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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | cing | stage | position | program | type |
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645682 |
6jxw ![]() ![]() |
cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H ASP 16 HT1 ASP 16 -6.557 15.820 10.847 2 HA ASP 16 HA ASP 16 -5.656 14.512 13.335 3 HB2 ASP 16 HB2 ASP 16 -8.292 14.751 11.902 4 HB3 ASP 16 HB1 ASP 16 -7.985 13.421 13.013 5 H HIS 17 HN HIS 17 -6.783 12.085 12.922 6 HA HIS 17 HA HIS 17 -4.969 10.944 10.982 7 HB2 HIS 17 HB2 HIS 17 -6.723 9.842 13.149 8 HB3 HIS 17 HB1 HIS 17 -6.092 8.768 11.907 9 HD2 HIS 17 HD2 HIS 17 -3.382 8.219 12.035 10 HE1 HIS 17 HE1 HIS 17 -2.787 10.206 15.720 11 HE2 HIS 17 HE2 HIS 17 -1.862 8.475 14.126 12 H ILE 18 HN ILE 18 -5.551 9.639 9.265 13 HA ILE 18 HA ILE 18 -8.326 9.970 8.329 14 HB ILE 18 HB ILE 18 -6.611 11.173 6.972 15 HG12 ILE 18 HG12 ILE 18 -7.899 8.887 5.474 16 HG13 ILE 18 HG11 ILE 18 -8.751 10.333 6.002 17 HG21 ILE 18 HG21 ILE 18 -5.088 9.889 5.544 18 HG22 ILE 18 HG22 ILE 18 -5.592 8.407 6.361 19 HG23 ILE 18 HG23 ILE 18 -4.743 9.664 7.261 20 HD11 ILE 18 HD11 ILE 18 -6.452 10.239 4.064 21 HD12 ILE 18 HD12 ILE 18 -7.283 11.699 4.606 22 HD13 ILE 18 HD13 ILE 18 -8.155 10.488 3.665 23 H ASN 19 HN ASN 19 -9.364 8.158 7.439 24 HA ASN 19 HA ASN 19 -8.060 5.609 8.121 25 HB2 ASN 19 HB2 ASN 19 -11.000 6.165 7.674 26 HB3 ASN 19 HB1 ASN 19 -10.294 4.655 8.251 27 HD21 ASN 19 HD21 ASN 19 -11.097 7.933 9.029 28 HD22 ASN 19 HD22 ASN 19 -10.888 7.788 10.746 29 H LEU 20 HN LEU 20 -7.138 4.665 6.442 30 HA LEU 20 HA LEU 20 -8.482 4.840 3.829 31 HB2 LEU 20 HB2 LEU 20 -5.612 4.122 4.444 32 HB3 LEU 20 HB1 LEU 20 -6.313 4.280 2.845 33 HG LEU 20 HG LEU 20 -6.021 6.532 4.839 34 HD11 LEU 20 HD11 LEU 20 -4.458 5.936 2.331 35 HD12 LEU 20 HD12 LEU 20 -3.862 5.771 3.980 36 HD13 LEU 20 HD13 LEU 20 -4.280 7.362 3.351 37 HD21 LEU 20 HD21 LEU 20 -6.578 7.941 2.861 38 HD22 LEU 20 HD22 LEU 20 -7.910 6.932 3.427 39 HD23 LEU 20 HD23 LEU 20 -7.000 6.465 1.991 40 H LYS 21 HN LYS 21 -9.502 3.088 3.137 41 HA LYS 21 HA LYS 21 -9.153 0.578 4.566 42 HB2 LYS 21 HB2 LYS 21 -11.068 1.327 2.345 43 HB3 LYS 21 HB1 LYS 21 -11.099 -0.173 3.259 44 HG2 LYS 21 HG2 LYS 21 -11.849 0.873 5.195 45 HG3 LYS 21 HG1 LYS 21 -11.336 2.469 4.641 46 HD2 LYS 21 HD2 LYS 21 -13.070 2.443 2.930 47 HD3 LYS 21 HD1 LYS 21 -13.574 0.835 3.451 48 HE2 LYS 21 HE2 LYS 21 -14.263 1.684 5.587 49 HE3 LYS 21 HE1 LYS 21 -13.582 3.268 5.225 50 HZ1 LYS 21 HZ1 LYS 21 -15.856 3.502 4.850 51 HZ2 LYS 21 HZ2 LYS 21 -15.987 2.002 4.065 52 HZ3 LYS 21 HZ3 LYS 21 -15.214 3.290 3.292 53 H VAL 22 HN VAL 22 -7.732 -0.873 3.909 54 HA VAL 22 HA VAL 22 -6.927 -0.880 1.076 55 HB VAL 22 HB VAL 22 -5.486 -2.126 3.430 56 HG11 VAL 22 HG11 VAL 22 -4.983 -3.213 1.317 57 HG12 VAL 22 HG12 VAL 22 -3.593 -2.291 1.887 58 HG13 VAL 22 HG13 VAL 22 -4.603 -1.656 0.589 59 HG21 VAL 22 HG21 VAL 22 -3.931 -0.271 3.304 60 HG22 VAL 22 HG22 VAL 22 -5.564 0.327 3.600 61 HG23 VAL 22 HG23 VAL 22 -4.860 0.445 1.989 62 H ALA 23 HN ALA 23 -7.421 -2.600 -0.166 63 HA ALA 23 HA ALA 23 -8.335 -5.051 1.189 64 HB1 ALA 23 HB1 ALA 23 -10.052 -5.323 -0.542 65 HB2 ALA 23 HB2 ALA 23 -9.591 -3.766 -1.233 66 HB3 ALA 23 HB3 ALA 23 -10.284 -3.840 0.388 67 H GLY 24 HN GLY 24 -7.701 -6.960 0.307 68 HA2 GLY 24 HA2 GLY 24 -5.621 -6.784 -1.736 69 HA3 GLY 24 HA1 GLY 24 -5.950 -8.169 -0.707 70 H GLN 25 HN GLN 25 -6.795 -9.855 -1.711 71 HA GLN 25 HA GLN 25 -8.472 -9.363 -4.085 72 HB2 GLN 25 HB2 GLN 25 -6.616 -11.706 -3.609 73 HB3 GLN 25 HB1 GLN 25 -7.622 -11.461 -5.029 74 HG2 GLN 25 HG2 GLN 25 -5.506 -9.503 -4.198 75 HG3 GLN 25 HG1 GLN 25 -5.168 -10.878 -5.247 76 HE21 GLN 25 HE21 GLN 25 -6.876 -7.840 -4.953 77 HE22 GLN 25 HE22 GLN 25 -7.158 -7.622 -6.645 78 H ASP 26 HN ASP 26 -8.684 -10.114 -1.012 79 HA ASP 26 HA ASP 26 -10.930 -11.955 -1.414 80 HB2 ASP 26 HB2 ASP 26 -10.317 -13.350 0.377 81 HB3 ASP 26 HB1 ASP 26 -8.805 -13.075 -0.476 82 H GLY 27 HN GLY 27 -11.819 -12.061 1.217 83 HA2 GLY 27 HA2 GLY 27 -13.016 -9.448 1.459 84 HA3 GLY 27 HA1 GLY 27 -13.400 -10.865 2.416 85 H SER 28 HN SER 28 -10.361 -9.069 1.963 86 HA SER 28 HA SER 28 -10.093 -8.921 4.875 87 HB2 SER 28 HB2 SER 28 -7.735 -7.997 4.040 88 HB3 SER 28 HB1 SER 28 -8.074 -9.728 4.087 89 HG SER 28 HG SER 28 -8.028 -9.810 1.977 90 H VAL 29 HN VAL 29 -10.765 -7.068 5.854 91 HA VAL 29 HA VAL 29 -10.604 -4.601 4.222 92 HB VAL 29 HB VAL 29 -12.560 -4.998 6.481 93 HG11 VAL 29 HG11 VAL 29 -13.741 -3.145 5.372 94 HG12 VAL 29 HG12 VAL 29 -12.447 -3.053 4.176 95 HG13 VAL 29 HG13 VAL 29 -12.110 -2.696 5.872 96 HG21 VAL 29 HG21 VAL 29 -14.280 -5.497 4.832 97 HG22 VAL 29 HG22 VAL 29 -13.001 -6.711 4.783 98 HG23 VAL 29 HG23 VAL 29 -13.078 -5.458 3.545 99 H VAL 30 HN VAL 30 -8.453 -4.234 5.046 100 HA VAL 30 HA VAL 30 -8.259 -3.773 7.917 101 HB VAL 30 HB VAL 30 -5.854 -3.312 7.514 102 HG11 VAL 30 HG11 VAL 30 -6.877 -5.921 6.398 103 HG12 VAL 30 HG12 VAL 30 -6.584 -5.549 8.096 104 HG13 VAL 30 HG13 VAL 30 -5.234 -5.624 6.966 105 HG21 VAL 30 HG21 VAL 30 -6.539 -3.982 4.654 106 HG22 VAL 30 HG22 VAL 30 -4.899 -3.906 5.299 107 HG23 VAL 30 HG23 VAL 30 -5.904 -2.457 5.271 108 H GLN 31 HN GLN 31 -8.087 -1.847 8.870 109 HA GLN 31 HA GLN 31 -8.608 0.507 7.177 110 HB2 GLN 31 HB2 GLN 31 -10.290 -0.210 8.927 111 HB3 GLN 31 HB1 GLN 31 -9.090 0.195 10.144 112 HG2 GLN 31 HG2 GLN 31 -9.166 2.493 9.592 113 HG3 GLN 31 HG1 GLN 31 -10.089 2.175 8.122 114 HE21 GLN 31 HE21 GLN 31 -10.712 3.885 10.445 115 HE22 GLN 31 HE22 GLN 31 -12.243 3.324 11.028 