 648 HB3 GLU 82 HB1 GLU 82 -5.859 2.752 -34.510 649 HG2 GLU 82 HG2 GLU 82 -7.814 2.537 -32.255 650 HG3 GLU 82 HG1 GLU 82 -6.533 1.350 -32.480 651 H GLU 83 HN GLU 83 -5.990 5.078 -35.878 652 HA GLU 83 HA GLU 83 -4.943 6.851 -33.998 653 HB2 GLU 83 HB2 GLU 83 -4.120 6.174 -36.323 654 HB3 GLU 83 HB1 GLU 83 -5.221 7.399 -36.937 655 HG2 GLU 83 HG2 GLU 83 -3.156 8.405 -36.813 656 HG3 GLU 83 HG1 GLU 83 -4.044 9.018 -35.428 657 H LEU 84 HN LEU 84 -7.215 7.460 -36.608 658 HA LEU 84 HA LEU 84 -7.975 10.042 -36.171 659 HB2 LEU 84 HB2 LEU 84 -9.956 7.884 -36.892 660 HB3 LEU 84 HB1 LEU 84 -10.091 9.592 -37.242 661 HG LEU 84 HG LEU 84 -8.182 7.627 -38.484 662 HD11 LEU 84 HD11 LEU 84 -10.451 7.493 -39.317 663 HD12 LEU 84 HD12 LEU 84 -9.383 8.182 -40.537 664 HD13 LEU 84 HD13 LEU 84 -10.464 9.230 -39.619 665 HD21 LEU 84 HD21 LEU 84 -8.397 10.589 -39.007 666 HD22 LEU 84 HD22 LEU 84 -7.359 9.437 -39.854 667 HD23 LEU 84 HD23 LEU 84 -7.075 9.794 -38.148 668 H GLN 85 HN GLN 85 -8.966 7.264 -34.269 669 HA GLN 85 HA GLN 85 -11.294 8.198 -33.100 670 HB2 GLN 85 HB2 GLN 85 -9.137 6.630 -31.684 671 HB3 GLN 85 HB1 GLN 85 -10.825 6.736 -31.213 672 HG2 GLN 85 HG2 GLN 85 -9.635 5.325 -33.577 673 HG3 GLN 85 HG1 GLN 85 -10.549 4.642 -32.237 674 HE21 GLN 85 HE21 GLN 85 -10.686 6.088 -35.328 675 HE22 GLN 85 HE22 GLN 85 -12.402 6.041 -35.525 676 H ASN 86 HN ASN 86 -8.047 9.309 -32.584 677 HA ASN 86 HA ASN 86 -8.755 10.707 -30.111 678 HB2 ASN 86 HB2 ASN 86 -6.112 10.609 -31.580 679 HB3 ASN 86 HB1 ASN 86 -6.384 11.310 -29.989 680 HD21 ASN 86 HD21 ASN 86 -6.013 8.408 -31.821 681 HD22 ASN 86 HD22 ASN 86 -5.868 7.327 -30.475 682 H ILE 87 HN ILE 87 -9.006 11.303 -33.356 683 HA ILE 87 HA ILE 87 -8.538 14.204 -33.027 684 HB ILE 87 HB ILE 87 -8.424 12.883 -35.718 685 HG12 ILE 87 HG12 ILE 87 -6.130 13.034 -33.748 686 HG13 ILE 87 HG11 ILE 87 -6.879 11.571 -34.368 687 HG21 ILE 87 HG21 ILE 87 -6.925 14.765 -36.212 688 HG22 ILE 87 HG22 ILE 87 -7.075 15.312 -34.542 689 HG23 ILE 87 HG23 ILE 87 -8.487 15.313 -35.599 690 HD11 ILE 87 HD11 ILE 87 -6.073 12.099 -36.602 691 HD12 ILE 87 HD12 ILE 87 -4.750 11.994 -35.440 692 HD13 ILE 87 HD13 ILE 87 -5.324 13.571 -35.982 693 H HIS 88 HN HIS 88 -10.084 15.594 -34.054 694 HA HIS 88 HA HIS 88 -12.693 14.445 -34.368 695 HB2 HIS 88 HB2 HIS 88 -12.255 16.781 -33.493 696 HB3 HIS 88 HB1 HIS 88 -11.863 17.248 -35.146 697 HD1 HIS 88 HD1 HIS 88 -14.684 16.740 -32.854 698 HD2 HIS 88 HD2 HIS 88 -14.115 17.061 -36.959 699 HE1 HIS 88 HE1 HIS 88 -16.968 17.132 -33.825 700 HE2 HIS 88 HE2 HIS 88 -16.616 17.043 -36.320 701 H ALA 89 HN ALA 89 -10.317 15.901 -36.555 702 HA ALA 89 HA ALA 89 -11.184 14.158 -38.681 703 HB1 ALA 89 HB1 ALA 89 -11.377 17.149 -39.042 704 HB2 ALA 89 HB2 ALA 89 -12.740 16.036 -38.935 705 HB3 ALA 89 HB3 ALA 89 -11.621 15.932 -40.295 706 H PHE 90 HN PHE 90 -9.353 13.391 -39.448 707 HA PHE 90 HA PHE 90 -6.995 15.151 -39.544 708 HB2 PHE 90 HB2 PHE 90 -6.642 13.379 -37.961 709 HB3 PHE 90 HB1 PHE 90 -7.226 12.173 -39.098 710 HD1 PHE 90 HD1 PHE 90 -4.467 14.578 -38.493 711 HD2 PHE 90 HD2 PHE 90 -5.766 11.078 -40.535 712 HE1 PHE 90 HE1 PHE 90 -2.157 14.151 -39.235 713 HE2 PHE 90 HE2 PHE 90 -3.464 10.649 -41.280 714 HZ PHE 90 HZ PHE 90 -1.657 12.180 -40.630 715 H SER 91 HN SER 91 -6.353 15.679 -41.527 716 HA SER 91 HA SER 91 -6.934 13.797 -43.712 717 HB2 SER 91 HB2 SER 91 -6.716 15.876 -45.185 718 HB3 SER 91 HB1 SER 91 -8.156 15.774 -44.171 719 HG SER 91 HG SER 91 -5.832 17.354 -43.796 720 H MET 92 HN MET 92 -5.262 12.986 -44.811 721 HA MET 92 HA MET 92 -2.597 14.004 -44.118 722 HB2 MET 92 HB2 MET 92 -1.721 11.808 -44.539 723 HB3 MET 92 HB1 MET 92 -3.105 11.646 -43.471 724 HG2 MET 92 HG2 MET 92 -3.174 11.174 -46.442 725 HG3 MET 92 HG1 MET 92 -2.968 9.911 -45.232 726 HE1 MET 92 HE1 MET 92 -4.941 10.864 -42.915 727 HE2 MET 92 HE2 MET 92 -4.844 9.200 -43.492 728 HE3 MET 92 HE3 MET 92 -6.411 9.999 -43.362 729 H LYS 93 HN LYS 93 -1.187 14.587 -45.654 730 HA LYS 93 HA LYS 93 -2.110 14.498 -48.448 731 HB2 LYS 93 HB2 LYS 93 -0.053 16.303 -47.150 732 HB3 LYS 93 HB1 LYS 93 -0.548 16.366 -48.836 733 HG2 LYS 93 HG2 LYS 93 -2.354 16.867 -46.481 734 HG3 LYS 93 HG1 LYS 93 -1.595 18.116 -47.469 735 HD2 LYS 93 HD2 LYS 93 -2.803 17.370 -49.419 736 HD3 LYS 93 HD1 LYS 93 -3.469 16.002 -48.526 737 HE2 LYS 93 HE2 LYS 93 -5.071 17.870 -48.790 738 HE3 LYS 93 HE1 LYS 93 -4.730 17.478 -47.105 739 HZ1 LYS 93 HZ1 LYS 93 -3.317 19.646 -48.546 740 HZ2 LYS 93 HZ2 LYS 93 -3.395 19.379 -46.867 741 HZ3 LYS 93 HZ3 LYS 93 -4.769 19.907 -47.712 742 H CYS 94 HN CYS 94 -1.211 12.897 -49.567 743 HA CYS 94 HA CYS 94 1.150 11.583 -48.524 744 HB2 CYS 94 HB2 CYS 94 -0.775 10.261 -49.324 745 HB3 CYS 94 HB1 CYS 94 -0.558 10.928 -50.937 746 HG CYS 94 HG CYS 94 1.566 9.509 -51.647 747 H HIS 95 HN HIS 95 3.115 12.208 -49.074 748 HA HIS 95 HA HIS 95 3.550 13.195 -51.809 749 HB2 HIS 95 HB2 HIS 95 3.459 15.034 -50.056 750 HB3 HIS 95 HB1 HIS 95 4.927 14.343 -49.380 751 HD1 HIS 95 HD1 HIS 95 3.716 15.673 -52.731 752 HD2 HIS 95 HD2 HIS 95 7.179 15.419 -50.438 753 HE1 HIS 95 HE1 HIS 95 5.465 16.962 -53.998 754 HE2 HIS 95 HE2 HIS 95 7.474 16.975 -52.484 755 H THR 96 HN THR 96 5.357 12.496 -52.795 756 HA THR 96 HA THR 96 6.871 10.409 -51.439 757 HB THR 96 HB THR 96 7.681 10.188 -53.966 758 HG1 THR 96 HG1 THR 96 6.570 11.463 -55.245 759 HG21 THR 96 HG21 THR 96 4.958 9.308 -52.984 760 HG22 THR 96 HG22 THR 96 6.481 8.465 -52.694 761 HG23 THR 96 HG23 THR 96 5.845 8.599 -54.333 762 HA PRO 97 HA PRO 97 10.495 12.877 -51.015 763 HB2 PRO 97 HB2 PRO 97 12.415 10.948 -51.191 764 HB3 PRO 97 HB1 PRO 97 11.407 11.203 -49.762 765 HG2 PRO 97 HG2 PRO 97 11.122 9.184 -51.948 766 HG3 PRO 97 HG1 PRO 97 10.902 8.983 -50.200 767 HD2 PRO 97 HD2 PRO 97 8.823 9.252 -51.906 768 HD3 PRO 97 HD1 PRO 97 8.775 9.862 -50.240 769 H LEU 98 HN LEU 98 10.112 10.834 -53.815 770 HA LEU 98 HA LEU 98 12.332 11.725 -55.307 771 HB2 LEU 98 HB2 LEU 98 10.638 9.785 -55.735 772 HB3 LEU 98 HB1 LEU 98 9.682 11.011 -56.538 773 HG LEU 98 HG LEU 98 11.027 9.644 -58.098 774 HD11 LEU 98 HD11 LEU 98 10.388 11.895 -58.754 775 HD12 LEU 98 HD12 LEU 98 11.979 11.480 -59.394 776 HD13 LEU 98 HD13 LEU 98 11.842 12.541 -57.993 777 HD21 LEU 98 HD21 LEU 98 12.935 9.213 -56.663 778 HD22 LEU 98 HD22 LEU 98 13.377 10.920 -56.710 779 HD23 LEU 98 HD23 LEU 98 13.452 9.948 -58.181 780 H GLU 99 HN GLU 99 8.935 12.786 -55.287 781 HA GLU 99 HA GLU 99 9.382 15.044 -56.948 782 HB2 GLU 99 HB2 GLU 99 7.123 14.192 -55.153 783 HB3 GLU 99 HB1 GLU 99 7.101 15.754 -55.954 784 HG2 GLU 99 HG2 GLU 99 5.830 14.068 -57.180 785 HG3 GLU 99 HG1 GLU 99 7.183 14.685 -58.120 786 H TYR 100 HN TYR 100 9.551 14.479 -53.512 787 HA TYR 100 HA TYR 100 9.506 17.144 -52.619 788 HB2 TYR 100 HB2 TYR 100 9.284 15.268 -51.073 789 HB3 TYR 100 HB1 TYR 100 10.926 14.748 -51.436 790 HD1 TYR 100 HD1 TYR 100 9.030 17.666 -50.089 791 HD2 TYR 100 HD2 TYR 100 12.682 15.479 -50.088 792 HE1 TYR 100 HE1 TYR 100 9.870 19.079 -48.261 793 HE2 TYR 100 HE2 TYR 100 13.533 16.890 -48.262 794 HH TYR 100 HH TYR 100 11.467 19.149 -46.582 795 H ASP 101 HN ASP 101 12.146 15.085 -53.751 796 HA ASP 101 HA ASP 101 14.273 16.813 -53.149 797 HB2 ASP 101 HB2 ASP 101 14.671 14.489 -53.750 798 HB3 ASP 101 HB1 ASP 101 14.025 14.768 -55.365 799 H LYS 102 HN LYS 102 12.038 16.731 -55.845 800 HA LYS 102 HA LYS 102 13.514 18.538 -57.486 801 HB2 LYS 102 HB2 LYS 102 10.835 17.282 -57.577 802 HB3 LYS 102 HB1 LYS 102 10.998 18.809 -58.427 803 HG2 LYS 102 HG2 LYS 102 11.505 17.352 -60.107 804 HG3 LYS 102 HG1 LYS 102 13.116 17.654 -59.463 805 HD2 LYS 102 HD2 LYS 102 11.413 15.322 -58.605 806 HD3 LYS 102 HD1 LYS 102 12.534 15.243 -59.962 807 HE2 LYS 102 HE2 LYS 102 13.276 15.912 -57.117 808 HE3 LYS 102 HE1 LYS 102 13.484 14.338 -57.880 809 HZ1 LYS 102 HZ1 LYS 102 15.066 15.251 -59.385 810 HZ2 LYS 102 HZ2 LYS 102 15.516 15.721 -57.818 811 HZ3 LYS 102 HZ3 LYS 102 14.764 16.836 -58.856 812 H LEU 103 HN LEU 103 11.303 18.905 -54.854 813 HA LEU 103 HA LEU 103 10.635 21.642 -55.384 814 HB2 LEU 103 HB2 LEU 103 10.449 20.069 -52.812 815 HB3 LEU 103 HB1 LEU 103 9.719 21.635 -53.103 816 HG LEU 103 HG LEU 103 9.000 19.062 -54.509 817 HD11 LEU 103 HD11 LEU 103 6.884 19.274 -53.306 818 HD12 LEU 103 HD12 LEU 103 7.497 20.702 -52.473 819 HD13 LEU 103 HD13 LEU 103 8.244 19.130 -52.194 820 HD21 LEU 103 HD21 LEU 103 8.753 20.987 -55.984 821 HD22 LEU 103 HD22 LEU 103 7.807 21.823 -54.753 822 HD23 LEU 103 HD23 LEU 103 7.177 20.357 -55.505 823 H LYS 104 HN LYS 104 12.758 20.026 -53.027 824 HA LYS 104 HA LYS 104 13.939 22.420 -52.066 825 HB2 LYS 104 HB2 LYS 104 15.784 20.724 -51.310 826 HB3 LYS 104 HB1 LYS 104 14.190 20.682 -50.567 827 HG2 LYS 104 HG2 LYS 104 13.756 18.638 -51.340 828 HG3 LYS 104 HG1 LYS 104 14.406 19.001 -52.938 829 HD2 LYS 104 HD2 LYS 104 16.097 18.397 -50.515 830 HD3 LYS 104 HD1 LYS 104 15.622 17.197 -51.719 831 HE2 LYS 104 HE2 LYS 104 16.656 18.802 -53.431 832 HE3 LYS 104 HE1 LYS 104 17.417 19.582 -52.046 833 HZ1 LYS 104 HZ1 LYS 104 17.754 16.770 -52.937 834 HZ2 LYS 104 HZ2 LYS 104 18.351 17.366 -51.462 835 HZ3 LYS 104 HZ3 LYS 104 18.930 17.995 -52.927 836 H SER 105 HN SER 105 14.415 20.653 -54.931 837 HA SER 105 HA SER 105 17.124 21.324 -55.446 838 HB2 SER 105 HB2 SER 105 16.068 19.496 -56.646 839 HB3 SER 105 HB1 SER 105 14.856 20.585 -57.314 840 HG SER 105 HG SER 105 17.593 21.082 -57.790 841 H LYS 106 HN LYS 106 14.030 22.789 -56.404 842 HA LYS 106 HA LYS 106 15.496 25.045 -57.552 843 HB2 LYS 106 HB2 LYS 106 13.338 25.626 -58.585 844 HB3 LYS 106 HB1 LYS 106 13.850 23.995 -58.999 845 HG2 LYS 106 HG2 LYS 106 12.321 23.076 -57.347 846 HG3 LYS 106 HG1 LYS 106 11.826 24.709 -56.887 847 HD2 LYS 106 HD2 LYS 106 11.101 25.072 -59.235 848 HD3 LYS 106 HD1 LYS 106 11.453 23.372 -59.549 849 HE2 LYS 106 HE2 LYS 106 9.715 22.631 -58.192 850 HE3 LYS 106 HE1 LYS 106 9.614 24.164 -57.324 851 HZ1 LYS 106 HZ1 LYS 106 8.871 23.786 -60.175 852 HZ2 LYS 106 HZ2 LYS 106 8.693 25.207 -59.264 853 HZ3 LYS 106 HZ3 LYS 106 7.768 23.833 -58.889 854 H GLY 107 HN GLY 107 13.944 27.118 -57.374 855 HA2 GLY 107 HA2 GLY 107 13.009 27.383 -54.594 856 HA3 GLY 107 HA1 GLY 107 14.096 28.585 -55.283 857 H SER 108 HN SER 108 11.640 26.999 -57.151 858 HA SER 108 HA SER 108 9.789 29.208 -56.952 859 HB2 SER 108 HB2 SER 108 9.830 29.529 -59.464 860 HB3 SER 108 HB1 SER 108 11.265 30.110 -58.621 861 HG SER 108 HG SER 108 11.038 27.565 -59.859 Start of MODEL 15 1 H1 MET 1 HT1 MET 1 10.605 20.569 -42.586 2 H2 MET 1 HT2 MET 1 9.033 20.951 -42.065 3 H3 MET 1 HT3 MET 1 10.312 20.900 -40.953 4 HA MET 1 HA MET 1 11.394 22.743 -42.092 5 HB2 MET 1 HB2 MET 1 8.799 22.804 -43.648 6 HB3 MET 1 HB1 MET 1 10.017 24.070 -43.678 7 HG2 MET 1 HG2 MET 1 11.632 22.470 -44.605 8 HG3 MET 1 HG1 MET 1 10.378 21.231 -44.614 9 HE1 MET 1 HE1 MET 1 10.243 25.054 -47.202 10 HE2 MET 1 HE2 MET 1 11.584 24.642 -46.133 11 HE3 MET 1 HE3 MET 1 10.014 25.066 -45.453 12 H GLY 2 HN GLY 2 7.951 22.357 -41.295 13 HA2 GLY 2 HA2 GLY 2 7.904 24.864 -39.841 14 HA3 GLY 2 HA1 GLY 2 6.598 23.691 -39.957 15 H SER 3 HN SER 3 7.113 21.551 -38.811 16 HA SER 3 HA SER 3 8.698 21.951 -36.383 17 HB2 SER 3 HB2 SER 3 5.760 21.199 -36.383 18 HB3 SER 3 HB1 SER 3 6.814 21.156 -34.967 19 HG SER 3 HG SER 3 7.218 23.464 -35.506 20 H SER 4 HN SER 4 9.353 20.389 -38.543 21 HA SER 4 HA SER 4 8.391 17.707 -38.212 22 HB2 SER 4 HB2 SER 4 10.771 18.586 -39.840 23 HB3 SER 4 HB1 SER 4 9.762 17.160 -40.078 24 HG SER 4 HG SER 4 8.078 19.109 -40.196 25 H HIS 5 HN HIS 5 9.083 17.745 -35.850 26 HA HIS 5 HA HIS 5 11.876 16.935 -35.545 27 HB2 HIS 5 HB2 HIS 5 10.783 18.368 -33.790 28 HB3 HIS 5 HB1 HIS 5 9.707 17.022 -33.428 29 HD1 HIS 5 HD1 HIS 5 10.710 17.042 -30.983 30 HD2 HIS 5 HD2 HIS 5 13.410 16.065 -33.998 31 HE1 HIS 5 HE1 HIS 5 12.696 16.019 -29.816 32 HE2 HIS 5 HE2 HIS 5 14.264 15.327 -31.669 33 H HIS 6 HN HIS 6 11.093 15.338 -37.224 34 HA HIS 6 HA HIS 6 9.301 13.265 -36.548 35 HB2 HIS 6 HB2 HIS 6 9.727 13.915 -38.850 36 HB3 HIS 6 HB1 HIS 6 11.415 13.451 -38.700 37 HD1 HIS 6 HD1 HIS 6 8.077 11.647 -38.156 38 HD2 HIS 6 HD2 HIS 6 11.834 11.088 -39.870 39 HE1 HIS 6 HE1 HIS 6 8.025 9.363 -39.203 40 HE2 HIS 6 HE2 HIS 6 10.223 9.143 -40.412 41 H HIS 7 HN HIS 7 12.675 13.732 -35.950 42 HA HIS 7 HA HIS 7 13.170 10.959 -35.315 43 HB2 HIS 7 HB2 HIS 7 14.915 12.698 -36.076 44 HB3 HIS 7 HB1 HIS 7 14.858 13.291 -34.418 45 HD1 HIS 7 HD1 HIS 7 17.402 12.003 -35.747 46 HD2 HIS 7 HD2 HIS 7 14.714 10.038 -33.250 47 HE1 HIS 7 HE1 HIS 7 18.657 10.039 -34.802 48 HE2 HIS 7 HE2 HIS 7 16.977 8.787 -33.400 49 H HIS 8 HN HIS 8 11.901 10.221 -33.715 50 HA HIS 8 HA HIS 8 11.419 11.884 -31.359 51 HB2 HIS 8 HB2 HIS 8 10.225 9.275 -32.306 52 HB3 HIS 8 HB1 HIS 8 9.881 9.955 -30.720 53 HD1 HIS 8 HD1 HIS 8 7.698 11.094 -30.716 54 HD2 HIS 8 HD2 HIS 8 9.642 11.500 -34.372 55 HE1 HIS 8 HE1 HIS 8 6.172 12.492 -32.152 56 HE2 HIS 8 HE2 HIS 8 7.366 12.727 -34.367 57 H HIS 9 HN HIS 9 11.245 10.389 -29.285 58 HA HIS 9 HA HIS 9 13.566 8.611 -29.169 59 HB2 HIS 9 HB2 HIS 9 13.279 11.151 -27.804 60 HB3 HIS 9 HB1 HIS 9 13.462 9.832 -26.654 61 HD1 HIS 9 HD1 HIS 9 15.804 10.808 -26.038 62 HD2 HIS 9 HD2 HIS 9 15.447 9.464 -29.956 63 HE1 HIS 9 HE1 HIS 9 18.155 10.642 -26.917 64 HE2 HIS 9 HE2 HIS 9 17.918 9.581 -29.187 65 H HIS 10 HN HIS 10 11.903 7.017 -29.363 66 HA HIS 10 HA HIS 10 10.031 6.675 -27.186 67 HB2 HIS 10 HB2 HIS 10 9.953 5.901 -29.760 68 HB3 HIS 10 HB1 HIS 10 10.655 4.445 -29.068 69 HD1 HIS 10 HD1 HIS 10 7.485 5.973 -29.798 70 HD2 HIS 10 HD2 HIS 10 8.929 3.384 -26.875 71 HE1 HIS 10 HE1 HIS 10 5.456 4.879 -28.802 72 HE2 HIS 10 HE2 HIS 10 6.364 3.201 -27.160 73 H SER 11 HN SER 11 11.884 6.822 -25.635 74 HA SER 11 HA SER 11 13.871 4.771 -25.582 75 HB2 SER 11 HB2 SER 11 14.183 7.108 -24.722 76 HB3 SER 11 HB1 SER 11 13.111 6.706 -23.383 77 HG SER 11 HG SER 11 15.608 5.495 -24.011 78 H SER 12 HN SER 12 10.693 5.112 -24.325 79 HA SER 12 HA SER 12 10.829 3.231 -22.225 80 HB2 SER 12 HB2 SER 12 8.276 3.094 -22.752 81 HB3 SER 12 HB1 SER 12 8.950 4.611 -22.152 82 HG SER 12 HG SER 12 8.006 5.380 -23.878 83 H GLY 13 HN GLY 13 11.686 1.290 -22.650 84 HA2 GLY 13 HA2 GLY 13 11.076 -0.057 -25.166 85 HA3 GLY 13 HA1 GLY 13 12.301 -0.535 -24.001 86 H ARG 14 HN ARG 14 10.404 -0.345 -21.754 87 HA ARG 14 HA ARG 14 8.763 -2.721 -22.363 88 HB2 ARG 14 HB2 ARG 14 9.199 -3.526 -20.053 89 HB3 ARG 14 HB1 ARG 14 10.644 -3.475 -21.051 90 HG2 ARG 14 HG2 ARG 14 10.080 -1.093 -19.389 91 HG3 ARG 14 HG1 ARG 14 10.571 -2.565 -18.551 92 HD2 ARG 14 HD2 ARG 14 12.093 -1.399 -20.873 93 HD3 ARG 14 HD1 ARG 14 12.432 -0.984 -19.194 94 HE ARG 14 HE ARG 14 12.443 -3.784 -19.455 95 HH11 ARG 14 HH11 ARG 14 14.345 -1.001 -20.424 96 HH12 ARG 14 HH12 ARG 14 15.841 -1.879 -20.452 97 HH21 ARG 14 HH21 ARG 14 14.422 -4.936 -19.504 98 HH22 ARG 14 HH22 ARG 14 15.885 -4.104 -19.939 99 H GLU 15 HN GLU 15 8.993 0.384 -20.915 100 HA GLU 15 HA GLU 15 6.463 0.052 -19.490 101 HB2 GLU 15 HB2 GLU 15 7.001 2.334 -18.574 102 HB3 GLU 15 HB1 GLU 15 8.141 1.069 -18.147 103 HG2 GLU 15 HG2 GLU 15 8.633 2.913 -20.459 104 HG3 GLU 15 HG1 GLU 15 9.062 3.355 -18.809 105 H ASN 16 HN ASN 16 6.988 0.475 -22.527 106 HA ASN 16 HA ASN 16 5.621 2.972 -23.036 107 HB2 ASN 16 HB2 ASN 16 5.819 2.423 -25.401 108 HB3 ASN 16 HB1 ASN 16 7.364 2.177 -24.597 109 HD21 ASN 16 HD21 ASN 16 8.231 0.153 -24.499 110 HD22 ASN 16 HD22 ASN 16 7.561 -1.214 -25.318 111 H LEU 17 HN LEU 17 4.572 0.123 -21.933 112 HA LEU 17 HA LEU 17 2.112 0.012 -23.503 113 HB2 LEU 17 HB2 LEU 17 3.180 -1.756 -21.301 114 HB3 LEU 17 HB1 LEU 17 1.604 -1.969 -22.031 115 HG LEU 17 HG LEU 17 3.000 -3.566 -23.046 116 HD11 LEU 17 HD11 LEU 17 2.831 -1.211 -24.914 117 HD12 LEU 17 HD12 LEU 17 1.572 -2.412 -24.626 118 HD13 LEU 17 HD13 LEU 17 3.089 -2.888 -25.390 119 HD21 LEU 17 HD21 LEU 17 5.015 -1.377 -23.525 120 HD22 LEU 17 HD22 LEU 17 5.153 -3.043 -24.087 121 HD23 LEU 17 HD23 LEU 17 5.156 -2.694 -22.358 122 H TYR 18 HN TYR 18 3.140 1.933 -21.188 123 HA TYR 18 HA TYR 18 0.603 1.899 -19.698 124 HB2 TYR 18 HB2 TYR 18 3.373 2.595 -18.719 125 HB3 TYR 18 HB1 TYR 18 1.904 2.944 -17.812 126 HD1 TYR 18 HD1 TYR 18 0.440 1.016 -17.106 127 HD2 TYR 18 HD2 TYR 18 4.369 0.463 -18.639 128 HE1 TYR 18 HE1 TYR 18 0.497 -1.237 -16.128 129 HE2 TYR 18 HE2 TYR 18 4.436 -1.795 -17.668 130 HH TYR 18 HH TYR 18 3.262 -2.987 -15.700 131 H PHE 19 HN PHE 19 0.595 4.166 -18.415 132 HA PHE 19 HA PHE 19 0.292 6.157 -20.509 133 HB2 PHE 19 HB2 PHE 19 -0.916 7.433 -18.755 134 HB3 PHE 19 HB1 PHE 19 -1.571 5.813 -18.974 135 HD1 PHE 19 HD1 PHE 19 -0.829 4.004 -17.332 136 HD2 PHE 19 HD2 PHE 19 -0.232 8.162 -16.646 137 HE1 PHE 19 HE1 PHE 19 -0.529 3.563 -14.940 138 HE2 PHE 19 HE2 PHE 19 0.059 7.722 -14.243 139 HZ PHE 19 HZ PHE 19 -0.090 5.420 -13.385 140 H GLN 20 HN GLN 20 2.888 5.258 -19.178 141 HA GLN 20 HA GLN 20 4.001 7.334 -17.670 142 HB2 GLN 20 HB2 GLN 20 5.367 5.438 -19.593 143 HB3 GLN 20 HB1 GLN 20 6.184 6.416 -18.383 144 HG2 GLN 20 HG2 GLN 20 4.124 4.318 -17.751 145 HG3 GLN 20 HG1 GLN 20 5.865 4.039 -17.746 146 HE21 GLN 20 HE21 GLN 20 3.203 5.564 -16.124 147 HE22 GLN 20 HE22 GLN 20 4.055 5.972 -14.671 148 H GLY 21 HN GLY 21 3.720 9.391 -18.403 149 HA2 GLY 21 HA2 GLY 21 4.849 11.163 -19.555 150 HA3 GLY 21 HA1 GLY 21 5.127 10.060 -20.894 151 H HIS 22 HN HIS 22 2.801 12.125 -19.304 152 HA HIS 22 HA HIS 22 0.692 11.683 -21.200 153 HB2 HIS 22 HB2 HIS 22 1.170 13.927 -19.226 154 HB3 HIS 22 HB1 HIS 22 -0.276 13.782 -20.214 155 HD1 HIS 22 HD1 HIS 22 -2.063 13.205 -18.605 156 HD2 HIS 22 HD2 HIS 22 1.385 10.967 -17.963 157 HE1 HIS 22 HE1 HIS 22 -2.633 11.592 -16.763 158 HE2 HIS 22 HE2 HIS 22 -0.455 10.441 -16.223 159 H MET 23 HN MET 23 0.843 12.284 -23.267 160 HA MET 23 HA MET 23 2.414 14.694 -23.892 161 HB2 MET 23 HB2 MET 23 2.117 12.183 -25.548 162 HB3 MET 23 HB1 MET 23 2.963 13.635 -26.064 163 HG2 MET 23 HG2 MET 23 4.524 13.353 -24.178 164 HG3 MET 23 HG1 MET 23 3.704 11.853 -23.756 165 HE1 MET 23 HE1 MET 23 5.977 10.515 -23.847 166 HE2 MET 23 HE2 MET 23 6.835 12.004 -24.240 167 HE3 MET 23 HE3 MET 23 7.088 10.558 -25.216 168 H CYS 24 HN CYS 24 1.815 15.768 -25.911 169 HA CYS 24 HA CYS 24 -0.980 16.257 -26.068 170 HB2 CYS 24 HB2 CYS 24 0.603 18.050 -26.500 171 HB3 CYS 24 HB1 CYS 24 1.311 17.149 -27.836 172 HG CYS 24 HG CYS 24 -1.342 19.154 -27.801 173 H ILE 25 HN ILE 25 -2.401 15.857 -27.748 174 HA ILE 25 HA ILE 25 -2.436 13.338 -28.870 175 HB ILE 25 HB ILE 25 -4.422 14.754 -28.615 176 HG12 ILE 25 HG12 ILE 25 -5.500 14.216 -30.802 177 HG13 ILE 25 HG11 ILE 25 -3.914 13.766 -31.423 178 HG21 ILE 25 HG21 ILE 25 -3.520 16.887 -29.313 179 HG22 ILE 25 HG22 ILE 25 -4.955 16.487 -30.257 180 HG23 ILE 25 HG23 ILE 25 -3.354 16.298 -30.969 181 HD11 ILE 25 HD11 ILE 25 -5.154 11.799 -30.747 182 HD12 ILE 25 HD12 ILE 25 -5.364 12.464 -29.126 183 HD13 ILE 25 HD13 ILE 25 -3.755 12.025 -29.697 184 H GLN 26 HN GLN 26 -1.208 16.332 -30.285 185 HA GLN 26 HA GLN 26 -0.875 15.384 -32.924 186 HB2 GLN 26 HB2 GLN 26 -0.911 17.764 -32.338 187 HB3 GLN 26 HB1 GLN 26 0.589 17.576 -31.443 188 HG2 GLN 26 HG2 GLN 26 1.762 17.027 -33.505 189 HG3 GLN 26 HG1 GLN 26 0.257 17.191 -34.410 190 HE21 GLN 26 HE21 GLN 26 1.066 18.857 -35.681 191 HE22 GLN 26 HE22 GLN 26 1.308 20.457 -35.062 192 H LYS 27 HN LYS 27 1.195 15.361 -30.099 193 HA LYS 27 HA LYS 27 3.574 14.567 -31.442 194 HB2 LYS 27 HB2 LYS 27 3.554 15.752 -29.276 195 HB3 LYS 27 HB1 LYS 27 2.810 14.351 -28.524 196 HG2 LYS 27 HG2 LYS 27 4.800 13.029 -28.980 197 HG3 LYS 27 HG1 LYS 27 5.547 14.415 -29.780 198 HD2 LYS 27 HD2 LYS 27 4.672 14.335 -26.891 199 HD3 LYS 27 HD1 LYS 27 6.330 14.129 -27.455 200 HE2 LYS 27 HE2 LYS 27 6.357 16.367 -28.343 201 HE3 LYS 27 HE1 LYS 27 4.647 16.578 -27.970 202 HZ1 LYS 27 HZ1 LYS 27 6.739 16.089 -25.918 203 HZ2 LYS 27 HZ2 LYS 27 5.121 16.527 -25.650 204 HZ3 LYS 27 HZ3 LYS 27 6.195 17.630 -26.362 205 H VAL 28 HN VAL 28 1.009 12.869 -29.722 206 HA VAL 28 HA VAL 28 2.233 10.321 -29.689 207 HB VAL 28 HB VAL 28 -0.716 10.987 -29.613 208 HG11 VAL 28 HG11 VAL 28 -0.328 8.644 -30.138 209 HG12 VAL 28 HG12 VAL 28 -0.964 8.811 -28.502 210 HG13 VAL 28 HG13 VAL 28 0.754 8.496 -28.753 211 HG21 VAL 28 HG21 VAL 28 1.265 10.611 -27.367 212 HG22 VAL 28 HG22 VAL 28 -0.476 10.819 -27.171 213 HG23 VAL 28 HG23 VAL 28 0.498 12.127 -27.842 214 H ILE 29 HN ILE 29 -0.115 11.807 -31.901 215 HA ILE 29 HA ILE 29 -0.547 9.584 -33.533 216 HB ILE 29 HB ILE 29 -1.023 12.494 -33.784 217 HG12 ILE 29 HG12 ILE 29 -3.278 11.735 -34.345 218 HG13 ILE 29 HG11 ILE 29 -2.712 10.072 -34.443 219 HG21 ILE 29 HG21 ILE 29 0.039 12.064 -35.934 220 HG22 ILE 29 HG22 ILE 29 -1.687 12.371 -36.129 221 HG23 ILE 29 HG23 ILE 29 -1.069 10.721 -36.222 222 HD11 ILE 29 HD11 ILE 29 -2.777 11.780 -31.969 223 HD12 ILE 29 HD12 ILE 29 -2.188 10.119 -32.058 224 HD13 ILE 29 HD13 ILE 29 -3.888 10.471 -32.370 225 H GLU 30 HN GLU 30 1.811 12.247 -33.945 226 HA GLU 30 HA GLU 30 2.822 11.342 -36.406 227 HB2 GLU 30 HB2 GLU 30 3.190 13.594 -35.117 228 HB3 GLU 30 HB1 GLU 30 4.579 12.763 -34.434 229 HG2 GLU 30 HG2 GLU 30 4.271 12.711 -37.382 230 HG3 GLU 30 HG1 GLU 30 4.720 14.238 -36.635 231 H ASP 31 HN ASP 31 3.728 10.580 -33.080 232 HA ASP 31 HA ASP 31 6.041 9.073 -33.687 233 HB2 ASP 31 HB2 ASP 31 5.460 9.920 -31.413 234 HB3 ASP 31 HB1 ASP 31 4.170 8.727 -31.332 235 H LYS 32 HN LYS 32 2.634 8.143 -33.364 236 HA LYS 32 HA LYS 32 3.187 5.354 -33.428 237 HB2 LYS 32 HB2 LYS 32 1.172 6.189 -32.363 238 HB3 LYS 32 HB1 LYS 32 0.600 6.840 -33.893 239 HG2 LYS 32 HG2 LYS 32 -0.532 4.758 -33.337 240 HG3 LYS 32 HG1 LYS 32 0.429 4.589 -34.807 241 HD2 LYS 32 HD2 LYS 32 0.793 2.628 -33.508 242 HD3 LYS 32 HD1 LYS 32 2.254 3.610 -33.378 243 HE2 LYS 32 HE2 LYS 32 1.691 2.742 -31.205 244 HE3 LYS 32 HE1 LYS 32 1.421 4.484 -31.216 245 HZ1 LYS 32 HZ1 LYS 32 -0.681 2.411 -31.546 246 HZ2 LYS 32 HZ2 LYS 32 -0.933 4.083 -31.533 247 HZ3 LYS 32 HZ3 LYS 32 -0.389 3.301 -30.131 248 H LEU 33 HN LEU 33 1.724 7.506 -35.915 249 HA LEU 33 HA LEU 33 1.599 5.376 -37.783 250 HB2 LEU 33 HB2 LEU 33 1.118 7.173 -39.474 251 HB3 LEU 33 HB1 LEU 33 0.017 7.059 -38.122 252 HG LEU 33 HG LEU 33 1.385 8.988 -37.094 253 HD11 LEU 33 HD11 LEU 33 2.207 9.268 -39.982 254 HD12 LEU 33 HD12 LEU 33 3.277 8.914 -38.624 255 HD13 LEU 33 HD13 LEU 33 2.452 10.470 -38.715 256 HD21 LEU 33 HD21 LEU 33 0.028 10.625 -38.280 257 HD22 LEU 33 HD22 LEU 33 -0.907 9.174 -37.915 258 HD23 LEU 33 HD23 LEU 33 -0.302 9.445 -39.550 259 H SER 34 HN SER 34 4.067 7.737 -37.061 260 HA SER 34 HA SER 34 5.571 7.235 -39.427 261 HB2 SER 34 HB2 SER 34 6.296 8.490 -36.787 262 HB3 SER 34 HB1 SER 34 7.440 8.331 -38.122 263 HG SER 34 HG SER 34 5.888 10.315 -37.803 264 H SER 35 HN SER 35 5.576 5.847 -36.171 265 HA SER 35 HA SER 35 7.866 4.228 -36.566 266 HB2 SER 35 HB2 SER 35 5.486 3.813 -34.738 267 HB3 SER 35 HB1 SER 35 6.995 2.903 -34.656 268 HG SER 35 HG SER 35 6.486 5.595 -34.017 269 H ALA 36 HN ALA 36 4.568 3.914 -37.615 270 HA ALA 36 HA ALA 36 4.873 1.069 -38.171 271 HB1 ALA 36 HB1 ALA 36 2.509 1.112 -38.735 272 HB2 ALA 36 HB2 ALA 36 2.488 2.867 -38.570 273 HB3 ALA 36 HB3 ALA 36 2.795 1.852 -37.160 274 H LEU 37 HN LEU 37 3.975 3.995 -40.048 275 HA LEU 37 HA LEU 37 4.198 2.542 -42.533 276 HB2 LEU 37 HB2 LEU 37 3.830 5.499 -42.034 277 HB3 LEU 37 HB1 LEU 37 3.694 4.707 -43.590 278 HG LEU 37 HG LEU 37 1.889 4.193 -41.223 279 HD11 LEU 37 HD11 LEU 37 1.546 6.416 -42.140 280 HD12 LEU 37 HD12 LEU 37 0.192 5.361 -42.547 281 HD13 LEU 37 HD13 LEU 37 1.410 5.740 -43.765 282 HD21 LEU 37 HD21 LEU 37 0.530 2.945 -42.833 283 HD22 LEU 37 HD22 LEU 37 2.135 2.236 -42.656 284 HD23 LEU 37 HD23 LEU 37 1.753 3.213 -44.075 285 H LYS 38 HN LYS 38 6.178 4.593 -40.601 286 HA LYS 38 HA LYS 38 8.346 5.185 -40.664 287 HB2 LYS 38 HB2 LYS 38 8.587 2.889 -42.607 288 HB3 LYS 38 HB1 LYS 38 9.920 3.657 -41.753 289 HG2 LYS 38 HG2 LYS 38 8.906 2.971 -39.615 290 HG3 LYS 38 HG1 LYS 38 7.635 2.140 -40.511 291 HD2 LYS 38 HD2 LYS 38 9.327 0.706 -41.559 292 HD3 LYS 38 HD1 LYS 38 10.587 1.531 -40.638 293 HE2 LYS 38 HE2 LYS 38 8.316 -0.119 -39.539 294 HE3 LYS 38 HE1 LYS 38 10.029 -0.538 -39.538 295 HZ1 LYS 38 HZ1 LYS 38 8.672 1.580 -37.976 296 HZ2 LYS 38 HZ2 LYS 38 10.356 1.530 -38.161 297 HZ3 LYS 38 HZ3 LYS 38 9.550 0.254 -37.394 298 HA PRO 39 HA PRO 39 8.377 7.578 -44.553 299 HB2 PRO 39 HB2 PRO 39 7.507 9.934 -43.637 300 HB3 PRO 39 HB1 PRO 39 6.373 8.654 -44.082 301 HG2 PRO 39 HG2 PRO 39 7.208 9.594 -41.393 302 HG3 PRO 39 HG1 PRO 39 5.659 8.915 -41.917 303 HD2 PRO 39 HD2 PRO 39 7.758 7.553 -40.589 304 HD3 PRO 39 HD1 PRO 39 6.303 6.834 -41.303 305 H THR 40 HN THR 40 9.785 9.454 -44.995 306 HA THR 40 HA THR 40 11.979 9.589 -43.068 307 HB THR 40 HB THR 40 13.168 10.792 -44.948 308 HG1 THR 40 HG1 THR 40 12.164 11.074 -46.826 309 HG21 THR 40 HG21 THR 40 13.510 8.403 -44.546 310 HG22 THR 40 HG22 THR 40 13.536 8.756 -46.273 311 HG23 THR 40 HG23 THR 40 12.106 8.026 -45.546 312 H PHE 41 HN PHE 41 9.520 11.551 -44.578 313 HA PHE 41 HA PHE 41 10.174 13.734 -42.724 314 HB2 PHE 41 HB2 PHE 41 10.992 14.344 -44.970 315 HB3 PHE 41 HB1 PHE 41 9.388 14.054 -45.633 316 HD1 PHE 41 HD1 PHE 41 11.350 16.235 -43.399 317 HD2 PHE 41 HD2 PHE 41 7.701 15.700 -45.523 318 HE1 PHE 41 HE1 PHE 41 10.757 18.583 -42.965 319 HE2 PHE 41 HE2 PHE 41 7.101 18.046 -45.090 320 HZ PHE 41 HZ PHE 41 8.630 19.490 -43.810 321 H LEU 42 HN LEU 42 8.441 14.551 -41.662 322 HA LEU 42 HA LEU 42 5.751 14.004 -42.659 323 HB2 LEU 42 HB2 LEU 42 6.780 12.293 -40.862 324 HB3 LEU 42 HB1 LEU 42 6.220 13.530 -39.757 325 HG LEU 42 HG LEU 42 4.579 11.741 -39.992 326 HD11 LEU 42 HD11 LEU 42 2.618 13.077 -40.530 327 HD12 LEU 42 HD12 LEU 42 3.645 14.302 -41.274 328 HD13 LEU 42 HD13 LEU 42 3.759 13.988 -39.541 329 HD21 LEU 42 HD21 LEU 42 3.417 11.373 -42.111 330 HD22 LEU 42 HD22 LEU 42 5.138 11.011 -42.242 331 HD23 LEU 42 HD23 LEU 42 4.501 12.517 -42.903 332 H GLU 43 HN GLU 43 4.851 15.975 -42.753 333 HA GLU 43 HA GLU 43 5.533 17.925 -40.643 334 HB2 GLU 43 HB2 GLU 43 6.124 18.459 -43.067 335 HB3 GLU 43 HB1 GLU 43 4.396 18.563 -43.366 336 HG2 GLU 43 HG2 GLU 43 5.082 20.766 -43.042 337 HG3 GLU 43 HG1 GLU 43 4.335 20.303 -41.515 338 H LEU 44 HN LEU 44 3.916 18.794 -39.438 339 HA LEU 44 HA LEU 44 1.191 17.825 -40.005 340 HB2 LEU 44 HB2 LEU 44 2.545 18.463 -37.389 341 HB3 LEU 44 HB1 LEU 44 0.807 18.313 -37.528 342 HG LEU 44 HG LEU 44 1.615 16.259 -36.676 343 HD11 LEU 44 HD11 LEU 44 -0.136 16.022 -38.326 344 HD12 LEU 44 HD12 LEU 44 0.974 14.654 -38.408 345 HD13 LEU 44 HD13 LEU 44 1.061 15.937 -39.616 346 HD21 LEU 44 HD21 LEU 44 3.326 14.919 -37.812 347 HD22 LEU 44 HD22 LEU 44 3.952 16.475 -37.265 348 HD23 LEU 44 HD23 LEU 44 3.568 16.226 -38.969 349 H VAL 45 HN VAL 45 -0.256 19.282 -40.572 350 HA VAL 45 HA VAL 45 0.014 22.028 -39.530 351 HB VAL 45 HB VAL 45 -1.041 21.272 -42.267 352 HG11 VAL 45 HG11 VAL 45 -1.054 23.686 -42.689 353 HG12 VAL 45 HG12 VAL 45 -0.556 23.976 -41.023 354 HG13 VAL 45 HG13 VAL 45 -2.127 23.248 -41.358 355 HG21 VAL 45 HG21 VAL 45 1.369 20.969 -42.181 356 HG22 VAL 45 HG22 VAL 45 1.567 22.587 -41.510 357 HG23 VAL 45 HG23 VAL 45 0.964 22.382 -43.155 358 H ASP 46 HN ASP 46 -1.802 22.809 -38.535 359 HA ASP 46 HA ASP 46 -4.098 21.101 -38.275 360 HB2 ASP 46 HB2 ASP 46 -3.661 22.393 -36.348 361 HB3 ASP 46 HB1 ASP 46 -3.483 23.879 -37.278 362 H LYS 47 HN LYS 47 -5.989 21.186 -39.308 363 HA LYS 47 HA LYS 47 -6.104 22.925 -41.645 364 HB2 LYS 47 HB2 LYS 47 -6.561 20.308 -41.456 365 HB3 LYS 47 HB1 LYS 47 -8.187 20.870 -41.094 366 HG2 LYS 47 HG2 LYS 47 -8.425 21.883 -43.191 367 HG3 LYS 47 HG1 LYS 47 -6.691 21.806 -43.517 368 HD2 LYS 47 HD2 LYS 47 -6.916 19.292 -43.437 369 HD3 LYS 47 HD1 LYS 47 -8.664 19.536 -43.436 370 HE2 LYS 47 HE2 LYS 47 -8.596 20.591 -45.568 371 HE3 LYS 47 HE1 LYS 47 -6.833 20.671 -45.537 372 HZ1 LYS 47 HZ1 LYS 47 -7.522 18.879 -46.943 373 HZ2 LYS 47 HZ2 LYS 47 -8.492 18.216 -45.720 374 HZ3 LYS 47 HZ3 LYS 47 -6.797 18.227 -45.551 375 H SER 48 HN SER 48 -7.236 22.832 -38.503 376 HA SER 48 HA SER 48 -8.693 24.069 -37.301 377 HB2 SER 48 HB2 SER 48 -8.871 25.784 -39.790 378 HB3 SER 48 HB1 SER 48 -9.324 26.265 -38.154 379 HG SER 48 HG SER 48 -6.868 25.369 -37.962 380 H CYS 49 HN CYS 49 -9.664 21.849 -38.959 381 HA CYS 49 HA CYS 49 -12.299 22.601 -39.856 382 HB2 CYS 49 HB2 CYS 49 -11.062 20.746 -40.923 383 HB3 CYS 49 HB1 CYS 49 -11.099 19.854 -39.408 384 HG CYS 49 HG CYS 49 -13.799 19.379 -39.404 385 H GLY 50 HN GLY 50 -13.685 23.253 -38.341 386 HA2 GLY 50 HA2 GLY 50 -15.290 22.693 -36.677 387 HA3 GLY 50 HA1 GLY 50 -14.188 21.463 -36.067 388 H CYS 51 HN CYS 51 -13.211 21.933 -34.232 389 HA CYS 51 HA CYS 51 -12.999 24.754 -33.430 390 HB2 CYS 51 HB2 CYS 51 -12.873 22.221 -31.784 391 HB3 CYS 51 HB1 CYS 51 -12.700 23.848 -31.136 392 HG CYS 51 HG CYS 51 -15.186 23.843 -30.492 393 H GLY 52 HN GLY 52 -11.168 22.981 -35.174 394 HA2 GLY 52 HA2 GLY 52 -8.920 23.348 -35.673 395 HA3 GLY 52 HA1 GLY 52 -8.727 24.137 -34.117 396 H THR 53 HN THR 53 -10.064 20.930 -34.644 397 HA THR 53 HA THR 53 -7.630 19.782 -33.457 398 HB THR 53 HB THR 53 -9.294 17.870 -32.794 399 HG1 THR 53 HG1 THR 53 -11.350 19.078 -32.167 400 HG21 THR 53 HG21 THR 53 -9.218 20.523 -31.355 401 HG22 THR 53 HG22 THR 53 -8.061 19.204 -31.181 402 HG23 THR 53 HG23 THR 53 -9.727 18.993 -30.641 403 H SER 54 HN SER 54 -7.420 20.111 -35.996 404 HA SER 54 HA SER 54 -7.997 17.511 -37.233 405 HB2 SER 54 HB2 SER 54 -8.501 18.789 -39.366 406 HB3 SER 54 HB1 SER 54 -9.715 18.944 -38.095 407 HG SER 54 HG SER 54 -7.765 20.825 -37.869 408 H PHE 55 HN PHE 55 -6.287 16.691 -38.344 409 HA PHE 55 HA PHE 55 -3.999 18.503 -38.734 410 HB2 PHE 55 HB2 PHE 55 -3.895 15.551 -38.071 411 HB3 PHE 55 HB1 PHE 55 -2.509 16.610 -38.303 412 HD1 PHE 55 HD1 PHE 55 -2.269 18.595 -36.693 413 HD2 PHE 55 HD2 PHE 55 -4.811 15.258 -35.970 414 HE1 PHE 55 HE1 PHE 55 -2.280 19.127 -34.292 415 HE2 PHE 55 HE2 PHE 55 -4.828 15.786 -33.567 416 HZ PHE 55 HZ PHE 55 -3.560 17.723 -32.727 417 H ASP 56 HN ASP 56 -3.221 18.653 -40.720 418 HA ASP 56 HA ASP 56 -3.866 16.522 -42.659 419 HB2 ASP 56 HB2 ASP 56 -4.595 19.021 -43.045 420 HB3 ASP 56 HB1 ASP 56 -2.901 19.259 -43.462 421 H ALA 57 HN ALA 57 -2.172 15.218 -43.009 422 HA ALA 57 HA ALA 57 0.465 16.198 -42.151 423 HB1 ALA 57 HB1 ALA 57 -0.471 14.339 -40.854 424 HB2 ALA 57 HB2 ALA 57 1.024 13.889 -41.674 425 HB3 ALA 57 HB3 ALA 57 -0.529 13.359 -42.319 426 H VAL 58 HN VAL 58 1.835 16.657 -43.684 427 HA VAL 58 HA VAL 58 1.666 15.460 -46.314 428 HB VAL 58 HB VAL 58 3.749 17.344 -45.187 429 HG11 VAL 58 HG11 VAL 58 4.321 17.786 -47.525 430 HG12 VAL 58 HG12 VAL 58 3.144 16.579 -48.043 431 HG13 VAL 58 HG13 VAL 58 4.562 16.087 -47.116 432 HG21 VAL 58 HG21 VAL 58 1.529 18.355 -45.176 433 HG22 VAL 58 HG22 VAL 58 1.319 17.934 -46.876 434 HG23 VAL 58 HG23 VAL 58 2.553 19.102 -46.401 435 H ILE 59 HN ILE 59 2.467 13.492 -46.648 436 HA ILE 59 HA ILE 59 4.601 12.532 -44.882 437 HB ILE 59 HB ILE 59 3.867 10.347 -45.201 438 HG12 ILE 59 HG12 ILE 59 1.939 10.070 -47.092 439 HG13 ILE 59 HG11 ILE 59 2.937 11.310 -47.844 440 HG21 ILE 59 HG21 ILE 59 2.221 11.651 -43.972 441 HG22 ILE 59 HG22 ILE 59 1.449 10.354 -44.887 442 HG23 ILE 59 HG23 ILE 59 1.378 12.014 -45.480 443 HD11 ILE 59 HD11 ILE 59 4.884 9.842 -47.658 444 HD12 ILE 59 HD12 ILE 59 3.586 9.101 -48.593 445 HD13 ILE 59 HD13 ILE 59 3.870 8.599 -46.926 446 H VAL 60 HN VAL 60 6.535 11.927 -45.626 447 HA VAL 60 HA VAL 60 6.902 11.651 -48.536 448 HB VAL 60 HB VAL 60 8.888 12.822 -46.566 449 HG11 VAL 60 HG11 VAL 60 10.002 11.495 -48.269 450 HG12 VAL 60 HG12 VAL 60 10.307 13.213 -48.522 451 HG13 VAL 60 HG13 VAL 60 9.136 12.366 -49.535 452 HG21 VAL 60 HG21 VAL 60 7.100 14.384 -47.139 453 HG22 VAL 60 HG22 VAL 60 7.412 14.121 -48.855 454 HG23 VAL 60 HG23 VAL 60 8.635 14.893 -47.845 455 H SER 61 HN SER 61 7.139 9.511 -48.859 456 HA SER 61 HA SER 61 9.081 8.034 -47.295 457 HB2 SER 61 HB2 SER 61 7.149 7.888 -45.824 458 HB3 SER 61 HB1 SER 61 6.137 7.331 -47.157 459 HG SER 61 HG SER 61 7.538 5.849 -45.510 460 H ASN 62 HN ASN 62 9.598 5.988 -48.134 461 HA ASN 62 HA ASN 62 9.302 5.621 -50.932 462 HB2 ASN 62 HB2 ASN 62 10.487 4.065 -48.680 463 HB3 ASN 62 HB1 ASN 62 10.133 3.199 -50.171 464 HD21 ASN 62 HD21 ASN 62 10.975 6.554 -50.270 465 HD22 ASN 62 HD22 ASN 62 12.553 6.350 -50.951 466 H ASN 63 HN ASN 63 7.373 4.825 -48.240 467 HA ASN 63 HA ASN 63 6.048 2.510 -49.057 468 HB2 ASN 63 HB2 ASN 63 5.911 3.632 -46.808 469 HB3 ASN 63 HB1 ASN 63 4.827 4.815 -47.527 470 HD21 ASN 63 HD21 ASN 63 2.722 4.227 -48.003 471 HD22 ASN 63 HD22 ASN 63 2.025 2.751 -47.448 472 H PHE 64 HN PHE 64 5.649 5.831 -50.065 473 HA PHE 64 HA PHE 64 3.243 5.167 -51.585 474 HB2 PHE 64 HB2 PHE 64 3.213 7.261 -50.317 475 HB3 PHE 64 HB1 PHE 64 4.647 7.821 -51.172 476 HD1 PHE 64 HD2 PHE 64 1.269 6.469 -52.016 477 HD2 PHE 64 HD1 PHE 64 4.289 9.349 -52.836 478 HE1 PHE 64 HE2 PHE 64 -0.157 7.460 -53.758 479 HE2 PHE 64 HE1 PHE 64 2.872 10.345 -54.581 480 HZ PHE 64 HZ PHE 64 0.645 9.402 -55.045 481 H GLU 65 HN GLU 65 6.568 5.115 -52.024 482 HA GLU 65 HA GLU 65 6.519 5.956 -54.784 483 HB2 GLU 65 HB2 GLU 65 8.421 6.821 -53.851 484 HB3 GLU 65 HB1 GLU 65 8.510 5.568 -52.620 485 HG2 GLU 65 HG2 GLU 65 10.355 5.155 -53.899 486 HG3 GLU 65 HG1 GLU 65 9.129 4.047 -54.519 487 H ASP 66 HN ASP 66 6.291 3.202 -52.791 488 HA ASP 66 HA ASP 66 7.142 1.226 -54.677 489 HB2 ASP 66 HB2 ASP 66 6.946 0.941 -52.153 490 HB3 ASP 66 HB1 ASP 66 5.205 0.828 -52.389 491 H LYS 67 HN LYS 67 4.713 3.358 -54.767 492 HA LYS 67 HA LYS 67 2.946 3.701 -56.121 493 HB2 LYS 67 HB2 LYS 67 3.676 1.108 -57.490 494 HB3 LYS 67 HB1 LYS 67 2.711 2.420 -58.147 495 HG2 LYS 67 HG2 LYS 67 5.669 2.369 -57.628 496 HG3 LYS 67 HG1 LYS 67 4.828 2.581 -59.163 497 HD2 LYS 67 HD2 LYS 67 3.942 4.742 -58.322 498 HD3 LYS 67 HD1 LYS 67 4.914 4.532 -56.863 499 HE2 LYS 67 HE2 LYS 67 6.896 4.275 -58.493 500 HE3 LYS 67 HE1 LYS 67 5.818 5.003 -59.682 501 HZ1 LYS 67 HZ1 LYS 67 6.639 6.915 -58.889 502 HZ2 LYS 67 HZ2 LYS 67 7.188 6.211 -57.445 503 HZ3 LYS 67 HZ3 LYS 67 5.562 6.678 -57.596 504 H LYS 68 HN LYS 68 2.550 2.394 -53.660 505 HA LYS 68 HA LYS 68 0.422 0.475 -54.197 506 HB2 LYS 68 HB2 LYS 68 1.830 1.334 -51.683 507 HB3 LYS 68 HB1 LYS 68 0.348 0.389 -51.637 508 HG2 LYS 68 HG2 LYS 68 2.915 -0.436 -52.975 509 HG3 LYS 68 HG1 LYS 68 2.319 -1.019 -51.419 510 HD2 LYS 68 HD2 LYS 68 0.244 -1.779 -52.647 511 HD3 LYS 68 HD1 LYS 68 1.113 -1.443 -54.144 512 HE2 LYS 68 HE2 LYS 68 1.976 -3.356 -51.981 513 HE3 LYS 68 HE1 LYS 68 1.254 -3.800 -53.527 514 HZ1 LYS 68 HZ1 LYS 68 3.158 -2.891 -54.667 515 HZ2 LYS 68 HZ2 LYS 68 3.676 -4.029 -53.521 516 HZ3 LYS 68 HZ3 LYS 68 3.846 -2.371 -53.204 517 H LEU 69 HN LEU 69 -1.194 1.779 -55.036 518 HA LEU 69 HA LEU 69 -2.129 4.117 -53.677 519 HB2 LEU 69 HB2 LEU 69 -2.380 3.501 -56.157 520 HB3 LEU 69 HB1 LEU 69 -3.680 2.449 -55.649 521 HG LEU 69 HG LEU 69 -3.679 5.417 -55.111 522 HD11 LEU 69 HD11 LEU 69 -5.159 5.623 -57.046 523 HD12 LEU 69 HD12 LEU 69 -4.918 3.916 -57.414 524 HD13 LEU 69 HD13 LEU 69 -3.561 5.039 -57.515 525 HD21 LEU 69 HD21 LEU 69 -6.082 5.103 -54.829 526 HD22 LEU 69 HD22 LEU 69 -5.185 4.082 -53.705 527 HD23 LEU 69 HD23 LEU 69 -5.906 3.378 -55.152 528 H LEU 70 HN LEU 70 -3.486 0.848 -54.121 529 HA LEU 70 HA LEU 70 -5.598 1.311 -52.290 530 HB2 LEU 70 HB2 LEU 70 -6.218 -0.979 -52.568 531 HB3 LEU 70 HB1 LEU 70 -5.796 -0.308 -54.120 532 HG LEU 70 HG LEU 70 -5.004 -2.503 -54.155 533 HD11 LEU 70 HD11 LEU 70 -3.349 -0.986 -55.035 534 HD12 LEU 70 HD12 LEU 70 -2.580 -2.379 -54.276 535 HD13 LEU 70 HD13 LEU 70 -2.615 -0.826 -53.439 536 HD21 LEU 70 HD21 LEU 70 -5.213 -3.050 -51.819 537 HD22 LEU 70 HD22 LEU 70 -3.793 -2.075 -51.435 538 HD23 LEU 70 HD23 LEU 70 -3.624 -3.530 -52.416 539 H ASP 71 HN ASP 71 -2.357 0.128 -51.921 540 HA ASP 71 HA ASP 71 -2.862 -1.245 -49.467 541 HB2 ASP 71 HB2 ASP 71 -1.003 -1.808 -51.069 542 HB3 ASP 71 HB1 ASP 71 -0.164 -0.371 -50.490 543 H ARG 72 HN ARG 72 -1.565 1.952 -50.295 544 HA ARG 72 HA ARG 72 -0.869 2.669 -47.664 545 HB2 ARG 72 HB2 ARG 72 -0.935 4.993 -48.407 546 HB3 ARG 72 HB1 ARG 72 -0.137 3.991 -49.610 547 HG2 ARG 72 HG2 ARG 72 -2.041 4.052 -51.036 548 HG3 ARG 72 HG1 ARG 72 -3.024 4.808 -49.784 549 HD2 ARG 72 HD2 ARG 72 -1.677 6.817 -49.894 550 HD3 ARG 72 HD1 ARG 72 -0.599 6.061 -51.069 551 HE ARG 72 HE ARG 72 -2.239 6.294 -52.714 552 HH11 ARG 72 HH11 ARG 72 -3.356 7.516 -49.625 553 HH12 ARG 72 HH12 ARG 72 -4.752 8.300 -50.291 554 HH21 ARG 72 HH21 ARG 72 -4.064 7.299 -53.589 555 HH22 ARG 72 HH22 ARG 72 -5.180 8.148 -52.559 556 H HIS 73 HN HIS 73 -3.913 2.703 -49.404 557 HA HIS 73 HA HIS 73 -5.363 4.212 -47.486 558 HB2 HIS 73 HB2 HIS 73 -6.186 4.001 -49.765 559 HB3 HIS 73 HB1 HIS 73 -6.316 2.256 -49.594 560 HD1 HIS 73 HD1 HIS 73 -7.996 5.462 -48.538 561 HD2 HIS 73 HD2 HIS 73 -8.620 1.351 -48.345 562 HE1 HIS 73 HE1 HIS 73 -10.372 5.167 -47.763 563 HE2 HIS 73 HE2 HIS 73 -10.654 2.676 -47.453 564 H ARG 74 HN ARG 74 -4.983 0.719 -48.040 565 HA ARG 74 HA ARG 74 -6.729 -0.030 -45.933 566 HB2 ARG 74 HB2 ARG 74 -5.861 -2.295 -46.241 567 HB3 ARG 74 HB1 ARG 74 -6.227 -1.550 -47.788 568 HG2 ARG 74 HG2 ARG 74 -3.770 -0.978 -47.937 569 HG3 ARG 74 HG1 ARG 74 -3.539 -2.046 -46.555 570 HD2 ARG 74 HD2 ARG 74 -4.828 -2.878 -49.149 571 HD3 ARG 74 HD1 ARG 74 -3.123 -3.112 -48.771 572 HE ARG 74 HE ARG 74 -5.383 -4.442 -47.420 573 HH11 ARG 74 HH11 ARG 74 -1.950 -4.195 -48.137 574 HH12 ARG 74 HH12 ARG 74 -1.593 -5.797 -47.556 575 HH21 ARG 74 HH21 ARG 74 -4.894 -6.562 -46.658 576 HH22 ARG 74 HH22 ARG 74 -3.246 -7.131 -46.711 577 H LEU 75 HN LEU 75 -3.221 0.446 -46.110 578 HA LEU 75 HA LEU 75 -2.647 -0.480 -43.501 579 HB2 LEU 75 HB2 LEU 75 -1.231 1.043 -45.583 580 HB3 LEU 75 HB1 LEU 75 -0.706 1.380 -43.943 581 HG LEU 75 HG LEU 75 0.660 -0.357 -45.027 582 HD11 LEU 75 HD11 LEU 75 0.437 -0.365 -42.610 583 HD12 LEU 75 HD12 LEU 75 0.545 -2.013 -43.227 584 HD13 LEU 75 HD13 LEU 75 -1.015 -1.357 -42.730 585 HD21 LEU 75 HD21 LEU 75 -1.026 -1.340 -46.478 586 HD22 LEU 75 HD22 LEU 75 -1.903 -1.945 -45.073 587 HD23 LEU 75 HD23 LEU 75 -0.298 -2.574 -45.448 588 H VAL 76 HN VAL 76 -3.240 2.805 -44.751 589 HA VAL 76 HA VAL 76 -3.000 4.167 -42.329 590 HB VAL 76 HB VAL 76 -4.637 4.771 -44.787 591 HG11 VAL 76 HG11 VAL 76 -5.063 7.005 -43.886 592 HG12 VAL 76 HG12 VAL 76 -4.301 6.547 -42.363 593 HG13 VAL 76 HG13 VAL 76 -5.804 5.771 -42.865 594 HG21 VAL 76 HG21 VAL 76 -2.211 4.943 -44.995 595 HG22 VAL 76 HG22 VAL 76 -2.159 6.022 -43.600 596 HG23 VAL 76 HG23 VAL 76 -2.960 6.537 -45.084 597 H ASN 77 HN ASN 77 -5.859 2.603 -43.775 598 HA ASN 77 HA ASN 77 -7.619 3.425 -41.707 599 HB2 ASN 77 HB2 ASN 77 -7.779 1.366 -43.876 600 HB3 ASN 77 HB1 ASN 77 -8.999 1.393 -42.606 601 HD21 ASN 77 HD21 ASN 77 -7.408 4.264 -43.812 602 HD22 ASN 77 HD22 ASN 77 -8.802 4.949 -44.582 603 H THR 78 HN THR 78 -5.411 0.743 -42.002 604 HA THR 78 HA THR 78 -6.584 -0.919 -40.033 605 HB THR 78 HB THR 78 -3.716 -0.773 -40.994 606 HG1 THR 78 HG1 THR 78 -5.213 -1.381 -42.613 607 HG21 THR 78 HG21 THR 78 -5.096 -2.932 -39.392 608 HG22 THR 78 HG22 THR 78 -3.838 -1.849 -38.798 609 HG23 THR 78 HG23 THR 78 -3.464 -3.025 -40.059 610 H ILE 79 HN ILE 79 -3.962 1.470 -39.869 611 HA ILE 79 HA ILE 79 -3.621 1.115 -37.019 612 HB ILE 79 HB ILE 79 -2.479 3.280 -38.792 613 HG12 ILE 79 HG12 ILE 79 -1.066 0.730 -38.037 614 HG13 ILE 79 HG11 ILE 79 -2.066 0.822 -39.484 615 HG21 ILE 79 HG21 ILE 79 -2.301 3.732 -36.404 616 HG22 ILE 79 HG22 ILE 79 -0.714 3.388 -37.092 617 HG23 ILE 79 HG23 ILE 79 -1.552 2.156 -36.148 618 HD11 ILE 79 HD11 ILE 79 0.274 1.176 -40.003 619 HD12 ILE 79 HD12 ILE 79 0.332 2.540 -38.886 620 HD13 ILE 79 HD13 ILE 79 -0.672 2.627 -40.336 621 H LEU 80 HN LEU 80 -4.722 3.705 -39.172 622 HA LEU 80 HA LEU 80 -5.435 5.419 -37.010 623 HB2 LEU 80 HB2 LEU 80 -5.884 5.574 -39.976 624 HB3 LEU 80 HB1 LEU 80 -6.554 6.759 -38.876 625 HG LEU 80 HG LEU 80 -4.209 7.267 -38.111 626 HD11 LEU 80 HD11 LEU 80 -3.131 5.193 -38.807 627 HD12 LEU 80 HD12 LEU 80 -2.356 6.597 -39.543 628 HD13 LEU 80 HD13 LEU 80 -3.447 5.590 -40.495 629 HD21 LEU 80 HD21 LEU 80 -5.407 8.666 -39.714 630 HD22 LEU 80 HD22 LEU 80 -4.795 7.672 -41.037 631 HD23 LEU 80 HD23 LEU 80 -3.677 8.620 -40.057 632 H LYS 81 HN LYS 81 -6.960 2.682 -38.200 633 HA LYS 81 HA LYS 81 -9.651 3.240 -38.021 634 HB2 LYS 81 HB2 LYS 81 -8.746 0.964 -38.389 635 HB3 LYS 81 HB1 LYS 81 -8.224 0.910 -36.710 636 HG2 LYS 81 HG2 LYS 81 -10.268 -0.340 -36.983 637 HG3 LYS 81 HG1 LYS 81 -10.565 1.089 -35.990 638 HD2 LYS 81 HD2 LYS 81 -11.438 2.254 -37.986 639 HD3 LYS 81 HD1 LYS 81 -11.204 0.777 -38.924 640 HE2 LYS 81 HE2 LYS 81 -12.747 -0.398 -37.403 641 HE3 LYS 81 HE1 LYS 81 -13.014 1.113 -36.535 642 HZ1 LYS 81 HZ1 LYS 81 -13.686 0.568 -39.377 643 HZ2 LYS 81 HZ2 LYS 81 -13.857 2.077 -38.620 644 HZ3 LYS 81 HZ3 LYS 81 -14.784 0.756 -38.099 645 H GLU 82 HN GLU 82 -7.652 2.217 -35.259 646 HA GLU 82 HA GLU 82 -9.481 3.345 -33.372 647 HB2 GLU 82 HB2 GLU 82 -6.651 2.340 -32.961 648 HB3 GLU 82 HB1 GLU 82 -7.804 2.703 -31.685 649 HG2 GLU 82 HG2 GLU 82 -9.279 0.927 -32.552 650 HG3 GLU 82 HG1 GLU 82 -8.056 0.535 -33.761 651 H GLU 83 HN GLU 83 -6.460 4.380 -34.884 652 HA GLU 83 HA GLU 83 -5.789 6.405 -33.069 653 HB2 GLU 83 HB2 GLU 83 -4.322 5.497 -34.865 654 HB3 GLU 83 HB1 GLU 83 -5.255 6.413 -36.040 655 HG2 GLU 83 HG2 GLU 83 -4.531 8.478 -35.132 656 HG3 GLU 83 HG1 GLU 83 -3.828 7.685 -33.723 657 H LEU 84 HN LEU 84 -7.894 6.542 -35.921 658 HA LEU 84 HA LEU 84 -8.323 9.286 -36.043 659 HB2 LEU 84 HB2 LEU 84 -10.119 6.988 -36.767 660 HB3 LEU 84 HB1 LEU 84 -10.598 8.656 -37.014 661 HG LEU 84 HG LEU 84 -8.244 7.268 -38.287 662 HD11 LEU 84 HD11 LEU 84 -9.488 7.608 -40.365 663 HD12 LEU 84 HD12 LEU 84 -10.829 8.292 -39.445 664 HD13 LEU 84 HD13 LEU 84 -10.382 6.599 -39.228 665 HD21 LEU 84 HD21 LEU 84 -9.221 10.102 -38.611 666 HD22 LEU 84 HD22 LEU 84 -7.937 9.338 -39.550 667 HD23 LEU 84 HD23 LEU 84 -7.726 9.605 -37.818 668 H GLN 85 HN GLN 85 -9.627 6.966 -33.788 669 HA GLN 85 HA GLN 85 -11.998 8.264 -33.068 670 HB2 GLN 85 HB2 GLN 85 -10.250 6.665 -31.199 671 HB3 GLN 85 HB1 GLN 85 -11.968 6.970 -31.031 672 HG2 GLN 85 HG2 GLN 85 -10.557 5.129 -32.915 673 HG3 GLN 85 HG1 GLN 85 -11.835 4.772 -31.759 674 HE21 GLN 85 HE21 GLN 85 -11.050 5.719 -34.929 675 HE22 GLN 85 HE22 GLN 85 -12.654 5.808 -35.544 676 H ASN 86 HN ASN 86 -8.762 9.183 -32.469 677 HA ASN 86 HA ASN 86 -9.512 10.823 -30.157 678 HB2 ASN 86 HB2 ASN 86 -6.820 10.050 -31.286 679 HB3 ASN 86 HB1 ASN 86 -7.024 11.199 -29.969 680 HD21 ASN 86 HD21 ASN 86 -7.158 7.872 -30.916 681 HD22 ASN 86 HD22 ASN 86 -7.319 7.217 -29.325 682 H ILE 87 HN ILE 87 -9.411 11.137 -33.439 683 HA ILE 87 HA ILE 87 -8.601 13.978 -33.302 684 HB ILE 87 HB ILE 87 -8.667 12.390 -35.862 685 HG12 ILE 87 HG12 ILE 87 -6.325 12.653 -33.958 686 HG13 ILE 87 HG11 ILE 87 -7.173 11.169 -34.378 687 HG21 ILE 87 HG21 ILE 87 -8.578 14.820 -36.035 688 HG22 ILE 87 HG22 ILE 87 -7.072 14.096 -36.601 689 HG23 ILE 87 HG23 ILE 87 -7.143 14.850 -35.009 690 HD11 ILE 87 HD11 ILE 87 -5.078 11.282 -35.548 691 HD12 ILE 87 HD12 ILE 87 -5.506 12.854 -36.225 692 HD13 ILE 87 HD13 ILE 87 -6.410 11.415 -36.698 693 H HIS 88 HN HIS 88 -9.903 15.491 -34.472 694 HA HIS 88 HA HIS 88 -12.665 14.664 -34.746 695 HB2 HIS 88 HB2 HIS 88 -12.005 16.866 -33.729 696 HB3 HIS 88 HB1 HIS 88 -11.460 17.381 -35.321 697 HD1 HIS 88 HD1 HIS 88 -14.479 16.985 -33.228 698 HD2 HIS 88 HD2 HIS 88 -13.581 17.792 -37.212 699 HE1 HIS 88 HE1 HIS 88 -16.606 17.860 -34.242 700 HE2 HIS 88 HE2 HIS 88 -16.081 18.217 -36.682 701 H ALA 89 HN ALA 89 -9.999 15.703 -36.806 702 HA ALA 89 HA ALA 89 -11.134 14.321 -39.052 703 HB1 ALA 89 HB1 ALA 89 -11.273 16.230 -40.558 704 HB2 ALA 89 HB2 ALA 89 -10.827 17.318 -39.243 705 HB3 ALA 89 HB3 ALA 89 -12.359 16.445 -39.184 706 H PHE 90 HN PHE 90 -9.330 13.196 -39.528 707 HA PHE 90 HA PHE 90 -6.815 14.682 -39.818 708 HB2 PHE 90 HB2 PHE 90 -6.779 12.700 -38.334 709 HB3 PHE 90 HB1 PHE 90 -7.266 11.693 -39.692 710 HD1 PHE 90 HD1 PHE 90 -4.552 13.825 -38.378 711 HD2 PHE 90 HD2 PHE 90 -5.685 10.901 -41.255 712 HE1 PHE 90 HE1 PHE 90 -2.188 13.506 -38.978 713 HE2 PHE 90 HE2 PHE 90 -3.322 10.577 -41.860 714 HZ PHE 90 HZ PHE 90 -1.571 11.879 -40.721 715 H SER 91 HN SER 91 -5.798 14.864 -41.726 716 HA SER 91 HA SER 91 -6.751 13.282 -44.011 717 HB2 SER 91 HB2 SER 91 -6.175 16.257 -44.062 718 HB3 SER 91 HB1 SER 91 -6.619 15.269 -45.453 719 HG SER 91 HG SER 91 -8.410 14.932 -43.478 720 H MET 92 HN MET 92 -5.095 13.200 -45.778 721 HA MET 92 HA MET 92 -2.388 13.695 -44.777 722 HB2 MET 92 HB2 MET 92 -1.633 11.483 -45.265 723 HB3 MET 92 HB1 MET 92 -3.055 11.342 -44.245 724 HG2 MET 92 HG2 MET 92 -3.045 11.005 -47.238 725 HG3 MET 92 HG1 MET 92 -2.967 9.686 -46.077 726 HE1 MET 92 HE1 MET 92 -4.950 10.700 -43.803 727 HE2 MET 92 HE2 MET 92 -4.960 9.048 -44.424 728 HE3 MET 92 HE3 MET 92 -6.466 9.961 -44.319 729 H LYS 93 HN LYS 93 -0.831 14.035 -46.297 730 HA LYS 93 HA LYS 93 -1.671 14.007 -49.127 731 HB2 LYS 93 HB2 LYS 93 0.347 15.816 -47.773 732 HB3 LYS 93 HB1 LYS 93 -0.017 15.811 -49.492 733 HG2 LYS 93 HG2 LYS 93 -1.981 16.488 -47.312 734 HG3 LYS 93 HG1 LYS 93 -1.090 17.659 -48.286 735 HD2 LYS 93 HD2 LYS 93 -2.144 16.767 -50.311 736 HD3 LYS 93 HD1 LYS 93 -3.040 15.607 -49.327 737 HE2 LYS 93 HE2 LYS 93 -3.231 18.605 -49.107 738 HE3 LYS 93 HE1 LYS 93 -4.394 17.570 -49.933 739 HZ1 LYS 93 HZ1 LYS 93 -3.733 17.461 -47.027 740 HZ2 LYS 93 HZ2 LYS 93 -4.860 16.475 -47.832 741 HZ3 LYS 93 HZ3 LYS 93 -5.133 18.138 -47.707 742 H CYS 94 HN CYS 94 -0.768 12.251 -50.031 743 HA CYS 94 HA CYS 94 1.669 11.150 -48.929 744 HB2 CYS 94 HB2 CYS 94 1.289 9.407 -50.764 745 HB3 CYS 94 HB1 CYS 94 0.082 9.512 -49.486 746 HG CYS 94 HG CYS 94 -1.739 10.980 -51.037 747 H HIS 95 HN HIS 95 3.631 11.700 -49.556 748 HA HIS 95 HA HIS 95 4.038 12.378 -52.394 749 HB2 HIS 95 HB2 HIS 95 5.243 13.826 -50.029 750 HB3 HIS 95 HB1 HIS 95 5.773 14.040 -51.691 751 HD1 HIS 95 HD1 HIS 95 4.341 15.538 -53.207 752 HD2 HIS 95 HD2 HIS 95 2.711 14.938 -49.423 753 HE1 HIS 95 HE1 HIS 95 2.461 17.186 -53.008 754 HE2 HIS 95 HE2 HIS 95 1.624 16.945 -50.648 755 H THR 96 HN THR 96 6.108 11.925 -53.242 756 HA THR 96 HA THR 96 7.502 9.767 -51.850 757 HB THR 96 HB THR 96 8.664 9.527 -54.110 758 HG1 THR 96 HG1 THR 96 6.862 10.550 -55.680 759 HG21 THR 96 HG21 THR 96 6.876 8.029 -53.394 760 HG22 THR 96 HG22 THR 96 6.748 8.367 -55.121 761 HG23 THR 96 HG23 THR 96 5.668 9.171 -53.983 762 HA PRO 97 HA PRO 97 10.957 12.267 -50.718 763 HB2 PRO 97 HB2 PRO 97 12.699 10.003 -51.498 764 HB3 PRO 97 HB1 PRO 97 12.514 10.790 -49.927 765 HG2 PRO 97 HG2 PRO 97 11.523 8.352 -50.369 766 HG3 PRO 97 HG1 PRO 97 10.652 9.528 -49.366 767 HD2 PRO 97 HD2 PRO 97 10.159 8.728 -52.213 768 HD3 PRO 97 HD1 PRO 97 8.988 9.035 -50.913 769 H LEU 98 HN LEU 98 11.026 10.534 -53.756 770 HA LEU 98 HA LEU 98 13.259 11.820 -54.901 771 HB2 LEU 98 HB2 LEU 98 11.941 9.677 -55.610 772 HB3 LEU 98 HB1 LEU 98 10.938 10.796 -56.508 773 HG LEU 98 HG LEU 98 12.689 9.710 -57.884 774 HD11 LEU 98 HD11 LEU 98 13.508 11.733 -58.979 775 HD12 LEU 98 HD12 LEU 98 12.998 12.691 -57.589 776 HD13 LEU 98 HD13 LEU 98 11.795 11.859 -58.574 777 HD21 LEU 98 HD21 LEU 98 15.023 10.411 -57.605 778 HD22 LEU 98 HD22 LEU 98 14.428 9.511 -56.209 779 HD23 LEU 98 HD23 LEU 98 14.578 11.266 -56.128 780 H GLU 99 HN GLU 99 9.751 12.409 -55.246 781 HA GLU 99 HA GLU 99 10.125 14.731 -56.866 782 HB2 GLU 99 HB2 GLU 99 8.079 13.281 -56.890 783 HB3 GLU 99 HB1 GLU 99 7.660 13.932 -55.311 784 HG2 GLU 99 HG2 GLU 99 6.419 15.053 -57.058 785 HG3 GLU 99 HG1 GLU 99 7.526 16.176 -56.271 786 H TYR 100 HN TYR 100 9.819 14.109 -53.461 787 HA TYR 100 HA TYR 100 9.125 16.618 -52.505 788 HB2 TYR 100 HB2 TYR 100 9.151 14.718 -51.031 789 HB3 TYR 100 HB1 TYR 100 10.878 14.488 -51.273 790 HD1 TYR 100 HD1 TYR 100 8.487 17.091 -50.045 791 HD2 TYR 100 HD2 TYR 100 12.323 15.288 -49.662 792 HE1 TYR 100 HE1 TYR 100 8.944 18.493 -48.077 793 HE2 TYR 100 HE2 TYR 100 12.790 16.685 -47.696 794 HH TYR 100 HH TYR 100 10.370 18.508 -46.119 795 H ASP 101 HN ASP 101 12.259 15.429 -53.588 796 HA ASP 101 HA ASP 101 13.827 17.446 -52.403 797 HB2 ASP 101 HB2 ASP 101 14.776 15.350 -53.335 798 HB3 ASP 101 HB1 ASP 101 14.436 15.946 -54.959 799 H LYS 102 HN LYS 102 12.098 17.321 -55.473 800 HA LYS 102 HA LYS 102 13.170 19.721 -56.543 801 HB2 LYS 102 HB2 LYS 102 10.784 18.032 -57.144 802 HB3 LYS 102 HB1 LYS 102 10.820 19.669 -57.781 803 HG2 LYS 102 HG2 LYS 102 11.661 18.245 -59.470 804 HG3 LYS 102 HG1 LYS 102 13.036 19.127 -58.808 805 HD2 LYS 102 HD2 LYS 102 13.668 16.835 -59.120 806 HD3 LYS 102 HD1 LYS 102 13.548 17.154 -57.390 807 HE2 LYS 102 HE2 LYS 102 12.559 14.985 -58.060 808 HE3 LYS 102 HE1 LYS 102 11.406 16.070 -57.286 809 HZ1 LYS 102 HZ1 LYS 102 10.678 14.839 -59.381 810 HZ2 LYS 102 HZ2 LYS 102 11.642 15.949 -60.230 811 HZ3 LYS 102 HZ3 LYS 102 10.339 16.496 -59.283 812 H LEU 103 HN LEU 103 10.542 19.001 -54.364 813 HA LEU 103 HA LEU 103 9.311 21.554 -54.431 814 HB2 LEU 103 HB2 LEU 103 9.307 19.540 -52.180 815 HB3 LEU 103 HB1 LEU 103 8.164 20.850 -52.406 816 HG LEU 103 HG LEU 103 8.474 18.455 -54.219 817 HD11 LEU 103 HD11 LEU 103 7.461 17.895 -52.077 818 HD12 LEU 103 HD12 LEU 103 6.274 17.818 -53.378 819 HD13 LEU 103 HD13 LEU 103 6.290 19.198 -52.280 820 HD21 LEU 103 HD21 LEU 103 7.810 20.430 -55.469 821 HD22 LEU 103 HD22 LEU 103 6.514 20.745 -54.313 822 HD23 LEU 103 HD23 LEU 103 6.462 19.302 -55.329 823 H LYS 104 HN LYS 104 11.703 20.070 -52.272 824 HA LYS 104 HA LYS 104 11.987 22.424 -50.666 825 HB2 LYS 104 HB2 LYS 104 14.106 21.137 -49.860 826 HB3 LYS 104 HB1 LYS 104 12.505 20.542 -49.440 827 HG2 LYS 104 HG2 LYS 104 12.829 18.635 -50.519 828 HG3 LYS 104 HG1 LYS 104 13.439 19.458 -51.953 829 HD2 LYS 104 HD2 LYS 104 15.065 18.927 -49.471 830 HD3 LYS 104 HD1 LYS 104 15.070 17.900 -50.905 831 HE2 LYS 104 HE2 LYS 104 15.685 20.027 -52.192 832 HE3 LYS 104 HE1 LYS 104 16.042 20.725 -50.614 833 HZ1 LYS 104 HZ1 LYS 104 18.041 19.857 -51.528 834 HZ2 LYS 104 HZ2 LYS 104 17.322 18.352 -51.852 835 HZ3 LYS 104 HZ3 LYS 104 17.584 18.842 -50.246 836 H SER 105 HN SER 105 13.167 21.634 -53.732 837 HA SER 105 HA SER 105 15.668 22.895 -53.741 838 HB2 SER 105 HB2 SER 105 13.594 22.855 -55.947 839 HB3 SER 105 HB1 SER 105 15.300 23.250 -56.152 840 HG SER 105 HG SER 105 15.361 20.964 -54.967 841 H LYS 106 HN LYS 106 12.405 24.212 -54.176 842 HA LYS 106 HA LYS 106 13.512 26.910 -53.914 843 HB2 LYS 106 HB2 LYS 106 11.060 27.574 -54.405 844 HB3 LYS 106 HB1 LYS 106 12.054 26.977 -55.722 845 HG2 LYS 106 HG2 LYS 106 10.381 25.025 -54.234 846 HG3 LYS 106 HG1 LYS 106 9.580 26.145 -55.335 847 HD2 LYS 106 HD2 LYS 106 11.820 24.242 -56.040 848 HD3 LYS 106 HD1 LYS 106 10.119 24.053 -56.471 849 HE2 LYS 106 HE2 LYS 106 10.281 26.225 -57.706 850 HE3 LYS 106 HE1 LYS 106 12.016 26.205 -57.401 851 HZ1 LYS 106 HZ1 LYS 106 12.118 24.060 -58.600 852 HZ2 LYS 106 HZ2 LYS 106 11.575 25.338 -59.574 853 HZ3 LYS 106 HZ3 LYS 106 10.466 24.210 -58.968 854 H GLY 107 HN GLY 107 11.167 24.707 -52.460 855 HA2 GLY 107 HA2 GLY 107 10.709 24.465 -50.196 856 HA3 GLY 107 HA1 GLY 107 11.708 25.873 -49.871 857 H SER 108 HN SER 108 8.876 25.550 -51.979 858 HA SER 108 HA SER 108 7.270 27.090 -50.131 859 HB2 SER 108 HB2 SER 108 6.685 28.673 -52.083 860 HB3 SER 108 HB1 SER 108 8.222 28.916 -51.256 861 HG SER 108 HG SER 108 7.847 27.495 -53.695 Start of MODEL 16 1 H1 MET 1 HT1 MET 1 -11.416 23.414 -31.525 2 H2 MET 1 HT2 MET 1 -10.341 23.325 -32.828 3 H3 MET 1 HT3 MET 1 -11.392 24.645 -32.694 4 HA MET 1 HA MET 1 -10.303 25.318 -30.644 5 HB2 MET 1 HB2 MET 1 -9.480 23.048 -30.048 6 HB3 MET 1 HB1 MET 1 -8.307 23.157 -31.354 7 HG2 MET 1 HG2 MET 1 -7.259 23.653 -29.238 8 HG3 MET 1 HG1 MET 1 -7.276 25.088 -30.263 9 HE1 MET 1 HE1 MET 1 -6.763 26.699 -28.251 10 HE2 MET 1 HE2 MET 1 -6.642 25.290 -27.196 11 HE3 MET 1 HE3 MET 1 -7.639 26.665 -26.720 12 H GLY 2 HN GLY 2 -8.931 24.223 -33.719 13 HA2 GLY 2 HA2 GLY 2 -8.245 25.688 -35.420 14 HA3 GLY 2 HA1 GLY 2 -8.139 26.980 -34.234 15 H SER 3 HN SER 3 -6.120 27.694 -34.423 16 HA SER 3 HA SER 3 -3.958 26.172 -35.304 17 HB2 SER 3 HB2 SER 3 -4.041 28.816 -33.858 18 HB3 SER 3 HB1 SER 3 -2.576 28.126 -34.562 19 HG SER 3 HG SER 3 -3.951 27.970 -36.556 20 H SER 4 HN SER 4 -2.899 24.673 -34.397 21 HA SER 4 HA SER 4 -2.266 24.837 -31.521 22 HB2 SER 4 HB2 SER 4 -2.735 22.296 -33.107 23 HB3 SER 4 HB1 SER 4 -2.426 22.417 -31.374 24 HG SER 4 HG SER 4 -4.670 23.551 -32.710 25 H HIS 5 HN HIS 5 -1.244 24.408 -34.776 26 HA HIS 5 HA HIS 5 1.467 23.628 -33.941 27 HB2 HIS 5 HB2 HIS 5 0.472 22.301 -35.755 28 HB3 HIS 5 HB1 HIS 5 0.221 23.762 -36.700 29 HD1 HIS 5 HD1 HIS 5 2.148 24.580 -38.119 30 HD2 HIS 5 HD2 HIS 5 3.236 21.526 -35.502 31 HE1 HIS 5 HE1 HIS 5 4.473 23.896 -38.794 32 HE2 HIS 5 HE2 HIS 5 5.043 21.941 -37.313 33 H HIS 6 HN HIS 6 2.742 25.296 -33.472 34 HA HIS 6 HA HIS 6 2.428 27.778 -35.015 35 HB2 HIS 6 HB2 HIS 6 2.247 27.866 -32.494 36 HB3 HIS 6 HB1 HIS 6 3.946 27.416 -32.424 37 HD1 HIS 6 HD1 HIS 6 1.714 30.289 -32.788 38 HD2 HIS 6 HD2 HIS 6 5.711 29.445 -33.568 39 HE1 HIS 6 HE1 HIS 6 2.835 32.519 -33.079 40 HE2 HIS 6 HE2 HIS 6 5.262 31.995 -33.509 41 H HIS 7 HN HIS 7 3.829 28.074 -36.603 42 HA HIS 7 HA HIS 7 6.218 26.532 -36.878 43 HB2 HIS 7 HB2 HIS 7 4.957 27.375 -38.826 44 HB3 HIS 7 HB1 HIS 7 5.335 29.027 -38.358 45 HD1 HIS 7 HD1 HIS 7 6.795 26.008 -40.007 46 HD2 HIS 7 HD2 HIS 7 7.977 29.850 -38.920 47 HE1 HIS 7 HE1 HIS 7 8.960 26.425 -41.216 48 HE2 HIS 7 HE2 HIS 7 9.561 28.818 -40.689 49 H HIS 8 HN HIS 8 8.222 26.951 -36.179 50 HA HIS 8 HA HIS 8 8.694 29.047 -34.318 51 HB2 HIS 8 HB2 HIS 8 9.811 26.814 -34.258 52 HB3 HIS 8 HB1 HIS 8 10.696 27.248 -35.713 53 HD1 HIS 8 HD1 HIS 8 13.042 27.565 -34.997 54 HD2 HIS 8 HD2 HIS 8 10.359 29.308 -32.336 55 HE1 HIS 8 HE1 HIS 8 14.453 28.729 -33.274 56 HE2 HIS 8 HE2 HIS 8 12.814 29.566 -31.553 57 H HIS 9 HN HIS 9 9.042 31.106 -34.809 58 HA HIS 9 HA HIS 9 9.512 31.889 -37.542 59 HB2 HIS 9 HB2 HIS 9 7.935 33.067 -35.981 60 HB3 HIS 9 HB1 HIS 9 9.336 33.663 -35.098 61 HD1 HIS 9 HD1 HIS 9 10.062 35.926 -35.785 62 HD2 HIS 9 HD2 HIS 9 8.125 33.915 -38.870 63 HE1 HIS 9 HE1 HIS 9 9.964 37.553 -37.701 64 HE2 HIS 9 HE2 HIS 9 8.963 36.247 -39.612 65 H HIS 10 HN HIS 10 11.657 30.521 -36.957 66 HA HIS 10 HA HIS 10 13.756 32.337 -37.493 67 HB2 HIS 10 HB2 HIS 10 13.611 32.592 -34.983 68 HB3 HIS 10 HB1 HIS 10 14.002 30.882 -34.843 69 HD1 HIS 10 HD1 HIS 10 16.447 30.247 -34.912 70 HD2 HIS 10 HD2 HIS 10 15.760 34.190 -36.068 71 HE1 HIS 10 HE1 HIS 10 18.721 31.300 -35.138 72 HE2 HIS 10 HE2 HIS 10 18.293 33.659 -35.923 73 H SER 11 HN SER 11 15.250 31.270 -38.665 74 HA SER 11 HA SER 11 14.815 28.661 -39.522 75 HB2 SER 11 HB2 SER 11 17.373 30.272 -39.588 76 HB3 SER 11 HB1 SER 11 17.076 28.806 -40.524 77 HG SER 11 HG SER 11 15.133 30.765 -40.763 78 H SER 12 HN SER 12 14.845 26.921 -38.310 79 HA SER 12 HA SER 12 17.185 26.410 -36.610 80 HB2 SER 12 HB2 SER 12 15.530 25.274 -35.009 81 HB3 SER 12 HB1 SER 12 15.541 27.037 -35.019 82 HG SER 12 HG SER 12 13.817 26.149 -36.875 83 H GLY 13 HN GLY 13 17.147 25.486 -39.093 84 HA2 GLY 13 HA2 GLY 13 15.775 22.933 -39.274 85 HA3 GLY 13 HA1 GLY 13 16.758 23.687 -40.520 86 H ARG 14 HN ARG 14 18.019 23.412 -37.314 87 HA ARG 14 HA ARG 14 19.961 21.427 -38.288 88 HB2 ARG 14 HB2 ARG 14 20.155 23.001 -35.725 89 HB3 ARG 14 HB1 ARG 14 21.448 22.218 -36.619 90 HG2 ARG 14 HG2 ARG 14 21.375 23.884 -38.326 91 HG3 ARG 14 HG1 ARG 14 19.913 24.595 -37.636 92 HD2 ARG 14 HD2 ARG 14 22.664 24.530 -36.409 93 HD3 ARG 14 HD1 ARG 14 21.794 25.946 -37.001 94 HE ARG 14 HE ARG 14 20.146 24.885 -35.093 95 HH11 ARG 14 HH11 ARG 14 23.474 26.000 -35.137 96 HH12 ARG 14 HH12 ARG 14 23.476 26.418 -33.443 97 HH21 ARG 14 HH21 ARG 14 20.166 25.413 -32.882 98 HH22 ARG 14 HH22 ARG 14 21.610 26.088 -32.175 99 H GLU 15 HN GLU 15 17.984 22.271 -35.500 100 HA GLU 15 HA GLU 15 18.399 19.616 -34.346 101 HB2 GLU 15 HB2 GLU 15 17.313 20.661 -32.321 102 HB3 GLU 15 HB1 GLU 15 18.852 21.353 -32.802 103 HG2 GLU 15 HG2 GLU 15 16.248 22.574 -33.655 104 HG3 GLU 15 HG1 GLU 15 16.980 22.942 -32.095 105 H ASN 16 HN ASN 16 16.034 21.333 -36.100 106 HA ASN 16 HA ASN 16 13.733 20.186 -34.855 107 HB2 ASN 16 HB2 ASN 16 12.424 21.305 -36.456 108 HB3 ASN 16 HB1 ASN 16 13.798 22.361 -36.174 109 HD21 ASN 16 HD21 ASN 16 15.576 20.655 -37.840 110 HD22 ASN 16 HD22 ASN 16 15.127 20.995 -39.470 111 H LEU 17 HN LEU 17 15.990 18.561 -36.391 112 HA LEU 17 HA LEU 17 14.355 16.921 -38.122 113 HB2 LEU 17 HB2 LEU 17 17.212 16.746 -37.197 114 HB3 LEU 17 HB1 LEU 17 16.456 15.427 -38.064 115 HG LEU 17 HG LEU 17 15.976 17.103 -39.921 116 HD11 LEU 17 HD11 LEU 17 17.427 19.067 -40.009 117 HD12 LEU 17 HD12 LEU 17 18.000 18.716 -38.378 118 HD13 LEU 17 HD13 LEU 17 16.311 19.146 -38.646 119 HD21 LEU 17 HD21 LEU 17 17.703 15.396 -40.081 120 HD22 LEU 17 HD22 LEU 17 18.841 16.452 -39.244 121 HD23 LEU 17 HD23 LEU 17 18.232 16.900 -40.838 122 H TYR 18 HN TYR 18 14.865 17.184 -34.834 123 HA TYR 18 HA TYR 18 14.210 14.360 -34.358 124 HB2 TYR 18 HB2 TYR 18 15.330 16.437 -32.460 125 HB3 TYR 18 HB1 TYR 18 14.940 14.777 -32.026 126 HD1 TYR 18 HD1 TYR 18 16.262 12.906 -33.014 127 HD2 TYR 18 HD2 TYR 18 17.376 16.978 -33.546 128 HE1 TYR 18 HE1 TYR 18 18.524 12.195 -33.665 129 HE2 TYR 18 HE2 TYR 18 19.642 16.277 -34.201 130 HH TYR 18 HH TYR 18 21.134 14.381 -33.921 131 H PHE 19 HN PHE 19 12.249 13.855 -33.669 132 HA PHE 19 HA PHE 19 10.248 15.880 -33.360 133 HB2 PHE 19 HB2 PHE 19 8.782 13.827 -32.876 134 HB3 PHE 19 HB1 PHE 19 9.519 13.939 -34.470 135 HD1 PHE 19 HD1 PHE 19 10.417 12.583 -31.102 136 HD2 PHE 19 HD2 PHE 19 10.364 11.993 -35.315 137 HE1 PHE 19 HE1 PHE 19 11.414 10.365 -30.798 138 HE2 PHE 19 HE2 PHE 19 11.360 9.763 -35.018 139 HZ PHE 19 HZ PHE 19 11.887 8.943 -32.756 140 H GLN 20 HN GLN 20 12.305 15.966 -31.342 141 HA GLN 20 HA GLN 20 11.389 14.870 -28.889 142 HB2 GLN 20 HB2 GLN 20 13.248 17.198 -29.412 143 HB3 GLN 20 HB1 GLN 20 12.998 16.444 -27.845 144 HG2 GLN 20 HG2 GLN 20 14.176 15.145 -30.289 145 HG3 GLN 20 HG1 GLN 20 15.045 15.654 -28.842 146 HE21 GLN 20 HE21 GLN 20 12.919 13.298 -30.231 147 HE22 GLN 20 HE22 GLN 20 13.028 12.145 -28.949 148 H GLY 21 HN GLY 21 9.481 15.400 -28.060 149 HA2 GLY 21 HA2 GLY 21 8.907 18.247 -27.662 150 HA3 GLY 21 HA1 GLY 21 7.690 17.252 -28.450 151 H HIS 22 HN HIS 22 6.304 17.836 -26.688 152 HA HIS 22 HA HIS 22 6.947 16.526 -24.135 153 HB2 HIS 22 HB2 HIS 22 6.435 18.999 -24.160 154 HB3 HIS 22 HB1 HIS 22 4.809 18.597 -24.694 155 HD1 HIS 22 HD1 HIS 22 7.088 18.304 -21.710 156 HD2 HIS 22 HD2 HIS 22 3.076 17.786 -22.693 157 HE1 HIS 22 HE1 HIS 22 5.877 18.037 -19.520 158 HE2 HIS 22 HE2 HIS 22 3.467 17.627 -20.141 159 H MET 23 HN MET 23 5.304 15.256 -23.101 160 HA MET 23 HA MET 23 3.796 13.551 -24.716 161 HB2 MET 23 HB2 MET 23 3.574 14.248 -21.793 162 HB3 MET 23 HB1 MET 23 2.521 13.061 -22.548 163 HG2 MET 23 HG2 MET 23 5.525 12.913 -22.472 164 HG3 MET 23 HG1 MET 23 4.433 12.053 -21.389 165 HE1 MET 23 HE1 MET 23 5.537 9.739 -21.991 166 HE2 MET 23 HE2 MET 23 6.677 10.556 -23.061 167 HE3 MET 23 HE3 MET 23 5.772 9.158 -23.639 168 H CYS 24 HN CYS 24 2.414 14.407 -26.128 169 HA CYS 24 HA CYS 24 -0.013 15.625 -25.085 170 HB2 CYS 24 HB2 CYS 24 1.617 16.862 -27.323 171 HB3 CYS 24 HB1 CYS 24 0.008 17.379 -26.831 172 HG CYS 24 HG CYS 24 1.463 17.601 -24.081 173 H ILE 25 HN ILE 25 -1.761 15.567 -26.679 174 HA ILE 25 HA ILE 25 -2.053 13.093 -27.893 175 HB ILE 25 HB ILE 25 -3.932 14.562 -27.286 176 HG12 ILE 25 HG12 ILE 25 -5.339 14.135 -29.306 177 HG13 ILE 25 HG11 ILE 25 -3.879 13.676 -30.176 178 HG21 ILE 25 HG21 ILE 25 -3.150 16.155 -29.718 179 HG22 ILE 25 HG22 ILE 25 -3.062 16.689 -28.039 180 HG23 ILE 25 HG23 ILE 25 -4.630 16.371 -28.783 181 HD11 ILE 25 HD11 ILE 25 -4.990 12.305 -27.738 182 HD12 ILE 25 HD12 ILE 25 -3.516 11.849 -28.594 183 HD13 ILE 25 HD13 ILE 25 -5.081 11.719 -29.398 184 H GLN 26 HN GLN 26 -0.746 16.060 -29.233 185 HA GLN 26 HA GLN 26 -0.811 15.433 -31.952 186 HB2 GLN 26 HB2 GLN 26 -0.224 17.654 -31.291 187 HB3 GLN 26 HB1 GLN 26 1.144 17.078 -30.348 188 HG2 GLN 26 HG2 GLN 26 2.266 16.372 -32.400 189 HG3 GLN 26 HG1 GLN 26 0.895 16.943 -33.348 190 HE21 GLN 26 HE21 GLN 26 2.258 18.345 -34.483 191 HE22 GLN 26 HE22 GLN 26 2.840 19.809 -33.777 192 H LYS 27 HN LYS 27 1.710 14.752 -29.530 193 HA LYS 27 HA LYS 27 3.426 13.502 -31.423 194 HB2 LYS 27 HB2 LYS 27 3.446 13.532 -28.410 195 HB3 LYS 27 HB1 LYS 27 4.635 12.651 -29.357 196 HG2 LYS 27 HG2 LYS 27 4.189 15.619 -29.239 197 HG3 LYS 27 HG1 LYS 27 5.625 14.710 -28.773 198 HD2 LYS 27 HD2 LYS 27 4.580 15.257 -31.543 199 HD3 LYS 27 HD1 LYS 27 6.130 15.729 -30.850 200 HE2 LYS 27 HE2 LYS 27 5.263 12.898 -31.440 201 HE3 LYS 27 HE1 LYS 27 6.333 13.868 -32.449 202 HZ1 LYS 27 HZ1 LYS 27 6.961 13.263 -29.624 203 HZ2 LYS 27 HZ2 LYS 27 8.010 13.806 -30.839 204 HZ3 LYS 27 HZ3 LYS 27 7.395 12.221 -30.887 205 H VAL 28 HN VAL 28 0.842 12.372 -29.382 206 HA VAL 28 HA VAL 28 1.378 9.624 -29.427 207 HB VAL 28 HB VAL 28 -1.324 10.983 -29.519 208 HG11 VAL 28 HG11 VAL 28 -1.481 8.634 -30.142 209 HG12 VAL 28 HG12 VAL 28 -2.185 8.904 -28.548 210 HG13 VAL 28 HG13 VAL 28 -0.586 8.177 -28.693 211 HG21 VAL 28 HG21 VAL 28 0.012 11.711 -27.617 212 HG22 VAL 28 HG22 VAL 28 0.309 10.031 -27.169 213 HG23 VAL 28 HG23 VAL 28 -1.324 10.689 -27.088 214 H ILE 29 HN ILE 29 -0.639 11.550 -31.631 215 HA ILE 29 HA ILE 29 -1.079 9.495 -33.513 216 HB ILE 29 HB ILE 29 -1.326 12.493 -33.640 217 HG12 ILE 29 HG12 ILE 29 -3.724 11.912 -34.063 218 HG13 ILE 29 HG11 ILE 29 -3.309 10.217 -33.847 219 HG21 ILE 29 HG21 ILE 29 -0.564 11.843 -35.850 220 HG22 ILE 29 HG22 ILE 29 -2.263 12.314 -35.896 221 HG23 ILE 29 HG23 ILE 29 -1.818 10.608 -35.941 222 HD11 ILE 29 HD11 ILE 29 -2.655 10.676 -31.544 223 HD12 ILE 29 HD12 ILE 29 -4.327 11.145 -31.856 224 HD13 ILE 29 HD13 ILE 29 -3.067 12.377 -31.766 225 H GLU 30 HN GLU 30 1.265 12.161 -33.416 226 HA GLU 30 HA GLU 30 2.392 11.788 -35.936 227 HB2 GLU 30 HB2 GLU 30 2.730 13.760 -34.437 228 HB3 GLU 30 HB1 GLU 30 3.814 12.780 -33.461 229 HG2 GLU 30 HG2 GLU 30 5.174 12.438 -35.566 230 HG3 GLU 30 HG1 GLU 30 4.189 13.706 -36.289 231 H ASP 31 HN ASP 31 3.520 10.539 -32.785 232 HA ASP 31 HA ASP 31 5.773 9.214 -33.892 233 HB2 ASP 31 HB2 ASP 31 4.576 9.514 -31.251 234 HB3 ASP 31 HB1 ASP 31 5.234 7.902 -31.506 235 H LYS 32 HN LYS 32 2.450 8.247 -33.330 236 HA LYS 32 HA LYS 32 2.878 5.452 -33.480 237 HB2 LYS 32 HB2 LYS 32 0.821 6.511 -32.577 238 HB3 LYS 32 HB1 LYS 32 0.380 6.988 -34.211 239 HG2 LYS 32 HG2 LYS 32 0.352 4.591 -34.848 240 HG3 LYS 32 HG1 LYS 32 0.646 4.180 -33.157 241 HD2 LYS 32 HD2 LYS 32 -1.728 5.686 -34.250 242 HD3 LYS 32 HD1 LYS 32 -1.723 4.021 -33.668 243 HE2 LYS 32 HE2 LYS 32 -1.203 4.755 -31.432 244 HE3 LYS 32 HE1 LYS 32 -1.030 6.421 -31.981 245 HZ1 LYS 32 HZ1 LYS 32 -3.543 4.833 -32.072 246 HZ2 LYS 32 HZ2 LYS 32 -3.362 6.462 -32.553 247 HZ3 LYS 32 HZ3 LYS 32 -3.168 6.027 -30.929 248 H LEU 33 HN LEU 33 1.627 7.718 -35.972 249 HA LEU 33 HA LEU 33 1.810 5.719 -37.993 250 HB2 LEU 33 HB2 LEU 33 1.328 7.585 -39.574 251 HB3 LEU 33 HB1 LEU 33 0.152 7.372 -38.297 252 HG LEU 33 HG LEU 33 1.467 9.276 -37.103 253 HD11 LEU 33 HD11 LEU 33 2.263 9.748 -39.970 254 HD12 LEU 33 HD12 LEU 33 3.351 9.345 -38.642 255 HD13 LEU 33 HD13 LEU 33 2.482 10.879 -38.636 256 HD21 LEU 33 HD21 LEU 33 -0.827 9.449 -37.887 257 HD22 LEU 33 HD22 LEU 33 -0.258 9.792 -39.520 258 HD23 LEU 33 HD23 LEU 33 0.059 10.937 -38.217 259 H SER 34 HN SER 34 4.051 8.040 -36.728 260 HA SER 34 HA SER 34 5.844 8.039 -38.931 261 HB2 SER 34 HB2 SER 34 5.881 9.728 -37.083 262 HB3 SER 34 HB1 SER 34 6.515 8.482 -36.008 263 HG SER 34 HG SER 34 8.180 9.756 -36.910 264 H SER 35 HN SER 35 5.459 5.990 -36.093 265 HA SER 35 HA SER 35 7.786 4.424 -36.573 266 HB2 SER 35 HB2 SER 35 5.288 3.743 -35.000 267 HB3 SER 35 HB1 SER 35 6.822 2.878 -34.921 268 HG SER 35 HG SER 35 6.188 5.475 -34.008 269 H ALA 36 HN ALA 36 4.336 3.974 -37.312 270 HA ALA 36 HA ALA 36 4.730 1.360 -38.398 271 HB1 ALA 36 HB1 ALA 36 2.645 2.033 -37.310 272 HB2 ALA 36 HB2 ALA 36 2.375 1.431 -38.946 273 HB3 ALA 36 HB3 ALA 36 2.333 3.165 -38.624 