116 H PHE 32 HN PHE 32 -6.774 1.591 6.776 117 HA PHE 32 HA PHE 32 -4.646 1.632 8.755 118 HB2 PHE 32 HB2 PHE 32 -4.873 2.193 5.872 119 HB3 PHE 32 HB1 PHE 32 -3.768 3.249 6.745 120 HD1 PHE 32 HD1 PHE 32 -4.405 -0.145 5.594 121 HD2 PHE 32 HD2 PHE 32 -1.772 2.360 7.803 122 HE1 PHE 32 HE1 PHE 32 -2.674 -1.889 5.498 123 HE2 PHE 32 HE2 PHE 32 -0.033 0.623 7.712 124 HZ PHE 32 HZ PHE 32 -0.485 -1.505 6.556 125 H LYS 33 HN LYS 33 -4.877 3.009 10.357 126 HA LYS 33 HA LYS 33 -6.116 5.622 9.853 127 HB2 LYS 33 HB2 LYS 33 -6.960 4.192 11.728 128 HB3 LYS 33 HB1 LYS 33 -5.383 4.334 12.490 129 HG2 LYS 33 HG2 LYS 33 -5.708 6.802 12.561 130 HG3 LYS 33 HG1 LYS 33 -7.350 6.551 11.966 131 HD2 LYS 33 HD2 LYS 33 -7.844 5.166 13.925 132 HD3 LYS 33 HD1 LYS 33 -6.200 5.415 14.515 133 HE2 LYS 33 HE2 LYS 33 -6.635 7.835 14.636 134 HE3 LYS 33 HE1 LYS 33 -8.288 7.551 14.093 135 HZ1 LYS 33 HZ1 LYS 33 -8.137 7.789 16.503 136 HZ2 LYS 33 HZ2 LYS 33 -7.094 6.462 16.584 137 HZ3 LYS 33 HZ3 LYS 33 -8.692 6.249 16.074 138 H ILE 34 HN ILE 34 -4.356 6.564 8.795 139 HA ILE 34 HA ILE 34 -2.009 7.084 10.504 140 HB ILE 34 HB ILE 34 -0.677 7.384 8.455 141 HG12 ILE 34 HG12 ILE 34 -3.032 6.229 6.953 142 HG13 ILE 34 HG11 ILE 34 -2.679 7.953 7.005 143 HG21 ILE 34 HG21 ILE 34 -0.448 5.047 7.892 144 HG22 ILE 34 HG22 ILE 34 -2.054 4.704 8.535 145 HG23 ILE 34 HG23 ILE 34 -0.762 5.209 9.622 146 HD11 ILE 34 HD11 ILE 34 -1.865 6.811 4.966 147 HD12 ILE 34 HD12 ILE 34 -0.777 5.862 5.980 148 HD13 ILE 34 HD13 ILE 34 -0.591 7.614 5.884 149 H LYS 35 HN LYS 35 -0.812 9.125 9.359 150 HA LYS 35 HA LYS 35 -2.811 11.248 9.552 151 HB2 LYS 35 HB2 LYS 35 0.215 11.383 9.590 152 HB3 LYS 35 HB1 LYS 35 -0.868 12.751 9.829 153 HG2 LYS 35 HG2 LYS 35 -1.744 11.743 11.850 154 HG3 LYS 35 HG1 LYS 35 -0.743 10.313 11.596 155 HD2 LYS 35 HD2 LYS 35 1.269 11.611 11.898 156 HD3 LYS 35 HD1 LYS 35 0.334 13.105 11.998 157 HE2 LYS 35 HE2 LYS 35 -0.861 11.978 13.977 158 HE3 LYS 35 HE1 LYS 35 0.485 10.842 13.963 159 HZ1 LYS 35 HZ1 LYS 35 2.008 12.634 14.351 160 HZ2 LYS 35 HZ2 LYS 35 0.788 12.709 15.518 161 HZ3 LYS 35 HZ3 LYS 35 0.776 13.785 14.216 162 H ARG 36 HN ARG 36 -2.847 12.984 7.991 163 HA ARG 36 HA ARG 36 -2.843 12.048 5.340 164 HB2 ARG 36 HB2 ARG 36 -3.060 14.838 6.457 165 HB3 ARG 36 HB1 ARG 36 -3.225 14.475 4.745 166 HG2 ARG 36 HG2 ARG 36 -5.080 12.884 5.386 167 HG3 ARG 36 HG1 ARG 36 -4.996 13.586 7.003 168 HD2 ARG 36 HD2 ARG 36 -6.430 15.131 6.271 169 HD3 ARG 36 HD1 ARG 36 -5.093 15.789 5.332 170 HE ARG 36 HE ARG 36 -5.885 14.305 3.492 171 HH11 ARG 36 HH11 ARG 36 -8.090 15.373 6.026 172 HH12 ARG 36 HH12 ARG 36 -9.550 15.161 4.990 173 HH21 ARG 36 HH21 ARG 36 -7.725 14.021 2.161 174 HH22 ARG 36 HH22 ARG 36 -9.353 14.439 2.837 175 H HIS 37 HN HIS 37 -0.267 13.263 7.210 176 HA HIS 37 HA HIS 37 1.247 13.919 4.784 177 HB2 HIS 37 HB2 HIS 37 2.914 14.917 6.440 178 HB3 HIS 37 HB1 HIS 37 1.390 15.761 6.226 179 HD2 HIS 37 HD2 HIS 37 -0.379 15.619 8.416 180 HE1 HIS 37 HE1 HIS 37 2.606 14.223 11.067 181 HE2 HIS 37 HE2 HIS 37 0.388 15.433 10.885 182 H THR 38 HN THR 38 0.680 11.259 6.420 183 HA THR 38 HA THR 38 3.412 10.365 6.833 184 HB THR 38 HB THR 38 0.878 8.721 7.001 185 HG1 THR 38 HG1 THR 38 1.894 10.668 8.660 186 HG21 THR 38 HG21 THR 38 3.599 8.342 8.262 187 HG22 THR 38 HG22 THR 38 2.966 7.427 6.893 188 HG23 THR 38 HG23 THR 38 2.199 7.290 8.475 189 HA PRO 39 HA PRO 39 3.941 9.208 2.536 190 HB2 PRO 39 HB2 PRO 39 5.912 7.367 3.808 191 HB3 PRO 39 HB1 PRO 39 6.125 8.479 2.448 192 HG2 PRO 39 HG2 PRO 39 7.099 9.089 4.833 193 HG3 PRO 39 HG1 PRO 39 6.361 10.331 3.802 194 HD2 PRO 39 HD2 PRO 39 5.271 9.011 6.235 195 HD3 PRO 39 HD1 PRO 39 5.046 10.670 5.646 196 H LEU 40 HN LEU 40 2.828 7.783 1.378 197 HA LEU 40 HA LEU 40 1.440 5.623 2.577 198 HB2 LEU 40 HB2 LEU 40 1.878 6.404 -0.299 199 HB3 LEU 40 HB1 LEU 40 0.894 5.031 0.173 200 HG LEU 40 HG LEU 40 0.360 7.879 1.028 201 HD11 LEU 40 HD11 LEU 40 -0.776 6.225 -1.210 202 HD12 LEU 40 HD12 LEU 40 -0.010 7.812 -1.304 203 HD13 LEU 40 HD13 LEU 40 -1.595 7.640 -0.549 204 HD21 LEU 40 HD21 LEU 40 -1.209 5.325 1.332 205 HD22 LEU 40 HD22 LEU 40 -1.859 6.935 1.639 206 HD23 LEU 40 HD23 LEU 40 -0.526 6.321 2.618 207 H SER 41 HN SER 41 4.588 5.902 1.335 208 HA SER 41 HA SER 41 5.091 3.321 0.391 209 HB2 SER 41 HB2 SER 41 7.365 4.396 1.798 210 HB3 SER 41 HB1 SER 41 7.109 4.250 0.057 211 HG SER 41 HG SER 41 7.186 6.379 0.280 212 H LYS 42 HN LYS 42 5.139 4.697 3.624 213 HA LYS 42 HA LYS 42 6.147 2.355 4.906 214 HB2 LYS 42 HB2 LYS 42 4.634 4.659 6.148 215 HB3 LYS 42 HB1 LYS 42 5.697 3.523 6.971 216 HG2 LYS 42 HG2 LYS 42 7.545 4.365 5.465 217 HG3 LYS 42 HG1 LYS 42 6.445 5.663 5.004 218 HD2 LYS 42 HD2 LYS 42 6.414 6.546 7.186 219 HD3 LYS 42 HD1 LYS 42 7.130 5.082 7.869 220 HE2 LYS 42 HE2 LYS 42 9.220 5.528 6.766 221 HE3 LYS 42 HE1 LYS 42 8.522 6.905 5.916 222 HZ1 LYS 42 HZ1 LYS 42 9.850 7.601 7.798 223 HZ2 LYS 42 HZ2 LYS 42 8.887 6.691 8.850 224 HZ3 LYS 42 HZ3 LYS 42 8.225 8.022 8.032 225 H LEU 43 HN LEU 43 3.024 3.599 4.049 226 HA LEU 43 HA LEU 43 1.428 1.897 5.650 227 HB2 LEU 43 HB2 LEU 43 0.544 3.917 4.587 228 HB3 LEU 43 HB1 LEU 43 0.861 3.249 2.999 229 HG LEU 43 HG LEU 43 -0.957 1.688 4.748 230 HD11 LEU 43 HD11 LEU 43 -2.867 3.122 4.149 231 HD12 LEU 43 HD12 LEU 43 -1.746 4.312 3.489 232 HD13 LEU 43 HD13 LEU 43 -1.720 3.937 5.211 233 HD21 LEU 43 HD21 LEU 43 -1.025 2.478 1.835 234 HD22 LEU 43 HD22 LEU 43 -2.127 1.350 2.625 235 HD23 LEU 43 HD23 LEU 43 -0.414 0.955 2.479 236 H MET 44 HN MET 44 2.724 1.687 2.376 237 HA MET 44 HA MET 44 1.574 -0.784 1.667 