274 H LEU 37 HN LEU 37 3.821 4.469 -39.930 275 HA LEU 37 HA LEU 37 4.072 3.308 -42.563 276 HB2 LEU 37 HB2 LEU 37 3.633 6.181 -41.737 277 HB3 LEU 37 HB1 LEU 37 3.497 5.558 -43.370 278 HG LEU 37 HG LEU 37 1.728 4.770 -41.051 279 HD11 LEU 37 HD11 LEU 37 1.178 6.527 -43.440 280 HD12 LEU 37 HD12 LEU 37 1.325 7.062 -41.765 281 HD13 LEU 37 HD13 LEU 37 -0.011 6.014 -42.241 282 HD21 LEU 37 HD21 LEU 37 2.008 2.961 -42.663 283 HD22 LEU 37 HD22 LEU 37 1.574 4.054 -43.978 284 HD23 LEU 37 HD23 LEU 37 0.381 3.637 -42.747 285 H LYS 38 HN LYS 38 5.880 5.406 -40.466 286 HA LYS 38 HA LYS 38 8.018 6.095 -40.415 287 HB2 LYS 38 HB2 LYS 38 8.256 3.565 -40.695 288 HB3 LYS 38 HB1 LYS 38 8.674 3.907 -42.369 289 HG2 LYS 38 HG2 LYS 38 10.597 5.153 -41.712 290 HG3 LYS 38 HG1 LYS 38 10.122 5.091 -40.014 291 HD2 LYS 38 HD2 LYS 38 10.925 2.749 -41.737 292 HD3 LYS 38 HD1 LYS 38 11.884 3.481 -40.450 293 HE2 LYS 38 HE2 LYS 38 9.254 2.034 -40.153 294 HE3 LYS 38 HE1 LYS 38 10.837 1.460 -39.635 295 HZ1 LYS 38 HZ1 LYS 38 9.587 2.331 -37.773 296 HZ2 LYS 38 HZ2 LYS 38 9.400 3.819 -38.550 297 HZ3 LYS 38 HZ3 LYS 38 10.940 3.313 -38.062 298 HA PRO 39 HA PRO 39 7.953 8.396 -44.350 299 HB2 PRO 39 HB2 PRO 39 7.600 10.835 -42.969 300 HB3 PRO 39 HB1 PRO 39 6.370 9.936 -43.855 301 HG2 PRO 39 HG2 PRO 39 6.436 10.359 -41.084 302 HG3 PRO 39 HG1 PRO 39 5.416 9.193 -41.940 303 HD2 PRO 39 HD2 PRO 39 7.980 8.761 -40.486 304 HD3 PRO 39 HD1 PRO 39 6.580 7.680 -40.660 305 H THR 40 HN THR 40 9.607 9.552 -45.236 306 HA THR 40 HA THR 40 12.018 9.854 -43.669 307 HB THR 40 HB THR 40 12.536 10.947 -46.155 308 HG1 THR 40 HG1 THR 40 10.889 8.670 -46.608 309 HG21 THR 40 HG21 THR 40 13.600 8.788 -46.639 310 HG22 THR 40 HG22 THR 40 12.696 8.048 -45.318 311 HG23 THR 40 HG23 THR 40 13.901 9.291 -44.976 312 H PHE 41 HN PHE 41 9.417 11.766 -44.874 313 HA PHE 41 HA PHE 41 10.407 13.983 -43.254 314 HB2 PHE 41 HB2 PHE 41 10.941 14.558 -45.620 315 HB3 PHE 41 HB1 PHE 41 9.235 14.382 -46.022 316 HD1 PHE 41 HD1 PHE 41 11.719 16.429 -44.273 317 HD2 PHE 41 HD2 PHE 41 7.628 16.062 -45.387 318 HE1 PHE 41 HE1 PHE 41 11.343 18.780 -43.652 319 HE2 PHE 41 HE2 PHE 41 7.244 18.413 -44.766 320 HZ PHE 41 HZ PHE 41 9.103 19.774 -43.898 321 H LEU 42 HN LEU 42 8.871 14.659 -41.898 322 HA LEU 42 HA LEU 42 6.058 14.309 -42.601 323 HB2 LEU 42 HB2 LEU 42 6.711 12.286 -41.371 324 HB3 LEU 42 HB1 LEU 42 7.308 13.276 -40.053 325 HG LEU 42 HG LEU 42 4.965 14.125 -39.737 326 HD11 LEU 42 HD11 LEU 42 4.087 13.617 -41.944 327 HD12 LEU 42 HD12 LEU 42 3.144 12.800 -40.698 328 HD13 LEU 42 HD13 LEU 42 4.314 11.892 -41.655 329 HD21 LEU 42 HD21 LEU 42 5.902 12.415 -38.294 330 HD22 LEU 42 HD22 LEU 42 5.438 11.162 -39.444 331 HD23 LEU 42 HD23 LEU 42 4.197 12.088 -38.601 332 H GLU 43 HN GLU 43 4.856 16.020 -41.982 333 HA GLU 43 HA GLU 43 5.593 17.492 -39.591 334 HB2 GLU 43 HB2 GLU 43 6.822 18.741 -41.275 335 HB3 GLU 43 HB1 GLU 43 5.384 18.859 -42.284 336 HG2 GLU 43 HG2 GLU 43 4.300 20.272 -40.691 337 HG3 GLU 43 HG1 GLU 43 5.590 20.022 -39.520 338 H LEU 44 HN LEU 44 3.876 18.348 -38.541 339 HA LEU 44 HA LEU 44 1.238 17.741 -39.612 340 HB2 LEU 44 HB2 LEU 44 2.122 18.805 -36.923 341 HB3 LEU 44 HB1 LEU 44 0.449 18.545 -37.363 342 HG LEU 44 HG LEU 44 1.109 16.706 -36.019 343 HD11 LEU 44 HD11 LEU 44 1.154 15.848 -38.902 344 HD12 LEU 44 HD12 LEU 44 -0.276 16.081 -37.896 345 HD13 LEU 44 HD13 LEU 44 0.868 14.791 -37.520 346 HD21 LEU 44 HD21 LEU 44 3.472 16.360 -37.855 347 HD22 LEU 44 HD22 LEU 44 3.028 15.281 -36.532 348 HD23 LEU 44 HD23 LEU 44 3.516 16.941 -36.190 349 H VAL 45 HN VAL 45 0.018 19.192 -40.593 350 HA VAL 45 HA VAL 45 0.876 21.997 -40.514 351 HB VAL 45 HB VAL 45 -0.932 20.619 -42.516 352 HG11 VAL 45 HG11 VAL 45 -0.644 22.648 -43.857 353 HG12 VAL 45 HG12 VAL 45 0.291 23.376 -42.549 354 HG13 VAL 45 HG13 VAL 45 -1.414 22.997 -42.308 355 HG21 VAL 45 HG21 VAL 45 0.964 20.799 -44.059 356 HG22 VAL 45 HG22 VAL 45 1.348 19.790 -42.665 357 HG23 VAL 45 HG23 VAL 45 1.960 21.441 -42.753 358 H ASP 46 HN ASP 46 -0.456 23.572 -39.900 359 HA ASP 46 HA ASP 46 -2.434 22.868 -37.997 360 HB2 ASP 46 HB2 ASP 46 -0.821 24.856 -37.963 361 HB3 ASP 46 HB1 ASP 46 -1.933 25.636 -39.083 362 H LYS 47 HN LYS 47 -4.331 22.077 -38.702 363 HA LYS 47 HA LYS 47 -5.622 23.332 -40.998 364 HB2 LYS 47 HB2 LYS 47 -5.461 20.839 -40.876 365 HB3 LYS 47 HB1 LYS 47 -6.495 20.881 -39.454 366 HG2 LYS 47 HG2 LYS 47 -7.849 20.322 -41.324 367 HG3 LYS 47 HG1 LYS 47 -8.247 21.975 -40.854 368 HD2 LYS 47 HD2 LYS 47 -8.100 22.000 -43.208 369 HD3 LYS 47 HD1 LYS 47 -6.597 22.723 -42.631 370 HE2 LYS 47 HE2 LYS 47 -5.449 20.586 -42.943 371 HE3 LYS 47 HE1 LYS 47 -6.952 19.860 -43.514 372 HZ1 LYS 47 HZ1 LYS 47 -5.834 20.411 -45.447 373 HZ2 LYS 47 HZ2 LYS 47 -5.251 21.873 -44.840 374 HZ3 LYS 47 HZ3 LYS 47 -6.889 21.723 -45.256 375 H SER 48 HN SER 48 -5.815 25.262 -39.567 376 HA SER 48 HA SER 48 -7.677 25.273 -37.430 377 HB2 SER 48 HB2 SER 48 -5.937 27.017 -37.741 378 HB3 SER 48 HB1 SER 48 -6.788 27.588 -39.174 379 HG SER 48 HG SER 48 -8.650 27.759 -37.590 380 H CYS 49 HN CYS 49 -8.024 25.166 -40.810 381 HA CYS 49 HA CYS 49 -10.852 25.920 -40.637 382 HB2 CYS 49 HB2 CYS 49 -9.594 27.020 -42.435 383 HB3 CYS 49 HB1 CYS 49 -9.097 25.452 -43.062 384 HG CYS 49 HG CYS 49 -11.351 24.796 -44.273 385 H GLY 50 HN GLY 50 -11.717 24.093 -39.699 386 HA2 GLY 50 HA2 GLY 50 -12.175 21.862 -41.414 387 HA3 GLY 50 HA1 GLY 50 -11.047 21.459 -40.127 388 H CYS 51 HN CYS 51 -12.295 20.114 -38.930 389 HA CYS 51 HA CYS 51 -14.878 21.168 -37.990 390 HB2 CYS 51 HB2 CYS 51 -13.927 18.296 -38.001 391 HB3 CYS 51 HB1 CYS 51 -15.535 18.866 -37.563 392 HG CYS 51 HG CYS 51 -15.554 20.043 -40.376 393 H GLY 52 HN GLY 52 -13.775 22.448 -36.393 394 HA2 GLY 52 HA2 GLY 52 -13.273 22.813 -34.178 395 HA3 GLY 52 HA1 GLY 52 -13.556 21.104 -33.881 396 H THR 53 HN THR 53 -11.846 19.642 -34.092 397 HA THR 53 HA THR 53 -9.183 20.885 -34.178 398 HB THR 53 HB THR 53 -9.966 18.365 -32.695 399 HG1 THR 53 HG1 THR 53 -9.789 19.698 -30.831 400 HG21 THR 53 HG21 THR 53 -7.615 18.413 -33.387 401 HG22 THR 53 HG22 THR 53 -7.759 18.604 -31.640 402 HG23 THR 53 HG23 THR 53 -7.426 20.006 -32.656 403 H SER 54 HN SER 54 -8.507 20.563 -36.195 404 HA SER 54 HA SER 54 -8.583 17.826 -37.261 405 HB2 SER 54 HB2 SER 54 -8.972 20.350 -38.893 406 HB3 SER 54 HB1 SER 54 -9.080 18.687 -39.471 407 HG SER 54 HG SER 54 -10.717 19.297 -37.333 408 H PHE 55 HN PHE 55 -6.798 17.250 -38.572 409 HA PHE 55 HA PHE 55 -4.576 19.163 -38.647 410 HB2 PHE 55 HB2 PHE 55 -4.416 16.336 -37.586 411 HB3 PHE 55 HB1 PHE 55 -3.009 17.310 -37.998 412 HD1 PHE 55 HD1 PHE 55 -2.676 19.505 -36.759 413 HD2 PHE 55 HD2 PHE 55 -5.405 16.497 -35.483 414 HE1 PHE 55 HE1 PHE 55 -2.678 20.472 -34.495 415 HE2 PHE 55 HE2 PHE 55 -5.413 17.461 -33.220 416 HZ PHE 55 HZ PHE 55 -4.048 19.449 -32.724 417 H ASP 56 HN ASP 56 -3.257 18.993 -40.410 418 HA ASP 56 HA ASP 56 -3.841 16.800 -42.301 419 HB2 ASP 56 HB2 ASP 56 -4.669 19.027 -43.083 420 HB3 ASP 56 HB1 ASP 56 -3.019 19.631 -42.999 421 H ALA 57 HN ALA 57 -2.116 15.491 -42.507 422 HA ALA 57 HA ALA 57 0.462 16.580 -41.595 423 HB1 ALA 57 HB1 ALA 57 -0.449 13.709 -41.678 424 HB2 ALA 57 HB2 ALA 57 -0.436 14.747 -40.253 425 HB3 ALA 57 HB3 ALA 57 1.082 14.301 -41.032 426 H VAL 58 HN VAL 58 1.912 16.983 -43.091 427 HA VAL 58 HA VAL 58 1.775 15.840 -45.722 428 HB VAL 58 HB VAL 58 4.004 17.435 -44.438 429 HG11 VAL 58 HG11 VAL 58 4.793 16.147 -46.356 430 HG12 VAL 58 HG12 VAL 58 4.744 17.867 -46.742 431 HG13 VAL 58 HG13 VAL 58 3.483 16.792 -47.344 432 HG21 VAL 58 HG21 VAL 58 3.092 19.333 -45.686 433 HG22 VAL 58 HG22 VAL 58 1.930 18.700 -44.522 434 HG23 VAL 58 HG23 VAL 58 1.754 18.326 -46.237 435 H ILE 59 HN ILE 59 2.318 13.804 -46.074 436 HA ILE 59 HA ILE 59 4.467 12.639 -44.452 437 HB ILE 59 HB ILE 59 2.400 11.574 -43.889 438 HG12 ILE 59 HG12 ILE 59 4.567 10.176 -44.448 439 HG13 ILE 59 HG11 ILE 59 3.064 9.378 -44.013 440 HG21 ILE 59 HG21 ILE 59 0.987 10.418 -45.519 441 HG22 ILE 59 HG22 ILE 59 1.991 11.054 -46.822 442 HG23 ILE 59 HG23 ILE 59 1.066 12.157 -45.804 443 HD11 ILE 59 HD11 ILE 59 4.121 9.767 -46.808 444 HD12 ILE 59 HD12 ILE 59 2.608 8.967 -46.382 445 HD13 ILE 59 HD13 ILE 59 4.147 8.269 -45.879 446 H VAL 60 HN VAL 60 6.237 12.596 -45.550 447 HA VAL 60 HA VAL 60 6.200 11.781 -48.378 448 HB VAL 60 HB VAL 60 8.372 13.165 -46.784 449 HG11 VAL 60 HG11 VAL 60 8.256 12.473 -49.713 450 HG12 VAL 60 HG12 VAL 60 9.312 11.735 -48.507 451 HG13 VAL 60 HG13 VAL 60 9.511 13.436 -48.933 452 HG21 VAL 60 HG21 VAL 60 6.475 14.627 -47.234 453 HG22 VAL 60 HG22 VAL 60 6.560 14.226 -48.950 454 HG23 VAL 60 HG23 VAL 60 7.880 15.109 -48.183 455 H SER 61 HN SER 61 6.449 9.617 -48.517 456 HA SER 61 HA SER 61 8.587 8.337 -47.035 457 HB2 SER 61 HB2 SER 61 6.811 8.234 -45.395 458 HB3 SER 61 HB1 SER 61 5.693 7.581 -46.593 459 HG SER 61 HG SER 61 7.227 6.208 -44.993 460 H ASN 62 HN ASN 62 9.073 6.238 -47.701 461 HA ASN 62 HA ASN 62 8.806 5.697 -50.448 462 HB2 ASN 62 HB2 ASN 62 9.881 4.223 -48.092 463 HB3 ASN 62 HB1 ASN 62 9.562 3.303 -49.558 464 HD21 ASN 62 HD21 ASN 62 10.478 6.638 -49.755 465 HD22 ASN 62 HD22 ASN 62 12.076 6.377 -50.365 466 H ASN 63 HN ASN 63 6.679 5.037 -47.828 467 HA ASN 63 HA ASN 63 5.456 2.686 -48.800 468 HB2 ASN 63 HB2 ASN 63 3.706 3.081 -47.225 469 HB3 ASN 63 HB1 ASN 63 5.204 3.613 -46.476 470 HD21 ASN 63 HD21 ASN 63 2.477 4.349 -45.852 471 HD22 ASN 63 HD22 ASN 63 2.383 6.064 -46.020 472 H PHE 64 HN PHE 64 5.085 6.028 -49.695 473 HA PHE 64 HA PHE 64 2.735 5.459 -51.322 474 HB2 PHE 64 HB2 PHE 64 2.957 7.618 -50.087 475 HB3 PHE 64 HB1 PHE 64 4.346 8.013 -51.092 476 HD1 PHE 64 HD2 PHE 64 0.774 6.988 -51.458 477 HD2 PHE 64 HD1 PHE 64 3.999 9.339 -52.936 478 HE1 PHE 64 HE2 PHE 64 -0.726 7.989 -53.132 479 HE2 PHE 64 HE1 PHE 64 2.505 10.345 -54.612 480 HZ PHE 64 HZ PHE 64 0.138 9.669 -54.711 481 H GLU 65 HN GLU 65 6.072 5.258 -51.553 482 HA GLU 65 HA GLU 65 6.255 5.786 -54.393 483 HB2 GLU 65 HB2 GLU 65 8.241 6.486 -53.564 484 HB3 GLU 65 HB1 GLU 65 8.054 5.553 -52.090 485 HG2 GLU 65 HG2 GLU 65 9.961 4.687 -53.035 486 HG3 GLU 65 HG1 GLU 65 8.702 3.551 -53.511 487 H ASP 66 HN ASP 66 5.421 3.312 -52.320 488 HA ASP 66 HA ASP 66 6.401 0.995 -53.582 489 HB2 ASP 66 HB2 ASP 66 5.309 1.199 -51.294 490 HB3 ASP 66 HB1 ASP 66 3.761 1.256 -52.126 491 H LYS 67 HN LYS 67 3.962 3.230 -54.435 492 HA LYS 67 HA LYS 67 2.875 3.575 -56.393 493 HB2 LYS 67 HB2 LYS 67 3.922 0.878 -57.266 494 HB3 LYS 67 HB1 LYS 67 3.062 2.015 -58.291 495 HG2 LYS 67 HG2 LYS 67 5.776 2.386 -57.044 496 HG3 LYS 67 HG1 LYS 67 5.401 2.172 -58.754 497 HD2 LYS 67 HD2 LYS 67 4.138 4.299 -58.702 498 HD3 LYS 67 HD1 LYS 67 4.625 4.517 -57.021 499 HE2 LYS 67 HE2 LYS 67 6.389 4.458 -59.462 500 HE3 LYS 67 HE1 LYS 67 6.102 5.814 -58.373 501 HZ1 LYS 67 HZ1 LYS 67 7.120 4.339 -56.596 502 HZ2 LYS 67 HZ2 LYS 67 8.172 4.961 -57.759 503 HZ3 LYS 67 HZ3 LYS 67 7.663 3.350 -57.862 504 H LYS 68 HN LYS 68 2.463 0.587 -54.668 505 HA LYS 68 HA LYS 68 -0.093 -0.075 -55.736 506 HB2 LYS 68 HB2 LYS 68 1.115 -0.847 -53.071 507 HB3 LYS 68 HB1 LYS 68 -0.246 -1.633 -53.857 508 HG2 LYS 68 HG2 LYS 68 2.496 -1.483 -55.074 509 HG3 LYS 68 HG1 LYS 68 1.954 -2.816 -54.053 510 HD2 LYS 68 HD2 LYS 68 0.452 -1.951 -56.508 511 HD3 LYS 68 HD1 LYS 68 1.761 -3.135 -56.568 512 HE2 LYS 68 HE2 LYS 68 0.556 -4.530 -54.952 513 HE3 LYS 68 HE1 LYS 68 -0.755 -3.350 -54.919 514 HZ1 LYS 68 HZ1 LYS 68 0.117 -4.634 -57.438 515 HZ2 LYS 68 HZ2 LYS 68 -1.349 -3.845 -57.105 516 HZ3 LYS 68 HZ3 LYS 68 -1.026 -5.358 -56.418 517 H LEU 69 HN LEU 69 -1.631 1.474 -55.626 518 HA LEU 69 HA LEU 69 -1.756 3.331 -53.477 519 HB2 LEU 69 HB2 LEU 69 -3.856 4.111 -54.559 520 HB3 LEU 69 HB1 LEU 69 -2.456 4.094 -55.608 521 HG LEU 69 HG LEU 69 -3.432 1.748 -56.334 522 HD11 LEU 69 HD11 LEU 69 -5.872 1.752 -56.373 523 HD12 LEU 69 HD12 LEU 69 -5.890 3.221 -55.396 524 HD13 LEU 69 HD13 LEU 69 -5.257 1.720 -54.721 525 HD21 LEU 69 HD21 LEU 69 -4.566 4.386 -57.250 526 HD22 LEU 69 HD22 LEU 69 -4.594 2.875 -58.160 527 HD23 LEU 69 HD23 LEU 69 -3.056 3.658 -57.798 528 H LEU 70 HN LEU 70 -3.517 0.369 -54.226 529 HA LEU 70 HA LEU 70 -5.439 0.730 -52.177 530 HB2 LEU 70 HB2 LEU 70 -6.147 -1.517 -52.534 531 HB3 LEU 70 HB1 LEU 70 -5.841 -0.768 -54.077 532 HG LEU 70 HG LEU 70 -5.141 -2.988 -54.283 533 HD11 LEU 70 HD11 LEU 70 -2.717 -2.903 -54.622 534 HD12 LEU 70 HD12 LEU 70 -2.680 -1.347 -53.799 535 HD13 LEU 70 HD13 LEU 70 -3.568 -1.522 -55.309 536 HD21 LEU 70 HD21 LEU 70 -5.104 -3.625 -51.959 537 HD22 LEU 70 HD22 LEU 70 -3.612 -2.717 -51.709 538 HD23 LEU 70 HD23 LEU 70 -3.618 -4.132 -52.761 539 H ASP 71 HN ASP 71 -2.220 -0.632 -52.205 540 HA ASP 71 HA ASP 71 -2.418 -1.728 -49.574 541 HB2 ASP 71 HB2 ASP 71 -0.116 -1.216 -51.434 542 HB3 ASP 71 HB1 ASP 71 0.165 -1.687 -49.760 543 H ARG 72 HN ARG 72 -1.223 1.274 -50.969 544 HA ARG 72 HA ARG 72 -0.365 2.541 -48.638 545 HB2 ARG 72 HB2 ARG 72 -0.073 3.439 -50.927 546 HB3 ARG 72 HB1 ARG 72 -1.797 3.746 -51.023 547 HG2 ARG 72 HG2 ARG 72 -0.182 5.006 -48.852 548 HG3 ARG 72 HG1 ARG 72 -0.149 5.676 -50.481 549 HD2 ARG 72 HD2 ARG 72 -2.569 5.299 -48.721 550 HD3 ARG 72 HD1 ARG 72 -1.812 6.827 -49.165 551 HE ARG 72 HE ARG 72 -3.343 5.076 -50.971 552 HH11 ARG 72 HH11 ARG 72 -1.895 8.173 -50.248 553 HH12 ARG 72 HH12 ARG 72 -2.679 8.995 -51.557 554 HH21 ARG 72 HH21 ARG 72 -4.405 6.169 -52.691 555 HH22 ARG 72 HH22 ARG 72 -4.095 7.862 -52.947 556 H HIS 73 HN HIS 73 -3.580 2.234 -50.050 557 HA HIS 73 HA HIS 73 -4.987 3.814 -48.196 558 HB2 HIS 73 HB2 HIS 73 -5.858 3.110 -50.405 559 HB3 HIS 73 HB1 HIS 73 -5.971 1.457 -49.822 560 HD1 HIS 73 HD1 HIS 73 -7.729 4.704 -49.831 561 HD2 HIS 73 HD2 HIS 73 -8.086 1.010 -47.951 562 HE1 HIS 73 HE1 HIS 73 -10.047 4.661 -48.845 563 HE2 HIS 73 HE2 HIS 73 -10.301 2.346 -47.869 564 H ARG 74 HN ARG 74 -4.555 0.275 -48.350 565 HA ARG 74 HA ARG 74 -6.086 -0.273 -46.052 566 HB2 ARG 74 HB2 ARG 74 -5.194 -2.522 -46.172 567 HB3 ARG 74 HB1 ARG 74 -5.580 -1.951 -47.788 568 HG2 ARG 74 HG2 ARG 74 -3.111 -1.326 -47.963 569 HG3 ARG 74 HG1 ARG 74 -2.889 -2.325 -46.528 570 HD2 ARG 74 HD2 ARG 74 -4.160 -3.277 -49.087 571 HD3 ARG 74 HD1 ARG 74 -2.462 -3.505 -48.676 572 HE ARG 74 HE ARG 74 -4.354 -4.528 -46.729 573 HH11 ARG 74 HH11 ARG 74 -2.300 -5.171 -49.497 574 HH12 ARG 74 HH12 ARG 74 -2.375 -6.904 -49.316 575 HH21 ARG 74 HH21 ARG 74 -4.432 -6.817 -46.470 576 HH22 ARG 74 HH22 ARG 74 -3.570 -7.834 -47.588 577 H LEU 75 HN LEU 75 -2.627 0.368 -46.449 578 HA LEU 75 HA LEU 75 -1.849 -0.351 -43.834 579 HB2 LEU 75 HB2 LEU 75 -0.666 1.145 -46.069 580 HB3 LEU 75 HB1 LEU 75 -0.101 1.647 -44.487 581 HG LEU 75 HG LEU 75 1.389 -0.019 -45.465 582 HD11 LEU 75 HD11 LEU 75 1.441 -1.595 -43.599 583 HD12 LEU 75 HD12 LEU 75 -0.177 -1.082 -43.121 584 HD13 LEU 75 HD13 LEU 75 1.168 0.057 -43.047 585 HD21 LEU 75 HD21 LEU 75 -1.009 -1.847 -45.420 586 HD22 LEU 75 HD22 LEU 75 0.646 -2.323 -45.805 587 HD23 LEU 75 HD23 LEU 75 -0.219 -1.206 -46.861 588 H VAL 76 HN VAL 76 -2.693 2.812 -45.218 589 HA VAL 76 HA VAL 76 -2.525 4.302 -42.860 590 HB VAL 76 HB VAL 76 -4.326 4.706 -45.259 591 HG11 VAL 76 HG11 VAL 76 -5.236 5.885 -43.328 592 HG12 VAL 76 HG12 VAL 76 -4.571 7.020 -44.503 593 HG13 VAL 76 HG13 VAL 76 -3.667 6.639 -43.037 594 HG21 VAL 76 HG21 VAL 76 -1.956 4.770 -45.789 595 HG22 VAL 76 HG22 VAL 76 -1.683 5.943 -44.500 596 HG23 VAL 76 HG23 VAL 76 -2.657 6.386 -45.902 597 H ASN 77 HN ASN 77 -5.213 2.459 -44.246 598 HA ASN 77 HA ASN 77 -7.132 3.181 -42.305 599 HB2 ASN 77 HB2 ASN 77 -6.898 0.934 -44.276 600 HB3 ASN 77 HB1 ASN 77 -8.166 0.891 -43.056 601 HD21 ASN 77 HD21 ASN 77 -7.011 3.897 -44.395 602 HD22 ASN 77 HD22 ASN 77 -8.440 4.267 -45.302 603 H THR 78 HN THR 78 -4.684 0.645 -42.368 604 HA THR 78 HA THR 78 -5.681 -0.911 -40.251 605 HB THR 78 HB THR 78 -2.794 -0.539 -41.086 606 HG1 THR 78 HG1 THR 78 -4.322 -1.359 -42.716 607 HG21 THR 78 HG21 THR 78 -2.979 -1.539 -38.861 608 HG22 THR 78 HG22 THR 78 -2.425 -2.729 -40.039 609 HG23 THR 78 HG23 THR 78 -4.100 -2.747 -39.489 610 H ILE 79 HN ILE 79 -3.238 1.698 -40.215 611 HA ILE 79 HA ILE 79 -3.021 1.560 -37.339 612 HB ILE 79 HB ILE 79 -1.814 3.436 -39.371 613 HG12 ILE 79 HG12 ILE 79 0.317 2.378 -38.422 614 HG13 ILE 79 HG11 ILE 79 -0.738 1.191 -37.665 615 HG21 ILE 79 HG21 ILE 79 -0.481 4.404 -37.553 616 HG22 ILE 79 HG22 ILE 79 -1.412 3.470 -36.382 617 HG23 ILE 79 HG23 ILE 79 -2.205 4.716 -37.346 618 HD11 ILE 79 HD11 ILE 79 -0.472 1.711 -40.618 619 HD12 ILE 79 HD12 ILE 79 -1.555 0.533 -39.876 620 HD13 ILE 79 HD13 ILE 79 0.192 0.339 -39.729 621 H LEU 80 HN LEU 80 -4.333 3.884 -39.684 622 HA LEU 80 HA LEU 80 -5.121 5.690 -37.618 623 HB2 LEU 80 HB2 LEU 80 -5.590 5.636 -40.580 624 HB3 LEU 80 HB1 LEU 80 -6.375 6.820 -39.553 625 HG LEU 80 HG LEU 80 -4.057 7.513 -38.772 626 HD11 LEU 80 HD11 LEU 80 -3.207 5.887 -41.160 627 HD12 LEU 80 HD12 LEU 80 -2.836 5.527 -39.474 628 HD13 LEU 80 HD13 LEU 80 -2.183 6.981 -40.230 629 HD21 LEU 80 HD21 LEU 80 -5.360 8.835 -40.339 630 HD22 LEU 80 HD22 LEU 80 -4.762 7.859 -41.681 631 HD23 LEU 80 HD23 LEU 80 -3.649 8.872 -40.763 632 H LYS 81 HN LYS 81 -6.435 2.806 -38.620 633 HA LYS 81 HA LYS 81 -9.169 3.112 -38.452 634 HB2 LYS 81 HB2 LYS 81 -8.047 0.939 -38.793 635 HB3 LYS 81 HB1 LYS 81 -7.466 0.976 -37.136 636 HG2 LYS 81 HG2 LYS 81 -9.306 -0.504 -37.198 637 HG3 LYS 81 HG1 LYS 81 -9.855 0.965 -36.390 638 HD2 LYS 81 HD2 LYS 81 -10.969 1.709 -38.391 639 HD3 LYS 81 HD1 LYS 81 -10.305 0.356 -39.309 640 HE2 LYS 81 HE2 LYS 81 -11.519 -1.194 -37.796 641 HE3 LYS 81 HE1 LYS 81 -12.261 0.204 -37.020 642 HZ1 LYS 81 HZ1 LYS 81 -13.669 -0.844 -38.731 643 HZ2 LYS 81 HZ2 LYS 81 -12.517 -0.445 -39.907 644 HZ3 LYS 81 HZ3 LYS 81 -13.332 0.781 -39.064 645 H GLU 82 HN GLU 82 -7.079 2.331 -35.671 646 HA GLU 82 HA GLU 82 -9.005 3.314 -33.794 647 HB2 GLU 82 HB2 GLU 82 -7.212 2.927 -32.111 648 HB3 GLU 82 HB1 GLU 82 -7.503 1.518 -33.121 649 HG2 GLU 82 HG2 GLU 82 -5.478 1.656 -34.148 650 HG3 GLU 82 HG1 GLU 82 -5.379 3.406 -33.970 651 H GLU 83 HN GLU 83 -6.157 4.591 -35.389 652 HA GLU 83 HA GLU 83 -5.494 6.671 -33.688 653 HB2 GLU 83 HB2 GLU 83 -4.242 5.925 -35.705 654 HB3 GLU 83 HB1 GLU 83 -5.430 6.768 -36.695 655 HG2 GLU 83 HG2 GLU 83 -3.628 8.204 -36.488 656 HG3 GLU 83 HG1 GLU 83 -4.859 8.836 -35.406 657 H LEU 84 HN LEU 84 -7.567 6.859 -36.539 658 HA LEU 84 HA LEU 84 -8.435 9.443 -36.388 659 HB2 LEU 84 HB2 LEU 84 -10.036 7.030 -37.218 660 HB3 LEU 84 HB1 LEU 84 -10.543 8.685 -37.493 661 HG LEU 84 HG LEU 84 -8.126 7.323 -38.677 662 HD11 LEU 84 HD11 LEU 84 -10.669 8.349 -39.927 663 HD12 LEU 84 HD12 LEU 84 -10.232 6.657 -39.686 664 HD13 LEU 84 HD13 LEU 84 -9.296 7.661 -40.795 665 HD21 LEU 84 HD21 LEU 84 -7.638 9.670 -38.174 666 HD22 LEU 84 HD22 LEU 84 -9.092 10.160 -39.043 667 HD23 LEU 84 HD23 LEU 84 -7.761 9.396 -39.913 668 H GLN 85 HN GLN 85 -9.482 6.806 -34.313 669 HA GLN 85 HA GLN 85 -11.897 7.881 -33.376 670 HB2 GLN 85 HB2 GLN 85 -9.927 6.337 -31.683 671 HB3 GLN 85 HB1 GLN 85 -11.656 6.485 -31.423 672 HG2 GLN 85 HG2 GLN 85 -10.180 4.843 -33.432 673 HG3 GLN 85 HG1 GLN 85 -11.393 4.346 -32.258 674 HE21 GLN 85 HE21 GLN 85 -10.780 5.486 -35.403 675 HE22 GLN 85 HE22 GLN 85 -12.402 5.466 -35.966 676 H ASN 86 HN ASN 86 -8.644 8.838 -32.818 677 HA ASN 86 HA ASN 86 -9.247 10.256 -30.343 678 HB2 ASN 86 HB2 ASN 86 -6.668 9.947 -31.894 679 HB3 ASN 86 HB1 ASN 86 -6.818 10.736 -30.328 680 HD21 ASN 86 HD21 ASN 86 -5.426 8.256 -31.384 681 HD22 ASN 86 HD22 ASN 86 -5.863 7.026 -30.249 682 H ILE 87 HN ILE 87 -9.381 10.895 -33.635 683 HA ILE 87 HA ILE 87 -8.962 13.786 -33.190 684 HB ILE 87 HB ILE 87 -8.666 12.533 -35.908 685 HG12 ILE 87 HG12 ILE 87 -6.514 12.716 -33.786 686 HG13 ILE 87 HG11 ILE 87 -7.150 11.250 -34.524 687 HG21 ILE 87 HG21 ILE 87 -7.478 14.992 -34.624 688 HG22 ILE 87 HG22 ILE 87 -8.817 14.954 -35.771 689 HG23 ILE 87 HG23 ILE 87 -7.201 14.469 -36.285 690 HD11 ILE 87 HD11 ILE 87 -6.205 11.905 -36.664 691 HD12 ILE 87 HD12 ILE 87 -4.965 11.824 -35.413 692 HD13 ILE 87 HD13 ILE 87 -5.585 13.388 -35.942 693 H HIS 88 HN HIS 88 -10.304 15.166 -34.663 694 HA HIS 88 HA HIS 88 -12.928 13.952 -35.063 695 HB2 HIS 88 HB2 HIS 88 -12.545 16.261 -33.973 696 HB3 HIS 88 HB1 HIS 88 -12.246 16.836 -35.610 697 HD1 HIS 88 HD1 HIS 88 -14.887 16.443 -33.230 698 HD2 HIS 88 HD2 HIS 88 -14.599 16.168 -37.373 699 HE1 HIS 88 HE1 HIS 88 -17.241 16.692 -34.097 700 HE2 HIS 88 HE2 HIS 88 -17.050 16.486 -36.606 701 H ALA 89 HN ALA 89 -10.455 15.712 -36.899 702 HA ALA 89 HA ALA 89 -11.193 14.192 -39.264 703 HB1 ALA 89 HB1 ALA 89 -11.351 16.162 -40.691 704 HB2 ALA 89 HB2 ALA 89 -11.131 17.209 -39.289 705 HB3 ALA 89 HB3 ALA 89 -12.576 16.206 -39.423 706 H PHE 90 HN PHE 90 -9.293 13.256 -39.686 707 HA PHE 90 HA PHE 90 -6.902 14.971 -39.730 708 HB2 PHE 90 HB2 PHE 90 -6.752 13.201 -38.043 709 HB3 PHE 90 HB1 PHE 90 -7.100 11.987 -39.267 710 HD1 PHE 90 HD1 PHE 90 -4.618 14.494 -38.175 711 HD2 PHE 90 HD2 PHE 90 -5.392 11.096 -40.615 712 HE1 PHE 90 HE1 PHE 90 -2.210 14.271 -38.621 713 HE2 PHE 90 HE2 PHE 90 -2.985 10.867 -41.067 714 HZ PHE 90 HZ PHE 90 -1.391 12.453 -40.070 715 H SER 91 HN SER 91 -6.008 15.306 -41.652 716 HA SER 91 HA SER 91 -6.434 13.293 -43.758 717 HB2 SER 91 HB2 SER 91 -6.318 15.198 -45.402 718 HB3 SER 91 HB1 SER 91 -7.749 15.220 -44.373 719 HG SER 91 HG SER 91 -5.421 16.835 -44.220 720 H MET 92 HN MET 92 -4.662 13.486 -45.490 721 HA MET 92 HA MET 92 -2.130 14.394 -44.368 722 HB2 MET 92 HB2 MET 92 -1.027 12.284 -44.623 723 HB3 MET 92 HB1 MET 92 -2.467 12.018 -43.655 724 HG2 MET 92 HG2 MET 92 -2.239 11.433 -46.599 725 HG3 MET 92 HG1 MET 92 -2.046 10.244 -45.316 726 HE1 MET 92 HE1 MET 92 -5.650 10.161 -43.764 727 HE2 MET 92 HE2 MET 92 -4.290 11.157 -43.249 728 HE3 MET 92 HE3 MET 92 -4.027 9.475 -43.706 729 H LYS 93 HN LYS 93 -0.572 14.876 -45.862 730 HA LYS 93 HA LYS 93 -1.399 14.852 -48.674 731 HB2 LYS 93 HB2 LYS 93 0.849 16.289 -47.240 732 HB3 LYS 93 HB1 LYS 93 0.594 16.355 -48.979 733 HG2 LYS 93 HG2 LYS 93 -1.440 17.239 -46.944 734 HG3 LYS 93 HG1 LYS 93 -0.284 18.317 -47.731 735 HD2 LYS 93 HD2 LYS 93 -1.218 17.818 -49.895 736 HD3 LYS 93 HD1 LYS 93 -2.279 16.592 -49.196 737 HE2 LYS 93 HE2 LYS 93 -2.367 19.537 -48.550 738 HE3 LYS 93 HE1 LYS 93 -3.447 18.715 -49.676 739 HZ1 LYS 93 HZ1 LYS 93 -3.220 18.253 -46.748 740 HZ2 LYS 93 HZ2 LYS 93 -4.130 17.274 -47.794 741 HZ3 LYS 93 HZ3 LYS 93 -4.545 18.903 -47.586 742 H CYS 94 HN CYS 94 -0.824 13.089 -49.739 743 HA CYS 94 HA CYS 94 1.391 11.479 -48.772 744 HB2 CYS 94 HB2 CYS 94 0.492 9.869 -50.558 745 HB3 CYS 94 HB1 CYS 94 -0.533 10.192 -49.163 746 HG CYS 94 HG CYS 94 -2.275 11.884 -50.477 747 H HIS 95 HN HIS 95 3.345 11.914 -49.510 748 HA HIS 95 HA HIS 95 3.709 12.301 -52.394 749 HB2 HIS 95 HB2 HIS 95 4.460 14.196 -50.228 750 HB3 HIS 95 HB1 HIS 95 5.624 13.965 -51.525 751 HD1 HIS 95 HD1 HIS 95 1.825 14.283 -51.740 752 HD2 HIS 95 HD2 HIS 95 5.289 16.126 -53.104 753 HE1 HIS 95 HE1 HIS 95 1.059 16.084 -53.310 754 HE2 HIS 95 HE2 HIS 95 3.176 16.988 -54.323 755 H THR 96 HN THR 96 5.857 11.800 -53.136 756 HA THR 96 HA THR 96 7.181 9.818 -51.436 757 HB THR 96 HB THR 96 8.390 9.187 -53.525 758 HG1 THR 96 HG1 THR 96 7.145 10.137 -55.471 759 HG21 THR 96 HG21 THR 96 6.471 8.155 -54.644 760 HG22 THR 96 HG22 THR 96 5.380 9.215 -53.749 761 HG23 THR 96 HG23 THR 96 6.347 8.014 -52.890 762 HA PRO 97 HA PRO 97 10.726 12.434 -50.717 763 HB2 PRO 97 HB2 PRO 97 12.737 10.568 -50.866 764 HB3 PRO 97 HB1 PRO 97 11.717 10.806 -49.445 765 HG2 PRO 97 HG2 PRO 97 11.508 8.755 -51.610 766 HG3 PRO 97 HG1 PRO 97 11.278 8.566 -49.862 767 HD2 PRO 97 HD2 PRO 97 9.198 8.736 -51.564 768 HD3 PRO 97 HD1 PRO 97 9.129 9.419 -49.925 769 H LEU 98 HN LEU 98 10.460 10.353 -53.461 770 HA LEU 98 HA LEU 98 12.639 11.338 -54.980 771 HB2 LEU 98 HB2 LEU 98 11.180 9.199 -55.263 772 HB3 LEU 98 HB1 LEU 98 10.095 10.246 -56.152 773 HG LEU 98 HG LEU 98 11.681 8.884 -57.547 774 HD11 LEU 98 HD11 LEU 98 10.582 10.860 -58.450 775 HD12 LEU 98 HD12 LEU 98 12.219 10.697 -59.087 776 HD13 LEU 98 HD13 LEU 98 11.879 11.879 -57.822 777 HD21 LEU 98 HD21 LEU 98 13.991 9.653 -57.715 778 HD22 LEU 98 HD22 LEU 98 13.628 9.063 -56.093 779 HD23 LEU 98 HD23 LEU 98 13.711 10.798 -56.404 780 H GLU 99 HN GLU 99 9.203 12.124 -54.803 781 HA GLU 99 HA GLU 99 9.337 14.260 -56.708 782 HB2 GLU 99 HB2 GLU 99 7.282 12.984 -56.332 783 HB3 GLU 99 HB1 GLU 99 7.238 13.518 -54.660 784 HG2 GLU 99 HG2 GLU 99 6.889 15.812 -55.388 785 HG3 GLU 99 HG1 GLU 99 6.966 15.295 -57.074 786 H TYR 100 HN TYR 100 9.463 13.948 -53.211 787 HA TYR 100 HA TYR 100 9.269 16.631 -52.476 788 HB2 TYR 100 HB2 TYR 100 9.187 14.813 -50.844 789 HB3 TYR 100 HB1 TYR 100 10.873 14.421 -51.169 790 HD1 TYR 100 HD1 TYR 100 8.711 17.217 -49.979 791 HD2 TYR 100 HD2 TYR 100 12.544 15.375 -49.858 792 HE1 TYR 100 HE1 TYR 100 9.407 18.795 -48.228 793 HE2 TYR 100 HE2 TYR 100 13.250 16.946 -48.104 794 HH TYR 100 HH TYR 100 11.068 18.930 -46.423 795 H ASP 101 HN ASP 101 11.972 14.796 -53.722 796 HA ASP 101 HA ASP 101 14.108 16.460 -53.199 797 HB2 ASP 101 HB2 ASP 101 14.510 14.355 -54.228 798 HB3 ASP 101 HB1 ASP 101 13.490 14.752 -55.605 799 H LYS 102 HN LYS 102 11.612 16.832 -55.662 800 HA LYS 102 HA LYS 102 12.908 19.082 -56.905 801 HB2 LYS 102 HB2 LYS 102 10.063 18.074 -57.140 802 HB3 LYS 102 HB1 LYS 102 10.739 19.374 -58.103 803 HG2 LYS 102 HG2 LYS 102 10.824 17.527 -59.508 804 HG3 LYS 102 HG1 LYS 102 12.467 17.641 -58.879 805 HD2 LYS 102 HD2 LYS 102 12.133 15.829 -57.405 806 HD3 LYS 102 HD1 LYS 102 10.383 15.882 -57.612 807 HE2 LYS 102 HE2 LYS 102 11.262 13.997 -58.821 808 HE3 LYS 102 HE1 LYS 102 10.678 15.199 -59.969 809 HZ1 LYS 102 HZ1 LYS 102 12.954 15.921 -60.329 810 HZ2 LYS 102 HZ2 LYS 102 12.801 14.261 -60.643 811 HZ3 LYS 102 HZ3 LYS 102 13.520 14.786 -59.204 812 H LEU 103 HN LEU 103 10.533 18.552 -54.411 813 HA LEU 103 HA LEU 103 9.531 21.240 -54.392 814 HB2 LEU 103 HB2 LEU 103 9.183 19.069 -52.328 815 HB3 LEU 103 HB1 LEU 103 8.217 20.524 -52.482 816 HG LEU 103 HG LEU 103 8.320 18.257 -54.474 817 HD11 LEU 103 HD11 LEU 103 6.163 19.116 -52.554 818 HD12 LEU 103 HD12 LEU 103 7.155 17.664 -52.424 819 HD13 LEU 103 HD13 LEU 103 6.022 17.840 -53.763 820 HD21 LEU 103 HD21 LEU 103 6.633 20.758 -54.456 821 HD22 LEU 103 HD22 LEU 103 6.496 19.424 -55.601 822 HD23 LEU 103 HD23 LEU 103 7.957 20.412 -55.566 823 H LYS 104 HN LYS 104 12.077 19.532 -52.757 824 HA LYS 104 HA LYS 104 12.361 21.531 -50.695 825 HB2 LYS 104 HB2 LYS 104 14.379 20.319 -50.049 826 HB3 LYS 104 HB1 LYS 104 13.033 19.208 -50.266 827 HG2 LYS 104 HG2 LYS 104 13.909 18.317 -52.209 828 HG3 LYS 104 HG1 LYS 104 14.944 19.714 -52.505 829 HD2 LYS 104 HD2 LYS 104 16.248 19.072 -50.473 830 HD3 LYS 104 HD1 LYS 104 15.290 17.590 -50.399 831 HE2 LYS 104 HE2 LYS 104 16.094 16.886 -52.536 832 HE3 LYS 104 HE1 LYS 104 16.886 18.441 -52.803 833 HZ1 LYS 104 HZ1 LYS 104 17.603 16.639 -50.559 834 HZ2 LYS 104 HZ2 LYS 104 18.469 17.975 -51.140 835 HZ3 LYS 104 HZ3 LYS 104 18.367 16.561 -52.072 836 H SER 105 HN SER 105 13.731 20.856 -53.836 837 HA SER 105 HA SER 105 15.946 22.592 -53.705 838 HB2 SER 105 HB2 SER 105 14.343 21.736 -56.132 839 HB3 SER 105 HB1 SER 105 15.974 22.409 -56.152 840 HG SER 105 HG SER 105 15.120 19.853 -55.561 841 H LYS 106 HN LYS 106 12.615 23.031 -54.787 842 HA LYS 106 HA LYS 106 12.693 25.775 -53.978 843 HB2 LYS 106 HB2 LYS 106 12.032 26.762 -56.132 844 HB3 LYS 106 HB1 LYS 106 13.649 26.080 -56.190 845 HG2 LYS 106 HG2 LYS 106 12.718 25.451 -58.200 846 HG3 LYS 106 HG1 LYS 106 12.516 24.018 -57.202 847 HD2 LYS 106 HD2 LYS 106 10.196 24.703 -56.752 848 HD3 LYS 106 HD1 LYS 106 10.418 26.083 -57.827 849 HE2 LYS 106 HE2 LYS 106 10.880 24.549 -59.685 850 HE3 LYS 106 HE1 LYS 106 10.637 23.175 -58.604 851 HZ1 LYS 106 HZ1 LYS 106 8.652 23.645 -59.906 852 HZ2 LYS 106 HZ2 LYS 106 8.595 25.222 -59.289 853 HZ3 LYS 106 HZ3 LYS 106 8.362 23.895 -58.256 854 H GLY 107 HN GLY 107 10.487 26.828 -54.733 855 HA2 GLY 107 HA2 GLY 107 8.486 24.822 -53.877 856 HA3 GLY 107 HA1 GLY 107 8.485 26.493 -53.336 857 H SER 108 HN SER 108 9.283 27.168 -56.247 858 HA SER 108 HA SER 108 6.854 26.635 -57.702 859 HB2 SER 108 HB2 SER 108 7.400 29.447 -56.707 860 HB3 SER 108 HB1 SER 108 6.158 29.006 -57.879 861 HG SER 108 HG SER 108 5.954 27.455 -55.691 Start of MODEL 17 1 H1 MET 1 HT1 MET 1 4.983 17.461 -35.426 2 H2 MET 1 HT2 MET 1 5.270 18.768 -36.474 3 H3 MET 1 HT3 MET 1 5.106 19.035 -34.805 4 HA MET 1 HA MET 1 7.305 17.600 -36.166 5 HB2 MET 1 HB2 MET 1 7.499 20.014 -36.324 6 HB3 MET 1 HB1 MET 1 7.167 20.192 -34.609 7 HG2 MET 1 HG2 MET 1 9.487 20.509 -34.916 8 HG3 MET 1 HG1 MET 1 9.272 18.938 -34.148 9 HE1 MET 1 HE1 MET 1 10.302 19.530 -38.607 10 HE2 MET 1 HE2 MET 1 10.117 20.849 -37.450 11 HE3 MET 1 HE3 MET 1 8.712 19.899 -37.936 12 H GLY 2 HN GLY 2 7.725 15.804 -35.014 13 HA2 GLY 2 HA2 GLY 2 8.727 15.971 -32.390 14 HA3 GLY 2 HA1 GLY 2 7.064 15.413 -32.318 15 H SER 3 HN SER 3 7.235 13.959 -34.859 16 HA SER 3 HA SER 3 8.251 11.507 -33.793 17 HB2 SER 3 HB2 SER 3 6.264 11.594 -35.267 18 HB3 SER 3 HB1 SER 3 7.294 12.116 -36.601 19 HG SER 3 HG SER 3 7.489 9.656 -35.168 20 H SER 4 HN SER 4 10.190 10.602 -34.035 21 HA SER 4 HA SER 4 12.279 11.959 -35.433 22 HB2 SER 4 HB2 SER 4 12.653 10.629 -33.347 23 HB3 SER 4 HB1 SER 4 12.315 9.162 -34.263 24 HG SER 4 HG SER 4 14.542 10.847 -34.315 25 H HIS 5 HN HIS 5 13.016 11.639 -37.437 26 HA HIS 5 HA HIS 5 11.419 9.850 -39.115 27 HB2 HIS 5 HB2 HIS 5 13.292 12.096 -39.890 28 HB3 HIS 5 HB1 HIS 5 12.252 11.194 -40.992 29 HD1 HIS 5 HD1 HIS 5 9.629 11.511 -40.616 30 HD2 HIS 5 HD2 HIS 5 12.086 14.193 -38.609 31 HE1 HIS 5 HE1 HIS 5 8.116 13.365 -39.834 32 HE2 HIS 5 HE2 HIS 5 9.587 14.817 -38.389 33 H HIS 6 HN HIS 6 13.795 9.092 -37.392 34 HA HIS 6 HA HIS 6 15.680 8.084 -39.332 35 HB2 HIS 6 HB2 HIS 6 15.381 7.615 -36.359 36 HB3 HIS 6 HB1 HIS 6 16.641 6.870 -37.339 37 HD1 HIS 6 HD1 HIS 6 15.714 10.032 -35.648 38 HD2 HIS 6 HD2 HIS 6 18.595 8.691 -38.333 39 HE1 HIS 6 HE1 HIS 6 17.460 11.839 -35.731 40 HE2 HIS 6 HE2 HIS 6 19.153 11.050 -37.423 41 H HIS 7 HN HIS 7 15.201 6.441 -40.582 42 HA HIS 7 HA HIS 7 12.912 4.798 -40.091 43 HB2 HIS 7 HB2 HIS 7 13.664 5.577 -42.352 44 HB3 HIS 7 HB1 HIS 7 15.033 4.480 -42.227 45 HD1 HIS 7 HD1 HIS 7 14.677 2.210 -43.163 46 HD2 HIS 7 HD2 HIS 7 11.090 4.129 -42.297 47 HE1 HIS 7 HE1 HIS 7 12.867 0.684 -44.013 48 HE2 HIS 7 HE2 HIS 7 10.719 1.962 -43.665 49 H HIS 8 HN HIS 8 13.513 3.810 -38.092 50 HA HIS 8 HA HIS 8 15.591 1.752 -38.243 51 HB2 HIS 8 HB2 HIS 8 13.943 2.771 -35.921 52 HB3 HIS 8 HB1 HIS 8 15.053 1.413 -35.804 53 HD1 HIS 8 HD1 HIS 8 17.622 2.203 -36.760 54 HD2 HIS 8 HD2 HIS 8 15.094 5.040 -35.068 55 HE1 HIS 8 HE1 HIS 8 19.117 4.088 -36.016 56 HE2 HIS 8 HE2 HIS 8 17.578 5.735 -34.877 57 H HIS 9 HN HIS 9 14.986 -0.160 -39.006 58 HA HIS 9 HA HIS 9 12.214 -0.973 -38.931 59 HB2 HIS 9 HB2 HIS 9 13.647 -1.430 -40.907 60 HB3 HIS 9 HB1 HIS 9 14.641 -2.491 -39.918 61 HD1 HIS 9 HD1 HIS 9 13.861 -4.869 -39.627 62 HD2 HIS 9 HD2 HIS 9 10.996 -2.435 -41.407 63 HE1 HIS 9 HE1 HIS 9 12.030 -6.417 -40.383 64 HE2 HIS 9 HE2 HIS 9 10.417 -4.950 -41.643 65 H HIS 10 HN HIS 10 11.899 -1.091 -36.679 66 HA HIS 10 HA HIS 10 11.478 -2.298 -34.805 67 HB2 HIS 10 HB2 HIS 10 11.209 -4.189 -36.443 68 HB3 HIS 10 HB1 HIS 10 12.889 -4.613 -36.149 69 HD1 HIS 10 HD1 HIS 10 9.668 -4.220 -34.152 70 HD2 HIS 10 HD2 HIS 10 13.206 -6.408 -34.151 71 HE1 HIS 10 HE1 HIS 10 9.430 -5.895 -32.293 72 HE2 HIS 10 HE2 HIS 10 11.467 -7.364 -32.490 73 H SER 11 HN SER 11 14.354 -1.228 -35.712 74 HA SER 11 HA SER 11 16.149 -2.434 -33.885 75 HB2 SER 11 HB2 SER 11 16.289 0.377 -34.995 76 HB3 SER 11 HB1 SER 11 17.631 -0.609 -34.414 77 HG SER 11 HG SER 11 17.261 -2.039 -36.153 78 H SER 12 HN SER 12 13.968 0.318 -33.703 79 HA SER 12 HA SER 12 14.875 1.145 -31.111 80 HB2 SER 12 HB2 SER 12 12.384 1.944 -32.641 81 HB3 SER 12 HB1 SER 12 13.051 2.775 -31.235 82 HG SER 12 HG SER 12 14.753 3.468 -32.415 83 H GLY 13 HN GLY 13 14.613 -0.566 -29.709 84 HA2 GLY 13 HA2 GLY 13 12.004 -0.830 -28.563 85 HA3 GLY 13 HA1 GLY 13 12.489 -2.283 -29.424 86 H ARG 14 HN