238 HB2 MET 44 HB2 MET 44 4.146 0.493 0.705 239 HB3 MET 44 HB1 MET 44 3.364 -0.883 -0.058 240 HG2 MET 44 HG2 MET 44 1.342 0.609 -0.350 241 HG3 MET 44 HG1 MET 44 2.386 1.949 0.119 242 HE1 MET 44 HE1 MET 44 4.372 2.906 -1.419 243 HE2 MET 44 HE2 MET 44 5.058 1.958 -2.735 244 HE3 MET 44 HE3 MET 44 5.120 1.347 -1.083 245 H LYS 45 HN LYS 45 4.722 0.043 3.057 246 HA LYS 45 HA LYS 45 5.768 -2.556 3.188 247 HB2 LYS 45 HB2 LYS 45 6.353 -0.051 4.759 248 HB3 LYS 45 HB1 LYS 45 7.221 -1.555 5.039 249 HG2 LYS 45 HG2 LYS 45 7.928 -1.552 2.678 250 HG3 LYS 45 HG1 LYS 45 7.123 0.005 2.468 251 HD2 LYS 45 HD2 LYS 45 8.582 1.013 4.127 252 HD3 LYS 45 HD1 LYS 45 9.341 -0.549 4.435 253 HE2 LYS 45 HE2 LYS 45 10.138 -0.608 2.115 254 HE3 LYS 45 HE1 LYS 45 9.399 0.967 1.828 255 HZ1 LYS 45 HZ1 LYS 45 10.883 1.970 3.379 256 HZ2 LYS 45 HZ2 LYS 45 11.810 1.048 2.308 257 HZ3 LYS 45 HZ3 LYS 45 11.496 0.469 3.864 258 H ALA 46 HN ALA 46 3.893 -0.677 5.545 259 HA ALA 46 HA ALA 46 4.066 -2.430 7.708 260 HB1 ALA 46 HB1 ALA 46 3.164 -0.165 7.878 261 HB2 ALA 46 HB2 ALA 46 2.046 -1.353 8.548 262 HB3 ALA 46 HB3 ALA 46 1.747 -0.656 6.956 263 H TYR 47 HN TYR 47 1.646 -2.318 5.102 264 HA TYR 47 HA TYR 47 0.144 -4.527 6.066 265 HB2 TYR 47 HB2 TYR 47 -0.884 -2.942 4.553 266 HB3 TYR 47 HB1 TYR 47 0.319 -3.280 3.312 267 HD1 TYR 47 HD1 TYR 47 -0.007 -5.023 1.764 268 HD2 TYR 47 HD2 TYR 47 -2.501 -4.790 5.206 269 HE1 TYR 47 HE1 TYR 47 -1.452 -6.775 0.827 270 HE2 TYR 47 HE2 TYR 47 -3.954 -6.544 4.275 271 HH TYR 47 HH TYR 47 -4.513 -7.541 2.153 272 H CYS 48 HN CYS 48 2.671 -4.196 3.614 273 HA CYS 48 HA CYS 48 2.681 -6.837 2.704 274 HB2 CYS 48 HB2 CYS 48 3.911 -4.677 1.850 275 HB3 CYS 48 HB1 CYS 48 5.225 -5.269 2.864 276 HG CYS 48 HG CYS 48 5.890 -7.381 1.437 277 H GLU 49 HN GLU 49 4.439 -5.315 5.378 278 HA GLU 49 HA GLU 49 6.012 -7.564 6.037 279 HB2 GLU 49 HB2 GLU 49 5.333 -4.981 7.283 280 HB3 GLU 49 HB1 GLU 49 5.791 -6.256 8.405 281 HG2 GLU 49 HG2 GLU 49 7.402 -5.119 6.143 282 HG3 GLU 49 HG1 GLU 49 7.762 -5.070 7.869 283 H ARG 50 HN ARG 50 2.791 -6.540 7.019 284 HA ARG 50 HA ARG 50 2.482 -8.431 9.103 285 HB2 ARG 50 HB2 ARG 50 1.058 -6.390 8.754 286 HB3 ARG 50 HB1 ARG 50 0.286 -7.227 7.414 287 HG2 ARG 50 HG2 ARG 50 -1.013 -8.426 8.766 288 HG3 ARG 50 HG1 ARG 50 0.321 -8.797 9.860 289 HD2 ARG 50 HD2 ARG 50 0.096 -6.620 10.908 290 HD3 ARG 50 HD1 ARG 50 -1.189 -6.193 9.780 291 HE ARG 50 HE ARG 50 -1.640 -8.561 11.401 292 HH11 ARG 50 HH11 ARG 50 -2.079 -5.100 11.022 293 HH12 ARG 50 HH12 ARG 50 -3.595 -5.054 12.010 294 HH21 ARG 50 HH21 ARG 50 -4.388 -6.982 12.983 295 HH22 ARG 50 HH22 ARG 50 -3.515 -8.546 12.742 296 H GLN 51 HN GLN 51 1.926 -8.528 5.641 297 HA GLN 51 HA GLN 51 0.643 -11.092 5.699 298 HB2 GLN 51 HB2 GLN 51 1.901 -9.615 3.374 299 HB3 GLN 51 HB1 GLN 51 0.855 -11.025 3.250 300 HG2 GLN 51 HG2 GLN 51 0.102 -8.285 4.240 301 HG3 GLN 51 HG1 GLN 51 -0.420 -9.064 2.748 302 HE21 GLN 51 HE21 GLN 51 -2.000 -10.635 2.821 303 HE22 GLN 51 HE22 GLN 51 -2.974 -10.916 4.220 304 H GLY 52 HN GLY 52 3.890 -9.872 5.204 305 HA2 GLY 52 HA2 GLY 52 5.821 -11.109 5.798 306 HA3 GLY 52 HA1 GLY 52 4.906 -12.594 5.587 307 H LEU 53 HN LEU 53 5.100 -9.890 3.336 308 HA LEU 53 HA LEU 53 6.637 -11.597 1.502 309 HB2 LEU 53 HB2 LEU 53 4.198 -9.949 0.827 310 HB3 LEU 53 HB1 LEU 53 5.246 -10.690 -0.367 311 HG LEU 53 HG LEU 53 3.718 -12.254 1.716 312 HD11 LEU 53 HD11 LEU 53 2.148 -12.810 -0.046 313 HD12 LEU 53 HD12 LEU 53 3.023 -11.778 -1.177 314 HD13 LEU 53 HD13 LEU 53 2.189 -11.064 0.204 315 HD21 LEU 53 HD21 LEU 53 5.736 -13.337 0.784 316 HD22 LEU 53 HD22 LEU 53 5.066 -13.132 -0.835 317 HD23 LEU 53 HD23 LEU 53 4.242 -14.165 0.334 318 H SER 54 HN SER 54 7.482 -10.275 -0.385 319 HA SER 54 HA SER 54 8.829 -7.951 0.699 320 HB2 SER 54 HB2 SER 54 10.276 -9.335 -0.543 321 HB3 SER 54 HB1 SER 54 9.092 -9.571 -1.827 322 HG SER 54 HG SER 54 10.930 -8.056 -2.207 323 H MET 55 HN MET 55 8.673 -5.857 -0.097 324 HA MET 55 HA MET 55 6.126 -5.026 -0.953 325 HB2 MET 55 HB2 MET 55 7.863 -3.680 0.329 326 HB3 MET 55 HB1 MET 55 8.655 -3.405 -1.217 327 HG2 MET 55 HG2 MET 55 6.627 -2.331 -2.063 328 HG3 MET 55 HG1 MET 55 5.843 -2.601 -0.508 329 HE1 MET 55 HE1 MET 55 8.452 -0.541 -2.530 330 HE2 MET 55 HE2 MET 55 9.515 -1.436 -1.443 331 HE3 MET 55 HE3 MET 55 9.339 0.308 -1.265 332 H ARG 56 HN ARG 56 8.787 -6.213 -2.733 333 HA ARG 56 HA ARG 56 7.940 -4.910 -5.199 334 HB2 ARG 56 HB2 ARG 56 10.383 -5.268 -4.526 335 HB3 ARG 56 HB1 ARG 56 10.129 -6.961 -4.930 336 HG2 ARG 56 HG2 ARG 56 9.509 -6.313 -7.212 337 HG3 ARG 56 HG1 ARG 56 9.812 -4.624 -6.802 338 HD2 ARG 56 HD2 ARG 56 12.142 -5.169 -6.307 339 HD3 ARG 56 HD1 ARG 56 11.837 -6.854 -6.720 340 HE ARG 56 HE ARG 56 11.275 -5.976 -9.007 341 HH11 ARG 56 HH11 ARG 56 14.378 -3.495 -8.189 342 HH12 ARG 56 HH12 ARG 56 13.462 -4.260 -6.840 343 HH21 ARG 56 HH21 ARG 56 13.805 -3.925 -10.363 344 HH22 ARG 56 HH22 ARG 56 12.446 -5.045 -10.741 345 H GLN 57 HN GLN 57 6.984 -7.559 -3.478 346 HA GLN 57 HA GLN 57 6.544 -9.295 -5.779 347 HB2 GLN 57 HB2 GLN 57 6.167 -9.607 -2.821 348 HB3 GLN 57 HB1 GLN 57 5.389 -10.720 -3.937 349 HG2 GLN 57 HG2 GLN 57 7.479 -11.457 -4.790 350 HG3 GLN 57 HG1 GLN 57 8.347 -10.176 -3.944 351 HE21 GLN 57 HE21 GLN 57 8.684 -13.080 -3.835 352 HE22 GLN 57 HE22 GLN 57 8.502 -13.515 -2.171 353 H ILE 58 HN ILE 58 4.923 -6.825 -4.123 354 HA ILE 58 HA ILE 58 2.415 -7.575 -5.466 355 HB ILE 58 HB ILE 58 1.183 -6.431 -3.601 356 HG12 ILE 58 HG12 ILE 58 3.828 -6.710 -2.153 357 HG13 ILE 58 HG11 ILE 58 3.125 -5.187 -2.686 358 HG21 ILE 58 HG21 ILE 58 1.212 -8.838 -3.757 359 HG22 ILE 58 HG22 ILE 58 1.316 -8.355 -2.065 360 HG23 ILE 58 HG23 ILE 58 2.759 -8.909 -2.913 361 HD11 ILE 58 HD11 ILE 58 1.935 -7.069 -0.662 362 HD12 ILE 58 HD12 ILE 58 1.223 -5.549 -1.198 363 HD13 ILE 58 HD13 ILE 58 2.750 -5.544 -0.316 364 H ARG 59 HN ARG 59 0.920 -5.592 -5.638 365 HA ARG 59 HA ARG 59 2.460 -3.123 -6.040 366 HB2 ARG 59 HB2 ARG 59 0.667 -4.443 -8.087 367 HB3 ARG 59 HB1 ARG 59 1.192 -2.770 -8.195 368 HG2 ARG 59 HG2 ARG 59 2.961 -5.208 -8.240 369 HG3 ARG 59 HG1 ARG 59 2.552 -4.175 -9.610 370 HD2 ARG 59 HD2 ARG 59 3.632 -2.274 -8.428 371 HD3 ARG 59 HD1 ARG 59 4.136 -3.395 -7.165 372 HE ARG 59 HE ARG 59 5.235 -3.150 -9.839 373 HH11 ARG 59 HH11 ARG 59 6.527 -5.984 -7.233 374 HH12 ARG 59 HH12 ARG 59 5.043 -5.022 -6.856 375 HH21 ARG 59 HH21 ARG 59 7.158 -4.294 -10.311 376 HH22 ARG 59 HH22 ARG 59 7.715 -5.570 -9.166 377 H PHE 60 HN PHE 60 1.382 -1.293 -5.505 378 HA PHE 60 HA PHE 60 -1.369 -1.622 -4.516 379 HB2 PHE 60 HB2 PHE 60 0.873 0.226 -3.726 380 HB3 PHE 60 HB1 PHE 60 -0.796 0.586 -3.303 381 HD1 PHE 60 HD1 PHE 60 1.807 -2.051 -2.975 382 HD2 PHE 60 HD2 PHE 60 -1.717 -0.283 -1.368 383 HE1 PHE 60 HE1 PHE 60 2.023 -3.445 -0.962 384 HE2 PHE 60 HE2 PHE 60 -1.506 -1.677 0.644 385 HZ PHE 60 HZ PHE 60 0.367 -3.260 0.848 386 H ARG 61 HN ARG 61 -2.987 -0.305 -5.219 387 HA ARG 61 HA ARG 61 -2.285 1.840 -7.096 388 HB2 ARG 61 HB2 ARG 61 -4.170 -0.447 -7.566 389 HB3 ARG 61 HB1 ARG 61 -4.412 1.095 -8.376 390 HG2 ARG 61 HG2 ARG 61 -2.187 0.932 -9.362 391 HG3 ARG 61 HG1 ARG 61 -1.943 -0.617 -8.552 392 HD2 ARG 61 HD2 ARG 61 -4.205 -1.213 -9.770 393 HD3 ARG 61 HD1 ARG 61 -3.690 0.075 -10.859 394 HE ARG 61 HE ARG 61 -1.494 -1.350 -10.834 395 HH11 ARG 61 HH11 ARG 61 -4.405 -3.985 -11.819 396 HH12 ARG 61 HH12 ARG 61 -4.835 -2.417 -11.032 397 HH21 ARG 61 HH21 ARG 61 -0.920 -3.288 -11.899 398 HH22 ARG 61 HH22 ARG 61 -2.224 -4.459 -12.323 399 H PHE 62 HN PHE 62 -3.611 3.600 -7.090 400 HA PHE 62 HA PHE 62 -5.692 3.623 -5.006 401 HB2 PHE 62 HB2 PHE 62 -3.946 5.157 -4.403 402 HB3 PHE 62 HB1 PHE 62 -3.881 5.823 -6.030 403 HD1 PHE 62 HD1 PHE 62 -6.463 5.306 -3.370 404 HD2 PHE 62 HD2 PHE 62 -4.759 7.917 -6.267 405 HE1 PHE 62 HE1 PHE 62 -8.052 7.064 -2.719 406 HE2 PHE 62 HE2 PHE 62 -6.347 9.680 -5.617 407 HZ PHE 62 HZ PHE 62 -7.997 9.252 -3.844 408 H ASP 63 HN ASP 63 -7.452 3.066 -6.174 409 HA ASP 63 HA ASP 63 -9.304 3.391 -7.448 410 HB2 ASP 63 HB2 ASP 63 -9.387 5.709 -6.947 411 HB3 ASP 63 HB1 ASP 63 -7.999 6.060 -7.970 412 H GLY 64 HN GLY 64 -6.411 4.535 -9.166 413 HA2 GLY 64 HA2 GLY 64 -6.762 2.463 -11.168 414 HA3 GLY 64 HA1 GLY 64 -6.954 4.108 -11.758 415 H GLN 65 HN GLN 65 -5.085 5.510 -10.462 416 HA GLN 65 HA GLN 65 -2.669 4.691 -11.759 417 HB2 GLN 65 HB2 GLN 65 -3.506 7.030 -10.088 418 HB3 GLN 65 HB1 GLN 65 -1.795 6.758 -10.392 419 HG2 GLN 65 HG2 GLN 65 -3.881 7.020 -12.544 420 HG3 GLN 65 HG1 GLN 65 -2.873 8.345 -11.964 421 HE21 GLN 65 HE21 GLN 65 -0.641 8.291 -12.379 422 HE22 GLN 65 HE22 GLN 65 0.012 7.324 -13.658 423 HA PRO 66 HA PRO 66 -0.894 2.415 -8.384 424 HB2 PRO 66 HB2 PRO 66 1.700 2.454 -9.184 425 HB3 PRO 66 HB1 PRO 66 0.478 1.426 -9.947 426 HG2 PRO 66 HG2 PRO 66 1.574 4.043 -10.869 427 HG3 PRO 66 HG1 PRO 66 1.197 2.587 -11.811 428 HD2 PRO 66 HD2 PRO 66 -0.449 4.738 -11.728 429 HD3 PRO 66 HD1 PRO 66 -1.042 3.078 -11.932 430 H ILE 67 HN ILE 67 0.183 2.810 -6.476 431 HA ILE 67 HA ILE 67 0.582 5.570 -5.792 432 HB ILE 67 HB ILE 67 1.093 3.081 -4.152 433 HG12 ILE 67 HG12 ILE 67 -1.296 4.939 -4.249 434 HG13 ILE 67 HG11 ILE 67 -1.249 3.284 -4.846 435 HG21 ILE 67 HG21 ILE 67 0.844 5.960 -3.286 436 HG22 ILE 67 HG22 ILE 67 2.326 5.005 -3.299 437 HG23 ILE 67 HG23 ILE 67 1.006 4.572 -2.212 438 HD11 ILE 67 HD11 ILE 67 -1.020 4.181 -1.984 439 HD12 ILE 67 HD12 ILE 67 -0.817 2.517 -2.529 440 HD13 ILE 67 HD13 ILE 67 -2.370 3.329 -2.732 441 H ASN 68 HN ASN 68 2.466 6.653 -5.446 442 HA ASN 68 HA ASN 68 4.895 5.406 -6.461 443 HB2 ASN 68 HB2 ASN 68 4.243 8.236 -5.619 444 HB3 ASN 68 HB1 ASN 68 5.858 7.730 -6.094 445 HD21 ASN 68 HD21 ASN 68 2.706 8.563 -7.136 446 HD22 ASN 68 HD22 ASN 68 3.013 8.502 -8.842 447 H GLU 69 HN GLU 69 6.943 5.693 -5.261 448 HA GLU 69 HA GLU 69 6.640 4.722 -2.583 449 HB2 GLU 69 HB2 GLU 69 9.103 5.473 -4.161 450 HB3 GLU 69 HB1 GLU 69 9.122 4.678 -2.594 451 HG2 GLU 69 HG2 GLU 69 8.178 2.714 -3.452 452 HG3 GLU 69 HG1 GLU 69 7.676 3.507 -4.943 453 H THR 70 HN THR 70 6.472 7.762 -3.795 454 HA THR 70 HA THR 70 7.350 8.937 -1.247 455 HB THR 70 HB THR 70 7.492 10.953 -3.222 456 HG1 THR 70 HG1 THR 70 8.632 10.079 -4.850 457 HG21 THR 70 HG21 THR 70 8.854 10.830 -1.199 458 HG22 THR 70 HG22 THR 70 9.880 10.957 -2.629 459 HG23 THR 70 HG23 THR 70 9.676 9.398 -1.826 460 H ASP 71 HN ASP 71 4.726 8.020 -2.550 461 HA ASP 71 HA ASP 71 3.225 10.480 -2.818 462 HB2 ASP 71 HB2 ASP 71 2.727 7.623 -3.323 463 HB3 ASP 71 HB1 ASP 71 1.335 8.502 -2.705 464 H THR 72 HN THR 72 1.479 11.091 -1.502 465 HA THR 72 HA THR 72 1.345 9.870 1.165 466 HB THR 72 HB THR 72 0.976 12.349 1.950 467 HG1 THR 72 HG1 THR 72 2.905 13.135 0.161 468 HG21 THR 72 HG21 THR 72 3.714 11.255 1.299 469 HG22 THR 72 HG22 THR 72 2.784 10.961 2.771 470 HG23 THR 72 HG23 THR 72 3.390 12.580 2.418 471 HA PRO 73 HA PRO 73 -3.057 10.049 0.734 472 HB2 PRO 73 HB2 PRO 73 -3.218 11.522 3.310 473 HB3 PRO 73 HB1 PRO 73 -3.983 10.000 2.834 474 HG2 PRO 73 HG2 PRO 73 -1.926 10.006 4.514 475 HG3 PRO 73 HG1 PRO 73 -2.106 8.738 3.285 476 HD2 PRO 73 HD2 PRO 73 -0.267 11.083 3.317 477 HD3 PRO 73 HD1 PRO 73 0.007 9.436 2.715 478 H ALA 74 HN ALA 74 -1.551 13.017 1.948 479 HA ALA 74 HA ALA 74 -3.664 14.724 1.039 480 HB1 ALA 74 HB1 ALA 74 -2.140 16.562 1.646 481 HB2 ALA 74 HB2 ALA 74 -0.861 15.383 1.939 482 HB3 ALA 74 HB3 ALA 74 -2.313 15.377 2.941 483 H GLN 75 HN GLN 75 -0.819 13.377 -0.387 484 HA GLN 75 HA GLN 75 -0.555 15.342 -2.464 485 HB2 GLN 75 HB2 GLN 75 1.339 13.917 -1.654 486 HB3 GLN 75 HB1 GLN 75 0.549 12.528 -2.387 487 HG2 GLN 75 HG2 GLN 75 2.226 13.237 -3.886 488 HG3 GLN 75 HG1 GLN 75 0.683 13.728 -4.586 489 HE21 GLN 75 HE21 GLN 75 1.474 15.391 -5.802 490 HE22 GLN 75 HE22 GLN 75 2.139 16.834 -5.121 491 H LEU 76 HN LEU 76 -1.949 12.104 -2.203 492 HA LEU 76 HA LEU 76 -2.828 12.158 -4.959 493 HB2 LEU 76 HB2 LEU 76 -3.182 10.153 -2.744 494 HB3 LEU 76 HB1 LEU 76 -3.870 9.948 -4.342 495 HG LEU 76 HG LEU 76 -0.924 10.152 -3.707 496 HD11 LEU 76 HD11 LEU 76 -2.614 7.811 -4.569 497 HD12 LEU 76 HD12 LEU 76 -1.891 8.045 -2.978 498 HD13 LEU 76 HD13 LEU 76 -0.860 7.803 -4.390 499 HD21 LEU 76 HD21 LEU 76 -1.318 11.096 -5.869 500 HD22 LEU 76 HD22 LEU 76 -2.397 9.771 -6.308 501 HD23 LEU 76 HD23 LEU 76 -0.674 9.471 -6.093 502 H GLU 77 HN GLU 77 -3.924 13.795 -2.458 503 HA GLU 77 HA GLU 77 -5.902 14.708 -1.804 504 HB2 GLU 77 HB2 GLU 77 -6.718 13.928 -4.611 505 HB3 GLU 77 HB1 GLU 77 -7.593 15.048 -3.576 506 HG2 GLU 77 HG2 GLU 77 -4.728 15.509 -4.319 507 HG3 GLU 77 HG1 GLU 77 -6.052 16.013 -5.367 508 H MET 78 HN MET 78 -5.538 12.189 -0.879 509 HA MET 78 HA MET 78 -7.886 10.577 -1.391 510 HB2 MET 78 HB2 MET 78 -5.775 10.191 0.736 511 HB3 MET 78 HB1 MET 78 -6.917 8.990 0.145 512 HG2 MET 78 HG2 MET 78 -5.840 8.920 -1.988 513 HG3 MET 78 HG1 MET 78 -4.796 10.273 -1.554 514 HE1 MET 78 HE1 MET 78 -4.441 5.941 -0.057 515 HE2 MET 78 HE2 MET 78 -5.425 6.492 -1.416 516 HE3 MET 78 HE3 MET 78 -5.893 6.898 0.235 517 H GLU 79 HN GLU 79 -9.672 10.467 -0.155 518 HA GLU 79 HA GLU 79 -9.855 12.382 2.056 519 HB2 GLU 79 HB2 GLU 79 -11.636 11.595 -0.058 520 HB3 GLU 79 HB1 GLU 79 -12.394 11.288 1.500 521 HG2 GLU 79 HG2 GLU 79 -11.309 13.901 0.486 522 HG3 GLU 79 HG1 GLU 79 -12.995 13.484 0.790 523 H ASP 80 HN ASP 80 -11.622 11.592 3.713 524 HA ASP 80 HA ASP 80 -10.466 9.348 5.032 525 HB2 ASP 80 HB2 ASP 80 -11.537 11.352 6.156 526 HB3 ASP 80 HB1 ASP 80 -13.098 10.681 5.701 527 H GLU 81 HN GLU 81 -11.154 7.302 5.194 528 HA GLU 81 HA GLU 81 -12.278 5.377 4.830 529 HB2 GLU 81 HB2 GLU 81 -14.537 7.234 4.099 530 HB3 GLU 81 HB1 GLU 81 -14.690 5.483 4.086 531 HG2 GLU 81 HG2 GLU 81 -13.803 5.684 6.535 532 HG3 GLU 81 HG1 GLU 81 -14.386 7.342 6.385 533 H ASP 82 HN ASP 82 -10.637 6.673 2.794 534 HA ASP 82 HA ASP 82 -11.859 6.090 0.254 535 HB2 ASP 82 HB2 ASP 82 -9.825 7.727 0.914 536 HB3 ASP 82 HB1 ASP 82 -8.898 6.302 0.450 537 H THR 83 HN THR 83 -10.234 4.635 -1.256 538 HA THR 83 HA THR 83 -9.778 2.135 0.242 539 HB THR 83 HB THR 83 -10.806 1.901 -2.535 540 HG1 THR 83 HG1 THR 83 -12.329 3.330 -1.789 541 HG21 THR 83 HG21 THR 83 -11.910 -0.066 -1.579 542 HG22 THR 83 HG22 THR 83 -11.342 0.388 0.027 543 HG23 THR 83 HG23 THR 83 -10.183 -0.075 -1.220 544 H ILE 84 HN ILE 84 -8.099 0.885 -0.385 545 HA ILE 84 HA ILE 84 -6.452 1.813 -2.650 546 HB ILE 84 HB ILE 84 -5.438 0.685 -0.031 547 HG12 ILE 84 HG12 ILE 84 -5.161 3.491 -1.137 548 HG13 ILE 84 HG11 ILE 84 -6.299 3.025 0.122 549 HG21 ILE 84 HG21 ILE 84 -3.204 1.255 -0.914 550 HG22 ILE 84 HG22 ILE 84 -3.951 1.697 -2.453 551 HG23 ILE 84 HG23 ILE 84 -4.026 0.028 -1.881 552 HD11 ILE 84 HD11 ILE 84 -3.297 2.867 0.311 553 HD12 ILE 84 HD12 ILE 84 -4.439 2.409 1.576 554 HD13 ILE 84 HD13 ILE 84 -4.327 4.089 1.057 555 H ASP 85 HN ASP 85 -5.909 0.262 -4.095 556 HA ASP 85 HA ASP 85 -6.876 -2.454 -3.569 557 HB2 ASP 85 HB2 ASP 85 -6.020 -1.096 -6.133 558 HB3 ASP 85 HB1 ASP 85 -6.543 -2.773 -6.027 559 H VAL 86 HN VAL 86 -5.580 -4.228 -3.544 560 HA VAL 86 HA VAL 86 -2.687 -3.809 -3.954 561 HB VAL 86 HB VAL 86 -3.915 -5.795 -2.037 562 HG11 VAL 86 HG11 VAL 86 -1.642 -6.010 -1.176 563 HG12 VAL 86 HG12 VAL 86 -1.069 -4.855 -2.379 564 HG13 VAL 86 HG13 VAL 86 -1.716 -6.414 -2.890 565 HG21 VAL 86 HG21 VAL 86 -3.204 -4.314 -0.228 566 HG22 VAL 86 HG22 VAL 86 -4.385 -3.521 -1.274 567 HG23 VAL 86 HG23 VAL 86 -2.671 -3.117 -1.410 568 H PHE 87 HN PHE 87 -1.882 -4.975 -5.568 569 HA PHE 87 HA PHE 87 -3.280 -7.453 -6.335 570 HB2 PHE 87 HB2 PHE 87 -1.867 -5.451 -8.107 571 HB3 PHE 87 HB1 PHE 87 -2.482 -7.006 -8.658 572 HD1 PHE 87 HD1 PHE 87 -4.938 -7.446 -8.586 573 HD2 PHE 87 HD2 PHE 87 -3.291 -3.587 -7.861 574 HE1 PHE 87 HE1 PHE 87 -7.140 -6.433 -8.990 575 HE2 PHE 87 HE2 PHE 87 -5.493 -2.570 -8.265 576 HZ PHE 87 HZ PHE 87 -7.418 -3.989 -8.827 577 H GLN 88 HN GLN 88 -1.860 -9.024 -7.496 578 HA GLN 88 HA GLN 88 0.705 -9.209 -6.087 579 HB2 GLN 88 HB2 GLN 88 -0.670 -11.356 -7.713 580 HB3 GLN 88 HB1 GLN 88 0.643 -11.562 -6.565 581 HG2 GLN 88 HG2 GLN 88 -2.079 -10.572 -5.772 582 HG3 GLN 88 HG1 GLN 88 -1.643 -12.280 -5.796 583 HE21 GLN 88 HE21 GLN 88 -2.428 -10.582 -3.565 584 HE22 GLN 88 HE22 GLN 88 -1.136 -10.662 -2.424 585 H GLN 89 HN GLN 89 2.646 -9.566 -7.187 586 HA GLN 89 HA GLN 89 2.716 -8.515 -9.873 587 HB2 GLN 89 HB2 GLN 89 4.456 -7.817 -8.353 588 HB3 GLN 89 HB1 GLN 89 4.885 -9.486 -8.004 589 HG2 GLN 89 HG2 GLN 89 6.504 -8.419 -9.481 590 HG3 GLN 89 HG1 GLN 89 5.706 -9.780 -10.264 591 HE21 GLN 89 HE21 GLN 89 6.131 -9.057 -12.321 592 HE22 GLN 89 HE22 GLN 89 5.344 -7.681 -13.010 593 H GLN 90 HN GLN 90 3.016 -9.630 -11.721 594 HA GLN 90 HA GLN 90 2.349 -12.327 -11.894 595 HB2 GLN 90 HB2 GLN 90 3.842 -10.572 -13.847 596 HB3 GLN 90 HB1 GLN 90 3.261 -12.185 -14.231 597 