ARG 14 14.519 -0.076 -27.562 87 HA ARG 14 HA ARG 14 14.810 -2.080 -25.462 88 HB2 ARG 14 HB2 ARG 14 17.272 -1.949 -25.535 89 HB3 ARG 14 HB1 ARG 14 16.594 -2.653 -26.996 90 HG2 ARG 14 HG2 ARG 14 17.004 -0.682 -28.243 91 HG3 ARG 14 HG1 ARG 14 17.386 0.239 -26.787 92 HD2 ARG 14 HD2 ARG 14 19.403 -0.377 -28.032 93 HD3 ARG 14 HD1 ARG 14 19.373 -1.112 -26.431 94 HE ARG 14 HE ARG 14 18.324 -3.055 -27.960 95 HH11 ARG 14 HH11 ARG 14 21.226 -1.118 -28.249 96 HH12 ARG 14 HH12 ARG 14 22.110 -2.341 -29.124 97 HH21 ARG 14 HH21 ARG 14 19.465 -4.656 -29.106 98 HH22 ARG 14 HH22 ARG 14 21.099 -4.352 -29.623 99 H GLU 15 HN GLU 15 15.347 1.193 -26.597 100 HA GLU 15 HA GLU 15 16.327 2.081 -24.037 101 HB2 GLU 15 HB2 GLU 15 16.420 4.311 -25.163 102 HB3 GLU 15 HB1 GLU 15 17.335 3.053 -25.982 103 HG2 GLU 15 HG2 GLU 15 15.395 2.750 -27.519 104 HG3 GLU 15 HG1 GLU 15 14.656 4.164 -26.769 105 H ASN 16 HN ASN 16 13.435 1.199 -24.840 106 HA ASN 16 HA ASN 16 11.753 3.362 -24.119 107 HB2 ASN 16 HB2 ASN 16 10.241 1.225 -23.490 108 HB3 ASN 16 HB1 ASN 16 10.475 1.783 -25.144 109 HD21 ASN 16 HD21 ASN 16 11.703 -0.472 -22.731 110 HD22 ASN 16 HD22 ASN 16 12.244 -1.663 -23.864 111 H LEU 17 HN LEU 17 13.888 1.492 -22.298 112 HA LEU 17 HA LEU 17 12.624 1.464 -19.782 113 HB2 LEU 17 HB2 LEU 17 15.483 1.440 -20.675 114 HB3 LEU 17 HB1 LEU 17 15.115 1.662 -18.976 115 HG LEU 17 HG LEU 17 15.619 -0.658 -19.400 116 HD11 LEU 17 HD11 LEU 17 12.673 -0.243 -18.929 117 HD12 LEU 17 HD12 LEU 17 13.946 -0.197 -17.709 118 HD13 LEU 17 HD13 LEU 17 13.581 -1.706 -18.545 119 HD21 LEU 17 HD21 LEU 17 13.350 -0.610 -21.382 120 HD22 LEU 17 HD22 LEU 17 14.254 -2.037 -20.878 121 HD23 LEU 17 HD23 LEU 17 15.064 -0.750 -21.770 122 H TYR 18 HN TYR 18 14.224 3.968 -21.598 123 HA TYR 18 HA TYR 18 13.853 5.832 -19.373 124 HB2 TYR 18 HB2 TYR 18 15.267 6.172 -22.020 125 HB3 TYR 18 HB1 TYR 18 15.051 7.457 -20.837 126 HD1 TYR 18 HD1 TYR 18 16.277 7.429 -18.731 127 HD2 TYR 18 HD2 TYR 18 16.854 4.376 -21.635 128 HE1 TYR 18 HE1 TYR 18 18.328 6.723 -17.571 129 HE2 TYR 18 HE2 TYR 18 18.905 3.659 -20.483 130 HH TYR 18 HH TYR 18 20.553 4.489 -18.963 131 H PHE 19 HN PHE 19 11.669 5.948 -19.390 132 HA PHE 19 HA PHE 19 10.293 6.687 -21.858 133 HB2 PHE 19 HB2 PHE 19 8.219 6.171 -20.588 134 HB3 PHE 19 HB1 PHE 19 9.334 4.812 -20.668 135 HD1 PHE 19 HD1 PHE 19 10.773 4.314 -18.655 136 HD2 PHE 19 HD2 PHE 19 7.482 7.011 -18.531 137 HE1 PHE 19 HE1 PHE 19 10.698 4.106 -16.207 138 HE2 PHE 19 HE2 PHE 19 7.403 6.807 -16.080 139 HZ PHE 19 HZ PHE 19 9.013 5.354 -14.916 140 H GLN 20 HN GLN 20 11.886 8.395 -19.758 141 HA GLN 20 HA GLN 20 9.938 10.366 -19.004 142 HB2 GLN 20 HB2 GLN 20 12.946 10.297 -18.844 143 HB3 GLN 20 HB1 GLN 20 12.029 11.736 -18.433 144 HG2 GLN 20 HG2 GLN 20 12.455 10.641 -16.403 145 HG3 GLN 20 HG1 GLN 20 10.764 10.328 -16.776 146 HE21 GLN 20 HE21 GLN 20 13.534 8.706 -18.232 147 HE22 GLN 20 HE22 GLN 20 13.200 7.150 -17.561 148 H GLY 21 HN GLY 21 9.240 10.325 -21.365 149 HA2 GLY 21 HA2 GLY 21 10.434 12.692 -22.638 150 HA3 GLY 21 HA1 GLY 21 10.179 11.238 -23.596 151 H HIS 22 HN HIS 22 8.428 13.391 -21.388 152 HA HIS 22 HA HIS 22 5.837 12.765 -22.125 153 HB2 HIS 22 HB2 HIS 22 5.171 14.913 -21.215 154 HB3 HIS 22 HB1 HIS 22 6.432 14.217 -20.210 155 HD1 HIS 22 HD1 HIS 22 5.503 17.355 -20.914 156 HD2 HIS 22 HD2 HIS 22 9.074 15.387 -21.735 157 HE1 HIS 22 HE1 HIS 22 7.231 19.163 -21.185 158 HE2 HIS 22 HE2 HIS 22 9.353 17.958 -21.819 159 H MET 23 HN MET 23 4.462 13.320 -23.741 160 HA MET 23 HA MET 23 5.364 15.189 -25.786 161 HB2 MET 23 HB2 MET 23 4.921 13.542 -27.588 162 HB3 MET 23 HB1 MET 23 6.276 13.093 -26.563 163 HG2 MET 23 HG2 MET 23 4.798 11.542 -25.344 164 HG3 MET 23 HG1 MET 23 3.492 11.952 -26.456 165 HE1 MET 23 HE1 MET 23 4.450 8.317 -27.567 166 HE2 MET 23 HE2 MET 23 3.151 9.387 -27.040 167 HE3 MET 23 HE3 MET 23 4.446 8.959 -25.923 168 H CYS 24 HN CYS 24 3.756 16.187 -26.870 169 HA CYS 24 HA CYS 24 1.162 16.192 -25.737 170 HB2 CYS 24 HB2 CYS 24 2.123 17.427 -28.323 171 HB3 CYS 24 HB1 CYS 24 0.641 17.842 -27.466 172 HG CYS 24 HG CYS 24 1.662 19.620 -25.943 173 H ILE 25 HN ILE 25 -0.836 16.074 -27.174 174 HA ILE 25 HA ILE 25 -1.131 13.404 -27.967 175 HB ILE 25 HB ILE 25 -3.009 14.676 -27.109 176 HG12 ILE 25 HG12 ILE 25 -4.724 14.017 -28.775 177 HG13 ILE 25 HG11 ILE 25 -3.444 13.739 -29.952 178 HG21 ILE 25 HG21 ILE 25 -2.879 16.256 -29.670 179 HG22 ILE 25 HG22 ILE 25 -2.516 16.853 -28.050 180 HG23 ILE 25 HG23 ILE 25 -4.159 16.360 -28.461 181 HD11 ILE 25 HD11 ILE 25 -4.199 11.660 -28.954 182 HD12 ILE 25 HD12 ILE 25 -3.795 12.270 -27.350 183 HD13 ILE 25 HD13 ILE 25 -2.519 11.987 -28.534 184 H GLN 26 HN GLN 26 -0.642 16.343 -29.925 185 HA GLN 26 HA GLN 26 -1.027 15.176 -32.446 186 HB2 GLN 26 HB2 GLN 26 -0.815 17.563 -32.276 187 HB3 GLN 26 HB1 GLN 26 0.796 17.426 -31.583 188 HG2 GLN 26 HG2 GLN 26 1.609 16.486 -33.700 189 HG3 GLN 26 HG1 GLN 26 -0.000 16.681 -34.389 190 HE21 GLN 26 HE21 GLN 26 2.619 17.821 -35.113 191 HE22 GLN 26 HE22 GLN 26 2.373 19.540 -35.150 192 H LYS 27 HN LYS 27 1.828 15.352 -30.397 193 HA LYS 27 HA LYS 27 3.655 14.196 -32.211 194 HB2 LYS 27 HB2 LYS 27 4.084 15.530 -30.046 195 HB3 LYS 27 HB1 LYS 27 3.831 14.012 -29.204 196 HG2 LYS 27 HG2 LYS 27 5.895 14.325 -31.362 197 HG3 LYS 27 HG1 LYS 27 6.223 14.704 -29.672 198 HD2 LYS 27 HD2 LYS 27 5.442 12.356 -29.137 199 HD3 LYS 27 HD1 LYS 27 5.489 12.045 -30.874 200 HE2 LYS 27 HE2 LYS 27 7.856 12.623 -30.923 201 HE3 LYS 27 HE1 LYS 27 7.815 12.973 -29.195 202 HZ1 LYS 27 HZ1 LYS 27 7.119 10.620 -28.865 203 HZ2 LYS 27 HZ2 LYS 27 8.682 10.799 -29.482 204 HZ3 LYS 27 HZ3 LYS 27 7.417 10.342 -30.514 205 H VAL 28 HN VAL 28 1.430 12.868 -29.832 206 HA VAL 28 HA VAL 28 2.290 10.191 -29.878 207 HB VAL 28 HB VAL 28 -0.511 11.257 -29.453 208 HG11 VAL 28 HG11 VAL 28 -0.553 8.888 -29.998 209 HG12 VAL 28 HG12 VAL 28 -0.938 9.137 -28.296 210 HG13 VAL 28 HG13 VAL 28 0.663 8.566 -28.762 211 HG21 VAL 28 HG21 VAL 28 1.087 12.177 -27.865 212 HG22 VAL 28 HG22 VAL 28 1.648 10.552 -27.470 213 HG23 VAL 28 HG23 VAL 28 0.000 11.039 -27.068 214 H ILE 29 HN ILE 29 -0.071 11.928 -31.876 215 HA ILE 29 HA ILE 29 -0.803 9.699 -33.467 216 HB ILE 29 HB ILE 29 -1.169 12.653 -33.710 217 HG12 ILE 29 HG12 ILE 29 -3.545 11.985 -33.909 218 HG13 ILE 29 HG11 ILE 29 -3.062 10.296 -33.829 219 HG21 ILE 29 HG21 ILE 29 -2.242 12.420 -35.897 220 HG22 ILE 29 HG22 ILE 29 -1.721 10.737 -35.970 221 HG23 ILE 29 HG23 ILE 29 -0.524 12.031 -35.970 222 HD11 ILE 29 HD11 ILE 29 -2.200 10.661 -31.573 223 HD12 ILE 29 HD12 ILE 29 -3.913 11.058 -31.703 224 HD13 ILE 29 HD13 ILE 29 -2.710 12.347 -31.658 225 H GLU 30 HN GLU 30 1.596 12.283 -33.889 226 HA GLU 30 HA GLU 30 2.497 11.692 -36.429 227 HB2 GLU 30 HB2 GLU 30 3.939 12.750 -34.012 228 HB3 GLU 30 HB1 GLU 30 4.784 12.490 -35.532 229 HG2 GLU 30 HG2 GLU 30 3.146 13.986 -36.635 230 HG3 GLU 30 HG1 GLU 30 2.444 14.320 -35.054 231 H ASP 31 HN ASP 31 3.656 10.287 -33.360 232 HA ASP 31 HA ASP 31 5.375 8.488 -34.781 233 HB2 ASP 31 HB2 ASP 31 4.877 9.064 -31.931 234 HB3 ASP 31 HB1 ASP 31 5.449 7.442 -32.319 235 H LYS 32 HN LYS 32 2.096 8.381 -33.811 236 HA LYS 32 HA LYS 32 1.767 5.605 -33.481 237 HB2 LYS 32 HB2 LYS 32 0.002 7.148 -32.855 238 HB3 LYS 32 HB1 LYS 32 -0.169 7.687 -34.518 239 HG2 LYS 32 HG2 LYS 32 -1.974 6.223 -34.042 240 HG3 LYS 32 HG1 LYS 32 -0.870 5.371 -35.119 241 HD2 LYS 32 HD2 LYS 32 0.108 4.248 -33.114 242 HD3 LYS 32 HD1 LYS 32 -1.151 5.007 -32.137 243 HE2 LYS 32 HE2 LYS 32 -2.845 3.922 -33.603 244 HE3 LYS 32 HE1 LYS 32 -1.534 3.064 -34.407 245 HZ1 LYS 32 HZ1 LYS 32 -2.406 1.608 -32.799 246 HZ2 LYS 32 HZ2 LYS 32 -2.430 2.800 -31.594 247 HZ3 LYS 32 HZ3 LYS 32 -0.946 2.173 -32.140 248 H LEU 33 HN LEU 33 1.156 7.604 -36.380 249 HA LEU 33 HA LEU 33 1.036 5.339 -38.100 250 HB2 LEU 33 HB2 LEU 33 1.046 7.012 -39.926 251 HB3 LEU 33 HB1 LEU 33 -0.179 7.311 -38.712 252 HG LEU 33 HG LEU 33 1.610 8.965 -37.730 253 HD11 LEU 33 HD11 LEU 33 3.416 8.343 -39.239 254 HD12 LEU 33 HD12 LEU 33 2.958 10.031 -39.461 255 HD13 LEU 33 HD13 LEU 33 2.433 8.813 -40.625 256 HD21 LEU 33 HD21 LEU 33 0.019 9.560 -40.219 257 HD22 LEU 33 HD22 LEU 33 0.645 10.756 -39.083 258 HD23 LEU 33 HD23 LEU 33 -0.584 9.602 -38.562 259 H SER 34 HN SER 34 3.566 7.389 -36.927 260 HA SER 34 HA SER 34 5.525 6.850 -38.874 261 HB2 SER 34 HB2 SER 34 5.558 8.571 -36.935 262 HB3 SER 34 HB1 SER 34 6.172 7.230 -35.967 263 HG SER 34 HG SER 34 7.637 8.795 -37.269 264 H SER 35 HN SER 35 4.714 5.219 -35.818 265 HA SER 35 HA SER 35 6.731 3.322 -35.765 266 HB2 SER 35 HB2 SER 35 3.852 2.995 -34.889 267 HB3 SER 35 HB1 SER 35 5.193 1.965 -34.387 268 HG SER 35 HG SER 35 4.850 4.740 -33.862 269 H ALA 36 HN ALA 36 3.945 3.495 -37.811 270 HA ALA 36 HA ALA 36 4.136 0.724 -38.648 271 HB1 ALA 36 HB1 ALA 36 2.160 1.248 -39.999 272 HB2 ALA 36 HB2 ALA 36 2.293 2.943 -39.520 273 HB3 ALA 36 HB3 ALA 36 1.943 1.709 -38.309 274 H LEU 37 HN LEU 37 4.702 3.958 -40.035 275 HA LEU 37 HA LEU 37 5.572 2.662 -42.531 276 HB2 LEU 37 HB2 LEU 37 4.593 5.454 -41.980 277 HB3 LEU 37 HB1 LEU 37 5.346 4.998 -43.493 278 HG LEU 37 HG LEU 37 3.488 3.254 -43.717 279 HD11 LEU 37 HD11 LEU 37 2.712 3.284 -41.404 280 HD12 LEU 37 HD12 LEU 37 1.419 3.725 -42.520 281 HD13 LEU 37 HD13 LEU 37 2.239 4.974 -41.582 282 HD21 LEU 37 HD21 LEU 37 3.597 5.285 -45.045 283 HD22 LEU 37 HD22 LEU 37 2.796 6.184 -43.757 284 HD23 LEU 37 HD23 LEU 37 1.930 4.908 -44.610 285 H LYS 38 HN LYS 38 6.614 4.833 -40.004 286 HA LYS 38 HA LYS 38 8.379 6.227 -39.721 287 HB2 LYS 38 HB2 LYS 38 9.824 3.937 -41.061 288 HB3 LYS 38 HB1 LYS 38 10.620 5.268 -40.239 289 HG2 LYS 38 HG2 LYS 38 8.879 3.134 -39.033 290 HG3 LYS 38 HG1 LYS 38 10.598 3.412 -38.763 291 HD2 LYS 38 HD2 LYS 38 8.326 5.206 -37.912 292 HD3 LYS 38 HD1 LYS 38 9.312 4.193 -36.860 293 HE2 LYS 38 HE2 LYS 38 11.257 5.529 -37.311 294 HE3 LYS 38 HE1 LYS 38 10.388 6.460 -38.532 295 HZ1 LYS 38 HZ1 LYS 38 9.839 6.429 -35.612 296 HZ2 LYS 38 HZ2 LYS 38 8.876 7.221 -36.756 297 HZ3 LYS 38 HZ3 LYS 38 10.477 7.718 -36.511 298 HA PRO 39 HA PRO 39 8.336 7.849 -44.016 299 HB2 PRO 39 HB2 PRO 39 7.094 10.246 -43.162 300 HB3 PRO 39 HB1 PRO 39 6.352 8.915 -44.048 301 HG2 PRO 39 HG2 PRO 39 5.778 9.689 -41.420 302 HG3 PRO 39 HG1 PRO 39 5.280 8.180 -42.201 303 HD2 PRO 39 HD2 PRO 39 7.495 8.688 -40.289 304 HD3 PRO 39 HD1 PRO 39 6.538 7.214 -40.548 305 H THR 40 HN THR 40 9.811 9.170 -44.889 306 HA THR 40 HA THR 40 11.944 10.166 -43.377 307 HB THR 40 HB THR 40 12.395 11.467 -45.618 308 HG1 THR 40 HG1 THR 40 10.051 10.829 -46.208 309 HG21 THR 40 HG21 THR 40 13.657 9.513 -44.889 310 HG22 THR 40 HG22 THR 40 13.300 9.405 -46.615 311 HG23 THR 40 HG23 THR 40 12.370 8.450 -45.460 312 H PHE 41 HN PHE 41 9.052 11.725 -44.642 313 HA PHE 41 HA PHE 41 9.597 13.962 -42.841 314 HB2 PHE 41 HB2 PHE 41 10.247 14.674 -45.139 315 HB3 PHE 41 HB1 PHE 41 8.607 14.327 -45.680 316 HD1 PHE 41 HD1 PHE 41 10.613 16.474 -43.434 317 HD2 PHE 41 HD2 PHE 41 6.878 15.893 -45.389 318 HE1 PHE 41 HE1 PHE 41 9.931 18.752 -42.802 319 HE2 PHE 41 HE2 PHE 41 6.190 18.170 -44.760 320 HZ PHE 41 HZ PHE 41 7.718 19.603 -43.465 321 H LEU 42 HN LEU 42 7.929 14.285 -41.555 322 HA LEU 42 HA LEU 42 5.216 13.761 -42.480 323 HB2 LEU 42 HB2 LEU 42 6.134 11.688 -41.369 324 HB3 LEU 42 HB1 LEU 42 6.304 12.617 -39.898 325 HG LEU 42 HG LEU 42 4.285 11.084 -40.079 326 HD11 LEU 42 HD11 LEU 42 3.817 13.997 -39.486 327 HD12 LEU 42 HD12 LEU 42 4.451 12.790 -38.366 328 HD13 LEU 42 HD13 LEU 42 2.794 12.661 -38.958 329 HD21 LEU 42 HD21 LEU 42 3.655 11.599 -42.365 330 HD22 LEU 42 HD22 LEU 42 3.339 13.275 -41.917 331 HD23 LEU 42 HD23 LEU 42 2.338 11.981 -41.258 332 H GLU 43 HN GLU 43 4.028 15.515 -41.977 333 HA GLU 43 HA GLU 43 4.547 16.858 -39.420 334 HB2 GLU 43 HB2 GLU 43 5.888 18.064 -41.113 335 HB3 GLU 43 HB1 GLU 43 4.429 18.349 -42.049 336 HG2 GLU 43 HG2 GLU 43 5.031 20.323 -40.790 337 HG3 GLU 43 HG1 GLU 43 3.503 19.664 -40.206 338 H LEU 44 HN LEU 44 2.758 17.752 -38.477 339 HA LEU 44 HA LEU 44 0.220 17.355 -39.911 340 HB2 LEU 44 HB2 LEU 44 0.977 17.167 -37.036 341 HB3 LEU 44 HB1 LEU 44 -0.646 17.697 -37.426 342 HG LEU 44 HG LEU 44 -0.954 15.588 -38.738 343 HD11 LEU 44 HD11 LEU 44 1.366 15.057 -39.186 344 HD12 LEU 44 HD12 LEU 44 0.587 13.736 -38.313 345 HD13 LEU 44 HD13 LEU 44 1.667 14.840 -37.462 346 HD21 LEU 44 HD21 LEU 44 -0.268 15.283 -35.820 347 HD22 LEU 44 HD22 LEU 44 -1.250 14.168 -36.771 348 HD23 LEU 44 HD23 LEU 44 -1.816 15.813 -36.478 349 H VAL 45 HN VAL 45 -0.649 19.110 -40.700 350 HA VAL 45 HA VAL 45 -0.219 21.680 -39.338 351 HB VAL 45 HB VAL 45 -1.227 21.174 -42.144 352 HG11 VAL 45 HG11 VAL 45 -0.859 23.581 -42.466 353 HG12 VAL 45 HG12 VAL 45 -0.421 23.733 -40.765 354 HG13 VAL 45 HG13 VAL 45 -2.060 23.262 -41.214 355 HG21 VAL 45 HG21 VAL 45 0.968 21.993 -42.883 356 HG22 VAL 45 HG22 VAL 45 1.109 20.516 -41.930 357 HG23 VAL 45 HG23 VAL 45 1.496 22.075 -41.202 358 H ASP 46 HN ASP 46 -1.824 22.354 -38.107 359 HA ASP 46 HA ASP 46 -4.437 21.202 -38.171 360 HB2 ASP 46 HB2 ASP 46 -3.493 21.957 -36.064 361 HB3 ASP 46 HB1 ASP 46 -3.321 23.593 -36.688 362 H LYS 47 HN LYS 47 -6.088 21.780 -39.410 363 HA LYS 47 HA LYS 47 -5.914 24.357 -40.833 364 HB2 LYS 47 HB2 LYS 47 -7.481 21.916 -41.680 365 HB3 LYS 47 HB1 LYS 47 -7.234 23.383 -42.609 366 HG2 LYS 47 HG2 LYS 47 -4.746 22.802 -42.526 367 HG3 LYS 47 HG1 LYS 47 -5.273 21.204 -41.992 368 HD2 LYS 47 HD2 LYS 47 -5.998 22.593 -44.572 369 HD3 LYS 47 HD1 LYS 47 -4.972 21.172 -44.383 370 HE2 LYS 47 HE2 LYS 47 -7.877 21.248 -43.585 371 HE3 LYS 47 HE1 LYS 47 -7.322 20.722 -45.171 372 HZ1 LYS 47 HZ1 LYS 47 -6.110 18.933 -44.172 373 HZ2 LYS 47 HZ2 LYS 47 -7.707 18.882 -43.603 374 HZ3 LYS 47 HZ3 LYS 47 -6.479 19.482 -42.610 375 H SER 48 HN SER 48 -7.609 25.748 -40.775 376 HA SER 48 HA SER 48 -9.806 25.213 -38.993 377 HB2 SER 48 HB2 SER 48 -10.589 27.494 -39.908 378 HB3 SER 48 HB1 SER 48 -9.091 27.466 -38.980 379 HG SER 48 HG SER 48 -7.926 27.547 -40.902 380 H CYS 49 HN CYS 49 -10.927 23.493 -39.847 381 HA CYS 49 HA CYS 49 -11.931 23.777 -42.598 382 HB2 CYS 49 HB2 CYS 49 -10.525 21.775 -42.027 383 HB3 CYS 49 HB1 CYS 49 -11.788 21.266 -40.913 384 HG CYS 49 HG CYS 49 -13.694 21.304 -43.166 385 H GLY 50 HN GLY 50 -12.979 24.736 -39.817 386 HA2 GLY 50 HA2 GLY 50 -15.144 25.341 -39.222 387 HA3 GLY 50 HA1 GLY 50 -15.760 24.281 -40.480 388 H CYS 51 HN CYS 51 -14.487 21.907 -39.674 389 HA CYS 51 HA CYS 51 -16.267 21.070 -37.582 390 HB2 CYS 51 HB2 CYS 51 -14.054 19.529 -38.953 391 HB3 CYS 51 HB1 CYS 51 -15.385 18.846 -38.024 392 HG CYS 51 HG CYS 51 -17.320 19.910 -39.889 393 H GLY 52 HN GLY 52 -14.451 23.008 -36.638 394 HA2 GLY 52 HA2 GLY 52 -13.184 23.391 -34.758 395 HA3 GLY 52 HA1 GLY 52 -13.362 21.688 -34.358 396 H THR 53 HN THR 53 -11.303 21.174 -33.852 397 HA THR 53 HA THR 53 -9.097 22.035 -35.470 398 HB THR 53 HB THR 53 -8.697 21.796 -33.113 399 HG1 THR 53 HG1 THR 53 -6.986 21.156 -34.621 400 HG21 THR 53 HG21 THR 53 -10.376 20.110 -32.577 401 HG22 THR 53 HG22 THR 53 -8.794 19.628 -31.964 402 HG23 THR 53 HG23 THR 53 -9.437 18.885 -33.429 403 H SER 54 HN SER 54 -8.270 21.065 -37.163 404 HA SER 54 HA SER 54 -8.669 18.195 -37.529 405 HB2 SER 54 HB2 SER 54 -9.189 18.553 -39.937 406 HB3 SER 54 HB1 SER 54 -10.426 19.220 -38.874 407 HG SER 54 HG SER 54 -8.997 21.240 -39.151 408 H PHE 55 HN PHE 55 -6.904 17.178 -38.382 409 HA PHE 55 HA PHE 55 -4.587 18.931 -38.817 410 HB2 PHE 55 HB2 PHE 55 -4.755 16.159 -37.638 411 HB3 PHE 55 HB1 PHE 55 -3.235 16.915 -38.105 412 HD1 PHE 55 HD1 PHE 55 -2.453 18.938 -36.923 413 HD2 PHE 55 HD2 PHE 55 -5.860 16.741 -35.625 414 HE1 PHE 55 HE1 PHE 55 -2.316 20.032 -34.723 415 HE2 PHE 55 HE2 PHE 55 -5.729 17.832 -33.426 416 HZ PHE 55 HZ PHE 55 -3.955 19.480 -32.970 417 H ASP 56 HN ASP 56 -3.516 18.825 -40.636 418 HA ASP 56 HA ASP 56 -4.125 16.636 -42.516 419 HB2 ASP 56 HB2 ASP 56 -4.590 19.194 -43.035 420 HB3 ASP 56 HB1 ASP 56 -2.863 19.210 -43.376 421 H ALA 57 HN ALA 57 -2.484 15.238 -42.799 422 HA ALA 57 HA ALA 57 0.145 16.080 -41.792 423 HB1 ALA 57 HB1 ALA 57 0.596 13.730 -41.383 424 HB2 ALA 57 HB2 ALA 57 -0.969 13.294 -42.072 425 HB3 ALA 57 HB3 ALA 57 -0.891 14.231 -40.579 426 H VAL 58 HN VAL 58 1.520 16.597 -43.309 427 HA VAL 58 HA VAL 58 1.455 15.484 -45.946 428 HB VAL 58 HB VAL 58 3.717 16.974 -44.589 429 HG11 VAL 58 HG11 VAL 58 3.141 16.493 -47.512 430 HG12 VAL 58 HG12 VAL 58 4.435 15.752 -46.570 431 HG13 VAL 58 HG13 VAL 58 4.449 17.489 -46.874 432 HG21 VAL 58 HG21 VAL 58 2.851 18.971 -45.728 433 HG22 VAL 58 HG22 VAL 58 1.690 18.316 -44.573 434 HG23 VAL 58 HG23 VAL 58 1.471 18.035 -46.301 435 H ILE 59 HN ILE 59 1.947 13.439 -46.290 436 HA ILE 59 HA ILE 59 3.957 12.162 -44.574 437 HB ILE 59 HB ILE 59 1.838 11.087 -44.305 438 HG12 ILE 59 HG12 ILE 59 4.012 9.682 -44.733 439 HG13 ILE 59 HG11 ILE 59 2.457 8.883 -44.564 440 HG21 ILE 59 HG21 ILE 59 0.704 11.845 -46.278 441 HG22 ILE 59 HG22 ILE 59 0.574 10.091 -46.148 442 HG23 ILE 59 HG23 ILE 59 1.707 10.810 -47.294 443 HD11 ILE 59 HD11 ILE 59 2.293 8.680 -46.989 444 HD12 ILE 59 HD12 ILE 59 3.769 7.931 -46.379 445 HD13 ILE 59 HD13 ILE 59 3.841 9.508 -47.167 446 H VAL 60 HN VAL 60 5.834 12.145 -45.476 447 HA VAL 60 HA VAL 60 6.072 11.689 -48.373 448 HB VAL 60 HB VAL 60 8.048 12.978 -46.477 449 HG11 VAL 60 HG11 VAL 60 9.152 11.859 -48.328 450 HG12 VAL 60 HG12 VAL 60 9.266 13.611 -48.502 451 HG13 VAL 60 HG13 VAL 60 8.111 12.701 -49.475 452 HG21 VAL 60 HG21 VAL 60 7.502 15.068 -47.639 453 HG22 VAL 60 HG22 VAL 60 6.097 14.391 -46.816 454 HG23 VAL 60 HG23 VAL 60 6.263 14.223 -48.561 455 H SER 61 HN SER 61 6.373 9.551 -48.669 456 HA SER 61 HA SER 61 8.749 8.355 -47.557 457 HB2 SER 61 HB2 SER 61 7.625 6.407 -46.562 458 HB3 SER 61 HB1 SER 61 7.152 7.898 -45.752 459 HG SER 61 HG SER 61 5.269 7.857 -47.182 460 H ASN 62 HN ASN 62 9.546 6.744 -48.778 461 HA ASN 62 HA ASN 62 8.598 6.392 -51.414 462 HB2 ASN 62 HB2 ASN 62 10.818 5.213 -49.804 463 HB3 ASN 62 HB1 ASN 62 10.384 4.472 -51.344 464 HD21 ASN 62 HD21 ASN 62 12.705 6.139 -50.323 465 HD22 ASN 62 HD22 ASN 62 12.925 7.330 -51.548 466 H ASN 63 HN ASN 63 7.825 4.785 -48.497 467 HA ASN 63 HA ASN 63 7.138 2.231 -49.238 468 HB2 ASN 63 HB2 ASN 63 6.912 3.142 -46.943 469 HB3 ASN 63 HB1 ASN 63 5.500 4.056 -47.458 470 HD21 ASN 63 HD21 ASN 63 4.111 3.048 -46.042 471 HD22 ASN 63 HD22 ASN 63 3.625 1.400 -46.215 472 H PHE 64 HN PHE 64 5.404 5.227 -49.947 473 HA PHE 64 HA PHE 64 3.317 3.685 -51.318 474 HB2 PHE 64 HB2 PHE 64 3.401 6.580 -50.462 475 HB3 PHE 64 HB1 PHE 64 2.090 5.867 -51.395 476 HD1 PHE 64 HD2 PHE 64 2.282 3.150 -49.859 477 HD2 PHE 64 HD1 PHE 64 1.959 7.215 -48.644 478 HE1 PHE 64 HE2 PHE 64 1.187 2.436 -47.776 479 HE2 PHE 64 HE1 PHE 64 0.864 6.508 -46.558 480 HZ PHE 64 HZ PHE 64 0.473 4.116 -46.123 481 H GLU 65 HN GLU 65 6.124 4.307 -52.314 482 HA GLU 65 HA GLU 65 5.570 5.924 -54.635 483 HB2 GLU 65 HB2 GLU 65 7.642 6.506 -53.834 484 HB3 GLU 65 HB1 GLU 65 7.922 4.935 -53.112 485 HG2 GLU 65 HG2 GLU 65 9.475 5.012 -54.776 486 HG3 GLU 65 HG1 GLU 65 8.114 4.127 -55.474 487 H ASP 66 HN ASP 66 5.523 2.725 -53.549 488 HA ASP 66 HA ASP 66 6.183 1.385 -55.986 489 HB2 ASP 66 HB2 ASP 66 6.221 0.430 -53.592 490 HB3 ASP 66 HB1 ASP 66 4.482 0.234 -53.779 491 H LYS 67 HN LYS 67 3.628 3.276 -55.080 492 HA LYS 67 HA LYS 67 1.781 3.958 -56.188 493 HB2 LYS 67 HB2 LYS 67 2.792 2.070 -58.315 494 HB3 LYS 67 HB1 LYS 67 1.431 3.165 -58.533 495 HG2 LYS 67 HG2 LYS 67 2.902 5.071 -58.112 496 HG3 LYS 67 HG1 LYS 67 4.265 3.969 -57.911 497 HD2 LYS 67 HD2 LYS 67 4.000 3.208 -60.211 498 HD3 LYS 67 HD1 LYS 67 2.611 4.280 -60.415 499 HE2 LYS 67 HE2 LYS 67 4.054 6.213 -59.975 500 HE3 LYS 67 HE1 LYS 67 5.438 5.134 -59.805 501 HZ1 LYS 67 HZ1 LYS 67 3.809 5.480 -62.262 502 HZ2 LYS 67 HZ2 LYS 67 5.142 4.447 -62.100 503 HZ3 LYS 67 HZ3 LYS 67 5.354 6.126 -62.002 504 H LYS 68 HN LYS 68 1.821 1.580 -54.426 505 HA LYS 68 HA LYS 68 -0.445 0.036 -55.427 506 HB2 LYS 68 HB2 LYS 68 1.065 -0.222 -52.820 507 HB3 LYS 68 HB1 LYS 68 -0.099 -1.368 -53.469 508 HG2 LYS 68 HG2 LYS 68 2.510 -0.657 -54.781 509 HG3 LYS 68 HG1 LYS 68 2.249 -2.067 -53.756 510 HD2 LYS 68 HD2 LYS 68 0.735 -1.485 -56.300 511 HD3 LYS 68 HD1 LYS 68 2.119 -2.573 -56.179 512 HE2 LYS 68 HE2 LYS 68 -0.559 -2.860 -54.834 513 HE3 LYS 68 HE1 LYS 68 0.119 -3.885 -56.097 514 HZ1 LYS 68 HZ1 LYS 68 1.977 -4.304 -54.412 515 HZ2 LYS 68 HZ2 LYS 68 0.488 -5.074 -54.161 516 HZ3 LYS 68 HZ3 LYS 68 0.891 -3.696 -53.253 517 H LEU 69 HN LEU 69 -2.237 1.334 -55.305 518 HA LEU 69 HA LEU 69 -2.606 3.147 -53.135 519 HB2 LEU 69 HB2 LEU 69 -4.827 3.583 -54.141 520 HB3 LEU 69 HB1 LEU 69 -3.488 3.786 -55.248 521 HG LEU 69 HG LEU 69 -4.106 1.337 -55.980 522 HD11 LEU 69 HD11 LEU 69 -6.718 2.334 -54.849 523 HD12 LEU 69 HD12 LEU 69 -5.789 0.956 -54.256 524 HD13 LEU 69 HD13 LEU 69 -6.508 0.908 -55.866 525 HD21 LEU 69 HD21 LEU 69 -4.175 3.305 -57.409 526 HD22 LEU 69 HD22 LEU 69 -5.742 3.752 -56.736 527 HD23 LEU 69 HD23 LEU 69 -5.580 2.276 -57.687 528 H LEU 70 HN LEU 70 -3.757 -0.092 -53.850 529 HA LEU 70 HA LEU 70 -5.653 -0.142 -51.752 530 HB2 LEU 70 HB2 LEU 70 -5.824 -2.514 -52.054 531 HB3 LEU 70 HB1 LEU 70 -5.797 -1.722 -53.606 532 HG LEU 70 HG LEU 70 -4.602 -3.723 -53.861 533 HD11 LEU 70 HD11 LEU 70 -2.361 -3.079 -54.454 534 HD12 LEU 70 HD12 LEU 70 -2.508 -1.601 -53.504 535 HD13 LEU 70 HD13 LEU 70 -3.515 -1.836 -54.933 536 HD21 LEU 70 HD21 LEU 70 -4.250 -4.301 -51.547 537 HD22 LEU 70 HD22 LEU 70 -3.025 -3.042 -51.390 538 HD23 LEU 70 HD23 LEU 70 -2.736 -4.428 -52.443 539 H ASP 71 HN ASP 71 -2.212 -0.865 -51.876 540 HA ASP 71 HA ASP 71 -2.070 -1.836 -49.196 541 HB2 ASP 71 HB2 ASP 71 0.010 -0.804 -51.122 542 HB3 ASP 71 HB1 ASP 71 0.419 -1.203 -49.458 543 H ARG 72 HN ARG 72 -1.440 1.269 -50.749 544 HA ARG 72 HA ARG 72 -0.784 2.821 -48.559 545 HB2 ARG 72 HB2 ARG 72 -0.700 3.609 -50.880 546 HB3 ARG 72 HB1 ARG 72 -2.448 3.549 -50.985 547 HG2 ARG 72 HG2 ARG 72 -1.128 5.308 -48.959 548 HG3 ARG 72 HG1 ARG 72 -1.254 5.817 -50.643 549 HD2 ARG 72 HD2 ARG 72 -3.727 5.354 -50.474 550 HD3 ARG 72 HD1 ARG 72 -3.492 5.154 -48.739 551 HE ARG 72 HE ARG 72 -2.732 7.664 -50.079 552 HH11 ARG 72 HH11 ARG 72 -4.574 5.938 -47.663 553 HH12 ARG 72 HH12 ARG 72 -5.232 7.372 -46.948 554 HH21 ARG 72 HH21 ARG 72 -3.575 9.555 -49.154 555 HH22 ARG 72 HH22 ARG 72 -4.643 9.450 -47.785 556 H HIS 73 HN HIS 73 -3.988 2.021 -49.831 557 HA HIS 73 HA HIS 73 -5.451 3.539 -47.957 558 HB2 HIS 73 HB2 HIS 73 -6.316 2.738 -50.153 559 HB3 HIS 73 HB1 HIS 73 -6.361 1.104 -49.503 560 HD1 HIS 73 HD1 HIS 73 -8.096 4.419 -49.291 561 HD2 HIS 73 HD2 HIS 73 -8.522 0.545 -47.835 562 HE1 HIS 73 HE1 HIS 73 -10.405 4.321 -48.284 563 HE2 HIS 73 HE2 HIS 73 -10.597 1.998 -47.309 564 H ARG 74 HN ARG 74 -4.727 0.036 -48.078 565 HA ARG 74 HA ARG 74 -6.284 -0.529 -45.782 566 HB2 ARG 74 HB2 ARG 74 -5.475 -2.767 -45.930 567 HB3 ARG 74 HB1 ARG 74 -5.732 -2.180 -47.563 568 HG2 ARG 74 HG2 ARG 74 -3.256 -1.697 -47.650 569 HG3 ARG 74 HG1 ARG 74 -3.121 -2.598 -46.138 570 HD2 ARG 74 HD2 ARG 74 -4.028 -3.594 -48.828 571 HD3 ARG 74 HD1 ARG 74 -2.642 -4.129 -47.882 572 HE ARG 74 HE ARG 74 -5.430 -4.590 -47.012 573 HH11 ARG 74 HH11 ARG 74 -2.152 -5.719 -47.549 574 HH12 ARG 74 HH12 ARG 74 -2.477 -7.332 -46.980 575 HH21 ARG 74 HH21 ARG 74 -5.853 -6.692 -46.238 576 HH22 ARG 74 HH22 ARG 74 -4.580 -7.877 -46.197 577 H LEU 75 HN LEU 75 -2.789 0.012 -46.191 578 HA LEU 75 HA LEU 75 -2.071 -0.686 -43.549 579 HB2 LEU 75 HB2 LEU 75 -0.743 1.192 -45.503 580 HB3 LEU 75 HB1 LEU 75 -0.029 0.696 -43.982 581 HG LEU 75 HG LEU 75 -0.724 -1.150 -46.269 582 HD11 LEU 75 HD11 LEU 75 1.700 -1.358 -46.534 583 HD12 LEU 75 HD12 LEU 75 1.941 -0.140 -45.282 584 HD13 LEU 75 HD13 LEU 75 1.157 0.297 -46.799 585 HD21 LEU 75 HD21 LEU 75 -0.918 -2.253 -44.106 586 HD22 LEU 75 HD22 LEU 75 0.690 -1.683 -43.657 587 HD23 LEU 75 HD23 LEU 75 0.498 -2.837 -44.979 588 H VAL 76 HN VAL 76 -2.729 2.466 -45.046 589 HA VAL 76 HA VAL 76 -2.449 4.043 -42.763 590 HB VAL 76 HB VAL 76 -4.108 4.398 -45.257 591 HG11 VAL 76 HG11 VAL 76 -4.499 6.721 -44.589 592 HG12 VAL 76 HG12 VAL 76 -3.760 6.394 -43.020 593 HG13 VAL 76 HG13 VAL 76 -5.265 5.593 -43.471 594 HG21 VAL 76 HG21 VAL 76 -1.609 5.741 -44.234 595 HG22 VAL 76 HG22 VAL 76 -2.429 6.116 -45.749 596 HG23 VAL 76 HG23 VAL 76 -1.695 4.530 -45.514 597 H ASN 77 HN ASN 77 -5.324 2.391 -44.055 598 HA ASN 77 HA ASN 77 -7.150 3.409 -42.171 599 HB2 ASN 77 HB2 ASN 77 -7.152 1.021 -43.979 600 HB3 ASN 77 HB1 ASN 77 -8.419 1.198 -42.771 601 HD21 ASN 77 HD21 ASN 77 -6.941 3.956 -44.304 602 HD22 ASN 77 HD22 ASN 77 -8.313 4.408 -45.253 603 H THR 78 HN THR 78 -5.087 0.539 -42.097 604 HA THR 78 HA THR 78 -6.259 -0.708 -39.878 605 HB THR 78 HB THR 78 -3.371 -0.841 -40.765 606 HG1 THR 78 HG1 THR 78 -4.812 -1.477 -42.419 607 HG21 THR 78 HG21 THR 78 -4.998 -2.751 -39.083 608 HG22 THR 78 HG22 THR 78 -3.693 -1.718 -38.502 609 HG23 THR 78 HG23 THR 78 -3.346 -3.020 -39.640 610 H ILE 79 HN ILE 79 -3.449 1.508 -40.016 611 HA ILE 79 HA ILE 79 -3.190 1.429 -37.134 612 HB ILE 79 HB ILE 79 -1.689 2.941 -39.264 613 HG12 ILE 79 HG12 ILE 79 0.219 1.580 -38.240 614 HG13 ILE 79 HG11 ILE 79 -1.023 0.669 -37.394 615 HG21 ILE 79 HG21 ILE 79 -0.191 3.776 -37.512 616 HG22 ILE 79 HG22 ILE 79 -1.264 3.104 -36.284 617 HG23 ILE 79 HG23 ILE 79 -1.829 4.406 -37.332 618 HD11 ILE 79 HD11 ILE 79 -1.978 -0.010 -39.532 619 HD12 ILE 79 HD12 ILE 79 -0.284 -0.484 -39.394 620 HD13 ILE 79 HD13 ILE 79 -0.732 0.908 -40.378 621 H LEU 80 HN LEU 80 -4.095 3.888 -39.537 622 HA LEU 80 HA LEU 80 -4.539 5.913 -37.615 623 HB2 LEU 80 HB2 LEU 80 -5.215 5.632 -40.520 624 HB3 LEU 80 HB1 LEU 80 -5.821 6.989 -39.588 625 HG LEU 80 HG LEU 80 -3.457 7.584 -39.029 626 HD11 LEU 80 HD11 LEU 80 -2.417 5.407 -39.366 627 HD12 LEU 80 HD12 LEU 80 -1.658 6.637 -40.378 628 HD13 LEU 80 HD13 LEU 80 -2.790 5.488 -41.088 629 HD21 LEU 80 HD21 LEU 80 -4.656 8.718 -40.806 630 HD22 LEU 80 HD22 LEU 80 -4.164 7.471 -41.953 631 HD23 LEU 80 HD23 LEU 80 -2.953 8.528 -41.225 632 H LYS 81 HN LYS 81 -6.386 3.194 -38.403 633 HA LYS 81 HA LYS 81 -8.993 4.054 -37.973 634 HB2 LYS 81 HB2 LYS 81 -8.592 1.758 -38.536 635 HB3 LYS 81 HB1 LYS 81 -7.590 1.520 -37.110 636 HG2 LYS 81 HG2 LYS 81 -9.767 0.483 -36.842 637 HG3 LYS 81 HG1 LYS 81 -9.539 1.790 -35.680 638 HD2 LYS 81 HD2 LYS 81 -10.796 3.278 -37.274 639 HD3 LYS 81 HD1 LYS 81 -11.190 1.824 -38.196 640 HE2 LYS 81 HE2 LYS 81 -11.861 2.309 -35.297 641 HE3 LYS 81 HE1 LYS 81 -12.983 2.445 -36.646 642 HZ1 LYS 81 HZ1 LYS 81 -13.240 0.327 -35.562 643 HZ2 LYS 81 HZ2 LYS 81 -11.596 -0.027 -35.756 644 HZ3 LYS 81 HZ3 LYS 81 -12.603 0.078 -37.114 645 H GLU 82 HN GLU 82 -6.758 2.810 -35.511 646 HA GLU 82 HA GLU 82 -8.269 3.764 -33.308 647 HB2 GLU 82 HB2 GLU 82 -6.670 1.907 -33.114 648 HB3 GLU 82 HB1 GLU 82 -5.342 2.998 -33.487 649 HG2 GLU 82 HG2 GLU 82 -6.090 4.306 -31.417 650 HG3 GLU 82 HG1 GLU 82 -7.022 2.865 -31.012 651 H GLU 83 HN GLU 83 -5.584 5.030 -35.181 652 HA GLU 83 HA GLU 83 -4.800 7.168 -33.596 653 HB2 GLU 83 HB2 GLU 83 -3.582 6.410 -35.564 654 HB3 GLU 83 HB1 GLU 83 -4.892 6.938 -36.606 655 HG2 GLU 83 HG2 GLU 83 -4.457 9.217 -36.117 656 HG3 GLU 83 HG1 GLU 83 -3.285 8.789 -34.870 657 H LEU 84 HN LEU 84 -7.414 6.989 -35.971 658 HA LEU 84 HA LEU 84 -8.206 9.638 -36.072 659 HB2 LEU 84 HB2 LEU 84 -9.830 7.114 -36.289 660 HB3 LEU 84 HB1 LEU 84 -10.518 8.704 -36.551 661 HG LEU 84 HG LEU 84 -8.308 7.439 -38.163 662 HD11 LEU 84 HD11 LEU 84 -10.493 6.461 -38.591 663 HD12 LEU 84 HD12 LEU 84 -9.950 7.424 -39.965 664 HD13 LEU 84 HD13 LEU 84 -11.169 8.067 -38.863 665 HD21 LEU 84 HD21 LEU 84 -8.002 9.851 -37.990 666 HD22 LEU 84 HD22 LEU 84 -9.672 10.106 -38.497 667 HD23 LEU 84 HD23 LEU 84 -8.511 9.395 -39.616 668 H GLN 85 HN GLN 85 -8.733 7.326 -33.507 669 HA GLN 85 HA GLN 85 -11.061 8.438 -32.393 670 HB2 GLN 85 HB2 GLN 85 -8.870 7.036 -30.860 671 HB3 GLN 85 HB1 GLN 85 -10.546 7.216 -30.374 672 HG2 GLN 85 HG2 GLN 85 -9.385 5.453 -32.497 673 HG3 GLN 85 HG1 GLN 85 -10.346 5.007 -31.092 674 HE21 GLN 85 HE21 GLN 85 -10.364 5.963 -34.369 675 HE22 GLN 85 HE22 GLN 85 -12.074 5.912 -34.617 676 H ASN 86 HN ASN 86 -7.853 9.617 -32.428 677 HA ASN 86 HA ASN 86 -8.326 11.343 -30.095 678 HB2 ASN 86 HB2 ASN 86 -5.767 10.954 -31.662 679 HB3 ASN 86 HB1 ASN 86 -5.944 11.819 -30.141 680 HD21 ASN 86 HD21 ASN 86 -5.706 8.744 -31.683 681 HD22 ASN 86 HD22 ASN 86 -5.528 7.797 -30.246 682 H ILE 87 HN ILE 87 -9.085 11.480 -33.204 683 HA ILE 87 HA ILE 87 -8.363 14.330 -33.500 684 HB ILE 87 HB ILE 87 -8.652 12.555 -35.906 685 HG12 ILE 87 HG12 ILE 87 -6.091 12.948 -34.337 686 HG13 ILE 87 HG11 ILE 87 -6.998 11.445 -34.459 687 HG21 ILE 87 HG21 ILE 87 -7.155 14.213 -36.912 688 HG22 ILE 87 HG22 ILE 87 -7.053 15.056 -35.367 689 HG23 ILE 87 HG23 ILE 87 -8.592 14.971 -36.226 690 HD11 ILE 87 HD11 ILE 87 -5.636 12.873 -36.725 691 HD12 ILE 87 HD12 ILE 87 -6.553 11.371 -36.853 692 HD13 ILE 87 HD13 ILE 87 -5.064 11.418 -35.908 693 H HIS 88 HN HIS 88 -9.884 15.520 -34.951 694 HA HIS 88 HA HIS 88 -12.593 14.423 -34.773 695 HB2 HIS 88 HB2 HIS 88 -12.080 16.797 -34.024 696 HB3 HIS 88 HB1 HIS 88 -11.809 17.186 -35.720 697 HD1 HIS 88 HD1 HIS 88 -14.424 16.912 -33.202 698 HD2 HIS 88 HD2 HIS 88 -14.216 16.825 -37.356 699 HE1 HIS 88 HE1 HIS 88 -16.780 17.296 -34.011 700 HE2 HIS 88 HE2 HIS 88 -16.655 17.075 -36.519 701 H ALA 89 HN ALA 89 -10.478 15.985 -37.167 702 HA ALA 89 HA ALA 89 -11.500 14.161 -39.201 703 HB1 ALA 89 HB1 ALA 89 -11.457 17.155 -39.578 704 HB2 ALA 89 HB2 ALA 89 -12.901 16.160 -39.396 705 HB3 ALA 89 HB3 ALA 89 -11.866 15.961 -40.811 706 H PHE 90 HN PHE 90 -9.596 13.139 -39.523 707 HA PHE 90 HA PHE 90 -7.154 14.698 -39.838 708 HB2 PHE 90 HB2 PHE 90 -7.184 12.632 -38.444 709 HB3 PHE 90 HB1 PHE 90 -7.546 11.698 -39.891 710 HD1 PHE 90 HD1 PHE 90 -5.022 13.970 -38.400 711 HD2 PHE 90 HD2 PHE 90 -5.825 10.906 -41.242 712 HE1 PHE 90 HE1 PHE 90 -2.614 13.752 -38.843 713 HE2 PHE 90 HE2 PHE 90 -3.417 10.686 -41.688 714 HZ PHE 90 HZ PHE 90 -1.808 12.108 -40.487 715 H SER 91 HN SER 91 -6.032 14.894 -41.700 716 HA SER 91 HA SER 91 -6.874 13.376 -44.062 717 HB2 SER 91 HB2 SER 91 -6.363 16.368 -44.081 718 HB3 SER 91 HB1 SER 91 -6.824 15.373 -45.462 719 HG SER 91 HG SER 91 -8.531 15.129 -43.338 720 H MET 92 HN MET 92 -5.109 13.510 -45.797 721 HA MET 92 HA MET 92 -2.500 14.208 -44.712 722 HB2 MET 92 HB2 MET 92 -1.508 12.062 -45.009 723 HB3 MET 92 HB1 MET 92 -2.951 11.834 -44.038 724 HG2 MET 92 HG2 MET 92 -2.833 11.345 -47.001 725 HG3 MET 92 HG1 MET 92 -2.552 10.101 -45.786 726 HE1 MET 92 HE1 MET 92 -4.408 9.226 -44.107 727 HE2 MET 92 HE2 MET 92 -6.047 9.877 -44.029 728 HE3 MET 92 HE3 MET 92 -4.675 10.874 -43.543 729 H LYS 93 HN LYS 93 -0.862 14.423 -46.232 730 HA LYS 93 HA LYS 93 -1.745 14.481 -49.052 731 HB2 LYS 93 HB2 LYS 93 0.503 16.074 -47.793 732 HB3 LYS 93 HB1 LYS 93 -0.117 16.241 -49.428 733 HG2 LYS 93 HG2 LYS 93 -1.695 16.827 -46.935 734 HG3 LYS 93 HG1 LYS 93 -0.844 18.035 -47.896 735 HD2 LYS 93 HD2 LYS 93 -2.238 17.538 -49.815 736 HD3 LYS 93 HD1 LYS 93 -3.041 16.240 -48.925 737 HE2 LYS 93 HE2 LYS 93 -3.922 17.851 -47.331 738 HE3 LYS 93 HE1 LYS 93 -3.073 19.158 -48.157 739 HZ1 LYS 93 HZ1 LYS 93 -5.451 18.993 -48.736 740 HZ2 LYS 93 HZ2 LYS 93 -5.160 17.468 -49.425 741 HZ3 LYS 93 HZ3 LYS 93 -4.428 18.851 -50.079 742 H CYS 94 HN CYS 94 -0.869 12.881 -50.230 743 HA CYS 94 HA CYS 94 1.401 11.408 -49.193 744 HB2 CYS 94 HB2 CYS 94 -0.550 10.231 -50.159 745 HB3 CYS 94 HB1 CYS 94 -0.213 10.976 -51.717 746 HG CYS 94 HG CYS 94 2.535 9.710 -51.419 747 H HIS 95 HN HIS 95 3.451 11.778 -49.745 748 HA HIS 95 HA HIS 95 4.085 12.730 -52.430 749 HB2 HIS 95 HB2 HIS 95 3.799 14.646 -50.595 750 HB3 HIS 95 HB1 HIS 95 5.436 14.160 -50.182 751 HD1 HIS 95 HD1 HIS 95 3.518 16.191 -52.541 752 HD2 HIS 95 HD2 HIS 95 7.325 14.521 -52.369 753 HE1 HIS 95 HE1 HIS 95 4.856 17.375 -54.306 754 HE2 HIS 95 HE2 HIS 95 7.090 16.221 -54.308 755 H THR 96 HN THR 96 6.279 12.300 -53.031 756 HA THR 96 HA THR 96 7.570 10.307 -51.316 757 HB THR 96 HB THR 96 8.991 10.084 -53.548 758 HG1 THR 96 HG1 THR 96 7.483 10.368 -55.341 