HG2 GLN 90 HG2 GLN 90 1.622 -10.799 -15.097 598 HG3 GLN 90 HG1 GLN 90 0.951 -11.299 -13.546 599 HE21 GLN 90 HE21 GLN 90 -0.391 -9.502 -13.433 600 HE22 GLN 90 HE22 GLN 90 0.216 -7.914 -13.103 601 H THR 91 HN THR 91 3.483 -14.204 -12.011 602 HA THR 91 HA THR 91 5.920 -14.455 -10.695 603 HB THR 91 HB THR 91 5.553 -16.635 -12.533 604 HG1 THR 91 HG1 THR 91 3.281 -16.840 -11.225 605 HG21 THR 91 HG21 THR 91 5.023 -16.353 -9.571 606 HG22 THR 91 HG22 THR 91 6.544 -16.843 -10.317 607 HG23 THR 91 HG23 THR 91 5.124 -17.878 -10.449 608 H GLY 92 HN GLY 92 5.358 -15.063 -14.178 609 HA2 GLY 92 HA2 GLY 92 7.482 -13.489 -15.100 610 HA3 GLY 92 HA1 GLY 92 8.076 -15.128 -14.864 611 H ASN 357 HT1 ASN 357 -16.265 -10.985 7.344 612 HA ASN 357 HA ASN 357 -13.793 -10.673 5.756 613 HB2 ASN 357 HB2 ASN 357 -14.404 -8.305 5.593 614 HB3 ASN 357 HB1 ASN 357 -15.628 -9.321 4.846 615 HD21 ASN 357 HD21 ASN 357 -15.778 -6.602 5.906 616 HD22 ASN 357 HD22 ASN 357 -17.048 -6.619 7.080 617 H ASN 358 HN ASN 358 -12.198 -9.399 6.779 618 HA ASN 358 HA ASN 358 -12.534 -9.180 9.684 619 HB2 ASN 358 HB2 ASN 358 -10.272 -9.862 10.057 620 HB3 ASN 358 HB1 ASN 358 -11.007 -11.046 8.985 621 HD21 ASN 358 HD21 ASN 358 -10.294 -11.209 6.869 622 HD22 ASN 358 HD22 ASN 358 -8.848 -10.442 6.322 623 H ARG 359 HN ARG 359 -12.052 -7.277 10.656 624 HA ARG 359 HA ARG 359 -10.727 -5.284 8.941 625 HB2 ARG 359 HB2 ARG 359 -12.073 -3.540 9.979 626 HB3 ARG 359 HB1 ARG 359 -13.105 -4.753 9.243 627 HG2 ARG 359 HG2 ARG 359 -13.479 -5.748 11.462 628 HG3 ARG 359 HG1 ARG 359 -12.490 -4.469 12.172 629 HD2 ARG 359 HD2 ARG 359 -15.110 -4.164 10.718 630 HD3 ARG 359 HD1 ARG 359 -14.794 -3.866 12.425 631 HE ARG 359 HE ARG 359 -13.131 -2.120 11.308 632 HH11 ARG 359 HH11 ARG 359 -16.507 -2.865 10.647 633 HH12 ARG 359 HH12 ARG 359 -16.885 -1.204 10.050 634 HH21 ARG 359 HH21 ARG 359 -13.544 -0.000 10.518 635 HH22 ARG 359 HH22 ARG 359 -15.221 0.399 9.977 636 H ASP 360 HN ASP 360 -8.907 -4.527 9.661 637 HA ASP 360 HA ASP 360 -8.342 -4.540 12.539 638 HB2 ASP 360 HB2 ASP 360 -7.112 -6.354 11.206 639 HB3 ASP 360 HB1 ASP 360 -6.210 -5.032 10.465 640 HA PRO 361 HA PRO 361 -7.104 -0.408 11.353 641 HB2 PRO 361 HB2 PRO 361 -7.315 0.704 13.794 642 HB3 PRO 361 HB1 PRO 361 -8.747 0.175 12.899 643 HG2 PRO 361 HG2 PRO 361 -7.566 -0.980 15.303 644 HG3 PRO 361 HG1 PRO 361 -9.163 -1.258 14.595 645 HD2 PRO 361 HD2 PRO 361 -6.750 -2.878 14.352 646 HD3 PRO 361 HD1 PRO 361 -8.420 -3.269 13.895 647 H ILE 362 HN ILE 362 -5.127 0.313 11.011 648 HA ILE 362 HA ILE 362 -2.995 -0.264 12.971 649 HB ILE 362 HB ILE 362 -2.650 0.056 9.988 650 HG12 ILE 362 HG12 ILE 362 -2.443 -2.539 11.506 651 HG13 ILE 362 HG11 ILE 362 -3.960 -2.009 10.786 652 HG21 ILE 362 HG21 ILE 362 -0.724 -0.992 12.059 653 HG22 ILE 362 HG22 ILE 362 -0.668 0.618 11.343 654 HG23 ILE 362 HG23 ILE 362 -0.423 -0.802 10.330 655 HD11 ILE 362 HD11 ILE 362 -1.378 -2.512 9.324 656 HD12 ILE 362 HD12 ILE 362 -2.881 -1.961 8.588 657 HD13 ILE 362 HD13 ILE 362 -2.797 -3.558 9.329 658 H VAL 363 HN VAL 363 -1.821 1.416 13.719 659 HA VAL 363 HA VAL 363 -2.295 4.033 12.428 660 HB VAL 363 HB VAL 363 -1.564 3.606 15.324 661 HG11 VAL 363 HG11 VAL 363 -1.019 5.801 14.430 662 HG12 VAL 363 HG12 VAL 363 -2.334 5.903 15.602 663 HG13 VAL 363 HG13 VAL 363 -2.683 6.001 13.876 664 HG21 VAL 363 HG21 VAL 363 -3.893 3.997 15.895 665 HG22 VAL 363 HG22 VAL 363 -3.729 2.559 14.888 666 HG23 VAL 363 HG23 VAL 363 -4.316 4.065 14.185 667 H ILE 364 HN ILE 364 -0.586 5.051 11.672 668 HA ILE 364 HA ILE 364 2.094 4.208 12.554 669 HB ILE 364 HB ILE 364 1.320 5.207 9.806 670 HG12 ILE 364 HG12 ILE 364 2.239 2.471 10.718 671 HG13 ILE 364 HG11 ILE 364 0.601 2.883 10.218 672 HG21 ILE 364 HG21 ILE 364 3.985 4.308 10.897 673 HG22 ILE 364 HG22 ILE 364 3.546 5.951 10.422 674 HG23 ILE 364 HG23 ILE 364 3.652 4.677 9.206 675 HD11 ILE 364 HD11 ILE 364 1.446 3.404 7.970 676 HD12 ILE 364 HD12 ILE 364 1.769 1.734 8.440 677 HD13 ILE 364 HD13 ILE 364 3.065 2.931 8.487 678 H SER 365 HN SER 365 3.431 5.763 13.260 679 HA SER 365 HA SER 365 2.562 8.564 12.960 680 HB2 SER 365 HB2 SER 365 4.241 7.699 15.282 681 HB3 SER 365 HB1 SER 365 3.030 8.982 15.191 682 HG SER 365 HG SER 365 2.163 6.355 14.840 683 H ASP 366 HN ASP 366 4.001 9.870 12.015 684 HA ASP 366 HA ASP 366 6.780 8.921 11.787 685 HB2 ASP 366 HB2 ASP 366 5.214 8.903 9.686 686 HB3 ASP 366 HB1 ASP 366 5.525 10.635 9.673 687 H SER 367 HN SER 367 8.325 10.269 12.393 688 HA SER 367 HA SER 367 7.584 12.903 13.364 689 HB2 SER 367 HB2 SER 367 10.392 12.385 13.639 690 HB3 SER 367 HB1 SER 367 9.164 12.481 14.903 691 HG SER 367 HG SER 367 10.360 10.279 13.774 692 HA PRO 368 HA PRO 368 9.000 14.771 9.558 693 HB2 PRO 368 HB2 PRO 368 8.792 17.360 10.367 694 HB3 PRO 368 HB1 PRO 368 7.394 16.381 9.902 695 HG2 PRO 368 HG2 PRO 368 8.398 17.040 12.627 696 HG3 PRO 368 HG1 PRO 368 6.729 16.970 12.029 697 HD2 PRO 368 HD2 PRO 368 7.842 14.969 13.476 698 HD3 PRO 368 HD1 PRO 368 6.601 14.690 12.238 Start of MODEL 2 1 H ASP 16 HT1 ASP 16 -7.157 15.874 11.454 2 HA ASP 16 HA ASP 16 -6.475 14.382 13.901 3 HB2 ASP 16 HB2 ASP 16 -9.108 14.721 12.529 4 HB3 ASP 16 HB1 ASP 16 -8.702 13.137 13.184 5 H HIS 17 HN HIS 17 -7.058 11.941 13.204 6 HA HIS 17 HA HIS 17 -5.192 11.371 11.087 7 HB2 HIS 17 HB2 HIS 17 -6.838 9.579 12.886 8 HB3 HIS 17 HB1 HIS 17 -5.695 8.978 11.692 9 HD2 HIS 17 HD2 HIS 17 -3.048 9.055 12.411 10 HE1 HIS 17 HE1 HIS 17 -3.705 10.745 16.237 11 HE2 HIS 17 HE2 HIS 17 -2.066 9.485 14.776 12 H ILE 18 HN ILE 18 -5.672 9.877 9.341 13 HA ILE 18 HA ILE 18 -8.437 10.158 8.353 14 HB ILE 18 HB ILE 18 -6.886 11.449 6.979 15 HG12 ILE 18 HG12 ILE 18 -7.757 8.922 5.560 16 HG13 ILE 18 HG11 ILE 18 -8.786 10.314 5.888 17 HG21 ILE 18 HG21 ILE 18 -5.090 10.357 5.706 18 HG22 ILE 18 HG22 ILE 18 -5.401 8.857 6.579 19 HG23 ILE 18 HG23 ILE 18 -4.821 10.280 7.447 20 HD11 ILE 18 HD11 ILE 18 -6.326 10.322 4.156 21 HD12 ILE 18 HD12 ILE 18 -7.389 11.696 4.460 22 HD13 ILE 18 HD13 ILE 18 -7.993 10.288 3.587 23 H ASN 19 HN ASN 19 -9.467 8.320 7.638 24 HA ASN 19 HA ASN 19 -8.044 5.812 8.190 25 HB2 ASN 19 HB2 ASN 19 -11.015 6.228 7.841 26 HB3 ASN 19 HB1 ASN 19 -10.212 4.777 8.432 27 HD21 ASN 19 HD21 ASN 19 -11.212 8.006 9.163 28 HD22 ASN 19 HD22 ASN 19 -10.954 7.914 10.877 29 H LEU 20 HN LEU 20 -7.170 4.884 6.509 30 HA LEU 20 HA LEU 20 -8.554 4.990 3.911 31 HB2 LEU 20 HB2 LEU 20 -5.662 4.384 4.553 32 HB3 LEU 20 HB1 LEU 20 -6.360 4.355 2.945 33 HG LEU 20 HG LEU 20 -6.187 6.813 4.694 34 HD11 LEU 20 HD11 LEU 20 -3.973 6.060 4.010 35 HD12 LEU 20 HD12 LEU 20 -4.426 7.537 3.158 36 HD13 LEU 20 HD13 LEU 20 -4.508 5.983 2.329 37 HD21 LEU 20 HD21 LEU 20 -6.737 7.983 2.578 38 HD22 LEU 20 HD22 LEU 20 -8.039 6.952 3.165 39 HD23 LEU 20 HD23 LEU 20 -7.027 6.411 1.826 40 H LYS 21 HN LYS 21 -9.155 3.087 2.916 41 HA LYS 21 HA LYS 21 -8.812 0.665 4.554 42 HB2 LYS 21 HB2 LYS 21 -10.856 1.295 2.418 43 HB3 LYS 21 HB1 LYS 21 -10.774 -0.206 3.330 44 HG2 LYS 21 HG2 LYS 21 -11.293 0.937 5.372 45 HG3 LYS 21 HG1 LYS 21 -11.192 2.503 4.566 46 HD2 LYS 21 HD2 LYS 21 -13.089 1.854 3.126 47 HD3 LYS 21 HD1 LYS 21 -13.211 0.330 4.007 48 HE2 LYS 21 HE2 LYS 21 -13.728 1.494 6.047 49 HE3 LYS 21 HE1 LYS 21 -13.447 3.054 5.277 50 HZ1 LYS 21 HZ1 LYS 21 -15.769 2.700 5.373 51 HZ2 LYS 21 HZ2 LYS 21 -15.644 1.143 4.723 52 HZ3 LYS 21 HZ3 LYS 21 -15.320 2.490 3.755 53 H VAL 22 HN VAL 22 -7.657 -0.994 3.820 54 HA VAL 22 HA VAL 22 -6.716 -0.903 1.038 55 HB VAL 22 HB VAL 22 -5.613 -2.253 3.501 56 HG11 VAL 22 HG11 VAL 22 -5.463 -3.885 1.709 57 HG12 VAL 22 HG12 VAL 22 -3.863 -3.242 2.089 58 HG13 VAL 22 HG13 VAL 22 -4.721 -2.681 0.653 59 HG21 VAL 22 HG21 VAL 22 -3.622 -0.954 3.005 60 HG22 VAL 22 HG22 VAL 22 -5.030 0.100 3.127 61 HG23 VAL 22 HG23 VAL 22 -4.380 -0.322 1.544 62 H ALA 23 HN ALA 23 -7.755 -2.158 -0.354 63 HA ALA 23 HA ALA 23 -9.475 -4.280 0.617 64 HB1 ALA 23 HB1 ALA 23 -10.307 -4.389 -1.666 65 HB2 ALA 23 HB2 ALA 23 -9.053 -3.266 -2.189 66 HB3 ALA 23 HB3 ALA 23 -10.309 -2.730 -1.074 67 H GLY 24 HN GLY 24 -8.478 -6.133 1.096 68 HA2 GLY 24 HA2 GLY 24 -6.237 -7.088 -0.472 69 HA3 GLY 24 HA1 GLY 24 -6.954 -7.886 0.923 70 H GLN 25 HN GLN 25 -6.209 -9.098 -1.605 71 HA GLN 25 HA GLN 25 -8.461 -9.506 -3.256 72 HB2 GLN 25 HB2 GLN 25 -5.982 -11.175 -2.831 73 HB3 GLN 25 HB1 GLN 25 -7.194 -11.529 -4.051 74 HG2 GLN 25 HG2 GLN 25 -5.700 -8.924 -3.899 75 HG3 GLN 25 HG1 GLN 25 -5.186 -10.299 -4.874 76 HE21 GLN 25 HE21 GLN 25 -6.019 -7.569 -5.622 77 HE22 GLN 25 HE22 GLN 25 -7.305 -7.786 -6.762 78 H ASP 26 HN ASP 26 -7.507 -10.870 -0.239 79 HA ASP 26 HA ASP 26 -9.335 -13.116 -0.439 80 HB2 ASP 26 HB2 ASP 26 -8.559 -13.450 1.999 81 HB3 ASP 26 HB1 ASP 26 -7.380 -13.697 0.716 82 H GLY 27 HN GLY 27 -9.830 -9.965 0.013 83 HA2 GLY 27 HA2 GLY 27 -11.840 -8.963 0.632 84 HA3 GLY 27 HA1 GLY 27 -12.310 -10.450 1.438 85 H SER 28 HN SER 28 -9.220 -8.987 2.089 86 HA SER 28 HA SER 28 -9.897 -8.690 4.863 87 HB2 SER 28 HB2 SER 28 -7.445 -7.439 4.464 88 HB3 SER 28 HB1 SER 28 -7.678 -9.129 4.911 89 HG SER 28 HG SER 28 -7.268 -9.755 2.906 90 H VAL 29 HN VAL 29 -10.433 -6.811 5.934 91 HA VAL 29 HA VAL 29 -10.390 -4.352 4.288 92 HB VAL 29 HB VAL 29 -12.357 -4.692 6.527 93 HG11 VAL 29 HG11 VAL 29 -13.630 -3.063 5.218 94 HG12 VAL 29 HG12 VAL 29 -12.388 -3.091 3.969 95 HG13 VAL 29 HG13 VAL 29 -12.011 -2.469 5.575 96 HG21 VAL 29 HG21 VAL 29 -14.043 -5.466 4.914 97 HG22 VAL 29 HG22 VAL 29 -12.734 -6.633 5.114 98 HG23 VAL 29 HG23 VAL 29 -12.787 -5.601 3.685 99 H VAL 30 HN VAL 30 -8.192 -4.240 5.271 100 HA VAL 30 HA VAL 30 -8.061 -3.664 8.088 101 HB VAL 30 HB VAL 30 -5.677 -3.155 7.701 102 HG11 VAL 30 HG11 VAL 30 -6.582 -5.715 6.389 103 HG12 VAL 30 HG12 VAL 30 -6.404 -5.454 8.125 104 HG13 VAL 30 HG13 VAL 30 -4.988 -5.402 7.075 105 HG21 VAL 30 HG21 VAL 30 -4.676 -3.490 5.507 106 HG22 VAL 30 HG22 VAL 30 -5.866 -2.189 5.461 107 HG23 VAL 30 HG23 VAL 30 -6.270 -3.779 4.809 108 H GLN 31 HN GLN 31 -8.023 -1.741 9.065 109 HA GLN 31 HA GLN 31 -8.598 0.599 7.377 110 HB2 GLN 31 HB2 GLN 31 -10.259 -0.099 9.103 111 HB3 GLN 31 HB1 GLN 31 -9.053 0.216 10.339 112 HG2 GLN 31 HG2 GLN 31 -9.033 2.555 9.798 113 HG3 GLN 31 HG1 GLN 31 -10.112 2.284 8.429 114 HE21 GLN 31 HE21 GLN 31 -10.480 3.998 10.760 115 HE22 GLN 31 HE22 GLN 31 -11.939 3.458 11.517 116 H PHE 32 HN PHE 32 -6.844 1.740 6.942 117 HA PHE 32 HA PHE 32 -4.654 1.883 8.850 118 HB2 PHE 32 HB2 PHE 32 -5.014 2.521 5.971 119 HB3 PHE 32 HB1 PHE 32 -3.819 3.466 6.854 120 HD1 PHE 32 HD1 PHE 32 -4.624 0.251 5.407 121 HD2 PHE 32 HD2 PHE 32 -1.903 2.343 7.928 122 HE1 PHE 32 HE1 PHE 32 -2.997 -1.579 5.173 123 HE2 PHE 32 HE2 PHE 32 -0.277 0.519 7.695 124 HZ PHE 32 HZ PHE 32 -0.821 -1.448 6.315 125 H LYS 33 HN LYS 33 -4.985 3.243 10.465 126 HA LYS 33 HA LYS 33 -6.265 5.831 9.929 127 HB2 LYS 33 HB2 LYS 33 -7.085 4.248 11.757 128 HB3 LYS 33 HB1 LYS 33 -5.603 4.635 12.616 129 HG2 LYS 33 HG2 LYS 33 -6.263 7.017 12.596 130 HG3 LYS 33 HG1 LYS 33 -7.791 6.554 11.839 131 HD2 LYS 33 HD2 LYS 33 -8.122 4.988 13.813 132 HD3 LYS 33 HD1 LYS 33 -6.774 5.829 14.578 133 HE2 LYS 33 HE2 LYS 33 -8.029 7.966 14.242 134 HE3 LYS 33 HE1 LYS 33 -9.404 