759 HG21 THR 96 HG21 THR 96 7.826 8.245 -52.592 760 HG22 THR 96 HG22 THR 96 7.325 8.362 -54.284 761 HG23 THR 96 HG23 THR 96 6.257 8.943 -53.007 762 HA PRO 97 HA PRO 97 10.921 12.798 -50.062 763 HB2 PRO 97 HB2 PRO 97 12.805 10.654 -50.798 764 HB3 PRO 97 HB1 PRO 97 12.466 11.357 -49.216 765 HG2 PRO 97 HG2 PRO 97 11.651 8.878 -49.921 766 HG3 PRO 97 HG1 PRO 97 10.750 9.899 -48.791 767 HD2 PRO 97 HD2 PRO 97 10.179 9.249 -51.633 768 HD3 PRO 97 HD1 PRO 97 9.056 9.584 -50.302 769 H LEU 98 HN LEU 98 11.713 10.903 -52.961 770 HA LEU 98 HA LEU 98 13.780 12.571 -53.858 771 HB2 LEU 98 HB2 LEU 98 12.026 10.602 -55.308 772 HB3 LEU 98 HB1 LEU 98 13.309 11.481 -56.113 773 HG LEU 98 HG LEU 98 14.143 9.318 -55.580 774 HD11 LEU 98 HD11 LEU 98 16.028 9.832 -54.114 775 HD12 LEU 98 HD12 LEU 98 15.217 11.310 -53.595 776 HD13 LEU 98 HD13 LEU 98 15.725 11.126 -55.273 777 HD21 LEU 98 HD21 LEU 98 12.550 8.678 -53.865 778 HD22 LEU 98 HD22 LEU 98 13.278 9.822 -52.737 779 HD23 LEU 98 HD23 LEU 98 14.201 8.429 -53.298 780 H GLU 99 HN GLU 99 10.309 12.652 -54.422 781 HA GLU 99 HA GLU 99 10.479 14.634 -56.484 782 HB2 GLU 99 HB2 GLU 99 8.612 13.002 -56.318 783 HB3 GLU 99 HB1 GLU 99 8.078 13.801 -54.847 784 HG2 GLU 99 HG2 GLU 99 6.807 14.432 -56.883 785 HG3 GLU 99 HG1 GLU 99 7.538 15.791 -56.032 786 H TYR 100 HN TYR 100 9.837 14.656 -53.005 787 HA TYR 100 HA TYR 100 9.254 17.420 -52.814 788 HB2 TYR 100 HB2 TYR 100 8.682 15.931 -50.987 789 HB3 TYR 100 HB1 TYR 100 10.372 15.496 -50.760 790 HD1 TYR 100 HD1 TYR 100 8.282 18.606 -50.860 791 HD2 TYR 100 HD2 TYR 100 11.451 16.479 -48.977 792 HE1 TYR 100 HE1 TYR 100 8.528 20.428 -49.228 793 HE2 TYR 100 HE2 TYR 100 11.706 18.297 -47.341 794 HH TYR 100 HH TYR 100 11.205 20.564 -47.004 795 H ASP 101 HN ASP 101 12.211 15.572 -52.867 796 HA ASP 101 HA ASP 101 14.066 17.424 -51.991 797 HB2 ASP 101 HB2 ASP 101 14.721 15.157 -52.407 798 HB3 ASP 101 HB1 ASP 101 14.296 15.287 -54.110 799 H LYS 102 HN LYS 102 12.741 17.044 -55.280 800 HA LYS 102 HA LYS 102 14.301 19.061 -56.474 801 HB2 LYS 102 HB2 LYS 102 11.664 17.828 -57.181 802 HB3 LYS 102 HB1 LYS 102 12.207 19.257 -58.044 803 HG2 LYS 102 HG2 LYS 102 12.990 17.611 -59.412 804 HG3 LYS 102 HG1 LYS 102 14.392 17.853 -58.372 805 HD2 LYS 102 HD2 LYS 102 13.949 15.486 -58.670 806 HD3 LYS 102 HD1 LYS 102 13.682 15.958 -56.990 807 HE2 LYS 102 HE2 LYS 102 11.923 14.459 -57.799 808 HE3 LYS 102 HE1 LYS 102 11.286 16.045 -57.373 809 HZ1 LYS 102 HZ1 LYS 102 11.885 15.102 -60.130 810 HZ2 LYS 102 HZ2 LYS 102 11.260 16.624 -59.722 811 HZ3 LYS 102 HZ3 LYS 102 10.339 15.229 -59.433 812 H LEU 103 HN LEU 103 11.103 19.180 -54.961 813 HA LEU 103 HA LEU 103 10.522 21.845 -55.586 814 HB2 LEU 103 HB2 LEU 103 9.594 20.282 -53.179 815 HB3 LEU 103 HB1 LEU 103 8.837 21.720 -53.834 816 HG LEU 103 HG LEU 103 8.993 19.010 -55.152 817 HD11 LEU 103 HD11 LEU 103 6.665 20.606 -54.096 818 HD12 LEU 103 HD12 LEU 103 7.350 19.153 -53.368 819 HD13 LEU 103 HD13 LEU 103 6.559 19.062 -54.941 820 HD21 LEU 103 HD21 LEU 103 9.230 20.775 -56.815 821 HD22 LEU 103 HD22 LEU 103 7.793 21.578 -56.184 822 HD23 LEU 103 HD23 LEU 103 7.654 19.994 -56.946 823 H LYS 104 HN LYS 104 12.043 20.442 -52.701 824 HA LYS 104 HA LYS 104 12.307 23.010 -51.427 825 HB2 LYS 104 HB2 LYS 104 13.556 21.783 -49.694 826 HB3 LYS 104 HB1 LYS 104 12.000 21.044 -50.046 827 HG2 LYS 104 HG2 LYS 104 12.925 19.174 -50.935 828 HG3 LYS 104 HG1 LYS 104 14.347 20.028 -51.536 829 HD2 LYS 104 HD2 LYS 104 13.949 19.732 -48.591 830 HD3 LYS 104 HD1 LYS 104 14.539 18.358 -49.527 831 HE2 LYS 104 HE2 LYS 104 16.429 19.559 -48.663 832 HE3 LYS 104 HE1 LYS 104 16.357 19.807 -50.405 833 HZ1 LYS 104 HZ1 LYS 104 15.286 21.759 -48.437 834 HZ2 LYS 104 HZ2 LYS 104 15.538 21.993 -50.099 835 HZ3 LYS 104 HZ3 LYS 104 16.862 21.822 -49.062 836 H SER 105 HN SER 105 14.043 21.460 -53.839 837 HA SER 105 HA SER 105 16.691 22.168 -53.138 838 HB2 SER 105 HB2 SER 105 16.159 20.492 -54.870 839 HB3 SER 105 HB1 SER 105 15.481 21.761 -55.888 840 HG SER 105 HG SER 105 18.163 21.749 -54.949 841 H LYS 106 HN LYS 106 14.129 23.809 -54.888 842 HA LYS 106 HA LYS 106 15.797 26.229 -54.966 843 HB2 LYS 106 HB2 LYS 106 14.052 27.025 -56.661 844 HB3 LYS 106 HB1 LYS 106 15.201 25.809 -57.189 845 HG2 LYS 106 HG2 LYS 106 12.537 24.963 -56.148 846 HG3 LYS 106 HG1 LYS 106 12.674 25.602 -57.787 847 HD2 LYS 106 HD2 LYS 106 14.274 23.287 -56.693 848 HD3 LYS 106 HD1 LYS 106 12.822 23.131 -57.685 849 HE2 LYS 106 HE2 LYS 106 13.934 24.291 -59.515 850 HE3 LYS 106 HE1 LYS 106 15.373 24.512 -58.522 851 HZ1 LYS 106 HZ1 LYS 106 15.624 22.652 -60.042 852 HZ2 LYS 106 HZ2 LYS 106 14.256 21.896 -59.389 853 HZ3 LYS 106 HZ3 LYS 106 15.641 22.109 -58.439 854 H GLY 107 HN GLY 107 12.580 24.996 -54.234 855 HA2 GLY 107 HA2 GLY 107 11.389 25.667 -52.288 856 HA3 GLY 107 HA1 GLY 107 12.267 27.191 -52.313 857 H SER 108 HN SER 108 10.354 25.447 -54.750 858 HA SER 108 HA SER 108 8.897 27.937 -55.249 859 HB2 SER 108 HB2 SER 108 9.090 25.427 -56.935 860 HB3 SER 108 HB1 SER 108 8.257 26.913 -57.392 861 HG SER 108 HG SER 108 10.157 27.940 -57.630 Start of MODEL 18 1 H1 MET 1 HT1 MET 1 -10.263 46.400 -33.661 2 H2 MET 1 HT2 MET 1 -11.818 46.924 -33.232 3 H3 MET 1 HT3 MET 1 -11.624 45.673 -34.364 4 HA MET 1 HA MET 1 -10.898 45.561 -31.494 5 HB2 MET 1 HB2 MET 1 -13.068 44.136 -33.054 6 HB3 MET 1 HB1 MET 1 -12.684 43.863 -31.359 7 HG2 MET 1 HG2 MET 1 -13.722 46.420 -32.562 8 HG3 MET 1 HG1 MET 1 -14.642 45.268 -31.594 9 HE1 MET 1 HE1 MET 1 -14.455 48.423 -31.000 10 HE2 MET 1 HE2 MET 1 -14.292 48.404 -29.244 11 HE3 MET 1 HE3 MET 1 -15.420 47.303 -30.036 12 H GLY 2 HN GLY 2 -9.927 43.626 -30.806 13 HA2 GLY 2 HA2 GLY 2 -8.509 42.244 -32.968 14 HA3 GLY 2 HA1 GLY 2 -8.044 42.263 -31.274 15 H SER 3 HN SER 3 -8.740 40.690 -29.939 16 HA SER 3 HA SER 3 -9.567 38.695 -29.251 17 HB2 SER 3 HB2 SER 3 -11.743 39.220 -31.296 18 HB3 SER 3 HB1 SER 3 -11.811 38.015 -30.010 19 HG SER 3 HG SER 3 -11.313 40.040 -28.642 20 H SER 4 HN SER 4 -7.722 38.966 -31.556 21 HA SER 4 HA SER 4 -8.446 36.795 -33.340 22 HB2 SER 4 HB2 SER 4 -5.984 38.554 -33.318 23 HB3 SER 4 HB1 SER 4 -6.495 37.485 -34.625 24 HG SER 4 HG SER 4 -8.565 38.925 -34.274 25 H HIS 5 HN HIS 5 -8.024 34.777 -32.718 26 HA HIS 5 HA HIS 5 -5.534 34.242 -31.252 27 HB2 HIS 5 HB2 HIS 5 -8.044 32.618 -31.645 28 HB3 HIS 5 HB1 HIS 5 -6.556 31.900 -31.037 29 HD1 HIS 5 HD1 HIS 5 -5.915 32.369 -28.609 30 HD2 HIS 5 HD2 HIS 5 -9.304 34.436 -29.870 31 HE1 HIS 5 HE1 HIS 5 -6.947 33.322 -26.526 32 HE2 HIS 5 HE2 HIS 5 -9.107 34.373 -27.286 33 H HIS 6 HN HIS 6 -5.369 34.999 -33.904 34 HA HIS 6 HA HIS 6 -5.242 32.983 -35.818 35 HB2 HIS 6 HB2 HIS 6 -5.045 35.411 -36.296 36 HB3 HIS 6 HB1 HIS 6 -3.452 35.414 -35.552 37 HD1 HIS 6 HD1 HIS 6 -1.489 34.508 -36.940 38 HD2 HIS 6 HD2 HIS 6 -5.166 34.254 -38.872 39 HE1 HIS 6 HE1 HIS 6 -0.962 33.955 -39.334 40 HE2 HIS 6 HE2 HIS 6 -3.177 34.049 -40.521 41 H HIS 7 HN HIS 7 -3.822 31.404 -36.279 42 HA HIS 7 HA HIS 7 -1.774 30.853 -34.282 43 HB2 HIS 7 HB2 HIS 7 -2.804 29.222 -36.614 44 HB3 HIS 7 HB1 HIS 7 -1.522 28.688 -35.534 45 HD1 HIS 7 HD1 HIS 7 -2.320 28.589 -32.892 46 HD2 HIS 7 HD2 HIS 7 -5.283 28.501 -35.810 47 HE1 HIS 7 HE1 HIS 7 -4.357 27.631 -31.764 48 HE2 HIS 7 HE2 HIS 7 -6.080 27.442 -33.590 49 H HIS 8 HN HIS 8 0.287 31.339 -34.542 50 HA HIS 8 HA HIS 8 1.269 31.885 -37.261 51 HB2 HIS 8 HB2 HIS 8 1.557 33.811 -35.839 52 HB3 HIS 8 HB1 HIS 8 2.273 32.831 -34.566 53 HD1 HIS 8 HD1 HIS 8 3.074 34.352 -37.922 54 HD2 HIS 8 HD2 HIS 8 4.984 32.325 -34.834 55 HE1 HIS 8 HE1 HIS 8 5.532 34.520 -38.415 56 HE2 HIS 8 HE2 HIS 8 6.646 33.103 -36.653 57 H HIS 9 HN HIS 9 2.134 30.083 -38.084 58 HA HIS 9 HA HIS 9 3.288 28.025 -36.528 59 HB2 HIS 9 HB2 HIS 9 4.088 27.086 -38.671 60 HB3 HIS 9 HB1 HIS 9 2.384 27.513 -38.718 61 HD1 HIS 9 HD1 HIS 9 1.696 29.488 -40.261 62 HD2 HIS 9 HD2 HIS 9 5.729 28.481 -40.452 63 HE1 HIS 9 HE1 HIS 9 2.574 30.585 -42.347 64 HE2 HIS 9 HE2 HIS 9 4.947 29.770 -42.560 65 H HIS 10 HN HIS 10 5.313 27.623 -35.886 66 HA HIS 10 HA HIS 10 7.452 29.434 -36.745 67 HB2 HIS 10 HB2 HIS 10 8.244 29.524 -34.343 68 HB3 HIS 10 HB1 HIS 10 6.767 30.417 -34.676 69 HD1 HIS 10 HD1 HIS 10 8.124 27.622 -32.648 70 HD2 HIS 10 HD2 HIS 10 4.413 29.269 -33.554 71 HE1 HIS 10 HE1 HIS 10 6.523 26.659 -30.965 72 HE2 HIS 10 HE2 HIS 10 4.326 27.813 -31.418 73 H SER 11 HN SER 11 9.522 28.543 -36.717 74 HA SER 11 HA SER 11 9.515 25.676 -37.001 75 HB2 SER 11 HB2 SER 11 10.757 27.109 -38.581 76 HB3 SER 11 HB1 SER 11 11.805 27.641 -37.266 77 HG SER 11 HG SER 11 12.677 25.907 -38.551 78 H SER 12 HN SER 12 9.590 24.463 -35.261 79 HA SER 12 HA SER 12 11.673 25.017 -33.256 80 HB2 SER 12 HB2 SER 12 8.966 23.773 -32.691 81 HB3 SER 12 HB1 SER 12 10.195 24.223 -31.508 82 HG SER 12 HG SER 12 9.898 26.435 -32.385 83 H GLY 13 HN GLY 13 11.821 23.445 -35.655 84 HA2 GLY 13 HA2 GLY 13 11.221 20.697 -35.107 85 HA3 GLY 13 HA1 GLY 13 12.064 21.318 -36.513 86 H ARG 14 HN ARG 14 13.430 22.295 -33.553 87 HA ARG 14 HA ARG 14 15.658 20.447 -33.908 88 HB2 ARG 14 HB2 ARG 14 15.262 22.756 -31.998 89 HB3 ARG 14 HB1 ARG 14 16.728 21.794 -32.114 90 HG2 ARG 14 HG2 ARG 14 17.042 22.549 -34.409 91 HG3 ARG 14 HG1 ARG 14 15.565 23.510 -34.290 92 HD2 ARG 14 HD2 ARG 14 17.611 24.851 -33.936 93 HD3 ARG 14 HD1 ARG 14 16.531 24.860 -32.543 94 HE ARG 14 HE ARG 14 18.059 23.158 -31.550 95 HH11 ARG 14 HH11 ARG 14 19.216 25.265 -34.086 96 HH12 ARG 14 HH12 ARG 14 20.862 25.235 -33.543 97 HH21 ARG 14 HH21 ARG 14 20.238 23.114 -30.815 98 HH22 ARG 14 HH22 ARG 14 21.447 24.014 -31.690 99 H GLU 15 HN GLU 15 13.323 21.419 -31.466 100 HA GLU 15 HA GLU 15 14.250 19.346 -29.647 101 HB2 GLU 15 HB2 GLU 15 12.673 20.452 -28.045 102 HB3 GLU 15 HB1 GLU 15 13.947 21.497 -28.657 103 HG2 GLU 15 HG2 GLU 15 12.307 22.384 -30.319 104 HG3 GLU 15 HG1 GLU 15 11.058 21.457 -29.487 105 H ASN 16 HN ASN 16 12.824 18.628 -32.082 106 HA ASN 16 HA ASN 16 10.159 17.855 -31.413 107 HB2 ASN 16 HB2 ASN 16 10.141 16.639 -33.491 108 HB3 ASN 16 HB1 ASN 16 10.983 18.157 -33.765 109 HD21 ASN 16 HD21 ASN 16 13.154 18.136 -34.278 110 HD22 ASN 16 HD22 ASN 16 14.018 16.683 -34.642 111 H LEU 17 HN LEU 17 13.199 16.681 -30.596 112 HA LEU 17 HA LEU 17 12.501 13.896 -30.339 113 HB2 LEU 17 HB2 LEU 17 14.903 15.390 -29.284 114 HB3 LEU 17 HB1 LEU 17 14.741 13.650 -29.425 115 HG LEU 17 HG LEU 17 14.746 15.547 -31.773 116 HD11 LEU 17 HD11 LEU 17 16.899 15.591 -30.655 117 HD12 LEU 17 HD12 LEU 17 17.014 14.721 -32.185 118 HD13 LEU 17 HD13 LEU 17 16.960 13.828 -30.665 119 HD21 LEU 17 HD21 LEU 17 13.560 13.461 -32.186 120 HD22 LEU 17 HD22 LEU 17 14.951 12.544 -31.607 121 HD23 LEU 17 HD23 LEU 17 15.080 13.506 -33.079 122 H TYR 18 HN TYR 18 11.907 16.641 -28.517 123 HA TYR 18 HA TYR 18 12.130 15.264 -25.945 124 HB2 TYR 18 HB2 TYR 18 11.637 18.176 -26.595 125 HB3 TYR 18 HB1 TYR 18 11.751 17.517 -24.966 126 HD1 TYR 18 HD2 TYR 18 13.632 18.293 -28.035 127 HD2 TYR 18 HD1 TYR 18 13.884 16.943 -24.008 128 HE1 TYR 18 HE2 TYR 18 16.071 18.592 -28.093 129 HE2 TYR 18 HE1 TYR 18 16.323 17.240 -24.058 130 HH TYR 18 HH TYR 18 18.129 17.296 -25.773 131 H PHE 19 HN PHE 19 10.400 15.338 -24.418 132 HA PHE 19 HA PHE 19 7.742 15.549 -25.676 133 HB2 PHE 19 HB2 PHE 19 6.956 13.821 -24.146 134 HB3 PHE 19 HB1 PHE 19 8.338 13.230 -25.056 135 HD1 PHE 19 HD1 PHE 19 10.579 13.128 -23.933 136 HD2 PHE 19 HD2 PHE 19 6.978 13.899 -21.800 137 HE1 PHE 19 HE1 PHE 19 11.697 12.512 -21.830 138 HE2 PHE 19 HE2 PHE 19 8.090 13.288 -19.694 139 HZ PHE 19 HZ PHE 19 10.452 12.593 -19.706 140 H GLN 20 HN GLN 20 9.828 16.713 -23.296 141 HA GLN 20 HA GLN 20 9.686 18.456 -21.870 142 HB2 GLN 20 HB2 GLN 20 6.925 18.698 -23.030 143 HB3 GLN 20 HB1 GLN 20 7.487 19.754 -21.741 144 HG2 GLN 20 HG2 GLN 20 8.765 19.447 -24.451 145 HG3 GLN 20 HG1 GLN 20 7.745 20.789 -23.933 146 HE21 GLN 20 HE21 GLN 20 10.869 19.306 -23.698 147 HE22 GLN 20 HE22 GLN 20 11.646 20.589 -22.839 148 H GLY 21 HN GLY 21 6.541 16.779 -21.646 149 HA2 GLY 21 HA2 GLY 21 7.209 16.015 -18.912 150 HA3 GLY 21 HA1 GLY 21 5.839 17.100 -19.094 151 H HIS 22 HN HIS 22 4.812 16.055 -21.487 152 HA HIS 22 HA HIS 22 4.265 13.244 -21.045 153 HB2 HIS 22 HB2 HIS 22 2.668 14.345 -19.530 154 HB3 HIS 22 HB1 HIS 22 2.099 15.358 -20.849 155 HD1 HIS 22 HD1 HIS 22 0.102 14.541 -22.046 156 HD2 HIS 22 HD2 HIS 22 2.053 11.490 -20.003 157 HE1 HIS 22 HE1 HIS 22 -1.363 12.509 -22.298 158 HE2 HIS 22 HE2 HIS 22 -0.284 10.756 -20.843 159 H MET 23 HN MET 23 3.790 12.247 -22.969 160 HA MET 23 HA MET 23 4.144 13.682 -25.383 161 HB2 MET 23 HB2 MET 23 2.954 10.930 -24.948 162 HB3 MET 23 HB1 MET 23 3.453 11.583 -26.503 163 HG2 MET 23 HG2 MET 23 5.758 11.714 -25.706 164 HG3 MET 23 HG1 MET 23 5.253 11.060 -24.148 165 HE1 MET 23 HE1 MET 23 7.025 9.118 -24.252 166 HE2 MET 23 HE2 MET 23 7.621 9.778 -25.775 167 HE3 MET 23 HE3 MET 23 7.240 8.060 -25.647 168 H CYS 24 HN CYS 24 2.756 15.185 -25.992 169 HA CYS 24 HA CYS 24 0.061 15.352 -25.288 170 HB2 CYS 24 HB2 CYS 24 1.356 16.565 -27.736 171 HB3 CYS 24 HB1 CYS 24 -0.083 17.145 -26.902 172 HG CYS 24 HG CYS 24 1.133 18.692 -25.245 173 H ILE 25 HN ILE 25 -1.819 15.263 -26.731 174 HA ILE 25 HA ILE 25 -2.174 12.751 -27.844 175 HB ILE 25 HB ILE 25 -4.039 14.153 -27.103 176 HG12 ILE 25 HG12 ILE 25 -5.596 13.671 -28.988 177 HG13 ILE 25 HG11 ILE 25 -4.206 13.295 -29.998 178 HG21 ILE 25 HG21 ILE 25 -3.513 15.783 -29.583 179 HG22 ILE 25 HG22 ILE 25 -3.302 16.312 -27.915 180 HG23 ILE 25 HG23 ILE 25 -4.916 15.948 -28.525 181 HD11 ILE 25 HD11 ILE 25 -5.012 11.832 -27.493 182 HD12 ILE 25 HD12 ILE 25 -3.619 11.451 -28.506 183 HD13 ILE 25 HD13 ILE 25 -5.251 11.274 -29.150 184 H GLN 26 HN GLN 26 -1.143 15.742 -29.384 185 HA GLN 26 HA GLN 26 -1.357 14.974 -32.059 186 HB2 GLN 26 HB2 GLN 26 -0.899 17.276 -31.386 187 HB3 GLN 26 HB1 GLN 26 0.663 16.803 -30.737 188 HG2 GLN 26 HG2 GLN 26 0.070 16.319 -33.622 189 HG3 GLN 26 HG1 GLN 26 0.471 17.947 -33.080 190 HE21 GLN 26 HE21 GLN 26 1.949 16.162 -34.849 191 HE22 GLN 26 HE22 GLN 26 3.511 15.933 -34.129 192 H LYS 27 HN LYS 27 1.334 14.555 -29.773 193 HA LYS 27 HA LYS 27 2.993 13.241 -31.671 194 HB2 LYS 27 HB2 LYS 27 3.172 13.477 -28.668 195 HB3 LYS 27 HB1 LYS 27 4.366 12.621 -29.638 196 HG2 LYS 27 HG2 LYS 27 4.359 14.907 -30.979 197 HG3 LYS 27 HG1 LYS 27 3.828 15.521 -29.414 198 HD2 LYS 27 HD2 LYS 27 5.791 14.680 -28.340 199 HD3 LYS 27 HD1 LYS 27 6.276 13.809 -29.797 200 HE2 LYS 27 HE2 LYS 27 6.368 16.060 -30.947 201 HE3 LYS 27 HE1 LYS 27 6.204 16.781 -29.347 202 HZ1 LYS 27 HZ1 LYS 27 8.517 16.604 -30.065 203 HZ2 LYS 27 HZ2 LYS 27 8.370 14.927 -30.167 204 HZ3 LYS 27 HZ3 LYS 27 8.236 15.699 -28.665 205 H VAL 28 HN VAL 28 0.403 12.163 -29.684 206 HA VAL 28 HA VAL 28 1.115 9.413 -29.582 207 HB VAL 28 HB VAL 28 -1.645 10.663 -29.607 208 HG11 VAL 28 HG11 VAL 28 -2.398 8.574 -28.575 209 HG12 VAL 28 HG12 VAL 28 -0.778 7.901 -28.755 210 HG13 VAL 28 HG13 VAL 28 -1.733 8.296 -30.184 211 HG21 VAL 28 HG21 VAL 28 -1.558 10.405 -27.174 212 HG22 VAL 28 HG22 VAL 28 -0.281 11.470 -27.759 213 HG23 VAL 28 HG23 VAL 28 0.097 9.810 -27.298 214 H ILE 29 HN ILE 29 -0.999 11.261 -31.751 215 HA ILE 29 HA ILE 29 -1.397 9.274 -33.695 216 HB ILE 29 HB ILE 29 -1.477 12.292 -33.830 217 HG12 ILE 29 HG12 ILE 29 -3.912 11.850 -34.306 218 HG13 ILE 29 HG11 ILE 29 -3.609 10.151 -33.980 219 HG21 ILE 29 HG21 ILE 29 -2.394 12.143 -36.094 220 HG22 ILE 29 HG22 ILE 29 -2.068 10.409 -36.109 221 HG23 ILE 29 HG23 ILE 29 -0.732 11.556 -36.018 222 HD11 ILE 29 HD11 ILE 29 -3.268 12.410 -32.030 223 HD12 ILE 29 HD12 ILE 29 -2.967 10.704 -31.697 224 HD13 ILE 29 HD13 ILE 29 -4.600 11.256 -32.070 225 H GLU 30 HN GLU 30 0.947 11.921 -33.508 226 HA GLU 30 HA GLU 30 2.312 11.560 -35.881 227 HB2 GLU 30 HB2 GLU 30 2.608 13.477 -34.391 228 HB3 GLU 30 HB1 GLU 30 3.384 12.450 -33.198 229 HG2 GLU 30 HG2 GLU 30 5.184 11.999 -34.853 230 HG3 GLU 30 HG1 GLU 30 4.430 13.192 -35.915 231 H ASP 31 HN ASP 31 3.063 10.143 -32.710 232 HA ASP 31 HA ASP 31 5.430 8.858 -33.487 233 HB2 ASP 31 HB2 ASP 31 4.834 9.293 -31.135 234 HB3 ASP 31 HB1 ASP 31 3.546 8.096 -31.245 235 H LYS 32 HN LYS 32 2.082 7.625 -33.329 236 HA LYS 32 HA LYS 32 2.887 4.957 -33.874 237 HB2 LYS 32 HB2 LYS 32 0.199 6.292 -34.006 238 HB3 LYS 32 HB1 LYS 32 0.434 4.595 -34.406 239 HG2 LYS 32 HG2 LYS 32 1.553 4.427 -32.095 240 HG3 LYS 32 HG1 LYS 32 0.754 5.966 -31.768 241 HD2 LYS 32 HD2 LYS 32 -0.593 3.400 -32.612 242 HD3 LYS 32 HD1 LYS 32 -0.605 4.095 -30.992 243 HE2 LYS 32 HE2 LYS 32 -1.752 5.381 -33.466 244 HE3 LYS 32 HE1 LYS 32 -2.682 4.558 -32.213 245 HZ1 LYS 32 HZ1 LYS 32 -2.045 6.203 -30.632 246 HZ2 LYS 32 HZ2 LYS 32 -2.644 7.011 -32.004 247 HZ3 LYS 32 HZ3 LYS 32 -0.975 6.934 -31.725 248 H LEU 33 HN LEU 33 1.510 7.474 -36.034 249 HA LEU 33 HA LEU 33 1.609 5.707 -38.271 250 HB2 LEU 33 HB2 LEU 33 1.191 7.713 -39.659 251 HB3 LEU 33 HB1 LEU 33 0.030 7.474 -38.373 252 HG LEU 33 HG LEU 33 1.432 9.220 -37.073 253 HD11 LEU 33 HD11 LEU 33 2.574 10.855 -38.475 254 HD12 LEU 33 HD12 LEU 33 2.305 9.838 -39.892 255 HD13 LEU 33 HD13 LEU 33 3.348 9.274 -38.586 256 HD21 LEU 33 HD21 LEU 33 0.138 11.022 -38.068 257 HD22 LEU 33 HD22 LEU 33 -0.840 9.561 -37.912 258 HD23 LEU 33 HD23 LEU 33 -0.187 10.023 -39.484 259 H SER 34 HN SER 34 3.898 7.890 -36.825 260 HA SER 34 HA SER 34 5.757 7.948 -38.955 261 HB2 SER 34 HB2 SER 34 5.901 9.524 -37.084 262 HB3 SER 34 HB1 SER 34 6.214 8.194 -35.969 263 HG SER 34 HG SER 34 8.217 8.726 -36.403 264 H SER 35 HN SER 35 5.401 5.822 -36.139 265 HA SER 35 HA SER 35 7.661 4.219 -36.781 266 HB2 SER 35 HB2 SER 35 5.297 3.542 -35.015 267 HB3 SER 35 HB1 SER 35 6.874 2.751 -35.004 268 HG SER 35 HG SER 35 6.179 5.354 -34.153 269 H ALA 36 HN ALA 36 4.324 4.186 -37.749 270 HA ALA 36 HA ALA 36 4.325 1.437 -38.593 271 HB1 ALA 36 HB1 ALA 36 2.081 1.885 -39.400 272 HB2 ALA 36 HB2 ALA 36 2.321 3.615 -39.159 273 HB3 ALA 36 HB3 ALA 36 2.287 2.528 -37.771 274 H LEU 37 HN LEU 37 4.549 4.592 -40.218 275 HA LEU 37 HA LEU 37 4.786 3.181 -42.788 276 HB2 LEU 37 HB2 LEU 37 4.220 6.097 -42.247 277 HB3 LEU 37 HB1 LEU 37 4.281 5.348 -43.831 278 HG LEU 37 HG LEU 37 2.263 4.735 -41.668 279 HD11 LEU 37 HD11 LEU 37 0.668 5.788 -43.195 280 HD12 LEU 37 HD12 LEU 37 1.989 6.198 -44.289 281 HD13 LEU 37 HD13 LEU 37 1.921 6.917 -42.680 282 HD21 LEU 37 HD21 LEU 37 2.476 3.693 -44.493 283 HD22 LEU 37 HD22 LEU 37 1.152 3.378 -43.371 284 HD23 LEU 37 HD23 LEU 37 2.767 2.765 -43.021 285 H LYS 38 HN LYS 38 6.394 5.496 -40.705 286 HA LYS 38 HA LYS 38 8.360 6.581 -40.772 287 HB2 LYS 38 HB2 LYS 38 9.001 3.857 -41.730 288 HB3 LYS 38 HB1 LYS 38 10.241 5.088 -41.950 289 HG2 LYS 38 HG2 LYS 38 9.897 5.646 -39.495 290 HG3 LYS 38 HG1 LYS 38 8.995 4.134 -39.395 291 HD2 LYS 38 HD2 LYS 38 10.882 2.842 -39.876 292 HD3 LYS 38 HD1 LYS 38 11.765 4.219 -40.540 293 HE2 LYS 38 HE2 LYS 38 11.014 3.844 -37.640 294 HE3 LYS 38 HE1 LYS 38 12.615 3.569 -38.331 295 HZ1 LYS 38 HZ1 LYS 38 12.666 5.921 -38.986 296 HZ2 LYS 38 HZ2 LYS 38 12.527 5.737 -37.310 297 HZ3 LYS 38 HZ3 LYS 38 11.167 6.170 -38.229 298 HA PRO 39 HA PRO 39 8.343 8.313 -44.937 299 HB2 PRO 39 HB2 PRO 39 7.929 10.886 -43.846 300 HB3 PRO 39 HB1 PRO 39 6.726 9.869 -44.639 301 HG2 PRO 39 HG2 PRO 39 6.742 10.607 -41.936 302 HG3 PRO 39 HG1 PRO 39 5.764 9.320 -42.661 303 HD2 PRO 39 HD2 PRO 39 8.322 9.131 -41.141 304 HD3 PRO 39 HD1 PRO 39 6.949 8.002 -41.194 305 H THR 40 HN THR 40 9.888 9.728 -45.906 306 HA THR 40 HA THR 40 12.331 10.117 -44.400 307 HB THR 40 HB THR 40 13.134 11.133 -46.588 308 HG1 THR 40 HG1 THR 40 11.620 11.562 -47.996 309 HG21 THR 40 HG21 THR 40 12.029 8.320 -46.685 310 HG22 THR 40 HG22 THR 40 13.590 8.799 -46.018 311 HG23 THR 40 HG23 THR 40 13.280 8.970 -47.746 312 H PHE 41 HN PHE 41 9.587 11.880 -45.507 313 HA PHE 41 HA PHE 41 10.399 14.140 -43.842 314 HB2 PHE 41 HB2 PHE 41 10.899 14.873 -46.116 315 HB3 PHE 41 HB1 PHE 41 9.296 14.388 -46.655 316 HD1 PHE 41 HD1 PHE 41 11.059 16.724 -44.375 317 HD2 PHE 41 HD2 PHE 41 7.510 15.882 -46.565 318 HE1 PHE 41 HE1 PHE 41 10.203 18.969 -43.843 319 HE2 PHE 41 HE2 PHE 41 6.647 18.125 -46.039 320 HZ PHE 41 HZ PHE 41 7.995 19.672 -44.675 321 H LEU 42 HN LEU 42 8.779 14.813 -42.550 322 HA LEU 42 HA LEU 42 6.034 14.005 -43.186 323 HB2 LEU 42 HB2 LEU 42 6.984 12.323 -41.664 324 HB3 LEU 42 HB1 LEU 42 7.411 13.585 -40.527 325 HG LEU 42 HG LEU 42 5.010 14.085 -40.208 326 HD11 LEU 42 HD11 LEU 42 4.591 11.674 -41.969 327 HD12 LEU 42 HD12 LEU 42 4.178 13.341 -42.371 328 HD13 LEU 42 HD13 LEU 42 3.336 12.516 -41.058 329 HD21 LEU 42 HD21 LEU 42 6.170 12.563 -38.696 330 HD22 LEU 42 HD22 LEU 42 5.779 11.204 -39.750 331 HD23 LEU 42 HD23 LEU 42 4.490 12.075 -38.918 332 H GLU 43 HN GLU 43 4.729 15.706 -43.058 333 HA GLU 43 HA GLU 43 5.511 17.935 -41.294 334 HB2 GLU 43 HB2 GLU 43 5.746 18.408 -43.742 335 HB3 GLU 43 HB1 GLU 43 4.019 18.137 -43.918 336 HG2 GLU 43 HG2 GLU 43 3.548 20.020 -42.469 337 HG3 GLU 43 HG1 GLU 43 5.274 20.269 -42.202 338 H LEU 44 HN LEU 44 4.127 18.248 -39.677 339 HA LEU 44 HA LEU 44 1.384 17.229 -39.946 340 HB2 LEU 44 HB2 LEU 44 3.003 17.900 -37.482 341 HB3 LEU 44 HB1 LEU 44 1.317 17.434 -37.446 342 HG LEU 44 HG LEU 44 2.517 15.513 -36.841 343 HD11 LEU 44 HD11 LEU 44 2.088 13.917 -38.634 344 HD12 LEU 44 HD12 LEU 44 1.877 15.250 -39.770 345 HD13 LEU 44 HD13 LEU 44 0.750 15.048 -38.429 346 HD21 LEU 44 HD21 LEU 44 4.312 15.975 -39.217 347 HD22 LEU 44 HD22 LEU 44 4.389 14.594 -38.121 348 HD23 LEU 44 HD23 LEU 44 4.736 16.216 -37.522 349 H VAL 45 HN VAL 45 -0.108 18.707 -40.399 350 HA VAL 45 HA VAL 45 0.285 21.454 -39.388 351 HB VAL 45 HB VAL 45 -1.071 20.654 -41.971 352 HG11 VAL 45 HG11 VAL 45 -0.422 23.378 -40.846 353 HG12 VAL 45 HG12 VAL 45 -2.029 22.666 -40.986 354 HG13 VAL 45 HG13 VAL 45 -1.111 23.062 -42.438 355 HG21 VAL 45 HG21 VAL 45 1.618 21.954 -41.530 356 HG22 VAL 45 HG22 VAL 45 0.845 21.699 -43.094 357 HG23 VAL 45 HG23 VAL 45 1.337 20.315 -42.120 358 H ASP 46 HN ASP 46 -1.268 22.089 -38.005 359 HA ASP 46 HA ASP 46 -3.750 20.623 -37.800 360 HB2 ASP 46 HB2 ASP 46 -2.810 21.389 -35.721 361 HB3 ASP 46 HB1 ASP 46 -2.713 23.043 -36.313 362 H LYS 47 HN LYS 47 -5.522 21.061 -38.867 363 HA LYS 47 HA LYS 47 -5.646 23.538 -40.420 364 HB2 LYS 47 HB2 LYS 47 -7.242 20.977 -40.622 365 HB3 LYS 47 HB1 LYS 47 -7.494 22.389 -41.642 366 HG2 LYS 47 HG2 LYS 47 -5.193 22.180 -42.472 367 HG3 LYS 47 HG1 LYS 47 -4.981 20.738 -41.482 368 HD2 LYS 47 HD2 LYS 47 -7.055 21.041 -43.649 369 HD3 LYS 47 HD1 LYS 47 -5.494 20.251 -43.863 370 HE2 LYS 47 HE2 LYS 47 -6.157 18.716 -41.963 371 HE3 LYS 47 HE1 LYS 47 -7.780 19.396 -42.100 372 HZ1 LYS 47 HZ1 LYS 47 -6.282 17.986 -44.250 373 HZ2 LYS 47 HZ2 LYS 47 -7.823 18.677 -44.427 374 HZ3 LYS 47 HZ3 LYS 47 -7.599 17.364 -43.378 375 H SER 48 HN SER 48 -6.554 25.148 -39.358 376 HA SER 48 HA SER 48 -8.568 24.751 -37.351 377 HB2 SER 48 HB2 SER 48 -7.506 27.308 -38.578 378 HB3 SER 48 HB1 SER 48 -8.474 27.189 -37.109 379 HG SER 48 HG SER 48 -6.589 25.620 -36.544 380 H CYS 49 HN CYS 49 -9.219 23.961 -40.131 381 HA CYS 49 HA CYS 49 -11.166 25.873 -41.062 382 HB2 CYS 49 HB2 CYS 49 -9.851 24.295 -42.556 383 HB3 CYS 49 HB1 CYS 49 -10.852 22.992 -41.928 384 HG CYS 49 HG CYS 49 -12.490 23.232 -43.885 385 H GLY 50 HN GLY 50 -12.805 26.172 -39.674 386 HA2 GLY 50 HA2 GLY 50 -14.966 25.361 -38.929 387 HA3 GLY 50 HA1 GLY 50 -14.222 23.785 -38.677 388 H CYS 51 HN CYS 51 -13.871 23.311 -36.614 389 HA CYS 51 HA CYS 51 -12.559 25.225 -34.903 390 HB2 CYS 51 HB2 CYS 51 -14.986 25.785 -34.657 391 HB3 CYS 51 HB1 CYS 51 -15.261 24.148 -34.068 392 HG CYS 51 HG CYS 51 -12.923 25.998 -32.469 393 H GLY 52 HN GLY 52 -11.555 24.264 -33.128 394 HA2 GLY 52 HA2 GLY 52 -11.179 22.396 -31.654 395 HA3 GLY 52 HA1 GLY 52 -11.821 21.337 -32.905 396 H THR 53 HN THR 53 -10.078 19.998 -33.158 397 HA THR 53 HA THR 53 -7.792 21.263 -34.474 398 HB THR 53 HB THR 53 -7.040 20.840 -32.191 399 HG1 THR 53 HG1 THR 53 -5.668 20.378 -34.138 400 HG21 THR 53 HG21 THR 53 -6.882 18.566 -31.298 401 HG22 THR 53 HG22 THR 53 -7.730 17.948 -32.715 402 HG23 THR 53 HG23 THR 53 -8.559 19.024 -31.590 403 H SER 54 HN SER 54 -7.099 20.252 -36.228 404 HA SER 54 HA SER 54 -7.818 17.481 -36.747 405 HB2 SER 54 HB2 SER 54 -8.648 19.757 -38.573 406 HB3 SER 54 HB1 SER 54 -8.757 18.043 -38.979 407 HG SER 54 HG SER 54 -10.024 19.213 -36.727 408 H PHE 55 HN PHE 55 -6.290 16.476 -38.062 409 HA PHE 55 HA PHE 55 -3.969 18.211 -38.560 410 HB2 PHE 55 HB2 PHE 55 -3.979 15.260 -37.900 411 HB3 PHE 55 HB1 PHE 55 -2.557 16.271 -38.119 412 HD1 PHE 55 HD1 PHE 55 -2.067 18.067 -36.472 413 HD2 PHE 55 HD2 PHE 55 -5.124 15.176 -35.843 414 HE1 PHE 55 HE1 PHE 55 -2.074 18.603 -34.072 415 HE2 PHE 55 HE2 PHE 55 -5.139 15.708 -33.441 416 HZ PHE 55 HZ PHE 55 -3.612 17.424 -32.552 417 H ASP 56 HN ASP 56 -3.144 18.333 -40.474 418 HA ASP 56 HA ASP 56 -3.875 16.347 -42.525 419 HB2 ASP 56 HB2 ASP 56 -4.406 18.881 -42.819 420 HB3 ASP 56 HB1 ASP 56 -2.676 19.060 -43.070 421 H ALA 57 HN ALA 57 -2.284 14.916 -42.847 422 HA ALA 57 HA ALA 57 0.421 15.706 -42.007 423 HB1 ALA 57 HB1 ALA 57 -0.579 13.842 -40.769 424 HB2 ALA 57 HB2 ALA 57 0.856 13.336 -41.659 425 HB3 ALA 57 HB3 ALA 57 -0.750 12.938 -42.273 426 H VAL 58 HN VAL 58 1.731 16.220 -43.591 427 HA VAL 58 HA VAL 58 1.452 15.084 -46.243 428 HB VAL 58 HB VAL 58 3.661 16.854 -45.166 429 HG11 VAL 58 HG11 VAL 58 4.282 15.656 -47.187 430 HG12 VAL 58 HG12 VAL 58 4.073 17.374 -47.527 431 HG13 VAL 58 HG13 VAL 58 2.821 16.223 -47.995 432 HG21 VAL 58 HG21 VAL 58 2.459 18.718 -46.217 433 HG22 VAL 58 HG22 VAL 58 1.511 17.967 -44.935 434 HG23 VAL 58 HG23 VAL 58 1.133 17.627 -46.624 435 H ILE 59 HN ILE 59 2.164 13.093 -46.594 436 HA ILE 59 HA ILE 59 4.453 12.162 -45.018 437 HB ILE 59 HB ILE 59 2.459 10.928 -44.468 438 HG12 ILE 59 HG12 ILE 59 4.766 9.753 -44.841 439 HG13 ILE 59 HG11 ILE 59 3.332 8.793 -44.516 440 HG21 ILE 59 HG21 ILE 59 2.226 10.265 -47.391 441 HG22 ILE 59 HG22 ILE 59 1.144 11.291 -46.447 442 HG23 ILE 59 HG23 ILE 59 1.247 9.565 -46.102 443 HD11 ILE 59 HD11 ILE 59 4.676 7.792 -46.262 444 HD12 ILE 59 HD12 ILE 59 4.568 9.268 -47.220 445 HD13 ILE 59 HD13 ILE 59 3.118 8.314 -46.906 446 H VAL 60 HN VAL 60 6.203 12.370 -46.142 447 HA VAL 60 HA VAL 60 6.249 11.528 -48.964 448 HB VAL 60 HB VAL 60 8.234 13.208 -47.410 449 HG11 VAL 60 HG11 VAL 60 8.186 12.468 -50.330 450 HG12 VAL 60 HG12 VAL 60 9.345 11.903 -49.128 451 HG13 VAL 60 HG13 VAL 60 9.302 13.608 -49.581 452 HG21 VAL 60 HG21 VAL 60 6.161 14.411 -47.842 453 HG22 VAL 60 HG22 VAL 60 6.265 14.001 -49.554 454 HG23 VAL 60 HG23 VAL 60 7.474 15.058 -48.826 455 H SER 61 HN SER 61 6.836 9.424 -49.124 456 HA SER 61 HA SER 61 9.122 8.475 -47.609 457 HB2 SER 61 HB2 SER 61 7.322 8.119 -46.011 458 HB3 SER 61 HB1 SER 61 6.372 7.267 -47.227 459 HG SER 61 HG SER 61 8.186 6.264 -45.564 460 H ASN 62 HN ASN 62 9.958 6.492 -48.297 461 HA ASN 62 HA ASN 62 9.649 5.824 -51.034 462 HB2 ASN 62 HB2 ASN 62 10.991 4.373 -48.743 463 HB3 ASN 62 HB1 ASN 62 11.047 3.808 -50.407 464 HD21 ASN 62 HD21 ASN 62 11.252 6.428 -51.583 465 HD22 ASN 62 HD22 ASN 62 12.842 6.999 -51.244 466 H ASN 63 HN ASN 63 7.960 4.947 -48.206 467 HA ASN 63 HA ASN 63 7.037 2.370 -48.909 468 HB2 ASN 63 HB2 ASN 63 6.903 3.424 -46.624 469 HB3 ASN 63 HB1 ASN 63 5.582 4.419 -47.224 470 HD21 ASN 63 HD21 ASN 63 4.089 3.592 -45.816 471 HD22 ASN 63 HD22 ASN 63 3.474 1.981 -45.930 472 H PHE 64 HN PHE 64 6.206 5.517 -50.031 473 HA PHE 64 HA PHE 64 3.846 4.419 -51.406 474 HB2 PHE 64 HB2 PHE 64 3.433 6.393 -49.928 475 HB3 PHE 64 HB1 PHE 64 4.524 7.335 -50.940 476 HD1 PHE 64 HD2 PHE 64 1.499 5.174 -51.272 477 HD2 PHE 64 HD1 PHE 64 3.605 8.624 -52.611 478 HE1 PHE 64 HE2 PHE 64 -0.370 5.726 -52.775 479 HE2 PHE 64 HE1 PHE 64 1.739 9.180 -54.117 480 HZ PHE 64 HZ PHE 64 -0.248 7.730 -54.200 481 H GLU 65 HN GLU 65 6.957 4.637 -51.961 482 HA GLU 65 HA GLU 65 7.056 6.173 -54.370 483 HB2 GLU 65 HB2 GLU 65 9.136 6.262 -53.519 484 HB3 GLU 65 HB1 GLU 65 8.889 4.823 -52.546 485 HG2 GLU 65 HG2 GLU 65 10.641 4.290 -53.945 486 HG3 GLU 65 HG1 GLU 65 9.227 3.524 -54.665 487 H ASP 66 HN ASP 66 6.597 2.848 -53.436 488 HA ASP 66 HA ASP 66 6.694 1.767 -56.069 489 HB2 ASP 66 HB2 ASP 66 5.483 0.782 -53.489 490 HB3 ASP 66 HB1 ASP 66 5.331 -0.116 -54.997 491 H LYS 67 HN LYS 67 4.566 3.821 -54.522 492 HA LYS 67 HA LYS 67 2.742 4.928 -55.246 493 HB2 LYS 67 HB2 LYS 67 3.242 3.448 -57.834 494 HB3 LYS 67 HB1 LYS 67 2.165 4.828 -57.638 495 HG2 LYS 67 HG2 LYS 67 4.000 6.260 -57.075 496 HG3 LYS 67 HG1 LYS 67 5.114 4.894 -57.049 497 HD2 LYS 67 HD2 LYS 67 4.619 4.539 -59.469 498 HD3 LYS 67 HD1 LYS 67 3.675 6.031 -59.441 499 HE2 LYS 67 HE2 LYS 67 5.926 6.450 -60.268 500 HE3 LYS 67 HE1 LYS 67 5.662 7.273 -58.732 501 HZ1 LYS 67 HZ1 LYS 67 6.809 5.396 -57.633 502 HZ2 LYS 67 HZ2 LYS 67 7.807 6.239 -58.710 503 HZ3 LYS 67 HZ3 LYS 67 7.156 4.740 -59.157 504 H LYS 68 HN LYS 68 2.496 2.280 -53.980 505 HA LYS 68 HA LYS 68 -0.013 1.311 -55.086 506 HB2 LYS 68 HB2 LYS 68 1.543 0.392 -52.665 507 HB3 LYS 68 HB1 LYS 68 0.090 -0.377 -53.287 508 HG2 LYS 68 HG2 LYS 68 2.762 -0.182 -54.656 509 HG3 LYS 68 HG1 LYS 68 2.017 -1.627 -53.977 510 HD2 LYS 68 HD2 LYS 68 1.007 -0.026 -56.329 511 HD3 LYS 68 HD1 LYS 68 1.788 -1.604 -56.397 512 HE2 LYS 68 HE2 LYS 68 -0.884 -0.948 -55.166 513 HE3 LYS 68 HE1 LYS 68 -0.594 -1.875 -56.634 514 HZ1 LYS 68 HZ1 LYS 68 -0.055 -2.658 -53.829 515 HZ2 LYS 68 HZ2 LYS 68 0.683 -3.457 -55.133 516 HZ3 LYS 68 HZ3 LYS 68 -1.007 -3.456 -54.987 517 H LEU 69 HN LEU 69 -1.562 2.803 -54.725 518 HA LEU 69 HA LEU 69 -1.624 4.368 -52.334 519 HB2 LEU 69 HB2 LEU 69 -3.739 5.288 -53.266 520 HB3 LEU 69 HB1 LEU 69 -2.354 5.422 -54.331 521 HG LEU 69 HG LEU 69 -3.365 3.168 -55.324 522 HD11 LEU 69 HD11 LEU 69 -5.806 3.260 -55.371 523 HD12 LEU 69 HD12 LEU 69 -5.780 4.600 -54.225 524 HD13 LEU 69 HD13 LEU 69 -5.200 3.009 -53.735 525 HD21 LEU 69 HD21 LEU 69 -4.494 4.537 -57.006 526 HD22 LEU 69 HD22 LEU 69 -2.920 5.206 -56.570 527 HD23 LEU 69 HD23 LEU 69 -4.395 5.933 -55.933 528 H LEU 70 HN LEU 70 -3.412 1.558 -53.492 529 HA LEU 70 HA LEU 70 -5.286 1.582 -51.369 530 HB2 LEU 70 HB2 LEU 70 -5.977 -0.604 -52.054 531 HB3 LEU 70 HB1 LEU 70 -5.737 0.392 -53.463 532 HG LEU 70 HG LEU 70 -5.000 -1.746 -54.054 533 HD11 LEU 70 HD11 LEU 70 -2.522 -0.206 -53.349 534 HD12 LEU 70 HD12 LEU 70 -3.482 -0.037 -54.820 535 HD13 LEU 70 HD13 LEU 70 -2.623 -1.544 -54.493 536 HD21 LEU 70 HD21 LEU 70 -4.879 -2.754 -51.864 537 HD22 LEU 70 HD22 LEU 70 -3.398 -1.863 -51.510 538 HD23 LEU 70 HD23 LEU 70 -3.409 -3.088 -52.780 539 H ASP 71 HN ASP 71 -2.056 0.300 -51.669 540 HA ASP 71 HA ASP 71 -2.144 -1.401 -49.409 541 HB2 ASP 71 HB2 ASP 71 0.102 -0.134 -50.948 542 HB3 ASP 71 HB1 ASP 71 0.424 -1.017 -49.459 543 H ARG 72 HN ARG 72 -0.947 1.928 -49.814 544 HA ARG 72 HA ARG 72 -0.332 2.266 -47.075 545 HB2 ARG 72 HB2 ARG 72 -0.179 4.661 -47.569 546 HB3 ARG 72 HB1 ARG 72 0.653 3.710 -48.786 547 HG2 ARG 72 HG2 ARG 72 -0.417 5.224 -50.106 548 HG3 ARG 72 HG1 ARG 72 -1.627 3.941 -50.067 549 HD2 ARG 72 HD2 ARG 72 -2.713 5.142 -48.156 550 HD3 ARG 72 HD1 ARG 72 -1.590 6.473 -48.431 551 HE ARG 72 HE ARG 72 -3.351 5.562 -50.600 552 HH11 ARG 72 HH11 ARG 72 -2.342 8.048 -48.361 553 HH12 ARG 72 HH12 ARG 72 -3.236 9.315 -49.148 554 HH21 ARG 72 HH21 ARG 72 -4.550 7.232 -51.638 555 HH22 ARG 72 HH22 ARG 72 -4.492 8.842 -51.000 556 H HIS 73 HN HIS 73 -3.281 2.461 -48.875 557 HA HIS 73 HA HIS 73 -4.773 4.030 -47.031 558 HB2 HIS 73 HB2 HIS 73 -5.501 3.815 -49.340 559 HB3 HIS 73 HB1 HIS 73 -5.669 2.074 -49.161 560 HD1 HIS 73 HD1 HIS 73 -7.251 5.289 -47.891 561 HD2 HIS 73 HD2 HIS 73 -8.140 1.247 -48.344 562 HE1 HIS 73 HE1 HIS 73 -9.696 5.060 -47.338 563 HE2 HIS 73 HE2 HIS 73 -10.203 2.600 -47.553 564 H ARG 74 HN ARG 74 -4.586 0.509 -47.594 565 HA ARG 74 HA ARG 74 -6.387 -0.136 -45.511 566 HB2 ARG 74 HB2 ARG 74 -5.568 -2.443 -45.779 567 HB3 ARG 74 HB1 ARG 74 -5.971 -1.693 -47.316 568 HG2 ARG 74 HG2 ARG 74 -3.474 -1.156 -47.490 569 HG3 ARG 74 HG1 ARG 74 -3.271 -2.333 -46.191 570 HD2 ARG 74 HD2 ARG 74 -4.533 -2.826 -48.883 571 HD3 ARG 74 HD1 ARG 74 -2.954 -3.394 -48.347 572 HE ARG 74 HE ARG 74 -4.435 -4.554 -46.524 573 HH11 ARG 74 HH11 ARG 74 -5.165 -4.129 -49.914 574 HH12 ARG 74 HH12 ARG 74 -6.092 -5.591 -50.049 575 HH21 ARG 74 HH21 ARG 74 -5.663 -6.497 -46.680 576 HH22 ARG 74 HH22 ARG 74 -6.336 -6.963 -48.216 577 H LEU 75 HN LEU 75 -2.879 0.220 -45.595 578 HA LEU 75 HA LEU 75 -2.410 -0.745 -42.971 579 HB2 LEU 75 HB2 LEU 75 -0.858 0.779 -44.981 580 HB3 LEU 75 HB1 LEU 75 -0.340 0.933 -43.315 581 HG LEU 75 HG LEU 75 0.930 -0.800 -44.466 582 HD11 LEU 75 HD11 LEU 75 0.578 -2.625 -42.879 583 HD12 LEU 75 HD12 LEU 75 -0.972 -1.924 -42.415 584 HD13 LEU 75 HD13 LEU 75 0.526 -1.054 -42.079 585 HD21 LEU 75 HD21 LEU 75 -1.723 -2.180 -44.845 586 HD22 LEU 75 HD22 LEU 75 -0.141 -2.862 -45.218 587 HD23 LEU 75 HD23 LEU 75 -0.735 -1.466 -46.118 588 H VAL 76 HN VAL 76 -2.752 2.574 -44.244 589 HA VAL 76 HA VAL 76 -2.449 3.841 -41.756 590 HB VAL 76 HB VAL 76 -2.333 4.964 -44.019 591 HG11 VAL 76 HG11 VAL 76 -4.410 4.175 -44.987 592 HG12 VAL 76 HG12 VAL 76 -4.386 5.937 -44.924 593 HG13 VAL 76 HG13 VAL 76 -5.333 5.026 -43.748 594 HG21 VAL 76 HG21 VAL 76 -2.241 6.225 -41.962 595 HG22 VAL 76 HG22 VAL 76 -4.004 6.268 -41.882 596 HG23 VAL 76 HG23 VAL 76 -3.160 7.110 -43.181 597 H ASN 77 HN ASN 77 -5.266 2.486 -43.372 598 HA ASN 77 HA ASN 77 -7.166 3.476 -41.505 599 HB2 ASN 77 HB2 ASN 77 -7.195 1.404 -43.650 600 HB3 ASN 77 HB1 ASN 77 -8.477 1.367 -42.443 601 HD21 ASN 77 HD21 ASN 77 -6.973 4.353 -43.425 602 HD22 ASN 77 HD22 ASN 77 -8.338 4.979 -44.283 603 H THR 78 HN THR 78 -5.143 0.618 -41.617 604 HA THR 78 HA THR 78 -6.408 -0.895 -39.637 605 HB THR 78 HB THR 78 -3.479 -0.771 -40.381 606 HG1 THR 78 HG1 THR 78 -5.014 -1.484 -42.017 607 HG21 THR 78 HG21 THR 78 -4.941 -2.851 -38.750 608 HG22 THR 78 HG22 THR 78 -3.731 -1.722 -38.141 609 HG23 THR 78 HG23 THR 78 -3.271 -2.965 -39.305 610 H ILE 79 HN ILE 79 -3.715 1.435 -39.306 611 HA ILE 79 HA ILE 79 -3.811 1.181 -36.416 612 HB ILE 79 HB ILE 79 -2.136 2.961 -38.192 613 HG12 ILE 79 HG12 ILE 79 -0.308 1.467 -37.086 614 HG13 ILE 79 HG11 ILE 79 -1.644 0.380 -36.738 615 HG21 ILE 79 HG21 ILE 79 -2.493 4.096 -36.082 616 HG22 ILE 79 HG22 ILE 79 -0.832 3.509 -36.185 617 HG23 ILE 79 HG23 ILE 79 -2.014 2.647 -35.198 618 HD11 ILE 79 HD11 ILE 79 -0.790 1.319 -39.463 619 HD12 ILE 79 HD12 ILE 79 -2.139 0.235 -39.124 620 HD13 ILE 79 HD13 ILE 79 -0.488 -0.269 -38.759 621 H LEU 80 HN LEU 80 -4.566 3.698 -38.810 622 HA LEU 80 HA LEU 80 -5.223 5.566 -36.746 623 HB2 LEU 80 HB2 LEU 80 -5.291 5.678 -39.730 624 HB3 LEU 80 HB1 LEU 80 -6.093 6.919 -38.787 625 HG LEU 80 HG LEU 80 -3.895 7.368 -37.646 626 HD11 LEU 80 HD11 LEU 80 -1.858 6.570 -38.720 627 HD12 LEU 80 HD12 LEU 80 -2.820 5.576 -39.816 628 HD13 LEU 80 HD13 LEU 80 -2.815 5.230 -38.086 629 HD21 LEU 80 HD21 LEU 80 -3.980 7.702 -40.638 630 HD22 LEU 80 HD22 LEU 80 -2.951 8.607 -39.528 631 HD23 LEU 80 HD23 LEU 80 -4.704 8.782 -39.446 632 H LYS 81 HN LYS 81 -6.933 2.979 -37.916 633 HA LYS 81 HA LYS 81 -9.563 3.943 -37.994 634 HB2 LYS 81 HB2 LYS 81 -8.922 1.590 -38.493 635 HB3 LYS 81 HB1 LYS 81 -8.609 1.335 -36.782 636 HG2 LYS 81 HG2 LYS 81 -10.765 0.431 -37.406 637 HG3 LYS 81 HG1 LYS 81 -10.961 1.781 -36.287 638 HD2 LYS 81 HD2 LYS 81 -11.486 3.265 -38.152 639 HD3 LYS 81 HD1 LYS 81 -11.257 1.932 -39.285 640 HE2 LYS 81 HE2 LYS 81 -13.092 0.718 -38.185 641 HE3 LYS 81 HE1 LYS 81 -13.335 2.090 -37.108 642 HZ1 LYS 81 HZ1 LYS 81 -14.888 2.067 -38.987 643 HZ2 LYS 81 HZ2 LYS 81 -13.585 2.198 -40.067 644 HZ3 LYS 81 HZ3 LYS 81 -13.916 3.459 -38.979 645 H GLU 82 HN GLU 82 -7.799 2.572 -35.242 646 HA GLU 82 HA GLU 82 -9.643 3.536 -33.291 647 HB2 GLU 82 HB2 GLU 82 -6.777 2.615 -32.927 648 HB3 GLU 82 HB1 GLU 82 -7.984 2.770 -31.659 649 HG2 GLU 82 HG2 GLU 82 -9.255 0.967 -32.530 650 HG3 GLU 82 HG1 GLU 82 -8.289 0.919 -34.004 651 H GLU 83 HN GLU 83 -6.626 4.663 -34.683 652 HA GLU 83 HA GLU 83 -5.936 6.725 -32.965 653 HB2 GLU 83 HB2 GLU 83 -4.669 5.916 -34.940 654 HB3 GLU 83 HB1 GLU 83 -5.804 6.775 -35.972 655 HG2 GLU 83 HG2 GLU 83 -4.074 8.233 -35.833 656 HG3 GLU 83 HG1 GLU 83 -5.146 8.830 -34.575 657 H LEU 84 HN LEU 84 -8.022 6.929 -35.811 658 HA LEU 84 HA LEU 84 -8.609 9.589 -35.906 659 HB2 LEU 84 HB2 LEU 84 -10.387 7.249 -36.541 660 HB3 LEU 84 HB1 LEU 84 -10.857 8.903 -36.875 661 HG LEU 84 HG LEU 84 -8.509 7.434 -38.062 662 HD11 LEU 84 HD11 LEU 84 -9.750 7.660 -40.157 663 HD12 LEU 84 HD12 LEU 84 -11.093 8.394 -39.278 664 HD13 LEU 84 HD13 LEU 84 -10.643 6.717 -38.964 665 HD21 LEU 84 HD21 LEU 84 -9.467 10.254 -38.543 666 HD22 LEU 84 HD22 LEU 84 -8.199 9.429 -39.449 667 HD23 LEU 84 HD23 LEU 84 -7.969 9.788 -37.737 668 H GLN 85 HN GLN 85 -9.918 7.316 -33.595 669 HA GLN 85 HA GLN 85 -12.327 8.534 -32.957 670 HB2 GLN 85 HB2 GLN 85 -10.490 7.150 -31.001 671 HB3 GLN 85 HB1 GLN 85 -12.217 7.402 -30.812 672 HG2 GLN 85 HG2 GLN 85 -10.771 5.507 -32.613 673 HG3 GLN 85 HG1 GLN 85 -12.041 5.181 -31.436 674 HE21 GLN 85 HE21 GLN 85 -11.294 5.991 -34.667 675 HE22 GLN 85 HE22 GLN 85 -12.910 6.017 -35.274 676 H ASN 86 HN ASN 86 -9.155 9.704 -32.331 677 HA ASN 86 HA ASN 86 -10.130 11.494 -30.213 678 HB2 ASN 86 HB2 ASN 86 -7.288 10.995 -31.122 679 HB3 ASN 86 HB1 ASN 86 -7.781 11.956 -29.732 680 HD21 ASN 86 HD21 ASN 86 -7.274 8.797 -30.997 681 HD22 ASN 86 HD22 ASN 86 -7.519 7.935 -29.518 682 H ILE 87 HN ILE 87 -9.876 11.521 -33.480 683 HA ILE 87 HA ILE 87 -9.063 14.360 -33.612 684 HB ILE 87 HB ILE 87 -8.979 12.434 -35.936 685 HG12 ILE 87 HG12 ILE 87 -6.690 13.108 -34.070 686 HG13 ILE 87 HG11 ILE 87 -7.552 11.575 -34.090 687 HG21 ILE 87 HG21 ILE 87 -7.575 15.050 -35.396 688 HG22 ILE 87 HG22 ILE 87 -8.943 14.806 -36.483 689 HG23 ILE 87 HG23 ILE 87 -7.384 14.063 -36.845 690 HD11 ILE 87 HD11 ILE 87 -6.799 11.182 -36.377 691 HD12 ILE 87 HD12 ILE 87 -5.447 11.400 -35.265 692 HD13 ILE 87 HD13 ILE 87 -5.922 12.712 -36.346 693 H HIS 88 HN HIS 88 -10.294 15.734 -35.013 694 HA HIS 88 HA HIS 88 -13.043 14.879 -35.339 695 HB2 HIS 88 HB2 HIS 88 -12.493 17.162 -34.503 696 HB3 HIS 88 HB1 HIS 88 -11.781 17.534 -36.070 697 HD1 HIS 88 HD1 HIS 88 -15.160 16.391 -34.711 698 HD2 HIS 88 HD2 HIS 88 -13.537 18.695 -37.774 699 HE1 HIS 88 HE1 HIS 88 -17.120 17.385 -35.924 700 HE2 HIS 88 HE2 HIS 88 -16.110 18.956 -37.608 701 H ALA 89 HN ALA 89 -10.536 16.251 -37.492 702 HA ALA 89 HA ALA 89 -11.486 14.468 -39.600 703 HB1 ALA 89 HB1 ALA 89 -11.186 17.441 -40.021 704 HB2 ALA 89 HB2 ALA 89 -12.714 16.563 -39.931 705 HB3 ALA 89 HB3 ALA 89 -11.593 16.246 -41.254 706 H PHE 90 HN PHE 90 -9.553 13.331 -39.392 707 HA PHE 90 HA PHE 90 -7.044 14.716 -39.819 708 HB2 PHE 90 HB2 PHE 90 -7.207 12.778 -38.259 709 HB3 PHE 90 HB1 PHE 90 -7.587 11.743 -39.629 710 HD1 PHE 90 HD1 PHE 90 -4.971 13.739 -38.009 711 HD2 PHE 90 HD2 PHE 90 -5.878 11.004 -41.138 712 HE1 PHE 90 HE1 PHE 90 -2.567 13.370 -38.377 713 HE2 PHE 90 HE2 PHE 90 -3.473 10.628 -41.511 714 HZ PHE 90 HZ PHE 90 -1.817 11.812 -40.128 715 H SER 91 HN SER 91 -5.832 14.654 -41.675 716 HA SER 91 HA SER 91 -6.805 13.059 -43.930 717 HB2 SER 91 HB2 SER 91 -6.109 15.991 -44.213 718 HB3 SER 91 HB1 SER 91 -6.798 14.929 -45.441 719 HG SER 91 HG SER 91 -8.494 14.757 -43.535 720 H MET 92 HN MET 92 -5.138 12.841 -45.626 721 HA MET 92 HA MET 92 -2.444 13.544 -44.728 722 HB2 MET 92 HB2 MET 92 -1.578 11.336 -45.039 723 HB3 MET 92 HB1 MET 92 -2.958 11.220 -43.963 724 HG2 MET 92 HG2 MET 92 -3.043 10.615 -46.910 725 HG3 MET 92 HG1 MET 92 -2.808 9.409 -45.650 726 HE1 MET 92 HE1 MET 92 -6.233 9.582 -43.734 727 HE2 MET 92 HE2 MET 92 -4.759 10.480 -43.369 728 HE3 MET 92 HE3 MET 92 -4.662 8.783 -43.837 729 H LYS 93 HN LYS 93 -0.940 13.802 -46.320 730 HA LYS 93 HA LYS 93 -1.909 13.632 -49.106 731 HB2 LYS 93 HB2 LYS 93 -0.275 15.659 -47.660 732 HB3 LYS 93 HB1 LYS 93 0.172 15.317 -49.322 733 HG2 LYS 93 HG2 LYS 93 -1.312 17.252 -49.116 734 HG3 LYS 93 HG1 LYS 93 -2.025 15.963 -50.086 735 HD2 LYS 93 HD2 LYS 93 -3.543 15.391 -48.407 736 HD3 LYS 93 HD1 LYS 93 -2.609 16.216 -47.156 737 HE2 LYS 93 HE2 LYS 93 -3.949 17.640 -49.445 738 HE3 LYS 93 HE1 LYS 93 -4.711 17.390 -47.874 739 HZ1 LYS 93 HZ1 LYS 93 -3.621 19.572 -48.076 740 HZ2 LYS 93 HZ2 LYS 93 -2.127 18.798 -48.282 741 HZ3 LYS 93 HZ3 LYS 93 -2.970 18.631 -46.820 742 H CYS 94 HN CYS 94 -1.049 11.886 -50.035 743 HA CYS 94 HA CYS 94 1.458 10.804 -49.059 744 HB2 CYS 94 HB2 CYS 94 0.949 8.984 -50.742 745 HB3 CYS 94 HB1 CYS 94 -0.244 9.187 -49.463 746 HG CYS 94 HG CYS 94 -0.703 10.735 -52.457 747 H HIS 95 HN HIS 95 3.369 11.240 -49.920 748 HA HIS 95 HA HIS 95 3.572 11.827 -52.772 749 HB2 HIS 95 HB2 HIS 95 4.072 13.769 -50.607 750 HB3 HIS 95 HB1 HIS 95 5.330 13.671 -51.834 751 HD1 HIS 95 HD1 HIS 95 1.699 14.573 -51.409 752 HD2 HIS 95 HD2 HIS 95 4.675 14.736 -54.301 753 HE1 HIS 95 HE1 HIS 95 0.782 16.033 -53.238 754 HE2 HIS 95 HE2 HIS 95 2.507 15.911 -55.075 755 H THR 96 HN THR 96 5.777 11.762 -53.558 756 HA THR 96 HA THR 96 7.357 9.800 -52.070 757 HB THR 96 HB THR 96 8.525 9.565 -54.344 758 HG1 THR 96 HG1 THR 96 6.913 10.191 -56.070 759 HG21 THR 96 HG21 THR 96 5.610 8.813 -54.109 760 HG22 THR 96 HG22 THR 96 6.966 7.914 -53.428 761 HG23 THR 96 HG23 THR 96 6.794 8.062 -55.181 762 HA PRO 97 HA PRO 97 10.755 12.575 -51.318 763 HB2 PRO 97 HB2 PRO 97 12.488 10.385 -52.329 764 HB3 PRO 97 HB1 PRO 97 12.544 11.241 -50.784 765 HG2 PRO 97 HG2 PRO 97 11.618 8.749 -50.922 766 HG3 PRO 97 HG1 PRO 97 10.861 9.945 -49.854 767 HD2 PRO 97 HD2 PRO 97 9.942 8.922 -52.511 768 HD3 PRO 97 HD1 PRO 97 8.991 9.309 -51.061 769 H LEU 98 HN LEU 98 10.523 10.785 -54.326 770 HA LEU 98 HA LEU 98 12.380 12.110 -55.905 771 HB2 LEU 98 HB2 LEU 98 10.658 10.125 -56.331 772 HB3 LEU 98 HB1 LEU 98 9.717 11.414 -57.052 773 HG LEU 98 HG LEU 98 11.015 10.144 -58.709 774 HD11 LEU 98 HD11 LEU 98 11.938 12.993 -58.383 775 HD12 LEU 98 HD12 LEU 98 10.464 12.459 -59.191 776 HD13 LEU 98 HD13 LEU 98 12.039 12.037 -59.861 777 HD21 LEU 98 HD21 LEU 98 13.418 11.212 -57.243 778 HD22 LEU 98 HD22 LEU 98 13.448 10.339 -58.776 779 HD23 LEU 98 HD23 LEU 98 12.900 9.528 -57.308 780 H GLU 99 HN GLU 99 8.990 12.929 -55.269 781 HA GLU 99 HA GLU 99 8.901 15.283 -56.841 782 HB2 GLU 99 HB2 GLU 99 6.871 14.115 -56.182 783 HB3 GLU 99 HB1 GLU 99 7.231 14.384 -54.483 784 HG2 GLU 99 HG2 GLU 99 5.590 15.950 -54.995 785 HG3 GLU 99 HG1 GLU 99 7.094 16.867 -55.013 786 H TYR 100 HN TYR 100 9.276 14.763 -53.341 787 HA TYR 100 HA TYR 100 9.413 17.479 -52.642 788 HB2 TYR 100 HB2 TYR 100 8.957 15.590 -51.060 789 HB3 TYR 100 HB1 TYR 100 10.668 15.180 -51.131 790 HD1 TYR 100 HD1 TYR 100 8.329 17.928 -50.240 791 HD2 TYR 100 HD2 TYR 100 12.199 16.244 -49.711 792 HE1 TYR 100 HE1 TYR 100 8.782 19.548 -48.449 793 HE2 TYR 100 HE2 TYR 100 12.664 17.860 -47.920 794 HH TYR 100 HH TYR 100 10.261 19.740 -46.470 795 H ASP 101 HN ASP 101 11.843 15.214 -53.690 796 HA ASP 101 HA ASP 101 14.186 16.521 -52.983 797 HB2 ASP 101 HB2 ASP 101 14.005 14.239 -53.969 798 HB3 ASP 101 HB1 ASP 101 13.676 14.975 -55.531 799 H LYS 102 HN LYS 102 11.969 17.164 -55.631 800 HA LYS 102 HA LYS 102 13.667 19.114 -56.894 801 HB2 LYS 102 HB2 LYS 102 10.851 18.189 -57.262 802 HB3 LYS 102 HB1 LYS 102 11.282 19.771 -57.887 803 HG2 LYS 102 HG2 LYS 102 11.489 18.257 -59.679 804 HG3 LYS 102 HG1 LYS 102 13.129 18.651 -59.174 805 HD2 LYS 102 HD2 LYS 102 11.806 16.244 -58.019 806 HD3 LYS 102 HD1 LYS 102 12.410 16.171 -59.675 807 HE2 LYS 102 HE2 LYS 102 14.629 16.783 -58.924 808 HE3 LYS 102 HE1 LYS 102 14.042 16.974 -57.271 809 HZ1 LYS 102 HZ1 LYS 102 14.243 14.461 -58.837 810 HZ2 LYS 102 HZ2 LYS 102 13.407 14.581 -57.370 811 HZ3 LYS 102 HZ3 LYS 102 15.075 14.875 -57.416 812 H LEU 103 HN LEU 103 10.929 19.158 -54.677 813 HA LEU 103 HA LEU 103 10.500 21.947 -54.691 814 HB2 LEU 103 HB2 LEU 103 9.828 19.936 -52.542 815 HB3 LEU 103 HB1 LEU 103 9.153 21.546 -52.686 816 HG LEU 103 HG LEU 103 8.765 19.303 -54.672 817 HD11 LEU 103 HD11 LEU 103 6.866 20.515 -52.666 818 HD12 LEU 103 HD12 LEU 103 7.588 18.907 -52.575 819 HD13 LEU 103 HD13 LEU 103 6.458 19.294 -53.872 820 HD21 LEU 103 HD21 LEU 103 7.124 20.800 -55.704 821 HD22 LEU 103 HD22 LEU 103 8.747 21.489 -55.744 822 HD23 LEU 103 HD23 LEU 103 7.571 22.073 -54.566 823 H LYS 104 HN LYS 104 12.253 19.847 -52.425 824 HA LYS 104 HA LYS 104 12.898 21.752 -50.486 825 HB2 LYS 104 HB2 LYS 104 14.678 20.205 -49.806 826 HB3 LYS 104 HB1 LYS 104 13.187 19.335 -50.159 827 HG2 LYS 104 HG2 LYS 104 14.011 18.531 -52.201 828 HG3 LYS 104 HG1 LYS 104 15.345 19.678 -52.211 829 HD2 LYS 104 HD2 LYS 104 16.208 18.491 -50.153 830 HD3 LYS 104 HD1 LYS 104 15.003 17.239 -50.486 831 HE2 LYS 104 HE2 LYS 104 15.954 16.991 -52.754 832 HE3 LYS 104 HE1 LYS 104 17.199 18.162 -52.328 833 HZ1 LYS 104 HZ1 LYS 104 16.769 15.548 -50.992 834 HZ2 LYS 104 HZ2 LYS 104 17.978 16.667 -50.601 835 HZ3 LYS 104 HZ3 LYS 104 17.988 15.893 -52.108 836 H SER 105 HN SER 105 14.236 21.229 -53.617 837 HA SER 105 HA SER 105 16.850 22.175 -53.249 838 HB2 SER 105 HB2 SER 105 16.198 20.863 -55.197 839 HB3 SER 105 HB1 SER 105 15.101 22.137 -55.722 840 HG SER 105 HG SER 105 17.916 22.444 -55.435 841 H LYS 106 HN LYS 106 13.858 23.847 -53.393 842 HA LYS 106 HA LYS 106 15.289 26.374 -53.228 843 HB2 LYS 106 HB2 LYS 106 13.508 27.393 -54.814 844 HB3 LYS 106 HB1 LYS 106 14.915 26.596 -55.491 845 HG2 LYS 106 HG2 LYS 106 12.355 25.096 -55.113 846 HG3 LYS 106 HG1 LYS 106 12.578 26.157 -56.504 847 HD2 LYS 106 HD2 LYS 106 14.322 23.810 -55.745 848 HD3 LYS 106 HD1 LYS 106 13.163 23.864 -57.074 849 HE2 LYS 106 HE2 LYS 106 14.455 25.524 -58.220 850 HE3 LYS 106 HE1 LYS 106 15.530 25.715 -56.838 851 HZ1 LYS 106 HZ1 LYS 106 16.274 23.419 -57.167 852 HZ2 LYS 106 HZ2 LYS 106 16.576 24.376 -58.531 853 HZ3 LYS 106 HZ3 LYS 106 15.280 23.290 -58.533 854 H GLY 107 HN GLY 107 12.177 24.723 -53.061 855 HA2 GLY 107 HA2 GLY 107 10.787 24.883 -51.124 856 HA3 GLY 107 HA1 GLY 107 11.477 26.467 -50.800 857 H SER 108 HN SER 108 10.623 25.760 -54.034 858 HA SER 108 HA SER 108 8.299 27.544 -53.796 859 HB2 SER 108 HB2 SER 108 10.309 28.380 -55.102 860 HB3 SER 108 HB1 SER 108 9.995 27.094 -56.265 861 HG SER 108 HG SER 108 8.111 28.052 -56.845 Start of MODEL 19 1 H1 MET 1 HT1 MET 1 7.607 22.016 -57.194 2 H2 MET 1 HT2 MET 1 7.506 21.595 -58.830 3 H3 MET 1 HT3 MET 1 6.471 20.867 -57.698 4 HA MET 1 HA MET 1 6.504 23.724 -58.470 5 HB2 MET 1 HB2 MET 1 4.310 23.293 -59.447 6 HB3 MET 1 HB1 MET 1 5.518 22.242 -60.175 7 HG2 MET 1 HG2 MET 1 4.757 20.372 -58.891 8 HG3 MET 1 HG1 MET 1 3.670 21.402 -57.959 9 HE1 MET 1 HE1 MET 1 1.009 22.424 -60.645 10 HE2 MET 1 HE2 MET 1 2.469 23.302 -60.188 11 HE3 MET 1 HE3 MET 1 1.482 22.534 -58.947 12 H GLY 2 HN GLY 2 5.179 25.090 -57.301 13 HA2 GLY 2 HA2 GLY 2 3.634 25.751 -55.709 14 HA3 GLY 2 HA1 GLY 2 3.272 24.060 -55.401 15 H SER 3 HN SER 3 4.512 22.914 -53.901 16 HA SER 3 HA SER 3 5.324 24.461 -51.657 17 HB2 SER 3 HB2 SER 3 5.813 21.510 -52.063 18 HB3 SER 3 HB1 SER 3 5.569 22.374 -50.542 19 HG SER 3 HG SER 3 3.430 22.909 -51.826 20 H SER 4 HN SER 4 7.285 25.299 -51.256 21 HA SER 4 HA SER 4 9.664 23.865 -52.046 22 HB2 SER 4 HB2 SER 4 9.095 25.173 -54.077 23 HB3 SER 4 HB1 SER 4 9.166 26.652 -53.121 24 HG SER 4 HG SER 4 11.319 24.827 -53.479 25 H HIS 5 HN HIS 5 11.305 24.223 -50.707 26 HA HIS 5 HA HIS 5 11.685 26.720 -49.331 27 HB2 HIS 5 HB2 HIS 5 10.061 25.355 -47.874 28 HB3 HIS 5 HB1 HIS 5 11.399 24.243 -47.615 29 HD1 HIS 5 HD1 HIS 5 10.240 25.589 -45.182 30 HD2 HIS 5 HD2 HIS 5 13.340 27.254 -47.410 31 HE1 HIS 5 HE1 HIS 5 11.416 27.184 -43.635 32 HE2 HIS 5 HE2 HIS 5 13.178 28.300 -45.048 33 H HIS 6 HN HIS 6 13.785 27.031 -49.718 34 HA HIS 6 HA HIS 6 15.304 24.985 -50.911 35 HB2 HIS 6 HB2 HIS 6 16.107 27.726 -49.943 36 HB3 HIS 6 HB1 HIS 6 17.189 26.651 -50.825 37 HD1 HIS 6 HD1 HIS 6 16.662 26.240 -53.341 38 HD2 HIS 6 HD2 HIS 6 14.156 28.980 -51.477 39 HE1 HIS 6 HE1 HIS 6 15.399 27.371 -55.196 40 HE2 HIS 6 HE2 HIS 6 14.087 29.189 -54.049 41 H HIS 7 HN HIS 7 16.063 23.325 -49.957 42 HA HIS 7 HA HIS 7 17.647 23.600 -47.494 43 HB2 HIS 7 HB2 HIS 7 15.404 21.671 -48.053 44 HB3 HIS 7 HB1 HIS 7 16.726 21.198 -46.996 45 HD1 HIS 7 HD1 HIS 7 14.501 21.024 -45.368 46 HD2 HIS 7 HD2 HIS 7 15.970 24.810 -46.275 47 HE1 HIS 7 HE1 HIS 7 13.564 22.560 -43.608 48 HE2 HIS 7 HE2 HIS 7 14.630 24.799 -44.061 49 H HIS 8 HN HIS 8 19.049 21.657 -47.187 50 HA HIS 8 HA HIS 8 19.716 20.362 -49.753 51 HB2 HIS 8 HB2 HIS 8 22.016 20.046 -48.886 52 HB3 HIS 8 HB1 HIS 8 21.590 21.746 -49.023 53 HD1 HIS 8 HD1 HIS 8 22.696 19.178 -46.604 54 HD2 HIS 8 HD2 HIS 8 21.205 23.063 -46.508 55 HE1 HIS 8 HE1 HIS 8 23.179 20.036 -44.288 56 HE2 HIS 8 HE2 HIS 8 22.174 22.349 -44.218 57 H HIS 9 HN HIS 9 20.931 18.136 -49.181 58 HA HIS 9 HA HIS 9 19.092 16.508 -47.803 59 HB2 HIS 9 HB2 HIS 9 21.984 16.024 -48.547 60 HB3 HIS 9 HB1 HIS 9 20.972 14.800 -47.784 61 HD1 HIS 9 HD1 HIS 9 22.167 14.395 -50.622 62 HD2 HIS 9 HD2 HIS 9 18.350 15.850 -49.834 63 HE1 HIS 9 HE1 HIS 9 20.823 13.945 -52.702 64 HE2 HIS 9 HE2 HIS 9 18.541 14.937 -52.246 65 H HIS 10 HN HIS 10 18.775 16.199 -45.706 66 HA HIS 10 HA HIS 10 19.854 18.139 -43.983 67 HB2 HIS 10 HB2 HIS 10 17.558 16.864 -43.954 68 HB3 HIS 10 HB1 HIS 10 18.422 15.745 -42.905 69 HD1 HIS 10 HD1 HIS 10 18.701 16.416 -40.496 70 HD2 HIS 10 HD2 HIS 10 17.384 19.545 -42.901 71 HE1 HIS 10 HE1 HIS 10 18.102 18.284 -38.915 72 HE2 HIS 10 HE2 HIS 10 17.396 20.200 -40.398 73 H SER 11 HN SER 11 20.960 15.027 -44.782 74 HA SER 11 HA SER 11 22.771 13.825 -44.156 75 HB2 SER 11 HB2 SER 11 23.505 16.328 -42.615 76 HB3 SER 11 HB1 SER 11 24.590 14.976 -42.937 77 HG SER 11 HG SER 11 24.609 16.905 -44.422 78 H SER 12 HN SER 12 20.293 13.785 -42.670 79 HA SER 12 HA SER 12 21.188 13.025 -39.988 80 HB2 SER 12 HB2 SER 12 18.377 13.285 -41.091 81 HB3 SER 12 HB1 SER 12 18.810 12.986 -39.408 82 HG SER 12 HG SER 12 19.423 15.024 -39.168 83 H GLY 13 HN GLY 13 20.157 10.983 -39.114 84 HA2 GLY 13 HA2 GLY 13 19.110 8.927 -40.552 85 HA3 GLY 13 HA1 GLY 13 20.817 8.858 -40.953 86 H ARG 14 HN ARG 14 21.138 9.975 -37.997 87 HA ARG 14 HA ARG 14 21.147 7.251 -36.884 88 HB2 ARG 14 HB2 ARG 14 23.074 7.717 -35.665 89 HB3 ARG 14 HB1 ARG 14 23.355 8.533 -37.191 90 HG2 ARG 14 HG2 ARG 14 22.388 9.886 -34.682 91 HG3 ARG 14 HG1 ARG 14 24.066 9.828 -35.212 92 HD2 ARG 14 HD2 ARG 14 21.765 11.100 -36.689 93 HD3 ARG 14 HD1 ARG 14 23.035 11.948 -35.809 94 HE ARG 14 HE ARG 14 24.309 10.357 -37.682 95 HH11 ARG 14 HH11 ARG 14 22.024 13.037 -37.692 96 HH12 ARG 14 HH12 ARG 14 22.586 13.652 -39.222 97 HH21 ARG 14 HH21 ARG 14 25.019 11.171 -39.696 98 HH22 ARG 14 HH22 ARG 14 24.263 12.592 -40.360 99 H GLU 15 HN GLU 15 19.777 10.352 -36.525 100 HA GLU 15 HA GLU 15 19.272 10.026 -33.684 101 HB2 GLU 15 HB2 GLU 15 18.065 12.231 -33.920 102 HB3 GLU 15 HB1 GLU 15 19.786 12.254 -34.259 103 HG2 GLU 15 HG2 GLU 15 17.773 11.992 -36.460 104 HG3 GLU 15 HG1 GLU 15 18.218 13.564 -35.795 105 H ASN 16 HN ASN 16 17.977 8.451 -36.072 106 HA ASN 16 HA ASN 16 15.177 8.870 -35.567 107 HB2 ASN 16 HB2 ASN 16 14.749 7.016 -37.006 108 HB3 ASN 16 HB1 ASN 16 16.098 7.888 -37.718 109 HD21 ASN 16 HD21 ASN 16 18.104 6.922 -37.817 110 HD22 ASN 16 HD22 ASN 16 18.359 5.251 -37.453 111 H LEU 17 HN LEU 17 17.704 7.411 -33.936 112 HA LEU 17 HA LEU 17 16.019 5.580 -32.418 113 HB2 LEU 17 HB2 LEU 17 18.960 6.253 -32.228 114 HB3 LEU 17 HB1 LEU 17 18.146 5.174 -31.115 115 HG LEU 17 HG LEU 17 17.550 3.769 -33.178 116 HD11 LEU 17 HD11 LEU 17 19.769 5.437 -34.351 117 HD12 LEU 17 HD12 LEU 17 18.086 5.427 -34.879 118 HD13 LEU 17 HD13 LEU 17 19.079 3.983 -35.069 119 HD21 LEU 17 HD21 LEU 17 19.715 2.637 -33.114 120 HD22 LEU 17 HD22 LEU 17 19.178 3.097 -31.498 121 HD23 LEU 17 HD23 LEU 17 20.425 4.040 -32.316 122 H TYR 18 HN TYR 18 16.445 8.800 -32.457 123 HA TYR 18 HA TYR 18 16.319 9.046 -29.531 124 HB2 TYR 18 HB2 TYR 18 17.649 10.853 -31.540 125 HB3 TYR 18 HB1 TYR 18 17.285 11.357 -29.894 126 HD1 TYR 18 HD2 TYR 18 19.375 9.153 -31.971 127 HD2 TYR 18 HD1 TYR 18 18.532 10.511 -28.031 128 HE1 TYR 18 HE2 TYR 18 21.485 8.161 -31.186 129 HE2 TYR 18 HE1 TYR 18 20.638 9.525 -27.231 130 HH TYR 18 HH TYR 18 22.219 7.814 -27.844 131 H PHE 19 HN PHE 19 14.123 9.030 -29.428 132 HA PHE 19 HA PHE 19 12.748 11.325 -30.621 133 HB2 PHE 19 HB2 PHE 19 11.842 9.086 -31.224 134 HB3 PHE 19 HB1 PHE 19 11.552 8.771 -29.516 135 HD1 PHE 19 HD1 PHE 19 10.976 11.669 -31.733 136 HD2 PHE 19 HD2 PHE 19 9.296 8.852 -29.041 137 HE1 PHE 19 HE1 PHE 19 8.786 12.786 -31.947 138 HE2 PHE 19 HE2 PHE 19 7.102 9.952 -29.240 139 HZ PHE 19 HZ PHE 19 6.845 11.923 -30.696 140 H GLN 20 HN GLN 20 13.623 12.680 -28.951 141 HA GLN 20 HA GLN 20 11.975 12.579 -26.549 142 HB2 GLN 20 HB2 GLN 20 13.827 13.072 -25.065 143 HB3 GLN 20 HB1 GLN 20 14.127 11.565 -25.909 144 HG2 GLN 20 HG2 GLN 20 15.337 14.212 -26.679 145 HG3 GLN 20 HG1 GLN 20 16.120 13.020 -25.647 146 HE21 GLN 20 HE21 GLN 20 15.245 13.882 -28.870 147 HE22 GLN 20 HE22 GLN 20 16.093 12.605 -29.668 148 H GLY 21 HN GLY 21 11.157 14.469 -25.990 149 HA2 GLY 21 HA2 GLY 21 12.442 16.970 -26.317 150 HA3 GLY 21 HA1 GLY 21 11.295 16.722 -27.627 151 H HIS 22 HN HIS 22 9.065 16.262 -27.046 152 HA HIS 22 HA HIS 22 8.248 16.884 -24.330 153 HB2 HIS 22 HB2 HIS 22 8.380 19.085 -25.529 154 HB3 HIS 22 HB1 HIS 22 7.180 18.486 -26.669 155 HD1 HIS 22 HD1 HIS 22 4.793 18.873 -26.056 156 HD2 HIS 22 HD2 HIS 22 7.345 19.229 -22.791 157 HE1 HIS 22 HE1 HIS 22 3.355 19.688 -24.154 158 HE2 HIS 22 HE2 HIS 22 4.952 20.021 -22.228 159 H MET 23 HN MET 23 6.369 15.869 -23.776 160 HA MET 23 HA MET 23 5.249 14.088 -25.803 161 HB2 MET 23 HB2 MET 23 4.885 14.148 -22.804 162 HB3 MET 23 HB1 MET 23 4.166 12.958 -23.880 163 HG2 MET 23 HG2 MET 23 6.416 12.231 -24.546 164 HG3 MET 23 HG1 MET 23 7.106 13.389 -23.409 165 HE1 MET 23 HE1 MET 23 4.953 10.135 -23.817 166 HE2 MET 23 HE2 MET 23 3.865 11.204 -22.935 167 HE3 MET 23 HE3 MET 23 4.528 9.773 -22.144 168 H CYS 24 HN CYS 24 3.373 14.428 -26.718 169 HA CYS 24 HA CYS 24 1.179 15.661 -25.314 170 HB2 CYS 24 HB2 CYS 24 2.374 17.624 -26.274 171 HB3 CYS 24 HB1 CYS 24 2.216 16.910 -27.876 172 HG CYS 24 HG CYS 24 -0.639 17.384 -26.125 173 H ILE 25 HN ILE 25 -0.842 15.242 -26.390 174 HA ILE 25 HA ILE 25 -1.003 12.685 -27.441 175 HB ILE 25 HB ILE 25 -2.919 13.806 -26.409 176 HG12 ILE 25 HG12 ILE 25 -4.669 13.045 -27.986 177 HG13 ILE 25 HG11 ILE 25 -3.452 12.911 -29.251 178 HG21 ILE 25 HG21 ILE 25 -2.651 16.031 -27.323 179 HG22 ILE 25 HG22 ILE 25 -4.267 15.415 -27.674 180 HG23 ILE 25 HG23 ILE 25 -3.036 15.434 -28.937 181 HD11 ILE 25 HD11 ILE 25 -3.942 10.741 -28.320 182 HD12 ILE 25 HD12 ILE 25 -3.557 11.319 -26.699 183 HD13 ILE 25 HD13 ILE 25 -2.289 11.207 -27.922 184 H GLN 26 HN GLN 26 -0.806 15.759 -29.195 185 HA GLN 26 HA GLN 26 -1.343 14.752 -31.763 186 HB2 GLN 26 HB2 GLN 26 -1.322 17.150 -31.290 187 HB3 GLN 26 HB1 GLN 26 0.403 17.085 -30.953 188 HG2 GLN 26 HG2 GLN 26 0.772 16.350 -33.298 189 HG3 GLN 26 HG1 GLN 26 -0.946 16.606 -33.597 190 HE21 GLN 26 HE21 GLN 26 1.451 17.879 -34.734 191 HE22 GLN 26 HE22 GLN 26 1.219 19.584 -34.502 192 H LYS 27 HN LYS 27 1.764 15.326 -30.126 193 HA LYS 27 HA LYS 27 3.358 14.318 -32.219 194 HB2 LYS 27 HB2 LYS 27 4.230 15.810 -30.469 195 HB3 LYS 27 HB1 LYS 27 4.000 14.545 -29.271 196 HG2 LYS 27 HG2 LYS 27 6.332 14.729 -29.958 197 HG3 LYS 27 HG1 LYS 27 5.653 13.155 -30.378 198 HD2 LYS 27 HD2 LYS 27 6.970 13.921 -32.228 199 HD3 LYS 27 HD1 LYS 27 5.268 14.014 -32.689 200 HE2 LYS 27 HE2 LYS 27 5.282 16.418 -32.168 201 HE3 LYS 27 HE1 LYS 27 6.995 16.309 -31.760 202 HZ1 LYS 27 HZ1 LYS 27 6.786 17.110 -33.984 203 HZ2 LYS 27 HZ2 LYS 27 5.757 15.837 -34.421 204 HZ3 LYS 27 HZ3 LYS 27 7.388 15.527 -34.065 205 H VAL 28 HN VAL 28 1.784 12.788 -29.480 206 HA VAL 28 HA VAL 28 3.044 10.278 -29.626 207 HB VAL 28 HB VAL 28 0.217 10.946 -28.769 208 HG11 VAL 28 HG11 VAL 28 0.244 8.773 -27.620 209 HG12 VAL 28 HG12 VAL 28 1.811 8.417 -28.347 210 HG13 VAL 28 HG13 VAL 28 0.384 8.587 -29.369 211 HG21 VAL 28 HG21 VAL 28 1.134 10.755 -26.499 212 HG22 VAL 28 HG22 VAL 28 1.931 12.032 -27.417 213 HG23 VAL 28 HG23 VAL 28 2.738 10.482 -27.175 214 H ILE 29 HN ILE 29 0.116 11.519 -31.213 215 HA ILE 29 HA ILE 29 -0.463 9.210 -32.719 216 HB ILE 29 HB ILE 29 -1.060 12.090 -33.425 217 HG12 ILE 29 HG12 ILE 29 -1.984 11.542 -31.244 218 HG13 ILE 29 HG11 ILE 29 -3.283 11.642 -32.426 219 HG21 ILE 29 HG21 ILE 29 -1.297 10.621 -35.341 220 HG22 ILE 29 HG22 ILE 29 -2.877 11.169 -34.783 221 HG23 ILE 29 HG23 ILE 29 -2.327 9.537 -34.405 222 HD11 ILE 29 HD11 ILE 29 -3.604 9.780 -30.906 223 HD12 ILE 29 HD12 ILE 29 -2.045 9.107 -31.383 224 HD13 ILE 29 HD13 ILE 29 -3.357 9.212 -32.557 225 H GLU 30 HN GLU 30 1.474 12.085 -33.442 226 HA GLU 30 HA GLU 30 2.164 11.553 -36.071 227 HB2 GLU 30 HB2 GLU 30 3.778 12.845 -33.873 228 HB3 GLU 30 HB1 GLU 30 4.279 12.827 -35.558 229 HG2 GLU 30 HG2 GLU 30 2.250 14.055 -36.167 230 HG3 GLU 30 HG1 GLU 30 1.771 14.086 -34.469 231 H ASP 31 HN ASP 31 3.901 10.554 -33.123 232 HA ASP 31 HA ASP 31 5.879 9.049 -34.498 233 HB2 ASP 31 HB2 ASP 31 6.334 9.831 -32.266 234 HB3 ASP 31 HB1 ASP 31 4.941 8.965 -31.627 235 H LYS 32 HN LYS 32 2.735 8.302 -33.212 236 HA LYS 32 HA LYS 32 2.890 5.516 -33.118 237 HB2 LYS 32 HB2 LYS 32 1.133 6.706 -32.011 238 HB3 LYS 32 HB1 LYS 32 0.591 7.422 -33.519 239 HG2 LYS 32 HG2 LYS 32 -0.970 5.775 -32.990 240 HG3 LYS 32 HG1 LYS 32 0.021 5.095 -34.277 241 HD2 LYS 32 HD2 LYS 32 0.880 3.489 -32.944 242 HD3 LYS 32 HD1 LYS 32 0.893 4.528 -31.514 243 HE2 LYS 32 HE2 LYS 32 -0.782 2.535 -31.649 244 HE3 LYS 32 HE1 LYS 32 -1.312 4.088 -31.006 245 HZ1 LYS 32 HZ1 LYS 32 -2.921 3.199 -32.564 246 HZ2 LYS 32 HZ2 LYS 32 -1.750 3.115 -33.781 247 HZ3 LYS 32 HZ3 LYS 32 -2.243 4.629 -33.187 248 H LEU 33 HN LEU 33 1.452 7.569 -35.689 249 HA LEU 33 HA LEU 33 1.167 5.331 -37.431 250 HB2 LEU 33 HB2 LEU 33 0.458 6.960 -39.113 251 HB3 LEU 33 HB1 LEU 33 -0.383 7.160 -37.591 252 HG LEU 33 HG LEU 33 1.485 8.997 -37.193 253 HD11 LEU 33 HD11 LEU 33 2.708 8.555 -39.249 254 HD12 LEU 33 HD12 LEU 33 2.021 10.180 -39.262 255 HD13 LEU 33 HD13 LEU 33 1.259 8.893 -40.197 256 HD21 LEU 33 HD21 LEU 33 -0.933 9.386 -38.950 257 HD22 LEU 33 HD22 LEU 33 -0.077 10.660 -38.080 258 HD23 LEU 33 HD23 LEU 33 -0.913 9.391 -37.186 259 H SER 34 HN SER 34 3.702 7.690 -36.930 260 HA SER 34 HA SER 34 4.962 7.266 -39.454 261 HB2 SER 34 HB2 SER 34 6.895 8.466 -38.469 262 HB3 SER 34 HB1 SER 34 5.376 9.335 -38.265 263 HG SER 34 HG SER 34 5.453 9.028 -36.170 264 H SER 35 HN SER 35 5.290 5.783 -36.282 265 HA SER 35 HA SER 35 7.607 4.284 -36.865 266 HB2 SER 35 HB2 SER 35 5.353 3.761 -34.920 267 HB3 SER 35 HB1 SER 35 6.848 2.823 -34.978 268 HG SER 35 HG SER 35 6.433 5.491 -34.192 269 H ALA 36 HN ALA 36 4.277 3.861 -37.726 270 HA ALA 36 HA ALA 36 4.673 1.094 -38.517 271 HB1 ALA 36 HB1 ALA 36 2.578 1.750 -37.445 272 HB2 ALA 36 HB2 ALA 36 2.307 1.112 -39.066 273 HB3 ALA 36 HB3 ALA 36 2.240 2.851 -38.780 274 H LEU 37 HN LEU 37 3.857 4.190 -40.109 275 HA LEU 37 HA LEU 37 4.025 2.964 -42.723 276 HB2 LEU 37 HB2 LEU 37 3.588 5.818 -41.855 277 HB3 LEU 37 HB1 LEU 37 3.618 5.307 -43.531 278 HG LEU 37 HG LEU 37 1.642 4.334 -41.463 279 HD11 LEU 37 HD11 LEU 37 0.016 5.692 -42.683 280 HD12 LEU 37 HD12 LEU 37 1.303 6.306 -43.720 281 HD13 LEU 37 HD13 LEU 37 1.300 6.687 -41.998 282 HD21 LEU 37 HD21 LEU 37 0.470 3.381 -43.399 283 HD22 LEU 37 HD22 LEU 37 2.077 2.682 -43.198 284 HD23 LEU 37 HD23 LEU 37 1.793 3.895 -44.446 285 H LYS 38 HN LYS 38 6.068 4.855 -40.661 286 HA LYS 38 HA LYS 38 8.130 5.737 -40.830 287 HB2 LYS 38 HB2 LYS 38 8.271 3.204 -42.298 288 HB3 LYS 38 HB1 LYS 38 9.543 4.347 -42.706 289 HG2 LYS 38 HG2 LYS 38 8.877 3.327 -39.951 290 HG3 LYS 38 HG1 LYS 38 10.274 2.876 -40.933 291 HD2 LYS 38 HD2 LYS 38 10.861 5.360 -40.935 292 HD3 LYS 38 HD1 LYS 38 9.665 5.528 -39.650 293 HE2 LYS 38 HE2 LYS 38 12.066 3.702 -39.567 294 HE3 LYS 38 HE1 LYS 38 11.971 5.284 -38.799 295 HZ1 LYS 38 HZ1 LYS 38 11.559 3.508 -37.227 296 HZ2 LYS 38 HZ2 LYS 38 10.255 2.942 -38.153 297 HZ3 LYS 38 HZ3 LYS 38 10.170 4.466 -37.407 298 HA PRO 39 HA PRO 39 7.677 8.234 -44.584 299 HB2 PRO 39 HB2 PRO 39 6.966 10.546 -43.396 300 HB3 PRO 39 HB1 PRO 39 5.791 9.287 -43.781 301 HG2 PRO 39 HG2 PRO 39 6.860 10.114 -41.168 302 HG3 PRO 39 HG1 PRO 39 5.357 9.261 -41.548 303 HD2 PRO 39 HD2 PRO 39 7.847 8.160 -40.619 304 HD3 PRO 39 HD1 PRO 39 6.333 7.306 -40.968 305 H THR 40 HN THR 40 9.378 9.342 -45.407 306 HA THR 40 HA THR 40 11.706 9.833 -43.864 307 HB THR 40 HB THR 40 12.440 11.114 -45.959 308 HG1 THR 40 HG1 THR 40 9.858 10.911 -46.510 309 HG21 THR 40 HG21 THR 40 12.720 9.039 -47.270 310 HG22 THR 40 HG22 THR 40 11.569 8.234 -46.206 311 HG23 THR 40 HG23 THR 40 13.106 8.813 -45.564 312 H PHE 41 HN PHE 41 8.990 11.768 -44.898 313 HA PHE 41 HA PHE 41 9.796 13.851 -43.021 314 HB2 PHE 41 HB2 PHE 41 10.535 14.575 -45.303 315 HB3 PHE 41 HB1 PHE 41 8.860 14.474 -45.836 316 HD1 PHE 41 HD1 PHE 41 11.127 16.209 -43.479 317 HD2 PHE 41 HD2 PHE 41 7.380 16.259 -45.495 318 HE1 PHE 41 HE1 PHE 41 10.764 18.527 -42.740 319 HE2 PHE 41 HE2 PHE 41 7.011 18.577 -44.759 320 HZ PHE 41 HZ PHE 41 8.703 19.714 -43.380 321 H LEU 42 HN LEU 42 8.109 14.503 -41.798 322 HA LEU 42 HA LEU 42 5.382 14.119 -42.806 323 HB2 LEU 42 HB2 LEU 42 5.944 12.090 -41.539 324 HB3 LEU 42 HB1 LEU 42 6.378 13.071 -40.152 325 HG LEU 42 HG LEU 42 4.008 13.868 -40.055 326 HD11 LEU 42 HD11 LEU 42 2.307 12.600 -41.256 327 HD12 LEU 42 HD12 LEU 42 3.566 11.695 -42.096 328 HD13 LEU 42 HD13 LEU 42 3.392 13.428 -42.373 329 HD21 LEU 42 HD21 LEU 42 3.137 11.803 -39.072 330 HD22 LEU 42 HD22 LEU 42 4.809 12.099 -38.592 331 HD23 LEU 42 HD23 LEU 42 4.447 10.895 -39.828 332 H GLU 43 HN GLU 43 4.493 16.075 -42.669 333 HA GLU 43 HA GLU 43 4.994 17.647 -40.220 334 HB2 GLU 43 HB2 GLU 43 6.202 18.633 -42.134 335 HB3 GLU 43 HB1 GLU 43 4.691 18.742 -43.025 336 HG2 GLU 43 HG2 GLU 43 5.297 20.893 -42.093 337 HG3 GLU 43 HG1 GLU 43 3.809 20.292 -41.360 338 H LEU 44 HN LEU 44 3.235 18.635 -39.302 339 HA LEU 44 HA LEU 44 0.639 18.043 -40.571 340 HB2 LEU 44 HB2 LEU 44 1.400 17.997 -37.654 341 HB3 LEU 44 HB1 LEU 44 -0.264 18.050 -38.194 342 HG LEU 44 HG LEU 44 0.244 15.898 -39.476 343 HD11 LEU 44 HD11 LEU 44 2.606 15.875 -37.604 344 HD12 LEU 44 HD12 LEU 44 2.677 15.998 -39.362 345 HD13 LEU 44 HD13 LEU 44 2.062 14.529 -38.604 346 HD21 LEU 44 HD21 LEU 44 -0.131 14.526 -37.487 347 HD22 LEU 44 HD22 LEU 44 -1.133 15.978 -37.477 348 HD23 LEU 44 HD23 LEU 44 0.309 15.894 -36.464 349 H VAL 45 HN VAL 45 -0.491 19.775 -41.119 350 HA VAL 45 HA VAL 45 0.035 22.294 -39.683 351 HB VAL 45 HB VAL 45 -0.940 23.415 -41.731 352 HG11 VAL 45 HG11 VAL 45 1.157 23.277 -43.000 353 HG12 VAL 45 HG12 VAL 45 1.623 21.857 -42.062 354 HG13 VAL 45 HG13 VAL 45 1.450 23.422 -41.266 355 HG21 VAL 45 HG21 VAL 45 -2.060 21.565 -42.754 356 HG22 VAL 45 HG22 VAL 45 -0.546 20.670 -42.899 357 HG23 VAL 45 HG23 VAL 45 -0.797 22.138 -43.845 358 H ASP 46 HN ASP 46 -1.700 23.655 -39.184 359 HA ASP 46 HA ASP 46 -4.108 22.254 -38.456 360 HB2 ASP 46 HB2 ASP 46 -3.154 23.900 -36.938 361 HB3 ASP 46 HB1 ASP 46 -3.281 25.150 -38.168 362 H LYS 47 HN LYS 47 -5.811 22.012 -39.726 363 HA LYS 47 HA LYS 47 -6.124 23.787 -42.045 364 HB2 LYS 47 HB2 LYS 47 -6.041 21.328 -42.445 365 HB3 LYS 47 HB1 LYS 47 -7.482 21.147 -41.455 366 HG2 LYS 47 HG2 LYS 47 -8.626 22.717 -43.082 367 HG3 LYS 47 HG1 LYS 47 -7.223 22.489 -44.126 368 HD2 LYS 47 HD2 LYS 47 -9.059 20.320 -43.106 369 HD3 LYS 47 HD1 LYS 47 -9.032 20.972 -44.744 370 HE2 LYS 47 HE2 LYS 47 -6.748 19.534 -43.395 371 HE3 LYS 47 HE1 LYS 47 -7.856 18.818 -44.565 372 HZ1 LYS 47 HZ1 LYS 47 -7.090 20.442 -46.205 373 HZ2 LYS 47 HZ2 LYS 47 -5.812 19.478 -45.627 374 HZ3 LYS 47 HZ3 LYS 47 -5.989 21.073 -45.077 375 H SER 48 HN SER 48 -7.674 25.271 -42.052 376 HA SER 48 HA SER 48 -9.394 25.540 -39.771 377 HB2 SER 48 HB2 SER 48 -10.148 27.615 -41.029 378 HB3 SER 48 HB1 SER 48 -8.434 27.548 -40.616 379 HG SER 48 HG SER 48 -9.447 26.678 -43.119 380 H CYS 49 HN CYS 49 -11.093 24.195 -39.681 381 HA CYS 49 HA CYS 49 -12.841 24.046 -42.047 382 HB2 CYS 49 HB2 CYS 49 -11.897 21.871 -41.262 383 HB3 CYS 49 HB1 CYS 49 -12.687 22.121 -39.710 384 HG CYS 49 HG CYS 49 -15.279 22.233 -41.027 385 H GLY 50 HN GLY 50 -12.560 25.997 -39.683 386 HA2 GLY 50 HA2 GLY 50 -14.103 27.401 -38.666 387 HA3 GLY 50 HA1 GLY 50 -15.392 26.349 -39.243 388 H CYS 51 HN CYS 51 -16.436 25.229 -37.751 389 HA CYS 51 HA CYS 51 -15.273 24.889 -35.109 390 HB2 CYS 51 HB2 CYS 51 -17.677 25.538 -35.410 391 HB3 CYS 51 HB1 CYS 51 -17.968 23.966 -36.144 392 HG CYS 51 HG CYS 51 -17.170 24.628 -32.890 393 H GLY 52 HN GLY 52 -13.771 23.351 -35.061 394 HA2 GLY 52 HA2 GLY 52 -13.631 20.840 -34.870 395 HA3 GLY 52 HA1 GLY 52 -14.278 20.825 -36.509 396 H THR 53 HN THR 53 -11.484 21.144 -34.567 397 HA THR 53 HA THR 53 -9.861 22.430 -36.553 398 HB THR 53 HB THR 53 -7.975 21.850 -34.982 399 HG1 THR 53 HG1 THR 53 -8.967 20.016 -34.004 400 HG21 THR 53 HG21 THR 53 -9.124 24.001 -34.863 401 HG22 THR 53 HG22 THR 53 -8.690 23.438 -33.249 402 HG23 THR 53 HG23 THR 53 -10.355 23.299 -33.815 403 H SER 54 HN SER 54 -9.673 21.264 -38.387 404 HA SER 54 HA SER 54 -9.002 18.449 -38.278 405 HB2 SER 54 HB2 SER 54 -8.975 18.758 -40.828 406 HB3 SER 54 HB1 SER 54 -10.521 18.980 -40.009 407 HG SER 54 HG SER 54 -8.992 21.265 -40.208 408 H PHE 55 HN PHE 55 -7.064 17.552 -38.939 409 HA PHE 55 HA PHE 55 -4.823 19.453 -39.147 410 HB2 PHE 55 HB2 PHE 55 -4.911 16.645 -38.034 411 HB3 PHE 55 HB1 PHE 55 -3.416 17.524 -38.333 412 HD1 PHE 55 HD1 PHE 55 -2.824 19.464 -36.982 413 HD2 PHE 55 HD2 PHE 55 -6.336 17.197 -36.186 414 HE1 PHE 55 HE1 PHE 55 -2.986 20.505 -34.759 415 HE2 PHE 55 HE2 PHE 55 -6.505 18.236 -33.962 416 HZ PHE 55 HZ PHE 55 -4.830 19.893 -33.246 417 H ASP 56 HN ASP 56 -3.553 19.403 -40.878 418 HA ASP 56 HA ASP 56 -4.061 17.318 -42.902 419 HB2 ASP 56 HB2 ASP 56 -4.391 19.884 -43.364 420 HB3 ASP 56 HB1 ASP 56 -2.641 19.901 -43.456 421 H ALA 57 HN ALA 57 -2.536 15.764 -42.808 422 HA ALA 57 HA ALA 57 0.188 16.556 -42.024 423 HB1 ALA 57 HB1 ALA 57 0.543 14.232 -41.413 424 HB2 ALA 57 HB2 ALA 57 -1.075 13.820 -41.982 425 HB3 ALA 57 HB3 ALA 57 -0.874 14.884 -40.589 426 H VAL 58 HN VAL 58 1.525 16.823 -43.643 427 HA VAL 58 HA VAL 58 1.186 15.467 -46.170 428 HB VAL 58 HB VAL 58 3.468 17.224 -45.234 429 HG11 VAL 58 HG11 VAL 58 2.673 16.327 -48.004 430 HG12 VAL 58 HG12 VAL 58 4.088 15.788 -47.099 431 HG13 VAL 58 HG13 VAL 58 3.963 17.467 -47.624 432 HG21 VAL 58 HG21 VAL 58 2.381 19.002 -46.534 433 HG22 VAL 58 HG22 VAL 58 1.362 18.447 -45.205 434 HG23 VAL 58 HG23 VAL 58 1.020 17.928 -46.856 435 H ILE 59 HN ILE 59 1.775 13.429 -46.361 436 HA ILE 59 HA ILE 59 3.963 12.441 -44.682 437 HB ILE 59 HB ILE 59 1.910 11.282 -44.239 438 HG12 ILE 59 HG12 ILE 59 4.171 9.988 -44.565 439 HG13 ILE 59 HG11 ILE 59 2.679 9.107 -44.278 440 HG21 ILE 59 HG21 ILE 59 0.687 10.012 -45.943 441 HG22 ILE 59 HG22 ILE 59 1.749 10.683 -47.181 442 HG23 ILE 59 HG23 ILE 59 0.689 11.748 -46.256 443 HD11 ILE 59 HD11 ILE 59 4.025 8.056 -46.009 444 HD12 ILE 59 HD12 ILE 59 3.984 9.541 -46.961 445 HD13 ILE 59 HD13 ILE 59 2.496 8.639 -46.667 446 H VAL 60 HN VAL 60 5.800 12.516 -45.695 447 HA VAL 60 HA VAL 60 5.950 11.729 -48.528 448 HB VAL 60 HB VAL 60 7.999 13.184 -46.836 449 HG11 VAL 60 HG11 VAL 60 7.943 12.630 -49.797 450 HG12 VAL 60 HG12 VAL 60 9.020 11.882 -48.617 451 HG13 VAL 60 HG13 VAL 60 9.145 13.609 -48.956 452 HG21 VAL 60 HG21 VAL 60 6.050 14.581 -47.225 453 HG22 VAL 60 HG22 VAL 60 6.134 14.247 -48.954 454 HG23 VAL 60 HG23 VAL 60 7.421 15.164 -48.170 455 H SER 61 HN SER 61 6.356 9.578 -48.689 456 HA SER 61 HA SER 61 8.461 8.447 -46.992 457 HB2 SER 61 HB2 SER 61 6.478 7.968 -45.716 458 HB3 SER 61 HB1 SER 61 5.642 7.369 -47.149 459 HG SER 61 HG SER 61 7.350 6.071 -45.466 460 H ASN 62 HN ASN 62 9.510 6.677 -47.807 461 HA ASN 62 HA ASN 62 9.462 6.211 -50.601 462 HB2 ASN 62 HB2 ASN 62 10.699 4.557 -48.389 463 HB3 ASN 62 HB1 ASN 62 11.023 4.356 -50.106 464 HD21 ASN 62 HD21 ASN 62 12.024 6.112 -51.222 465 HD22 ASN 62 HD22 ASN 62 13.097 7.171 -50.372 466 H ASN 63 HN ASN 63 7.641 4.965 -48.000 467 HA ASN 63 HA ASN 63 7.073 2.364 -48.897 468 HB2 ASN 63 HB2 ASN 63 6.584 3.192 -46.613 469 HB3 ASN 63 HB1 ASN 63 5.303 4.206 -47.267 470 HD21 ASN 63 HD21 ASN 63 3.734 3.215 -46.032 471 HD22 ASN 63 HD22 ASN 63 3.168 1.615 -46.352 472 H PHE 64 HN PHE 64 5.955 5.427 -50.014 473 HA PHE 64 HA PHE 64 3.659 4.200 -51.357 474 HB2 PHE 64 HB2 PHE 64 3.357 6.270 -49.961 475 HB3 PHE 64 HB1 PHE 64 4.335 7.137 -51.139 476 HD1 PHE 64 HD2 PHE 64 1.315 4.955 -50.989 477 HD2 PHE 64 HD1 PHE 64 3.257 8.263 -52.834 478 HE1 PHE 64 HE2 PHE 64 -0.702 5.385 -52.329 479 HE2 PHE 64 HE1 PHE 64 1.242 8.699 -54.178 480 HZ PHE 64 HZ PHE 64 -0.740 7.260 -53.927 481 H GLU 65 HN GLU 65 6.855 4.806 -52.057 482 HA GLU 65 HA GLU 65 6.479 6.058 -54.624 483 HB2 GLU 65 HB2 GLU 65 8.826 6.029 -54.894 484 HB3 GLU 65 HB1 GLU 65 8.534 6.375 -53.198 485 HG2 GLU 65 HG2 GLU 65 9.167 4.187 -52.550 486 HG3 GLU 65 HG1 GLU 65 9.172 3.625 -54.223 487 H ASP 66 HN ASP 66 5.933 2.982 -53.605 488 HA ASP 66 HA ASP 66 6.762 1.738 -56.111 489 HB2 ASP 66 HB2 ASP 66 7.046 0.545 -53.914 490 HB3 ASP 66 HB1 ASP 66 5.291 0.456 -53.799 491 H LYS 67 HN LYS 67 4.374 3.666 -55.223 492 HA LYS 67 HA LYS 67 2.470 4.330 -56.265 493 HB2 LYS 67 HB2 LYS 67 3.681 3.456 -58.328 494 HB3 LYS 67 HB1 LYS 67 2.754 1.976 -58.133 495 HG2 LYS 67 HG2 LYS 67 0.676 3.393 -58.271 496 HG3 LYS 67 HG1 LYS 67 1.722 4.730 -58.747 497 HD2 LYS 67 HD2 LYS 67 1.425 2.092 -60.180 498 HD3 LYS 67 HD1 LYS 67 0.775 3.645 -60.707 499 HE2 LYS 67 HE2 LYS 67 3.048 4.525 -60.908 500 HE3 LYS 67 HE1 LYS 67 3.699 2.977 -60.372 501 HZ1 LYS 67 HZ1 LYS 67 3.802 3.114 -62.748 502 HZ2 LYS 67 HZ2 LYS 67 2.154 3.479 -62.858 503 HZ3 LYS 67 HZ3 LYS 67 2.646 1.947 -62.330 504 H LYS 68 HN LYS 68 2.721 1.982 -54.254 505 HA LYS 68 HA LYS 68 0.354 0.435 -54.719 506 HB2 LYS 68 HB2 LYS 68 2.220 0.694 -52.371 507 HB3 LYS 68 HB1 LYS 68 0.763 -0.288 -52.297 508 HG2 LYS 68 HG2 LYS 68 2.985 -0.652 -54.298 509 HG3 LYS 68 HG1 LYS 68 2.778 -1.597 -52.820 510 HD2 LYS 68 HD2 LYS 68 0.600 -2.368 -53.614 511 HD3 LYS 68 HD1 LYS 68 0.790 -1.410 -55.082 512 HE2 LYS 68 HE2 LYS 68 2.590 -3.672 -54.221 513 HE3 LYS 68 HE1 LYS 68 1.314 -3.786 -55.433 514 HZ1 LYS 68 HZ1 LYS 68 3.803 -2.170 -55.580 515 HZ2 LYS 68 HZ2 LYS 68 2.522 -2.018 -56.680 516 HZ3 LYS 68 HZ3 LYS 68 3.361 -3.482 -56.563 517 H LEU 69 HN LEU 69 -1.306 1.895 -54.952 518 HA LEU 69 HA LEU 69 -1.932 3.858 -52.971 519 HB2 LEU 69 HB2 LEU 69 -2.546 3.928 -55.434 520 HB3 LEU 69 HB1 LEU 69 -3.769 2.726 -55.086 521 HG LEU 69 HG LEU 69 -4.572 5.114 -55.263 522 HD11 LEU 69 HD11 LEU 69 -5.117 3.690 -52.665 523 HD12 LEU 69 HD12 LEU 69 -5.936 3.405 -54.202 524 HD13 LEU 69 HD13 LEU 69 -6.114 4.955 -53.382 525 HD21 LEU 69 HD21 LEU 69 -2.736 6.204 -54.111 526 HD22 LEU 69 HD22 LEU 69 -3.159 5.372 -52.614 527 HD23 LEU 69 HD23 LEU 69 -4.267 6.555 -53.311 528 H LEU 70 HN LEU 70 -3.279 0.690 -53.856 529 HA LEU 70 HA LEU 70 -5.293 0.785 -51.871 530 HB2 LEU 70 HB2 LEU 70 -5.838 -1.473 -52.437 531 HB3 LEU 70 HB1 LEU 70 -5.534 -0.573 -53.897 532 HG LEU 70 HG LEU 70 -4.675 -2.722 -54.262 533 HD11 LEU 70 HD11 LEU 70 -3.172 -1.065 -55.101 534 HD12 LEU 70 HD12 LEU 70 -2.255 -2.451 -54.511 535 HD13 LEU 70 HD13 LEU 70 -2.339 -0.976 -53.552 536 HD21 LEU 70 HD21 LEU 70 -3.116 -3.882 -52.782 537 HD22 LEU 70 HD22 LEU 70 -4.661 -3.553 -51.998 538 HD23 LEU 70 HD23 LEU 70 -3.251 -2.565 -51.616 539 H ASP 71 HN ASP 71 -2.012 -0.419 -51.866 540 HA ASP 71 HA ASP 71 -2.306 -1.881 -49.426 541 HB2 ASP 71 HB2 ASP 71 -0.532 -2.232 -51.262 542 HB3 ASP 71 HB1 ASP 71 0.320 -0.887 -50.508 543 H ARG 72 HN ARG 72 -1.161 1.319 -50.334 544 HA ARG 72 HA ARG 72 -0.469 2.214 -47.763 545 HB2 ARG 72 HB2 ARG 72 0.254 3.542 -49.566 546 HB3 ARG 72 HB1 ARG 72 -1.341 3.591 -50.293 547 HG2 ARG 72 HG2 ARG 72 -1.068 4.850 -47.634 548 HG3 ARG 72 HG1 ARG 72 -0.258 5.649 -48.984 549 HD2 ARG 72 HD2 ARG 72 -2.413 5.573 -50.235 550 HD3 ARG 72 HD1 ARG 72 -3.183 4.934 -48.784 551 HE ARG 72 HE ARG 72 -2.022 7.223 -47.917 552 HH11 ARG 72 HH11 ARG 72 -4.200 6.479 -50.554 553 HH12 ARG 72 HH12 ARG 72 -4.940 8.051 -50.559 554 HH21 ARG 72 HH21 ARG 72 -3.022 9.304 -47.926 555 HH22 ARG 72 HH22 ARG 72 -4.275 9.640 -49.077 556 H HIS 73 HN HIS 73 -3.531 2.170 -49.520 557 HA HIS 73 HA HIS 73 -5.047 3.655 -47.670 558 HB2 HIS 73 HB2 HIS 73 -5.764 3.183 -49.992 559 HB3 HIS 73 HB1 HIS 73 -5.996 1.492 -49.566 560 HD1 HIS 73 HD1 HIS 73 -7.613 4.822 -49.405 561 HD2 HIS 73 HD2 HIS 73 -8.256 1.001 -47.877 562 HE1 HIS 73 HE1 HIS 73 -9.979 4.815 -48.554 563 HE2 HIS 73 HE2 HIS 73 -10.321 2.533 -47.545 564 H ARG 74 HN ARG 74 -4.569 0.143 -48.006 565 HA ARG 74 HA ARG 74 -6.336 -0.560 -45.911 566 HB2 ARG 74 HB2 ARG 74 -5.335 -2.785 -46.041 567 HB3 ARG 74 HB1 ARG 74 -5.672 -2.154 -47.647 568 HG2 ARG 74 HG2 ARG 74 -3.252 -1.446 -47.737 569 HG3 ARG 74 HG1 ARG 74 -3.015 -2.402 -46.275 570 HD2 ARG 74 HD2 ARG 74 -4.133 -3.473 -48.858 571 HD3 ARG 74 HD1 ARG 74 -2.444 -3.599 -48.372 572 HE ARG 74 HE ARG 74 -4.612 -4.777 -46.756 573 HH11 ARG 74 HH11 ARG 74 -1.508 -4.973 -48.377 574 HH12 ARG 74 HH12 ARG 74 -1.239 -6.636 -47.930 575 HH21 ARG 74 HH21 ARG 74 -4.267 -6.972 -46.178 576 HH22 ARG 74 HH22 ARG 74 -2.810 -7.768 -46.686 577 H LEU 75 HN LEU 75 -2.873 0.153 -45.967 578 HA LEU 75 HA LEU 75 -2.357 -0.567 -43.282 579 HB2 LEU 75 HB2 LEU 75 -0.993 1.405 -45.109 580 HB3 LEU 75 HB1 LEU 75 -0.408 1.023 -43.502 581 HG LEU 75 HG LEU 75 -0.673 -0.937 -45.786 582 HD11 LEU 75 HD11 LEU 75 1.131 0.661 -46.132 583 HD12 LEU 75 HD12 LEU 75 1.773 -0.939 -45.761 584 HD13 LEU 75 HD13 LEU 75 1.763 0.316 -44.522 585 HD21 LEU 75 HD21 LEU 75 -1.034 -2.005 -43.627 586 HD22 LEU 75 HD22 LEU 75 0.453 -1.287 -43.008 587 HD23 LEU 75 HD23 LEU 75 0.524 -2.480 -44.306 588 H VAL 76 HN VAL 76 -3.143 2.553 -44.790 589 HA VAL 76 HA VAL 76 -3.225 4.104 -42.480 590 HB VAL 76 HB VAL 76 -4.822 4.362 -45.034 591 HG11 VAL 76 HG11 VAL 76 -6.020 5.506 -43.247 592 HG12 VAL 76 HG12 VAL 76 -5.289 6.672 -44.350 593 HG13 VAL 76 HG13 VAL 76 -4.544 6.353 -42.783 594 HG21 VAL 76 HG21 VAL 76 -3.214 6.151 -45.523 595 HG22 VAL 76 HG22 VAL 76 -2.416 4.594 -45.302 596 HG23 VAL 76 HG23 VAL 76 -2.374 5.798 -44.014 597 H ASN 77 HN ASN 77 -5.763 2.105 -43.955 598 HA ASN 77 HA ASN 77 -7.794 2.857 -42.141 599 HB2 ASN 77 HB2 ASN 77 -7.429 0.606 -44.060 600 HB3 ASN 77 HB1 ASN 77 -8.685 0.457 -42.837 601 HD21 ASN 77 HD21 ASN 77 -7.735 3.538 -44.160 602 HD22 ASN 77 HD22 ASN 77 -9.197 3.830 -45.042 603 H THR 78 HN THR 78 -5.431 0.222 -42.066 604 HA THR 78 HA THR 78 -6.544 -1.109 -39.835 605 HB THR 78 HB THR 78 -3.678 -1.154 -40.809 606 HG1 THR 78 HG1 THR 78 -5.053 -1.818 -42.461 607 HG21 THR 78 HG21 THR 78 -5.226 -3.126 -39.121 608 HG22 THR 78 HG22 THR 78 -3.923 -2.079 -38.557 609 HG23 THR 78 HG23 THR 78 -3.586 -3.356 -39.725 610 H ILE 79 HN ILE 79 -3.851 1.191 -40.109 611 HA ILE 79 HA ILE 79 -3.270 1.222 -37.311 612 HB ILE 79 HB ILE 79 -2.530 3.258 -39.424 613 HG12 ILE 79 HG12 ILE 79 -0.793 0.994 -38.461 614 HG13 ILE 79 HG11 ILE 79 -1.890 0.796 -39.825 615 HG21 ILE 79 HG21 ILE 79 -1.273 2.654 -36.747 616 HG22 ILE 79 HG22 ILE 79 -2.210 4.089 -37.158 617 HG23 ILE 79 HG23 ILE 79 -0.654 3.799 -37.938 618 HD11 ILE 79 HD11 ILE 79 0.367 1.306 -40.560 619 HD12 ILE 79 HD12 ILE 79 0.337 2.810 -39.638 620 HD13 ILE 79 HD13 ILE 79 -0.754 2.592 -41.008 621 H LEU 80 HN LEU 80 -4.847 3.510 -39.518 622 HA LEU 80 HA LEU 80 -5.352 5.332 -37.368 623 HB2 LEU 80 HB2 LEU 80 -5.949 5.414 -40.303 624 HB3 LEU 80 HB1 LEU 80 -6.595 6.618 -39.205 625 HG LEU 80 HG LEU 80 -4.199 7.117 -38.519 626 HD11 LEU 80 HD11 LEU 80 -3.150 5.076 -39.320 627 HD12 LEU 80 HD12 LEU 80 -2.441 6.493 -40.094 628 HD13 LEU 80 HD13 LEU 80 -3.587 5.487 -40.979 629 HD21 LEU 80 HD21 LEU 80 -5.476 8.567 -39.993 630 HD22 LEU 80 HD22 LEU 80 -4.991 7.597 -41.384 631 HD23 LEU 80 HD23 LEU 80 -3.781 8.507 -40.479 632 H LYS 81 HN LYS 81 -6.936 2.569 -38.297 633 HA LYS 81 HA LYS 81 -9.623 3.206 -38.096 634 HB2 LYS 81 HB2 LYS 81 -8.966 0.931 -38.516 635 HB3 LYS 81 HB1 LYS 81 -8.097 0.841 -36.992 636 HG2 LYS 81 HG2 LYS 81 -10.173 -0.391 -36.866 637 HG3 LYS 81 HG1 LYS 81 -10.210 0.993 -35.775 638 HD2 LYS 81 HD2 LYS 81 -12.333 0.814 -36.896 639 HD3 LYS 81 HD1 LYS 81 -11.494 2.250 -37.482 640 HE2 LYS 81 HE2 LYS 81 -10.855 1.111 -39.504 641 HE3 LYS 81 HE1 LYS 81 -11.501 -0.414 -38.896 642 HZ1 LYS 81 HZ1 LYS 81 -13.711 0.606 -38.862 643 HZ2 LYS 81 HZ2 LYS 81 -13.051 0.582 -40.425 644 HZ3 LYS 81 HZ3 LYS 81 -13.071 2.022 -39.535 645 H GLU 82 HN GLU 82 -7.633 2.114 -35.347 646 HA GLU 82 HA GLU 82 -9.333 3.427 -33.461 647 HB2 GLU 82 HB2 GLU 82 -8.098 1.363 -32.891 648 HB3 GLU 82 HB1 GLU 82 -6.581 2.240 -33.046 649 HG2 GLU 82 HG2 GLU 82 -7.175 3.674 -31.201 650 HG3 GLU 82 HG1 GLU 82 -8.760 2.912 -31.083 651 H GLU 83 HN GLU 83 -6.338 4.209 -35.132 652 HA GLU 83 HA GLU 83 -5.318 6.223 -33.545 653 HB2 GLU 83 HB2 GLU 83 -4.390 5.233 -35.675 654 HB3 GLU 83 HB1 GLU 83 -5.449 6.333 -36.547 655 HG2 GLU 83 HG2 GLU 83 -3.562 7.536 -36.520 656 HG3 GLU 83 HG1 GLU 83 -4.293 8.120 -35.027 657 H LEU 84 HN LEU 84 -7.594 6.602 -36.237 658 HA LEU 84 HA LEU 84 -8.049 9.302 -36.156 659 HB2 LEU 84 HB2 LEU 84 -10.029 7.119 -36.774 660 HB3 LEU 84 HB1 LEU 84 -10.330 8.819 -37.066 661 HG LEU 84 HG LEU 84 -8.241 7.100 -38.391 662 HD11 LEU 84 HD11 LEU 84 -10.695 8.484 -39.450 663 HD12 LEU 84 HD12 LEU 84 -10.490 6.748 -39.221 664 HD13 LEU 84 HD13 LEU 84 -9.516 7.600 -40.420 665 HD21 LEU 84 HD21 LEU 84 -7.693 9.077 -39.727 666 HD22 LEU 84 HD22 LEU 84 -7.341 9.333 -38.018 667 HD23 LEU 84 HD23 LEU 84 -8.786 10.046 -38.739 668 H GLN 85 HN GLN 85 -9.277 6.916 -33.897 669 HA GLN 85 HA GLN 85 -11.496 8.323 -32.924 670 HB2 GLN 85 HB2 GLN 85 -9.707 6.578 -31.229 671 HB3 GLN 85 HB1 GLN 85 -11.403 6.938 -30.966 672 HG2 GLN 85 HG2 GLN 85 -10.175 5.153 -33.037 673 HG3 GLN 85 HG1 GLN 85 -11.312 4.735 -31.760 674 HE21 GLN 85 HE21 GLN 85 -10.905 5.913 -34.941 675 HE22 GLN 85 HE22 GLN 85 -12.574 6.015 -35.365 676 H ASN 86 HN ASN 86 -8.129 8.912 -32.514 677 HA ASN 86 HA ASN 86 -8.494 10.532 -30.115 678 HB2 ASN 86 HB2 ASN 86 -5.997 10.008 -31.747 679 HB3 ASN 86 HB1 ASN 86 -6.057 10.832 -30.193 680 HD21 ASN 86 HD21 ASN 86 -6.190 7.797 -31.839 681 HD22 ASN 86 HD22 ASN 86 -6.126 6.793 -30.433 682 H ILE 87 HN ILE 87 -8.905 10.992 -33.366 683 HA ILE 87 HA ILE 87 -8.098 13.827 -33.218 684 HB ILE 87 HB ILE 87 -8.121 12.267 -35.793 685 HG12 ILE 87 HG12 ILE 87 -5.786 12.632 -33.899 686 HG13 ILE 87 HG11 ILE 87 -6.571 11.112 -34.305 687 HG21 ILE 87 HG21 ILE 87 -6.618 14.052 -36.534 688 HG22 ILE 87 HG22 ILE 87 -6.711 14.793 -34.937 689 HG23 ILE 87 HG23 ILE 87 -8.151 14.700 -35.950 690 HD11 ILE 87 HD11 ILE 87 -4.465 11.365 -35.477 691 HD12 ILE 87 HD12 ILE 87 -5.044 12.863 -36.207 692 HD13 ILE 87 HD13 ILE 87 -5.820 11.330 -36.606 693 H HIS 88 HN HIS 88 -9.603 15.296 -33.857 694 HA HIS 88 HA HIS 88 -12.302 14.429 -34.164 695 HB2 HIS 88 HB2 HIS 88 -11.482 16.636 -33.139 696 HB3 HIS 88 HB1 HIS 88 -11.271 17.198 -34.792 697 HD1 HIS 88 HD1 HIS 88 -13.381 18.122 -32.447 698 HD2 HIS 88 HD2 HIS 88 -14.171 16.048 -35.964 699 HE1 HIS 88 HE1 HIS 88 -15.805 18.564 -32.968 700 HE2 HIS 88 HE2 HIS 88 -16.245 17.345 -35.133 701 H ALA 89 HN ALA 89 -9.917 15.888 -36.361 702 HA ALA 89 HA ALA 89 -11.147 14.483 -38.583 703 HB1 ALA 89 HB1 ALA 89 -12.410 16.580 -38.512 704 HB2 ALA 89 HB2 ALA 89 -11.428 16.461 -39.971 705 HB3 ALA 89 HB3 ALA 89 -10.905 17.489 -38.638 706 H PHE 90 HN PHE 90 -9.319 13.376 -39.054 707 HA PHE 90 HA PHE 90 -6.844 14.899 -39.463 708 HB2 PHE 90 HB2 PHE 90 -6.753 12.929 -37.969 709 HB3 PHE 90 HB1 PHE 90 -7.272 11.906 -39.305 710 HD1 PHE 90 HD1 PHE 90 -4.561 14.209 -38.238 711 HD2 PHE 90 HD2 PHE 90 -5.705 10.962 -40.737 712 HE1 PHE 90 HE1 PHE 90 -2.208 13.875 -38.877 713 HE2 PHE 90 HE2 PHE 90 -3.355 10.624 -41.381 714 HZ PHE 90 HZ PHE 90 -1.604 12.079 -40.450 715 H SER 91 HN SER 91 -5.885 15.077 -41.408 716 HA SER 91 HA SER 91 -6.845 13.419 -43.637 717 HB2 SER 91 HB2 SER 91 -6.278 16.394 -43.823 718 HB3 SER 91 HB1 SER 91 -6.829 15.345 -45.131 719 HG SER 91 HG SER 91 -8.433 15.217 -42.934 720 H MET 92 HN MET 92 -5.217 13.008 -45.246 721 HA MET 92 HA MET 92 -2.524 13.890 -44.500 722 HB2 MET 92 HB2 MET 92 -1.581 11.719 -44.599 723 HB3 MET 92 HB1 MET 92 -2.997 11.587 -43.572 724 HG2 MET 92 HG2 MET 92 -2.892 10.788 -46.471 725 HG3 MET 92 HG1 MET 92 -2.706 9.687 -45.112 726 HE1 MET 92 HE1 MET 92 -4.834 10.706 -43.024 727 HE2 MET 92 HE2 MET 92 -4.641 9.009 -43.466 728 HE3 MET 92 HE3 MET 92 -6.243 9.746 -43.474 729 H LYS 93 HN LYS 93 -1.255 14.437 -46.137 730 HA LYS 93 HA LYS 93 -2.259 13.984 -48.867 731 HB2 LYS 93 HB2 LYS 93 -0.275 16.047 -47.877 732 HB3 LYS 93 HB1 LYS 93 -0.893 15.911 -49.517 733 HG2 LYS 93 HG2 LYS 93 -2.508 16.583 -47.065 734 HG3 LYS 93 HG1 LYS 93 -1.981 17.715 -48.312 735 HD2 LYS 93 HD2 LYS 93 -3.294 16.469 -49.975 736 HD3 LYS 93 HD1 LYS 93 -3.845 15.374 -48.704 737 HE2 LYS 93 HE2 LYS 93 -4.876 17.275 -47.536 738 HE3 LYS 93 HE1 LYS 93 -4.348 18.346 -48.833 739 HZ1 LYS 93 HZ1 LYS 93 -6.263 16.089 -49.070 740 HZ2 LYS 93 HZ2 LYS 93 -5.685 16.994 -50.380 741 HZ3 LYS 93 HZ3 LYS 93 -6.627 17.744 -49.184 742 H CYS 94 HN CYS 94 -1.226 12.457 -49.980 743 HA CYS 94 HA CYS 94 1.229 11.359 -48.929 744 HB2 CYS 94 HB2 CYS 94 0.892 9.686 -50.805 745 HB3 CYS 94 HB1 CYS 94 -0.380 9.750 -49.589 746 HG CYS 94 HG CYS 94 -0.537 11.192 -52.688 747 H HIS 95 HN HIS 95 3.204 11.730 -49.637 748 HA HIS 95 HA HIS 95 3.638 12.503 -52.416 749 HB2 HIS 95 HB2 HIS 95 3.756 14.390 -50.297 750 HB3 HIS 95 HB1 HIS 95 5.416 14.063 -50.786 751 HD1 HIS 95 HD1 HIS 95 2.418 15.930 -51.752 752 HD2 HIS 95 HD2 HIS 95 5.899 14.603 -53.608 753 HE1 HIS 95 HE1 HIS 95 2.604 17.255 -53.879 754 HE2 HIS 95 HE2 HIS 95 4.574 16.260 -55.095 755 H THR 96 HN THR 96 5.894 12.222 -53.056 756 HA THR 96 HA THR 96 7.191 10.176 -51.394 757 HB THR 96 HB THR 96 8.293 9.748 -53.810 758 HG1 THR 96 HG1 THR 96 7.192 10.939 -55.210 759 HG21 THR 96 HG21 THR 96 7.167 8.087 -52.404 760 HG22 THR 96 HG22 THR 96 6.655 7.946 -54.086 761 HG23 THR 96 HG23 THR 96 5.600 8.722 -52.904 762 HA PRO 97 HA PRO 97 10.770 12.562 -50.728 763 HB2 PRO 97 HB2 PRO 97 12.459 10.263 -51.495 764 HB3 PRO 97 HB1 PRO 97 12.346 11.110 -49.951 765 HG2 PRO 97 HG2 PRO 97 11.326 8.660 -50.267 766 HG3 PRO 97 HG1 PRO 97 10.527 9.871 -49.252 767 HD2 PRO 97 HD2 PRO 97 9.847 8.975 -52.024 768 HD3 PRO 97 HD1 PRO 97 8.768 9.361 -50.668 769 H LEU 98 HN LEU 98 10.599 10.797 -53.740 770 HA LEU 98 HA LEU 98 12.852 11.896 -55.007 771 HB2 LEU 98 HB2 LEU 98 11.296 9.918 -55.684 772 HB3 LEU 98 HB1 LEU 98 10.342 11.151 -56.481 773 HG LEU 98 HG LEU 98 11.918 9.924 -57.982 774 HD11 LEU 98 HD11 LEU 98 12.417 12.884 -57.722 775 HD12 LEU 98 HD12 LEU 98 11.098 12.126 -58.613 776 HD13 LEU 98 HD13 LEU 98 12.765 11.899 -59.143 777 HD21 LEU 98 HD21 LEU 98 14.297 10.464 -57.873 778 HD22 LEU 98 HD22 LEU 98 13.753 9.642 -56.409 779 HD23 LEU 98 HD23 LEU 98 14.022 11.385 -56.395 780 H GLU 99 HN GLU 99 9.410 12.836 -55.199 781 HA GLU 99 HA GLU 99 9.887 15.210 -56.646 782 HB2 GLU 99 HB2 GLU 99 7.579 14.354 -54.904 783 HB3 GLU 99 HB1 GLU 99 7.587 15.864 -55.801 784 HG2 GLU 99 HG2 GLU 99 6.529 14.597 -57.331 785 HG3 GLU 99 HG1 GLU 99 8.182 14.203 -57.794 786 H TYR 100 HN TYR 100 9.719 14.528 -53.184 787 HA TYR 100 HA TYR 100 9.684 17.173 -52.269 788 HB2 TYR 100 HB2 TYR 100 9.271 15.285 -50.769 789 HB3 TYR 100 HB1 TYR 100 10.943 14.759 -50.950 790 HD1 TYR 100 HD1 TYR 100 8.778 17.428 -49.599 791 HD2 TYR 100 HD2 TYR 100 12.695 15.768 -49.676 792 HE1 TYR 100 HE1 TYR 100 9.426 18.877 -47.721 793 HE2 TYR 100 HE2 TYR 100 13.356 17.218 -47.804 794 HH TYR 100 HH TYR 100 11.084 18.938 -45.934 795 H ASP 101 HN ASP 101 12.380 15.079 -53.164 796 HA ASP 101 HA ASP 101 14.482 16.708 -52.311 797 HB2 ASP 101 HB2 ASP 101 14.791 14.387 -53.074 798 HB3 ASP 101 HB1 ASP 101 14.407 14.876 -54.721 799 H LYS 102 HN LYS 102 12.500 16.841 -55.204 800 HA LYS 102 HA LYS 102 14.097 18.860 -56.474 801 HB2 LYS 102 HB2 LYS 102 11.489 17.538 -57.050 802 HB3 LYS 102 HB1 LYS 102 11.794 19.097 -57.794 803 HG2 LYS 102 HG2 LYS 102 12.548 17.697 -59.428 804 HG3 LYS 102 HG1 LYS 102 14.038 17.971 -58.534 805 HD2 LYS 102 HD2 LYS 102 12.260 15.622 -57.950 806 HD3 LYS 102 HD1 LYS 102 13.466 15.571 -59.233 807 HE2 LYS 102 HE2 LYS 102 14.029 16.159 -56.330 808 HE3 LYS 102 HE1 LYS 102 14.270 14.601 -57.116 809 HZ1 LYS 102 HZ1 LYS 102 16.302 15.968 -56.892 810 HZ2 LYS 102 HZ2 LYS 102 15.631 17.100 -57.961 811 HZ3 LYS 102 HZ3 LYS 102 15.953 15.521 -58.490 812 H LEU 103 HN LEU 103 11.286 18.774 -54.389 813 HA LEU 103 HA LEU 103 10.443 21.448 -54.731 814 HB2 LEU 103 HB2 LEU 103 10.090 19.687 -52.301 815 HB3 LEU 103 HB1 LEU 103 9.164 21.125 -52.679 816 HG LEU 103 HG LEU 103 9.123 18.517 -54.193 817 HD11 LEU 103 HD11 LEU 103 6.809 18.401 -53.427 818 HD12 LEU 103 HD12 LEU 103 7.036 19.893 -52.514 819 HD13 LEU 103 HD13 LEU 103 7.939 18.442 -52.074 820 HD21 LEU 103 HD21 LEU 103 7.602 21.069 -54.717 821 HD22 LEU 103 HD22 LEU 103 7.357 19.533 -55.548 822 HD23 LEU 103 HD23 LEU 103 8.883 20.400 -55.728 823 H LYS 104 HN LYS 104 12.556 19.925 -52.309 824 HA LYS 104 HA LYS 104 12.914 22.409 -50.925 825 HB2 LYS 104 HB2 LYS 104 14.506 21.159 -49.497 826 HB3 LYS 104 HB1 LYS 104 12.928 20.403 -49.611 827 HG2 LYS 104 HG2 LYS 104 14.392 18.615 -49.732 828 HG3 LYS 104 HG1 LYS 104 13.998 18.920 -51.425 829 HD2 LYS 104 HD2 LYS 104 16.076 20.237 -51.627 830 HD3 LYS 104 HD1 LYS 104 16.479 19.824 -49.964 831 HE2 LYS 104 HE2 LYS 104 16.749 17.544 -50.489 832 HE3 LYS 104 HE1 LYS 104 15.955 17.731 -52.053 833 HZ1 LYS 104 HZ1 LYS 104 18.287 17.567 -52.423 834 HZ2 LYS 104 HZ2 LYS 104 18.631 18.763 -51.275 835 HZ3 LYS 104 HZ3 LYS 104 17.845 19.176 -52.717 836 H SER 105 HN SER 105 14.532 20.881 -53.562 837 HA SER 105 HA SER 105 17.000 22.336 -53.155 838 HB2 SER 105 HB2 SER 105 16.066 20.766 -55.570 839 HB3 SER 105 HB1 SER 105 17.700 21.370 -55.297 840 HG SER 105 HG SER 105 16.450 19.152 -54.294 841 H LYS 106 HN LYS 106 14.510 22.346 -55.707 842 HA LYS 106 HA LYS 106 15.351 25.092 -56.349 843 HB2 LYS 106 HB2 LYS 106 14.481 24.566 -58.658 844 HB3 LYS 106 HB1 LYS 106 15.916 23.671 -58.177 845 HG2 LYS 106 HG2 LYS 106 14.345 21.791 -57.517 846 HG3 LYS 106 HG1 LYS 106 13.088 22.685 -58.373 847 HD2 LYS 106 HD2 LYS 106 14.364 22.593 -60.402 848 HD3 LYS 106 HD1 LYS 106 15.674 21.758 -59.569 849 HE2 LYS 106 HE2 LYS 106 14.125 19.910 -59.054 850 HE3 LYS 106 HE1 LYS 106 12.862 20.741 -59.961 851 HZ1 LYS 106 HZ1 LYS 106 14.251 20.579 -61.943 852 HZ2 LYS 106 HZ2 LYS 106 13.900 19.047 -61.305 853 HZ3 LYS 106 HZ3 LYS 106 15.433 19.736 -61.061 854 H GLY 107 HN GLY 107 12.539 22.928 -56.623 855 HA2 GLY 107 HA2 GLY 107 10.523 23.691 -55.355 856 HA3 GLY 107 HA1 GLY 107 10.823 25.268 -56.073 857 H SER 108 HN SER 108 11.608 24.127 -58.645 858 HA SER 108 HA SER 108 9.013 23.969 -59.826 859 HB2 SER 108 HB2 SER 108 10.313 23.693 -61.955 860 HB3 SER 108 HB1 SER 108 10.777 25.114 -61.020 861 HG SER 108 HG SER 108 12.113 22.616 -60.883 Start of MODEL 20 1 H1 MET 1 HT1 MET 1 41.049 36.970 -45.967 2 H2 MET 1 HT2 MET 1 40.884 36.599 -44.321 3 H3 MET 1 HT3 MET 1 42.383 36.392 -45.088 4 HA MET 1 HA MET 1 42.479 38.357 -43.780 5 HB2 MET 1 HB2 MET 1 42.177 38.959 -46.730 6 HB3 MET 1 HB1 MET 1 42.891 40.063 -45.562 7 HG2 MET 1 HG2 MET 1 44.628 38.395 -45.079 8 HG3 MET 1 HG1 MET 1 43.926 37.335 -46.299 9 HE1 MET 1 HE1 MET 1 46.986 38.180 -46.283 10 HE2 MET 1 HE2 MET 1 47.251 38.534 -47.989 11 HE3 MET 1 HE3 MET 1 46.278 37.139 -47.518 12 H GLY 2 HN GLY 2 41.231 39.575 -42.568 13 HA2 GLY 2 HA2 GLY 2 39.583 41.535 -42.906 14 HA3 GLY 2 HA1 GLY 2 38.545 40.259 -43.532 15 H SER 3 HN SER 3 37.076 40.875 -41.798 16 HA SER 3 HA SER 3 37.929 40.200 -39.105 17 HB2 SER 3 HB2 SER 3 36.471 42.167 -39.488 18 HB3 SER 3 HB1 SER 3 35.216 41.099 -40.111 19 HG SER 3 HG SER 3 36.306 40.710 -37.526 20 H SER 4 HN SER 4 38.325 37.982 -39.309 21 HA SER 4 HA SER 4 36.340 36.129 -40.138 22 HB2 SER 4 HB2 SER 4 38.721 35.716 -38.305 23 HB3 SER 4 HB1 SER 4 37.778 34.436 -39.068 24 HG SER 4 HG SER 4 39.335 34.664 -40.505 25 H HIS 5 HN HIS 5 34.725 35.156 -39.006 26 HA HIS 5 HA HIS 5 33.924 36.468 -36.571 27 HB2 HIS 5 HB2 HIS 5 32.649 34.199 -38.105 28 HB3 HIS 5 HB1 HIS 5 31.923 34.997 -36.716 29 HD1 HIS 5 HD1 HIS 5 31.278 34.924 -40.034 30 HD2 HIS 5 HD2 HIS 5 32.249 38.096 -37.524 31 HE1 HIS 5 HE1 HIS 5 30.421 36.992 -41.186 32 HE2 HIS 5 HE2 HIS 5 31.209 38.907 -39.750 33 H HIS 6 HN HIS 6 34.419 35.882 -34.597 34 HA HIS 6 HA HIS 6 35.794 33.443 -34.012 35 HB2 HIS 6 HB2 HIS 6 34.489 35.361 -32.059 36 HB3 HIS 6 HB1 HIS 6 35.711 34.153 -31.681 37 HD1 HIS 6 HD1 HIS 6 35.347 37.640 -32.351 38 HD2 HIS 6 HD2 HIS 6 38.254 34.773 -33.155 39 HE1 HIS 6 HE1 HIS 6 37.453 38.926 -32.844 40 HE2 HIS 6 HE2 HIS 6 39.150 37.179 -33.493 41 H HIS 7 HN HIS 7 34.518 31.693 -34.535 42 HA HIS 7 HA HIS 7 31.782 31.595 -33.673 43 HB2 HIS 7 HB2 HIS 7 31.681 29.388 -34.725 44 HB3 HIS 7 HB1 HIS 7 32.373 30.581 -35.810 45 HD1 HIS 7 HD1 HIS 7 32.810 27.214 -34.863 46 HD2 HIS 7 HD2 HIS 7 35.437 30.358 -35.610 47 HE1 HIS 7 HE1 HIS 7 35.028 26.145 -35.379 48 HE2 HIS 7 HE2 HIS 7 36.629 28.061 -35.724 49 H HIS 8 HN HIS 8 31.797 31.719 -31.488 50 HA HIS 8 HA HIS 8 33.228 29.857 -29.846 51 HB2 HIS 8 HB2 HIS 8 32.645 32.060 -28.971 52 HB3 HIS 8 HB1 HIS 8 30.933 31.734 -29.211 53 HD1 HIS 8 HD1 HIS 8 29.743 31.014 -27.184 54 HD2 HIS 8 HD2 HIS 8 33.800 30.105 -26.998 55 HE1 HIS 8 HE1 HIS 8 30.115 30.015 -24.903 56 HE2 HIS 8 HE2 HIS 8 32.603 29.615 -24.754 57 H HIS 9 HN HIS 9 32.695 27.810 -30.472 58 HA HIS 9 HA HIS 9 30.146 26.865 -31.086 59 HB2 HIS 9 HB2 HIS 9 31.064 24.601 -30.729 60 HB3 HIS 9 HB1 HIS 9 32.130 25.606 -31.699 61 HD1 HIS 9 HD1 HIS 9 31.886 23.929 -28.339 62 HD2 HIS 9 HD2 HIS 9 34.626 26.138 -30.568 63 HE1 HIS 9 HE1 HIS 9 34.086 23.700 -27.142 64 HE2 HIS 9 HE2 HIS 9 35.759 24.904 -28.594 65 H HIS 10 HN HIS 10 28.524 25.948 -29.969 66 HA HIS 10 HA HIS 10 28.853 25.638 -27.066 67 HB2 HIS 10 HB2 HIS 10 26.678 26.521 -26.628 68 HB3 HIS 10 HB1 HIS 10 27.471 27.680 -27.683 69 HD1 HIS 10 HD1 HIS 10 26.632 27.692 -30.231 70 HD2 HIS 10 HD2 HIS 10 24.307 25.507 -27.556 71 HE1 HIS 10 HE1 HIS 10 24.430 27.316 -31.388 72 HE2 HIS 10 HE2 HIS 10 23.063 25.928 -29.786 73 H SER 11 HN SER 11 27.827 23.837 -26.177 74 HA SER 11 HA SER 11 27.458 21.644 -27.941 75 HB2 SER 11 HB2 SER 11 26.740 21.866 -25.008 76 HB3 SER 11 HB1 SER 11 26.940 20.372 -25.925 77 HG SER 11 HG SER 11 28.902 20.554 -25.130 78 H SER 12 HN SER 12 25.616 20.692 -28.691 79 HA SER 12 HA SER 12 23.188 22.182 -28.625 80 HB2 SER 12 HB2 SER 12 23.698 19.375 -29.643 81 HB3 SER 12 HB1 SER 12 22.268 20.351 -29.980 82 HG SER 12 HG SER 12 23.517 20.761 -31.695 83 H GLY 13 HN GLY 13 22.733 22.328 -26.439 84 HA2 GLY 13 HA2 GLY 13 20.983 20.336 -25.419 85 HA3 GLY 13 HA1 GLY 13 22.523 20.314 -24.564 86 H ARG 14 HN ARG 14 20.166 22.681 -25.758 87 HA ARG 14 HA ARG 14 20.712 24.318 -23.366 88 HB2 ARG 14 HB2 ARG 14 19.573 25.136 -26.050 89 HB3 ARG 14 HB1 ARG 14 19.886 26.218 -24.699 90 HG2 ARG 14 HG2 ARG 14 22.017 24.593 -26.055 91 HG3 ARG 14 HG1 ARG 14 21.605 26.248 -26.511 92 HD2 ARG 14 HD2 ARG 14 22.469 25.406 -23.744 93 HD3 ARG 14 HD1 ARG 14 23.553 26.075 -24.965 94 HE ARG 14 HE ARG 14 22.023 28.078 -24.920 95 HH11 ARG 14 HH11 ARG 14 22.494 26.016 -22.109 96 HH12 ARG 14 HH12 ARG 14 22.034 27.261 -20.979 97 HH21 ARG 14 HH21 ARG 14 21.417 29.686 -23.441 98 HH22 ARG 14 HH22 ARG 14 21.423 29.344 -21.736 99 H GLU 15 HN GLU 15 18.295 22.845 -25.384 100 HA GLU 15 HA GLU 15 16.111 23.855 -23.746 101 HB2 GLU 15 HB2 GLU 15 14.662 22.687 -25.392 102 HB3 GLU 15 HB1 GLU 15 15.735 23.868 -26.127 103 HG2 GLU 15 HG2 GLU 15 16.389 20.938 -26.036 104 HG3 GLU 15 HG1 GLU 15 15.436 21.657 -27.331 105 H ASN 16 HN ASN 16 18.261 21.440 -23.380 106 HA ASN 16 HA ASN 16 16.535 19.241 -22.819 107 HB2 ASN 16 HB2 ASN 16 18.528 18.157 -21.814 108 HB3 ASN 16 HB1 ASN 16 18.798 18.740 -23.446 109 HD21 ASN 16 HD21 ASN 16 18.839 20.807 -20.582 110 HD22 ASN 16 HD22 ASN 16 20.526 21.161 -20.659 111 H LEU 17 HN LEU 17 16.899 22.071 -21.201 112 HA LEU 17 HA LEU 17 16.626 21.039 -18.519 113 HB2 LEU 17 HB2 LEU 17 16.335 23.796 -19.696 114 HB3 LEU 17 HB1 LEU 17 15.932 23.456 -18.026 115 HG LEU 17 HG LEU 17 18.363 22.563 -17.858 116 HD11 LEU 17 HD11 LEU 17 19.938 23.657 -19.360 117 HD12 LEU 17 HD12 LEU 17 18.598 24.333 -20.285 118 HD13 LEU 17 HD13 LEU 17 18.851 22.589 -20.249 119 HD21 LEU 17 HD21 LEU 17 19.164 24.805 -17.317 120 HD22 LEU 17 HD22 LEU 17 17.525 24.547 -16.716 121 HD23 LEU 17 HD23 LEU 17 17.790 25.506 -18.173 122 H TYR 18 HN TYR 18 14.583 21.530 -21.195 123 HA TYR 18 HA TYR 18 12.196 21.880 -19.572 124 HB2 TYR 18 HB2 TYR 18 12.567 21.723 -22.562 125 HB3 TYR 18 HB1 TYR 18 11.014 21.933 -21.762 126 HD1 TYR 18 HD1 TYR 18 10.648 24.003 -20.362 127 HD2 TYR 18 HD2 TYR 18 13.971 23.574 -22.985 128 HE1 TYR 18 HE1 TYR 18 10.976 26.436 -20.335 129 HE2 TYR 18 HE2 TYR 18 14.308 26.011 -22.963 130 HH TYR 18 HH TYR 18 12.912 28.058 -22.534 131 H PHE 19 HN PHE 19 12.052 19.954 -18.486 132 HA PHE 19 HA PHE 19 11.477 17.586 -20.126 133 HB2 PHE 19 HB2 PHE 19 11.803 16.266 -18.076 134 HB3 PHE 19 HB1 PHE 19 13.223 17.229 -18.453 135 HD1 PHE 19 HD1 PHE 19 13.681 19.299 -17.125 136 HD2 PHE 19 HD2 PHE 19 10.663 16.505 -16.030 137 HE1 PHE 19 HE1 PHE 19 13.666 20.216 -14.843 138 HE2 PHE 19 HE2 PHE 19 10.642 17.417 -13.745 139 HZ PHE 19 HZ PHE 19 12.146 19.275 -13.148 140 H GLN 20 HN GLN 20 9.892 20.075 -19.103 141 HA GLN 20 HA GLN 20 7.708 18.988 -17.628 142 HB2 GLN 20 HB2 GLN 20 8.162 21.587 -19.069 143 HB3 GLN 20 HB1 GLN 20 6.590 21.188 -18.395 144 HG2 GLN 20 HG2 GLN 20 7.876 22.601 -16.893 145 HG3 GLN 20 HG1 GLN 20 7.556 21.025 -16.175 146 HE21 GLN 20 HE21 GLN 20 9.984 23.084 -17.587 147 HE22 GLN 20 HE22 GLN 20 11.352 22.230 -16.966 148 H GLY 21 HN GLY 21 8.638 18.679 -20.812 149 HA2 GLY 21 HA2 GLY 21 6.135 18.798 -22.148 150 HA3 GLY 21 HA1 GLY 21 7.585 17.993 -22.731 151 H HIS 22 HN HIS 22 4.517 17.605 -21.295 152 HA HIS 22 HA HIS 22 4.941 14.858 -20.489 153 HB2 HIS 22 HB2 HIS 22 2.495 16.629 -20.565 154 HB3 HIS 22 HB1 HIS 22 2.426 14.932 -20.104 155 HD1 HIS 22 HD1 HIS 22 3.210 18.284 -18.811 156 HD2 HIS 22 HD2 HIS 22 3.811 14.335 -17.656 157 HE1 HIS 22 HE1 HIS 22 3.828 18.375 -16.373 158 HE2 HIS 22 HE2 HIS 22 3.977 15.965 -15.652 159 H MET 23 HN MET 23 3.277 13.232 -21.288 160 HA MET 23 HA MET 23 3.652 12.880 -24.072 161 HB2 MET 23 HB2 MET 23 3.435 10.994 -22.492 162 HB3 MET 23 HB1 MET 23 1.755 11.430 -22.214 163 HG2 MET 23 HG2 MET 23 1.883 9.570 -23.738 164 HG3 MET 23 HG1 MET 23 1.257 10.991 -24.571 165 HE1 MET 23 HE1 MET 23 5.591 9.468 -25.030 166 HE2 MET 23 HE2 MET 23 4.387 8.686 -24.008 167 HE3 MET 23 HE3 MET 23 4.996 10.286 -23.585 168 H CYS 24 HN CYS 24 2.765 14.472 -25.277 169 HA CYS 24 HA CYS 24 0.019 15.298 -24.899 170 HB2 CYS 24 HB2 CYS 24 1.952 16.037 -27.108 171 HB3 CYS 24 HB1 CYS 24 0.471 16.885 -26.671 172 HG CYS 24 HG CYS 24 2.943 16.578 -24.353 173 H ILE 25 HN ILE 25 -1.683 14.883 -26.319 174 HA ILE 25 HA ILE 25 -1.690 12.323 -27.468 175 HB ILE 25 HB ILE 25 -3.717 13.545 -26.632 176 HG12 ILE 25 HG12 ILE 25 -5.235 12.634 -28.390 177 HG13 ILE 25 HG11 ILE 25 -3.828 12.369 -29.416 178 HG21 ILE 25 HG21 ILE 25 -3.543 14.956 -29.290 179 HG22 ILE 25 HG22 ILE 25 -3.362 15.695 -27.699 180 HG23 ILE 25 HG23 ILE 25 -4.916 15.017 -28.185 181 HD11 ILE 25 HD11 ILE 25 -2.919 10.819 -27.761 182 HD12 ILE 25 HD12 ILE 25 -4.511 10.316 -28.328 183 HD13 ILE 25 HD13 ILE 25 -4.339 11.076 -26.746 184 H GLN 26 HN GLN 26 -1.050 15.484 -28.846 185 HA GLN 26 HA GLN 26 -1.261 14.792 -31.566 186 HB2 GLN 26 HB2 GLN 26 -1.121 17.114 -30.686 187 HB3 GLN 26 HB1 GLN 26 0.577 16.844 -30.325 188 HG2 GLN 26 HG2 GLN 26 0.383 18.081 -32.369 189 HG3 GLN 26 HG1 GLN 26 1.002 16.470 -32.721 190 HE21 GLN 26 HE21 GLN 26 -0.387 18.430 -34.425 191 HE22 GLN 26 HE22 GLN 26 -1.761 17.589 -35.058 192 H LYS 27 HN LYS 27 1.393 14.500 -29.267 193 HA LYS 27 HA LYS 27 3.322 13.646 -31.188 194 HB2 LYS 27 HB2 LYS 27 4.056 14.607 -29.072 195 HB3 LYS 27 HB1 LYS 27 3.243 13.332 -28.178 196 HG2 LYS 27 HG2 LYS 27 5.632 12.945 -28.250 197 HG3 LYS 27 HG1 LYS 27 4.773 11.681 -29.132 198 HD2 LYS 27 HD2 LYS 27 5.250 12.973 -31.239 199 HD3 LYS 27 HD1 LYS 27 6.302 14.015 -30.275 200 HE2 LYS 27 HE2 LYS 27 7.646 12.078 -29.640 201 HE3 LYS 27 HE1 LYS 27 6.590 11.025 -30.578 202 HZ1 LYS 27 HZ1 LYS 27 8.372 11.411 -31.976 203 HZ2 LYS 27 HZ2 LYS 27 8.517 13.042 -31.543 204 HZ3 LYS 27 HZ3 LYS 27 7.231 12.542 -32.530 205 H VAL 28 HN VAL 28 0.960 12.064 -29.143 206 HA VAL 28 HA VAL 28 1.781 9.400 -29.493 207 HB VAL 28 HB VAL 28 -1.037 10.444 -29.127 208 HG11 VAL 28 HG11 VAL 28 -1.020 8.141 -29.921 209 HG12 VAL 28 HG12 VAL 28 -1.530 8.211 -28.235 210 HG13 VAL 28 HG13 VAL 28 0.106 7.693 -28.640 211 HG21 VAL 28 HG21 VAL 28 0.445 11.189 -27.342 212 HG22 VAL 28 HG22 VAL 28 0.991 9.531 -27.085 213 HG23 VAL 28 HG23 VAL 28 -0.682 9.971 -26.745 214 H ILE 29 HN ILE 29 -0.632 11.316 -31.270 215 HA ILE 29 HA ILE 29 -1.215 9.453 -33.269 216 HB ILE 29 HB ILE 29 -1.417 12.436 -33.098 217 HG12 ILE 29 HG12 ILE 29 -3.809 11.954 -33.530 218 HG13 ILE 29 HG11 ILE 29 -3.426 10.241 -33.642 219 HG21 ILE 29 HG21 ILE 29 -2.369 12.563 -35.352 220 HG22 ILE 29 HG22 ILE 29 -1.929 10.877 -35.627 221 HG23 ILE 29 HG23 ILE 29 -0.670 12.089 -35.381 222 HD11 ILE 29 HD11 ILE 29 -2.715 10.250 -31.310 223 HD12 ILE 29 HD12 ILE 29 -4.383 10.799 -31.488 224 HD13 ILE 29 HD13 ILE 29 -3.095 11.969 -31.203 225 H GLU 30 HN GLU 30 1.179 12.073 -33.222 226 HA GLU 30 HA GLU 30 2.217 11.815 -35.768 227 HB2 GLU 30 HB2 GLU 30 2.771 13.626 -34.178 228 HB3 GLU 30 HB1 GLU 30 3.742 12.492 -33.248 229 HG2 GLU 30 HG2 GLU 30 4.993 12.142 -35.502 230 HG3 GLU 30 HG1 GLU 30 4.275 13.695 -35.921 231 H ASP 31 HN ASP 31 3.330 10.188 -32.798 232 HA ASP 31 HA ASP 31 5.522 8.924 -34.080 233 HB2 ASP 31 HB2 ASP 31 5.587 9.362 -31.699 234 HB3 ASP 31 HB1 ASP 31 4.194 8.317 -31.435 235 H LYS 32 HN LYS 32 2.252 7.788 -33.267 236 HA LYS 32 HA LYS 32 2.856 5.078 -33.823 237 HB2 LYS 32 HB2 LYS 32 0.206 6.502 -33.639 238 HB3 LYS 32 HB1 LYS 32 0.360 4.765 -33.877 239 HG2 LYS 32 HG2 LYS 32 1.766 4.748 -31.768 240 HG3 LYS 32 HG1 LYS 32 1.210 6.399 -31.508 241 HD2 LYS 32 HD2 LYS 32 -0.596 3.999 -31.810 242 HD3 LYS 32 HD1 LYS 32 -0.107 4.701 -30.269 243 HE2 LYS 32 HE2 LYS 32 -2.104 5.752 -30.538 244 HE3 LYS 32 HE1 LYS 32 -1.066 6.900 -31.381 245 HZ1 LYS 32 HZ1 LYS 32 -1.642 5.561 -33.444 246 HZ2 LYS 32 HZ2 LYS 32 -2.838 6.569 -32.805 247 HZ3 LYS 32 HZ3 LYS 32 -2.907 4.893 -32.524 248 H LEU 33 HN LEU 33 1.277 7.595 -35.831 249 HA LEU 33 HA LEU 33 1.075 5.809 -38.049 250 HB2 LEU 33 HB2 LEU 33 0.524 7.794 -39.395 251 HB3 LEU 33 HB1 LEU 33 -0.458 7.638 -37.957 252 HG LEU 33 HG LEU 33 1.204 9.355 -36.926 253 HD11 LEU 33 HD11 LEU 33 2.842 9.318 -38.729 254 HD12 LEU 33 HD12 LEU 33 2.133 10.922 -38.549 255 HD13 LEU 33 HD13 LEU 33 1.613 9.871 -39.868 256 HD21 LEU 33 HD21 LEU 33 -0.182 11.179 -37.755 257 HD22 LEU 33 HD22 LEU 33 -1.156 9.761 -37.366 258 HD23 LEU 33 HD23 LEU 33 -0.785 10.141 -39.047 259 H SER 34 HN SER 34 3.566 7.964 -36.892 260 HA SER 34 HA SER 34 5.170 7.968 -39.221 261 HB2 SER 34 HB2 SER 34 5.567 9.542 -37.372 262 HB3 SER 34 HB1 SER 34 6.019 8.203 -36.319 263 HG SER 34 HG SER 34 7.701 9.531 -37.606 264 H SER 35 HN SER 35 4.992 5.817 -36.424 265 HA SER 35 HA SER 35 7.142 4.141 -37.180 266 HB2 SER 35 HB2 SER 35 4.729 3.454 -35.484 267 HB3 SER 35 HB1 SER 35 6.274 2.600 -35.501 268 HG SER 35 HG SER 35 5.710 5.224 -34.571 269 H ALA 36 HN ALA 36 3.822 4.331 -38.138 270 HA ALA 36 HA ALA 36 3.645 1.690 -39.233 271 HB1 ALA 36 HB1 ALA 36 1.678 2.887 -38.408 272 HB2 ALA 36 HB2 ALA 36 1.493 2.413 -40.097 273 HB3 ALA 36 HB3 ALA 36 1.874 4.085 -39.687 274 H LEU 37 HN LEU 37 3.863 4.947 -40.682 275 HA LEU 37 HA LEU 37 4.085 3.779 -43.331 276 HB2 LEU 37 HB2 LEU 37 4.159 6.675 -42.481 277 HB3 LEU 37 HB1 LEU 37 4.009 6.087 -44.125 278 HG LEU 37 HG LEU 37 1.968 5.686 -41.937 279 HD11 LEU 37 HD11 LEU 37 1.935 7.499 -44.344 280 HD12 LEU 37 HD12 LEU 37 2.098 8.008 -42.663 281 HD13 LEU 37 HD13 LEU 37 0.602 7.254 -43.217 282 HD21 LEU 37 HD21 LEU 37 1.983 3.847 -43.536 283 HD22 LEU 37 HD22 LEU 37 1.868 4.994 -44.870 284 HD23 LEU 37 HD23 LEU 37 0.536 4.837 -43.726 285 H LYS 38 HN LYS 38 6.138 5.127 -40.917 286 HA LYS 38 HA LYS 38 8.337 5.604 -40.762 287 HB2 LYS 38 HB2 LYS 38 8.438 3.178 -41.422 288 HB3 LYS 38 HB1 LYS 38 8.703 3.703 -43.080 289 HG2 LYS 38 HG2 LYS 38 10.732 4.897 -42.345 290 HG3 LYS 38 HG1 LYS 38 10.478 4.271 -40.716 291 HD2 LYS 38 HD2 LYS 38 10.604 1.968 -41.647 292 HD3 LYS 38 HD1 LYS 38 11.016 2.672 -43.214 293 HE2 LYS 38 HE2 LYS 38 13.038 2.003 -42.091 294 HE3 LYS 38 HE1 LYS 38 12.969 3.763 -42.165 295 HZ1 LYS 38 HZ1 LYS 38 11.984 3.611 -39.842 296 HZ2 LYS 38 HZ2 LYS 38 13.635 3.276 -40.002 297 HZ3 LYS 38 HZ3 LYS 38 12.529 2.003 -39.829 298 HA PRO 39 HA PRO 39 8.507 8.485 -44.305 299 HB2 PRO 39 HB2 PRO 39 7.764 10.730 -42.903 300 HB3 PRO 39 HB1 PRO 39 6.642 9.672 -43.756 301 HG2 PRO 39 HG2 PRO 39 6.900 10.084 -40.923 302 HG3 PRO 39 HG1 PRO 39 5.731 9.074 -41.783 303 HD2 PRO 39 HD2 PRO 39 8.236 8.305 -40.429 304 HD3 PRO 39 HD1 PRO 39 6.823 7.310 -40.844 305 H THR 40 HN THR 40 10.250 9.724 -44.828 306 HA THR 40 HA THR 40 12.339 10.098 -42.870 307 HB THR 40 HB THR 40 13.527 11.221 -44.810 308 HG1 THR 40 HG1 THR 40 12.009 11.857 -46.214 309 HG21 THR 40 HG21 THR 40 12.480 8.423 -45.265 310 HG22 THR 40 HG22 THR 40 13.876 8.858 -44.280 311 HG23 THR 40 HG23 THR 40 13.910 9.122 -46.024 312 H PHE 41 HN PHE 41 9.768 11.878 -44.285 313 HA PHE 41 HA PHE 41 10.355 14.115 -42.495 314 HB2 PHE 41 HB2 PHE 41 11.122 14.809 -44.734 315 HB3 PHE 41 HB1 PHE 41 9.542 14.419 -45.399 316 HD1 PHE 41 HD1 PHE 41 11.403 16.744 -43.251 317 HD2 PHE 41 HD2 PHE 41 7.695 15.910 -45.164 318 HE1 PHE 41 HE1 PHE 41 10.655 19.043 -42.794 319 HE2 PHE 41 HE2 PHE 41 6.939 18.208 -44.710 320 HZ PHE 41 HZ PHE 41 8.421 19.778 -43.524 321 H LEU 42 HN LEU 42 8.635 14.525 -41.269 322 HA LEU 42 HA LEU 42 5.949 14.070 -42.324 323 HB2 LEU 42 HB2 LEU 42 6.842 12.032 -41.038 324 HB3 LEU 42 HB1 LEU 42 6.758 13.036 -39.607 325 HG LEU 42 HG LEU 42 4.830 11.456 -39.942 326 HD11 LEU 42 HD11 LEU 42 4.154 14.388 -39.818 327 HD12 LEU 42 HD12 LEU 42 4.624 13.367 -38.459 328 HD13 LEU 42 HD13 LEU 42 3.107 13.064 -39.307 329 HD21 LEU 42 HD21 LEU 42 4.606 11.658 -42.348 330 HD22 LEU 42 HD22 LEU 42 4.159 13.356 -42.180 331 HD23 LEU 42 HD23 LEU 42 3.097 12.098 -41.546 332 H GLU 43 HN GLU 43 4.865 15.904 -42.010 333 HA GLU 43 HA GLU 43 5.347 17.386 -39.517 334 HB2 GLU 43 HB2 GLU 43 6.555 18.554 -41.274 335 HB3 GLU 43 HB1 GLU 43 5.120 18.572 -42.290 336 HG2 GLU 43 HG2 GLU 43 4.009 20.082 -40.822 337 HG3 GLU 43 HG1 GLU 43 5.282 19.932 -39.613 338 H LEU 44 HN LEU 44 3.564 17.950 -38.442 339 HA LEU 44 HA LEU 44 0.966 17.422 -39.658 340 HB2 LEU 44 HB2 LEU 44 1.711 18.248 -36.842 341 HB3 LEU 44 HB1 LEU 44 0.076 17.938 -37.383 342 HG LEU 44 HG LEU 44 0.724 16.015 -36.207 343 HD11 LEU 44 HD11 LEU 44 1.138 15.435 -39.130 344 HD12 LEU 44 HD12 LEU 44 -0.406 15.493 -38.279 345 HD13 LEU 44 HD13 LEU 44 0.773 14.241 -37.884 346 HD21 LEU 44 HD21 LEU 44 3.111 16.419 -36.076 347 HD22 LEU 44 HD22 LEU 44 3.294 16.006 -37.781 348 HD23 LEU 44 HD23 LEU 44 2.794 14.773 -36.625 349 H VAL 45 HN VAL 45 -0.033 18.992 -40.718 350 HA VAL 45 HA VAL 45 0.752 21.767 -40.145 351 HB VAL 45 HB VAL 45 -0.517 20.660 -42.656 352 HG11 VAL 45 HG11 VAL 45 -1.014 23.016 -42.305 353 HG12 VAL 45 HG12 VAL 45 0.107 22.810 -43.649 354 HG13 VAL 45 HG13 VAL 45 0.701 23.358 -42.082 355 HG21 VAL 45 HG21 VAL 45 1.691 20.937 -43.678 356 HG22 VAL 45 HG22 VAL 45 1.726 19.770 -42.356 357 HG23 VAL 45 HG23 VAL 45 2.354 21.400 -42.110 358 H ASP 46 HN ASP 46 -0.668 23.158 -39.382 359 HA ASP 46 HA ASP 46 -3.363 22.563 -38.780 360 HB2 ASP 46 HB2 ASP 46 -1.976 24.343 -37.691 361 HB3 ASP 46 HB1 ASP 46 -2.093 25.287 -39.169 362 H LYS 47 HN LYS 47 -4.667 21.963 -40.436 363 HA LYS 47 HA LYS 47 -4.460 23.319 -43.001 364 HB2 LYS 47 HB2 LYS 47 -4.787 20.743 -42.538 365 HB3 LYS 47 HB1 LYS 47 -6.483 21.189 -42.429 366 HG2 LYS 47 HG2 LYS 47 -6.090 20.469 -44.649 367 HG3 LYS 47 HG1 LYS 47 -6.253 22.227 -44.705 368 HD2 LYS 47 HD2 LYS 47 -3.897 22.519 -44.893 369 HD3 LYS 47 HD1 LYS 47 -3.595 20.821 -44.523 370 HE2 LYS 47 HE2 LYS 47 -4.919 20.298 -46.636 371 HE3 LYS 47 HE1 LYS 47 -4.761 22.013 -47.022 372 HZ1 LYS 47 HZ1 LYS 47 -3.006 20.739 -48.070 373 HZ2 LYS 47 HZ2 LYS 47 -2.519 20.104 -46.571 374 HZ3 LYS 47 HZ3 LYS 47 -2.341 21.764 -46.891 375 H SER 48 HN SER 48 -7.225 22.284 -41.028 376 HA SER 48 HA SER 48 -8.835 24.445 -42.073 377 HB2 SER 48 HB2 SER 48 -9.721 22.124 -41.667 378 HB3 SER 48 HB1 SER 48 -9.540 22.418 -39.939 379 HG SER 48 HG SER 48 -11.580 23.045 -41.485 380 H CYS 49 HN CYS 49 -8.662 26.405 -41.230 381 HA CYS 49 HA CYS 49 -7.309 26.917 -38.809 382 HB2 CYS 49 HB2 CYS 49 -8.194 29.283 -39.179 383 HB3 CYS 49 HB1 CYS 49 -7.172 28.605 -40.441 384 HG CYS 49 HG CYS 49 -9.816 30.132 -40.973 385 H GLY 50 HN GLY 50 -7.958 27.100 -36.813 386 HA2 GLY 50 HA2 GLY 50 -10.191 28.008 -35.637 387 HA3 GLY 50 HA1 GLY 50 -10.706 26.414 -36.177 388 H CYS 51 HN CYS 51 -10.871 25.366 -34.243 389 HA CYS 51 HA CYS 51 -8.675 25.481 -32.348 390 HB2 CYS 51 HB2 CYS 51 -10.989 25.423 -31.513 391 HB3 CYS 51 HB1 CYS 51 -11.235 23.863 -32.291 392 HG CYS 51 HG CYS 51 -8.982 22.811 -30.684 393 H GLY 52 HN GLY 52 -9.574 23.667 -35.047 394 HA2 GLY 52 HA2 GLY 52 -7.608 22.261 -35.800 395 HA3 GLY 52 HA1 GLY 52 -7.791 21.458 -34.246 396 H THR 53 HN THR 53 -10.011 22.477 -36.824 397 HA THR 53 HA THR 53 -11.731 20.259 -36.484 398 HB THR 53 HB THR 53 -11.479 22.010 -38.935 399 HG1 THR 53 HG1 THR 53 -12.621 23.524 -37.884 400 HG21 THR 53 HG21 THR 53 -13.816 20.485 -37.779 401 HG22 THR 53 HG22 THR 53 -12.906 20.046 -39.224 402 HG23 THR 53 HG23 THR 53 -13.868 21.524 -39.203 403 H SER 54 HN SER 54 -9.131 20.985 -38.755 404 HA SER 54 HA SER 54 -9.004 18.151 -39.459 405 HB2 SER 54 HB2 SER 54 -8.819 20.301 -41.575 406 HB3 SER 54 HB1 SER 54 -8.940 18.558 -41.806 407 HG SER 54 HG SER 54 -11.070 18.826 -40.691 408 H PHE 55 HN PHE 55 -6.974 17.441 -39.294 409 HA PHE 55 HA PHE 55 -4.778 19.399 -39.525 410 HB2 PHE 55 HB2 PHE 55 -4.816 16.724 -38.095 411 HB3 PHE 55 HB1 PHE 55 -3.423 17.792 -38.210 412 HD1 PHE 55 HD1 PHE 55 -3.563 20.067 -37.127 413 HD2 PHE 55 HD2 PHE 55 -6.397 16.978 -36.404 414 HE1 PHE 55 HE1 PHE 55 -4.257 21.195 -35.054 415 HE2 PHE 55 HE2 PHE 55 -7.102 18.101 -34.332 416 HZ PHE 55 HZ PHE 55 -6.031 20.214 -33.655 417 H ASP 56 HN ASP 56 -3.256 19.056 -41.080 418 HA ASP 56 HA ASP 56 -3.697 16.695 -42.797 419 HB2 ASP 56 HB2 ASP 56 -4.415 18.810 -43.839 420 HB3 ASP 56 HB1 ASP 56 -2.804 19.474 -43.597 421 H ALA 57 HN ALA 57 -1.994 15.390 -43.081 422 HA ALA 57 HA ALA 57 0.552 16.310 -41.938 423 HB1 ALA 57 HB1 ALA 57 -0.480 14.395 -40.822 424 HB2 ALA 57 HB2 ALA 57 1.067 13.967 -41.553 425 HB3 ALA 57 HB3 ALA 57 -0.440 13.495 -42.338 426 H VAL 58 HN VAL 58 1.998 16.894 -43.363 427 HA VAL 58 HA VAL 58 2.064 15.881 -46.057 428 HB VAL 58 HB VAL 58 4.132 17.535 -44.583 429 HG11 VAL 58 HG11 VAL 58 5.048 16.410 -46.537 430 HG12 VAL 58 HG12 VAL 58 4.923 18.147 -46.819 431 HG13 VAL 58 HG13 VAL 58 3.742 17.049 -47.535 432 HG21 VAL 58 HG21 VAL 58 1.987 18.676 -44.651 433 HG22 VAL 58 HG22 VAL 58 1.886 18.415 -46.392 434 HG23 VAL 58 HG23 VAL 58 3.141 19.461 -45.727 435 H ILE 59 HN ILE 59 2.771 13.874 -46.449 436 HA ILE 59 HA ILE 59 4.808 12.763 -44.651 437 HB ILE 59 HB ILE 59 3.991 10.623 -44.993 438 HG12 ILE 59 HG12 ILE 59 2.086 10.435 -46.928 439 HG13 ILE 59 HG11 ILE 59 3.170 11.619 -47.653 440 HG21 ILE 59 HG21 ILE 59 1.561 12.368 -45.307 441 HG22 ILE 59 HG22 ILE 59 2.361 11.962 -43.787 442 HG23 ILE 59 HG23 ILE 59 1.568 10.700 -44.732 443 HD11 ILE 59 HD11 ILE 59 3.936 8.869 -46.693 444 HD12 ILE 59 HD12 ILE 59 5.029 10.051 -47.414 445 HD13 ILE 59 HD13 ILE 59 3.716 9.368 -48.371 446 H VAL 60 HN VAL 60 6.746 12.293 -45.367 447 HA VAL 60 HA VAL 60 7.162 11.981 -48.265 448 HB VAL 60 HB VAL 60 9.080 13.188 -46.253 449 HG11 VAL 60 HG11 VAL 60 10.564 13.565 -48.164 450 HG12 VAL 60 HG12 VAL 60 9.446 12.677 -49.199 451 HG13 VAL 60 HG13 VAL 60 10.277 11.848 -47.883 452 HG21 VAL 60 HG21 VAL 60 7.663 14.427 -48.611 453 HG22 VAL 60 HG22 VAL 60 8.858 15.227 -47.590 454 HG23 VAL 60 HG23 VAL 60 7.311 14.727 -46.909 455 H SER 61 HN SER 61 7.247 9.821 -48.481 456 HA SER 61 HA SER 61 9.191 8.317 -46.937 457 HB2 SER 61 HB2 SER 61 7.274 8.210 -45.458 458 HB3 SER 61 HB1 SER 61 6.225 7.732 -46.792 459 HG SER 61 HG SER 61 7.859 6.208 -45.234 460 H ASN 62 HN ASN 62 9.629 6.233 -47.785 461 HA ASN 62 HA ASN 62 9.324 5.948 -50.595 462 HB2 ASN 62 HB2 ASN 62 10.342 4.106 -48.444 463 HB3 ASN 62 HB1 ASN 62 10.168 3.557 -50.105 464 HD21 ASN 62 HD21 ASN 62 11.156 6.782 -49.088 465 HD22 ASN 62 HD22 ASN 62 12.771 6.683 -49.708 466 H ASN 63 HN ASN 63 7.337 5.172 -47.946 467 HA ASN 63 HA ASN 63 6.025 2.857 -48.853 468 HB2 ASN 63 HB2 ASN 63 5.992 3.827 -46.524 469 HB3 ASN 63 HB1 ASN 63 4.843 5.023 -47.106 470 HD21 ASN 63 HD21 ASN 63 2.729 4.419 -47.481 471 HD22 ASN 63 HD22 ASN 63 2.095 2.887 -47.003 472 H PHE 64 HN PHE 64 6.022 5.805 -50.353 473 HA PHE 64 HA PHE 64 3.283 5.458 -51.364 474 HB2 PHE 64 HB2 PHE 64 3.689 7.643 -50.344 475 HB3 PHE 64 HB1 PHE 64 5.063 7.906 -51.410 476 HD1 PHE 64 HD2 PHE 64 1.458 6.975 -51.749 477 HD2 PHE 64 HD1 PHE 64 4.703 9.349 -53.140 478 HE1 PHE 64 HE2 PHE 64 -0.028 8.028 -53.404 479 HE2 PHE 64 HE1 PHE 64 3.226 10.407 -54.800 480 HZ PHE 64 HZ PHE 64 0.857 9.746 -54.935 481 H GLU 65 HN GLU 65 6.413 4.711 -52.207 482 HA GLU 65 HA GLU 65 6.405 5.771 -54.880 483 HB2 GLU 65 HB2 GLU 65 8.562 4.793 -55.156 484 HB3 GLU 65 HB1 GLU 65 8.488 5.481 -53.545 485 HG2 GLU 65 HG2 GLU 65 9.482 3.516 -53.041 486 HG3 GLU 65 HG1 GLU 65 7.802 2.991 -52.930 487 H ASP 66 HN ASP 66 5.230 2.896 -53.422 488 HA ASP 66 HA ASP 66 5.178 1.319 -55.818 489 HB2 ASP 66 HB2 ASP 66 3.809 1.073 -53.152 490 HB3 ASP 66 HB1 ASP 66 3.374 0.019 -54.491 491 H LYS 67 HN LYS 67 3.406 3.931 -54.667 492 HA LYS 67 HA LYS 67 1.553 5.050 -55.265 493 HB2 LYS 67 HB2 LYS 67 1.169 5.387 -57.580 494 HB3 LYS 67 HB1 LYS 67 2.894 5.131 -57.384 495 HG2 LYS 67 HG2 LYS 67 2.640 2.828 -58.163 496 HG3 LYS 67 HG1 LYS 67 0.906 3.089 -58.358 497 HD2 LYS 67 HD2 LYS 67 1.343 4.813 -60.026 498 HD3 LYS 67 HD1 LYS 67 3.083 4.594 -59.811 499 HE2 LYS 67 HE2 LYS 67 2.873 2.267 -60.558 500 HE3 LYS 67 HE1 LYS 67 1.142 2.499 -60.783 501 HZ1 LYS 67 HZ1 LYS 67 3.268 3.984 -62.239 502 HZ2 LYS 67 HZ2 LYS 67 1.596 4.128 -62.486 503 HZ3 LYS 67 HZ3 LYS 67 2.382 2.675 -62.857 504 H LYS 68 HN LYS 68 1.238 2.015 -54.563 505 HA LYS 68 HA LYS 68 -1.247 1.366 -55.835 506 HB2 LYS 68 HB2 LYS 68 0.174 0.112 -53.491 507 HB3 LYS 68 HB1 LYS 68 -1.303 -0.521 -54.206 508 HG2 LYS 68 HG2 LYS 68 -0.044 -0.648 -56.387 509 HG3 LYS 68 HG1 LYS 68 1.418 -0.317 -55.454 510 HD2 LYS 68 HD2 LYS 68 -0.478 -2.609 -54.983 511 HD3 LYS 68 HD1 LYS 68 1.071 -2.720 -55.818 512 HE2 LYS 68 HE2 LYS 68 2.192 -1.953 -53.763 513 HE3 LYS 68 HE1 LYS 68 0.636 -1.932 -52.942 514 HZ1 LYS 68 HZ1 LYS 68 1.956 -3.962 -52.533 515 HZ2 LYS 68 HZ2 LYS 68 1.823 -4.355 -54.179 516 HZ3 LYS 68 HZ3 LYS 68 0.433 -4.275 -53.211 517 H LEU 69 HN LEU 69 -3.181 1.950 -55.282 518 HA LEU 69 HA LEU 69 -3.670 3.742 -53.138 519 HB2 LEU 69 HB2 LEU 69 -4.946 3.860 -55.191 520 HB3 LEU 69 HB1 LEU 69 -5.538 2.226 -54.959 521 HG LEU 69 HG LEU 69 -6.645 3.085 -52.830 522 HD11 LEU 69 HD11 LEU 69 -5.394 5.158 -52.612 523 HD12 LEU 69 HD12 LEU 69 -7.123 5.479 -52.757 524 HD13 LEU 69 HD13 LEU 69 -6.058 5.734 -54.142 525 HD21 LEU 69 HD21 LEU 69 -8.564 3.975 -54.073 526 HD22 LEU 69 HD22 LEU 69 -7.892 2.528 -54.828 527 HD23 LEU 69 HD23 LEU 69 -7.551 4.118 -55.512 528 H LEU 70 HN LEU 70 -4.767 0.415 -53.749 529 HA LEU 70 HA LEU 70 -6.275 0.266 -51.381 530 HB2 LEU 70 HB2 LEU 70 -6.714 -2.004 -51.926 531 HB3 LEU 70 HB1 LEU 70 -6.743 -1.066 -53.398 532 HG LEU 70 HG LEU 70 -5.760 -3.109 -53.973 533 HD11 LEU 70 HD11 LEU 70 -4.519 -1.268 -54.930 534 HD12 LEU 70 HD12 LEU 70 -3.461 -2.642 -54.609 535 HD13 LEU 70 HD13 LEU 70 -3.439 -1.246 -53.538 536 HD21 LEU 70 HD21 LEU 70 -5.351 -4.000 -51.774 537 HD22 LEU 70 HD22 LEU 70 -3.985 -2.907 -51.554 538 HD23 LEU 70 HD23 LEU 70 -3.912 -4.175 -52.779 539 H ASP 71 HN ASP 71 -2.931 -0.429 -52.010 540 HA ASP 71 HA ASP 71 -2.600 -2.179 -49.773 541 HB2 ASP 71 HB2 ASP 71 -1.146 -2.131 -51.862 542 HB3 ASP 71 HB1 ASP 71 -0.390 -0.692 -51.181 543 H ARG 72 HN ARG 72 -1.811 1.221 -50.417 544 HA ARG 72 HA ARG 72 -0.801 1.645 -47.784 545 HB2 ARG 72 HB2 ARG 72 -0.657 3.963 -48.356 546 HB3 ARG 72 HB1 ARG 72 -0.181 3.040 -49.772 547 HG2 ARG 72 HG2 ARG 72 -2.472 3.373 -50.683 548 HG3 ARG 72 HG1 ARG 72 -2.807 4.434 -49.313 549 HD2 ARG 72 HD2 ARG 72 -0.783 5.771 -50.020 550 HD3 ARG 72 HD1 ARG 72 -0.780 4.817 -51.502 551 HE ARG 72 HE ARG 72 -3.085 6.463 -50.684 552 HH11 ARG 72 HH11 ARG 72 -0.843 5.336 -53.119 553 HH12 ARG 72 HH12 ARG 72 -1.511 6.322 -54.386 554 HH21 ARG 72 HH21 ARG 72 -3.972 7.763 -52.342 555 HH22 ARG 72 HH22 ARG 72 -3.285 7.714 -53.936 556 H HIS 73 HN HIS 73 -3.919 1.865 -49.326 557 HA HIS 73 HA HIS 73 -5.311 3.342 -47.387 558 HB2 HIS 73 HB2 HIS 73 -6.202 2.825 -49.636 559 HB3 HIS 73 HB1 HIS 73 -6.347 1.132 -49.184 560 HD1 HIS 73 HD1 HIS 73 -7.887 4.513 -48.485 561 HD2 HIS 73 HD2 HIS 73 -8.639 0.477 -47.801 562 HE1 HIS 73 HE1 HIS 73 -10.237 4.397 -47.608 563 HE2 HIS 73 HE2 HIS 73 -10.583 1.983 -46.990 564 H ARG 74 HN ARG 74 -4.928 -0.190 -47.750 565 HA ARG 74 HA ARG 74 -6.415 -0.840 -45.445 566 HB2 ARG 74 HB2 ARG 74 -5.405 -3.077 -45.633 567 HB3 ARG 74 HB1 ARG 74 -6.004 -2.492 -47.177 568 HG2 ARG 74 HG2 ARG 74 -3.692 -1.849 -47.777 569 HG3 ARG 74 HG1 ARG 74 -3.139 -2.570 -46.266 570 HD2 ARG 74 HD2 ARG 74 -4.610 -4.025 -48.457 571 HD3 ARG 74 HD1 ARG 74 -2.867 -4.069 -48.200 572 HE ARG 74 HE ARG 74 -4.667 -4.951 -46.053 573 HH11 ARG 74 HH11 ARG 74 -2.169 -5.659 -48.400 574 HH12 ARG 74 HH12 ARG 74 -1.839 -7.243 -47.774 575 HH21 ARG 74 HH21 ARG 74 -4.237 -7.016 -45.210 576 HH22 ARG 74 HH22 ARG 74 -3.013 -8.015 -45.941 577 H LEU 75 HN LEU 75 -2.943 -0.260 -45.909 578 HA LEU 75 HA LEU 75 -2.149 -1.010 -43.299 579 HB2 LEU 75 HB2 LEU 75 -0.881 0.935 -45.233 580 HB3 LEU 75 HB1 LEU 75 -0.116 0.350 -43.768 581 HG LEU 75 HG LEU 75 -0.903 -1.335 -46.146 582 HD11 LEU 75 HD11 LEU 75 1.025 0.086 -46.583 583 HD12 LEU 75 HD12 LEU 75 1.510 -1.605 -46.445 584 HD13 LEU 75 HD13 LEU 75 1.800 -0.492 -45.107 585 HD21 LEU 75 HD21 LEU 75 0.503 -2.095 -43.589 586 HD22 LEU 75 HD22 LEU 75 0.255 -3.147 -44.983 587 HD23 LEU 75 HD23 LEU 75 -1.129 -2.569 -44.056 588 H VAL 76 HN VAL 76 -2.842 2.170 -44.718 589 HA VAL 76 HA VAL 76 -2.497 3.721 -42.441 590 HB VAL 76 HB VAL 76 -4.327 4.111 -44.814 591 HG11 VAL 76 HG11 VAL 76 -3.746 6.073 -42.596 592 HG12 VAL 76 HG12 VAL 76 -5.299 5.308 -42.926 593 HG13 VAL 76 HG13 VAL 76 -4.607 6.437 -44.092 594 HG21 VAL 76 HG21 VAL 76 -2.665 5.806 -45.439 595 HG22 VAL 76 HG22 VAL 76 -1.943 4.203 -45.286 596 HG23 VAL 76 HG23 VAL 76 -1.720 5.398 -44.007 597 H ASN 77 HN ASN 77 -5.422 2.037 -43.589 598 HA ASN 77 HA ASN 77 -7.058 2.962 -41.469 599 HB2 ASN 77 HB2 ASN 77 -7.363 0.507 -43.206 600 HB3 ASN 77 HB1 ASN 77 -8.589 1.104 -42.096 601 HD21 ASN 77 HD21 ASN 77 -7.866 3.929 -42.755 602 HD22 ASN 77 HD22 ASN 77 -8.593 4.219 -44.289 603 H THR 78 HN THR 78 -4.763 0.359 -41.689 604 HA THR 78 HA THR 78 -5.717 -1.226 -39.563 605 HB THR 78 HB THR 78 -2.873 -0.905 -40.553 606 HG1 THR 78 HG1 THR 78 -4.493 -1.721 -42.073 607 HG21 THR 78 HG21 THR 78 -2.460 -3.077 -39.494 608 HG22 THR 78 HG22 THR 78 -4.101 -3.074 -38.845 609 HG23 THR 78 HG23 THR 78 -2.935 -1.868 -38.301 610 H ILE 79 HN ILE 79 -3.146 1.274 -39.592 611 HA ILE 79 HA ILE 79 -2.998 1.179 -36.693 612 HB ILE 79 HB ILE 79 -1.583 2.932 -38.708 613 HG12 ILE 79 HG12 ILE 79 0.421 1.674 -37.684 614 HG13 ILE 79 HG11 ILE 79 -0.774 0.569 -37.020 615 HG21 ILE 79 HG21 ILE 79 -1.251 2.907 -35.709 616 HG22 ILE 79 HG22 ILE 79 -1.903 4.228 -36.679 617 HG23 ILE 79 HG23 ILE 79 -0.211 3.763 -36.847 618 HD11 ILE 79 HD11 ILE 79 0.166 -0.306 -39.060 619 HD12 ILE 79 HD12 ILE 79 -0.314 1.150 -39.932 620 HD13 ILE 79 HD13 ILE 79 -1.544 0.062 -39.286 621 H LEU 80 HN LEU 80 -4.215 3.412 -39.145 622 HA LEU 80 HA LEU 80 -4.884 5.404 -37.207 623 HB2 LEU 80 HB2 LEU 80 -5.331 5.151 -40.149 624 HB3 LEU 80 HB1 LEU 80 -6.196 6.371 -39.235 625 HG LEU 80 HG LEU 80 -3.972 7.248 -38.447 626 HD11 LEU 80 HD11 LEU 80 -1.982 6.640 -39.719 627 HD12 LEU 80 HD12 LEU 80 -2.901 5.398 -40.571 628 HD13 LEU 80 HD13 LEU 80 -2.626 5.257 -38.835 629 HD21 LEU 80 HD21 LEU 80 -3.478 8.401 -40.542 630 HD22 LEU 80 HD22 LEU 80 -5.214 8.323 -40.237 631 HD23 LEU 80 HD23 LEU 80 -4.476 7.240 -41.417 632 H LYS 81 HN LYS 81 -6.338 2.504 -37.943 633 HA LYS 81 HA LYS 81 -9.042 2.984 -37.689 634 HB2 LYS 81 HB2 LYS 81 -8.176 0.719 -37.892 635 HB3 LYS 81 HB1 LYS 81 -7.383 0.844 -36.328 636 HG2 LYS 81 HG2 LYS 81 -9.409 -0.485 -36.181 637 HG3 LYS 81 HG1 LYS 81 -9.558 0.992 -35.227 638 HD2 LYS 81 HD2 LYS 81 -10.760 2.019 -37.167 639 HD3 LYS 81 HD1 LYS 81 -10.751 0.431 -37.938 640 HE2 LYS 81 HE2 LYS 81 -12.018 -0.500 -36.093 641 HE3 LYS 81 HE1 LYS 81 -11.966 1.047 -35.248 642 HZ1 LYS 81 HZ1 LYS 81 -13.179 2.008 -37.166 643 HZ2 LYS 81 HZ2 LYS 81 -14.068 0.847 -36.310 644 HZ3 LYS 81 HZ3 LYS 81 -13.358 0.445 -37.800 645 H GLU 82 HN GLU 82 -6.858 2.365 -34.937 646 HA GLU 82 HA GLU 82 -8.651 3.620 -33.089 647 HB2 GLU 82 HB2 GLU 82 -7.358 1.890 -32.167 648 HB3 GLU 82 HB1 GLU 82 -5.882 2.441 -32.937 649 HG2 GLU 82 HG2 GLU 82 -7.143 4.164 -30.867 650 HG3 GLU 82 HG1 GLU 82 -6.278 2.716 -30.360 651 H GLU 83 HN GLU 83 -5.799 4.608 -34.883 652 HA GLU 83 HA GLU 83 -5.020 6.887 -33.528 653 HB2 GLU 83 HB2 GLU 83 -3.988 5.816 -35.565 654 HB3 GLU 83 HB1 GLU 83 -5.201 6.658 -36.521 655 HG2 GLU 83 HG2 GLU 83 -3.323 7.987 -36.640 656 HG3 GLU 83 HG1 GLU 83 -4.339 8.781 -35.441 657 H LEU 84 HN LEU 84 -7.274 6.761 -36.259 658 HA LEU 84 HA LEU 84 -8.075 9.371 -36.391 659 HB2 LEU 84 HB2 LEU 84 -9.739 6.910 -36.874 660 HB3 LEU 84 HB1 LEU 84 -10.254 8.530 -37.299 661 HG LEU 84 HG LEU 84 -7.901 7.033 -38.435 662 HD11 LEU 84 HD11 LEU 84 -9.158 7.166 -40.528 663 HD12 LEU 84 HD12 LEU 84 -10.491 7.942 -39.673 664 HD13 LEU 84 HD13 LEU 84 -10.043 6.280 -39.287 665 HD21 LEU 84 HD21 LEU 84 -8.863 9.826 -39.043 666 HD22 LEU 84 HD22 LEU 84 -7.584 8.964 -39.896 667 HD23 LEU 84 HD23 LEU 84 -7.370 9.406 -38.202 668 H GLN 85 HN GLN 85 -9.075 7.045 -33.956 669 HA GLN 85 HA GLN 85 -11.496 8.212 -33.163 670 HB2 GLN 85 HB2 GLN 85 -9.503 6.904 -31.308 671 HB3 GLN 85 HB1 GLN 85 -11.222 7.102 -31.029 672 HG2 GLN 85 HG2 GLN 85 -9.810 5.211 -32.857 673 HG3 GLN 85 HG1 GLN 85 -10.990 4.872 -31.596 674 HE21 GLN 85 HE21 GLN 85 -10.464 5.630 -34.869 675 HE22 GLN 85 HE22 GLN 85 -12.100 5.549 -35.386 676 H ASN 86 HN ASN 86 -8.264 9.299 -32.753 677 HA ASN 86 HA ASN 86 -8.958 11.077 -30.538 678 HB2 ASN 86 HB2 ASN 86 -6.303 10.448 -31.844 679 HB3 ASN 86 HB1 ASN 86 -6.515 11.533 -30.474 680 HD21 ASN 86 HD21 ASN 86 -5.092 8.905 -30.853 681 HD22 ASN 86 HD22 ASN 86 -5.672 7.915 -29.555 682 H ILE 87 HN ILE 87 -9.188 11.204 -33.803 683 HA ILE 87 HA ILE 87 -8.626 14.105 -33.880 684 HB ILE 87 HB ILE 87 -8.320 12.345 -36.304 685 HG12 ILE 87 HG12 ILE 87 -6.147 13.082 -34.327 686 HG13 ILE 87 HG11 ILE 87 -6.779 11.467 -34.620 687 HG21 ILE 87 HG21 ILE 87 -8.555 14.734 -36.683 688 HG22 ILE 87 HG22 ILE 87 -6.925 14.203 -37.097 689 HG23 ILE 87 HG23 ILE 87 -7.216 15.059 -35.582 690 HD11 ILE 87 HD11 ILE 87 -5.911 11.524 -36.890 691 HD12 ILE 87 HD12 ILE 87 -4.631 11.794 -35.705 692 HD13 ILE 87 HD13 ILE 87 -5.292 13.152 -36.616 693 H HIS 88 HN HIS 88 -10.196 15.369 -34.884 694 HA HIS 88 HA HIS 88 -12.740 14.203 -35.409 695 HB2 HIS 88 HB2 HIS 88 -12.543 16.528 -34.650 696 HB3 HIS 88 HB1 HIS 88 -11.698 16.954 -36.134 697 HD1 HIS 88 HD1 HIS 88 -15.097 15.644 -35.042 698 HD2 HIS 88 HD2 HIS 88 -13.334 17.773 -38.151 699 HE1 HIS 88 HE1 HIS 88 -16.992 16.395 -36.513 700 HE2 HIS 88 HE2 HIS 88 -15.874 17.438 -38.512 701 H ALA 89 HN ALA 89 -10.388 15.775 -37.577 702 HA ALA 89 HA ALA 89 -11.117 13.881 -39.676 703 HB1 ALA 89 HB1 ALA 89 -11.122 16.869 -40.099 704 HB2 ALA 89 HB2 ALA 89 -12.550 15.835 -40.047 705 HB3 ALA 89 HB3 ALA 89 -11.367 15.641 -41.341 706 H PHE 90 HN PHE 90 -9.177 12.918 -39.853 707 HA PHE 90 HA PHE 90 -6.762 14.537 -39.951 708 HB2 PHE 90 HB2 PHE 90 -6.724 12.476 -38.616 709 HB3 PHE 90 HB1 PHE 90 -7.110 11.533 -40.051 710 HD1 PHE 90 HD1 PHE 90 -4.547 13.835 -38.654 711 HD2 PHE 90 HD2 PHE 90 -5.410 10.689 -41.388 712 HE1 PHE 90 HE1 PHE 90 -2.146 13.600 -39.137 713 HE2 PHE 90 HE2 PHE 90 -3.011 10.451 -41.875 714 HZ PHE 90 HZ PHE 90 -1.375 11.904 -40.748 715 H SER 91 HN SER 91 -5.668 15.005 -41.728 716 HA SER 91 HA SER 91 -6.455 13.723 -44.259 717 HB2 SER 91 HB2 SER 91 -7.221 16.047 -44.200 718 HB3 SER 91 HB1 SER 91 -5.605 16.590 -43.752 719 HG SER 91 HG SER 91 -4.896 16.272 -45.748 720 H MET 92 HN MET 92 -4.695 13.556 -45.830 721 HA MET 92 HA MET 92 -2.011 13.795 -44.729 722 HB2 MET 92 HB2 MET 92 -1.405 11.515 -45.160 723 HB3 MET 92 HB1 MET 92 -2.843 11.505 -44.153 724 HG2 MET 92 HG2 MET 92 -2.820 11.079 -47.136 725 HG3 MET 92 HG1 MET 92 -2.873 9.798 -45.930 726 HE1 MET 92 HE1 MET 92 -4.823 10.989 -43.728 727 HE2 MET 92 HE2 MET 92 -4.945 9.339 -44.338 728 HE3 MET 92 HE3 MET 92 -6.379 10.365 -44.279 729 H LYS 93 HN LYS 93 -0.503 14.272 -46.224 730 HA LYS 93 HA LYS 93 -1.323 14.147 -49.051 731 HB2 LYS 93 HB2 LYS 93 0.690 15.973 -47.718 732 HB3 LYS 93 HB1 LYS 93 0.363 15.926 -49.446 733 HG2 LYS 93 HG2 LYS 93 -1.557 16.727 -47.269 734 HG3 LYS 93 HG1 LYS 93 -0.801 17.783 -48.465 735 HD2 LYS 93 HD2 LYS 93 -1.994 16.714 -50.252 736 HD3 LYS 93 HD1 LYS 93 -2.621 15.481 -49.157 737 HE2 LYS 93 HE2 LYS 93 -3.820 17.261 -47.921 738 HE3 LYS 93 HE1 LYS 93 -3.262 18.427 -49.122 739 HZ1 LYS 93 HZ1 LYS 93 -4.414 17.126 -50.832 740 HZ2 LYS 93 HZ2 LYS 93 -5.487 17.690 -49.647 741 HZ3 LYS 93 HZ3 LYS 93 -4.994 16.067 -49.640 742 H CYS 94 HN CYS 94 -0.491 12.441 -50.000 743 HA CYS 94 HA CYS 94 1.821 11.125 -48.867 744 HB2 CYS 94 HB2 CYS 94 0.186 10.354 -51.288 745 HB3 CYS 94 HB1 CYS 94 1.290 9.320 -50.387 746 HG CYS 94 HG CYS 94 -1.716 10.536 -49.311 747 H HIS 95 HN HIS 95 3.776 11.852 -49.389 748 HA HIS 95 HA HIS 95 4.367 12.255 -52.248 749 HB2 HIS 95 HB2 HIS 95 4.983 14.071 -49.956 750 HB3 HIS 95 HB1 HIS 95 6.150 13.951 -51.267 751 HD1 HIS 95 HD1 HIS 95 2.469 13.822 -51.983 752 HD2 HIS 95 HD2 HIS 95 5.626 16.510 -52.188 753 HE1 HIS 95 HE1 HIS 95 1.602 15.781 -53.294 754 HE2 HIS 95 HE2 HIS 95 3.633 17.220 -53.672 755 H THR 96 HN THR 96 6.587 11.870 -52.852 756 HA THR 96 HA THR 96 7.901 9.945 -51.064 757 HB THR 96 HB THR 96 9.225 9.306 -53.076 758 HG1 THR 96 HG1 THR 96 7.430 10.541 -54.801 759 HG21 THR 96 HG21 THR 96 6.229 9.156 -53.421 760 HG22 THR 96 HG22 THR 96 7.222 8.044 -52.478 761 HG23 THR 96 HG23 THR 96 7.411 8.128 -54.229 762 HA PRO 97 HA PRO 97 11.353 12.592 -50.208 763 HB2 PRO 97 HB2 PRO 97 13.481 10.900 -50.710 764 HB3 PRO 97 HB1 PRO 97 12.548 10.924 -49.210 765 HG2 PRO 97 HG2 PRO 97 12.317 9.096 -51.561 766 HG3 PRO 97 HG1 PRO 97 12.188 8.724 -49.832 767 HD2 PRO 97 HD2 PRO 97 10.014 8.930 -51.398 768 HD3 PRO 97 HD1 PRO 97 9.998 9.472 -49.707 769 H LEU 98 HN LEU 98 11.570 10.683 -53.178 770 HA LEU 98 HA LEU 98 13.494 12.353 -54.433 771 HB2 LEU 98 HB2 LEU 98 11.543 10.366 -55.600 772 HB3 LEU 98 HB1 LEU 98 12.766 11.195 -56.539 773 HG LEU 98 HG LEU 98 13.668 9.079 -56.123 774 HD11 LEU 98 HD11 LEU 98 15.270 10.848 -55.710 775 HD12 LEU 98 HD12 LEU 98 15.582 9.469 -54.657 776 HD13 LEU 98 HD13 LEU 98 14.793 10.908 -54.014 777 HD21 LEU 98 HD21 LEU 98 13.749 8.009 -53.926 778 HD22 LEU 98 HD22 LEU 98 12.090 8.329 -54.433 779 HD23 LEU 98 HD23 LEU 98 12.861 9.366 -53.233 780 H GLU 99 HN GLU 99 10.003 12.318 -54.285 781 HA GLU 99 HA GLU 99 9.592 14.306 -56.285 782 HB2 GLU 99 HB2 GLU 99 7.844 12.708 -55.518 783 HB3 GLU 99 HB1 GLU 99 7.817 13.527 -53.964 784 HG2 GLU 99 HG2 GLU 99 7.153 15.612 -55.158 785 HG3 GLU 99 HG1 GLU 99 7.007 14.651 -56.630 786 H TYR 100 HN TYR 100 9.654 14.350 -52.735 787 HA TYR 100 HA TYR 100 9.119 17.093 -52.450 788 HB2 TYR 100 HB2 TYR 100 8.835 15.463 -50.628 789 HB3 TYR 100 HB1 TYR 100 10.581 15.256 -50.542 790 HD1 TYR 100 HD1 TYR 100 7.915 17.834 -50.203 791 HD2 TYR 100 HD2 TYR 100 11.854 16.626 -49.142 792 HE1 TYR 100 HE1 TYR 100 8.055 19.706 -48.614 793 HE2 TYR 100 HE2 TYR 100 12.004 18.493 -47.549 794 HH TYR 100 HH TYR 100 9.293 20.337 -46.602 795 H ASP 101 HN ASP 101 12.151 15.342 -52.864 796 HA ASP 101 HA ASP 101 13.898 17.392 -52.086 797 HB2 ASP 101 HB2 ASP 101 14.655 15.086 -52.405 798 HB3 ASP 101 HB1 ASP 101 14.370 15.221 -54.137 799 H LYS 102 HN LYS 102 12.234 16.836 -55.127 800 HA LYS 102 HA LYS 102 13.699 18.902 -56.496 801 HB2 LYS 102 HB2 LYS 102 11.449 17.091 -57.183 802 HB3 LYS 102 HB1 LYS 102 11.529 18.613 -58.056 803 HG2 LYS 102 HG2 LYS 102 12.762 17.344 -59.464 804 HG3 LYS 102 HG1 LYS 102 14.054 17.859 -58.384 805 HD2 LYS 102 HD2 LYS 102 12.536 15.297 -57.969 806 HD3 LYS 102 HD1 LYS 102 13.957 15.388 -59.005 807 HE2 LYS 102 HE2 LYS 102 13.878 16.132 -56.085 808 HE3 LYS 102 HE1 LYS 102 14.474 14.604 -56.728 809 HZ1 LYS 102 HZ1 LYS 102 16.157 15.862 -57.968 810 HZ2 LYS 102 HZ2 LYS 102 16.296 16.079 -56.289 811 HZ3 LYS 102 HZ3 LYS 102 15.611 17.300 -57.246 812 H LEU 103 HN LEU 103 10.980 18.754 -54.415 813 HA LEU 103 HA LEU 103 9.761 21.203 -55.303 814 HB2 LEU 103 HB2 LEU 103 9.326 19.616 -52.771 815 HB3 LEU 103 HB1 LEU 103 8.328 20.947 -53.320 816 HG LEU 103 HG LEU 103 8.661 18.307 -54.747 817 HD11 LEU 103 HD11 LEU 103 6.341 17.919 -54.092 818 HD12 LEU 103 HD12 LEU 103 6.345 19.430 -53.181 819 HD13 LEU 103 HD13 LEU 103 7.390 18.097 -52.685 820 HD21 LEU 103 HD21 LEU 103 8.273 20.152 -56.298 821 HD22 LEU 103 HD22 LEU 103 6.870 20.659 -55.356 822 HD23 LEU 103 HD23 LEU 103 6.859 19.106 -56.191 823 H LYS 104 HN LYS 104 11.806 20.219 -52.579 824 HA LYS 104 HA LYS 104 11.838 22.688 -51.239 825 HB2 LYS 104 HB2 LYS 104 14.236 21.743 -50.535 826 HB3 LYS 104 HB1 LYS 104 12.737 21.097 -49.880 827 HG2 LYS 104 HG2 LYS 104 12.811 19.216 -51.262 828 HG3 LYS 104 HG1 LYS 104 14.015 19.939 -52.326 829 HD2 LYS 104 HD2 LYS 104 14.613 19.352 -49.444 830 HD3 LYS 104 HD1 LYS 104 14.783 18.117 -50.693 831 HE2 LYS 104 HE2 LYS 104 16.149 20.018 -51.902 832 HE3 LYS 104 HE1 LYS 104 16.346 20.612 -50.252 833 HZ1 LYS 104 HZ1 LYS 104 18.162 19.169 -50.847 834 HZ2 LYS 104 HZ2 LYS 104 17.092 17.913 -51.250 835 HZ3 LYS 104 HZ3 LYS 104 17.231 18.427 -49.636 836 H SER 105 HN SER 105 13.737 21.505 -53.943 837 HA SER 105 HA SER 105 15.753 23.460 -53.894 838 HB2 SER 105 HB2 SER 105 14.646 21.959 -56.278 839 HB3 SER 105 HB1 SER 105 16.205 22.781 -56.202 840 HG SER 105 HG SER 105 16.913 21.298 -54.712 841 H LYS 106 HN LYS 106 12.575 23.407 -55.464 842 HA LYS 106 HA LYS 106 13.049 25.998 -56.678 843 HB2 LYS 106 HB2 LYS 106 10.592 25.685 -57.385 844 HB3 LYS 106 HB1 LYS 106 11.803 24.626 -58.093 845 HG2 LYS 106 HG2 LYS 106 10.961 22.785 -57.111 846 HG3 LYS 106 HG1 LYS 106 10.530 23.643 -55.630 847 HD2 LYS 106 HD2 LYS 106 8.561 22.829 -56.862 848 HD3 LYS 106 HD1 LYS 106 8.583 24.585 -56.702 849 HE2 LYS 106 HE2 LYS 106 9.621 24.648 -59.008 850 HE3 LYS 106 HE1 LYS 106 9.227 22.933 -59.130 851 HZ1 LYS 106 HZ1 LYS 106 7.281 25.128 -58.663 852 HZ2 LYS 106 HZ2 LYS 106 6.898 23.481 -58.783 853 HZ3 LYS 106 HZ3 LYS 106 7.514 24.307 -60.130 854 H GLY 107 HN GLY 107 11.040 24.620 -54.110 855 HA2 GLY 107 HA2 GLY 107 10.390 25.728 -52.154 856 HA3 GLY 107 HA1 GLY 107 10.897 27.251 -52.869 857 H SER 108 HN SER 108 9.380 26.829 -55.320 858 HA SER 108 HA SER 108 6.620 26.952 -54.336 859 HB2 SER 108 HB2 SER 108 7.910 28.915 -56.251 860 HB3 SER 108 HB1 SER 108 6.204 28.900 -55.797 861 HG SER 108 HG SER 108 7.667 28.902 -53.572
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