7.005 13.700 135 HZ1 LYS 33 HZ1 LYS 33 -9.620 7.545 16.022 136 HZ2 LYS 33 HZ2 LYS 33 -8.116 6.865 16.370 137 HZ3 LYS 33 HZ3 LYS 33 -9.388 5.880 15.856 138 H ILE 34 HN ILE 34 -4.411 6.719 8.923 139 HA ILE 34 HA ILE 34 -2.158 7.256 10.753 140 HB ILE 34 HB ILE 34 -0.770 7.602 8.728 141 HG12 ILE 34 HG12 ILE 34 -3.046 6.360 7.176 142 HG13 ILE 34 HG11 ILE 34 -2.788 8.099 7.245 143 HG21 ILE 34 HG21 ILE 34 -0.488 5.259 8.183 144 HG22 ILE 34 HG22 ILE 34 -2.094 4.894 8.815 145 HG23 ILE 34 HG23 ILE 34 -0.820 5.440 9.906 146 HD11 ILE 34 HD11 ILE 34 -1.874 6.952 5.222 147 HD12 ILE 34 HD12 ILE 34 -0.708 6.161 6.280 148 HD13 ILE 34 HD13 ILE 34 -0.707 7.915 6.126 149 H LYS 35 HN LYS 35 -0.901 9.288 9.691 150 HA LYS 35 HA LYS 35 -2.842 11.456 9.848 151 HB2 LYS 35 HB2 LYS 35 0.189 11.560 9.851 152 HB3 LYS 35 HB1 LYS 35 -0.888 12.916 10.158 153 HG2 LYS 35 HG2 LYS 35 -1.793 11.591 12.113 154 HG3 LYS 35 HG1 LYS 35 -0.444 10.482 11.860 155 HD2 LYS 35 HD2 LYS 35 1.131 12.342 12.175 156 HD3 LYS 35 HD1 LYS 35 -0.227 13.436 12.453 157 HE2 LYS 35 HE2 LYS 35 -0.906 11.914 14.350 158 HE3 LYS 35 HE1 LYS 35 0.641 11.097 14.141 159 HZ1 LYS 35 HZ1 LYS 35 1.788 13.120 14.663 160 HZ2 LYS 35 HZ2 LYS 35 0.660 12.812 15.886 161 HZ3 LYS 35 HZ3 LYS 35 0.338 13.991 14.720 162 H ARG 36 HN ARG 36 -2.753 13.220 8.275 163 HA ARG 36 HA ARG 36 -2.743 12.199 5.632 164 HB2 ARG 36 HB2 ARG 36 -3.453 14.723 6.940 165 HB3 ARG 36 HB1 ARG 36 -2.866 14.909 5.291 166 HG2 ARG 36 HG2 ARG 36 -4.531 13.162 4.602 167 HG3 ARG 36 HG1 ARG 36 -5.197 13.252 6.233 168 HD2 ARG 36 HD2 ARG 36 -6.026 15.388 5.913 169 HD3 ARG 36 HD1 ARG 36 -4.876 15.749 4.624 170 HE ARG 36 HE ARG 36 -6.212 14.542 3.108 171 HH11 ARG 36 HH11 ARG 36 -7.636 14.767 6.316 172 HH12 ARG 36 HH12 ARG 36 -9.262 14.238 5.751 173 HH21 ARG 36 HH21 ARG 36 -8.243 13.852 2.359 174 HH22 ARG 36 HH22 ARG 36 -9.618 13.736 3.536 175 H HIS 37 HN HIS 37 -0.198 13.372 7.513 176 HA HIS 37 HA HIS 37 1.339 14.111 5.127 177 HB2 HIS 37 HB2 HIS 37 2.951 15.154 6.640 178 HB3 HIS 37 HB1 HIS 37 1.335 15.789 6.911 179 HD2 HIS 37 HD2 HIS 37 0.521 15.734 9.475 180 HE1 HIS 37 HE1 HIS 37 3.534 13.153 10.938 181 HE2 HIS 37 HE2 HIS 37 1.750 14.836 11.573 182 H THR 38 HN THR 38 0.680 11.402 6.693 183 HA THR 38 HA THR 38 3.358 10.373 7.064 184 HB THR 38 HB THR 38 0.755 8.840 7.144 185 HG1 THR 38 HG1 THR 38 1.759 10.739 8.820 186 HG21 THR 38 HG21 THR 38 3.432 8.307 8.443 187 HG22 THR 38 HG22 THR 38 2.800 7.468 7.027 188 HG23 THR 38 HG23 THR 38 1.990 7.304 8.584 189 HA PRO 39 HA PRO 39 3.852 9.366 2.726 190 HB2 PRO 39 HB2 PRO 39 5.863 7.508 3.889 191 HB3 PRO 39 HB1 PRO 39 6.046 8.706 2.601 192 HG2 PRO 39 HG2 PRO 39 7.030 9.175 5.015 193 HG3 PRO 39 HG1 PRO 39 6.275 10.471 4.067 194 HD2 PRO 39 HD2 PRO 39 5.199 8.969 6.401 195 HD3 PRO 39 HD1 PRO 39 4.981 10.671 5.949 196 H LEU 40 HN LEU 40 2.941 7.882 1.447 197 HA LEU 40 HA LEU 40 1.487 5.707 2.561 198 HB2 LEU 40 HB2 LEU 40 2.098 6.513 -0.275 199 HB3 LEU 40 HB1 LEU 40 1.121 5.111 0.117 200 HG LEU 40 HG LEU 40 0.454 7.936 0.955 201 HD11 LEU 40 HD11 LEU 40 -1.307 7.796 -0.765 202 HD12 LEU 40 HD12 LEU 40 -0.612 6.273 -1.320 203 HD13 LEU 40 HD13 LEU 40 0.320 7.765 -1.444 204 HD21 LEU 40 HD21 LEU 40 -1.054 5.333 1.140 205 HD22 LEU 40 HD22 LEU 40 -1.788 6.916 1.378 206 HD23 LEU 40 HD23 LEU 40 -0.519 6.362 2.467 207 H SER 41 HN SER 41 4.711 6.047 1.589 208 HA SER 41 HA SER 41 5.347 3.501 0.625 209 HB2 SER 41 HB2 SER 41 7.460 4.578 2.267 210 HB3 SER 41 HB1 SER 41 7.372 4.470 0.507 211 HG SER 41 HG SER 41 7.294 6.582 0.671 212 H LYS 42 HN LYS 42 5.312 4.803 3.924 213 HA LYS 42 HA LYS 42 6.122 2.353 5.143 214 HB2 LYS 42 HB2 LYS 42 4.800 4.795 6.346 215 HB3 LYS 42 HB1 LYS 42 5.521 3.478 7.264 216 HG2 LYS 42 HG2 LYS 42 7.695 3.990 6.154 217 HG3 LYS 42 HG1 LYS 42 6.934 5.407 5.432 218 HD2 LYS 42 HD2 LYS 42 6.519 6.355 7.610 219 HD3 LYS 42 HD1 LYS 42 7.100 4.886 8.399 220 HE2 LYS 42 HE2 LYS 42 9.313 5.290 7.250 221 HE3 LYS 42 HE1 LYS 42 8.691 6.872 6.791 222 HZ1 LYS 42 HZ1 LYS 42 10.084 6.702 8.897 223 HZ2 LYS 42 HZ2 LYS 42 8.721 5.998 9.611 224 HZ3 LYS 42 HZ3 LYS 42 8.637 7.574 8.999 225 H LEU 43 HN LEU 43 3.093 3.772 4.219 226 HA LEU 43 HA LEU 43 1.364 2.169 5.778 227 HB2 LEU 43 HB2 LEU 43 0.610 4.214 4.671 228 HB3 LEU 43 HB1 LEU 43 0.930 3.505 3.101 229 HG LEU 43 HG LEU 43 -0.978 2.009 4.793 230 HD11 LEU 43 HD11 LEU 43 -2.824 3.536 4.278 231 HD12 LEU 43 HD12 LEU 43 -1.674 4.699 3.619 232 HD13 LEU 43 HD13 LEU 43 -1.631 4.290 5.335 233 HD21 LEU 43 HD21 LEU 43 -1.027 2.934 1.919 234 HD22 LEU 43 HD22 LEU 43 -2.151 1.799 2.668 235 HD23 LEU 43 HD23 LEU 43 -0.451 1.364 2.484 236 H MET 44 HN MET 44 2.622 1.852 2.484 237 HA MET 44 HA MET 44 1.354 -0.599 1.880 238 HB2 MET 44 HB2 MET 44 3.869 0.665 0.776 239 HB3 MET 44 HB1 MET 44 3.137 -0.789 0.112 240 HG2 MET 44 HG2 MET 44 1.083 0.486 -0.344 241 HG3 MET 44 HG1 MET 44 1.881 1.940 0.252 242 HE1 MET 44 HE1 MET 44 3.756 3.246 -1.018 243 HE2 MET 44 HE2 MET 44 4.644 2.586 -2.394 244 HE3 MET 44 HE3 MET 44 4.774 1.822 -0.810 245 H LYS 45 HN LYS 45 4.476 0.219 3.269 246 HA LYS 45 HA LYS 45 5.608 -2.330 3.352 247 HB2 LYS 45 HB2 LYS 45 5.986 0.136 5.034 248 HB3 LYS 45 HB1 LYS 45 6.862 -1.346 5.398 249 HG2 LYS 45 HG2 LYS 45 6.936 0.023 2.721 250 HG3 LYS 45 HG1 LYS 45 8.108 0.309 4.009 251 HD2 LYS 45 HD2 LYS 45 8.823 -1.974 3.956 252 HD3 LYS 45 HD1 LYS 45 7.526 -2.408 2.842 253 HE2 LYS 45 HE2 LYS 45 8.510 -1.002 1.119 254 HE3 LYS 45 HE1 LYS 45 9.779 -0.499 2.234 255 HZ1 LYS 45 HZ1 LYS 45 9.328 -3.301 1.375 256 HZ2 LYS 45 HZ2 LYS 45 10.615 -2.723 2.304 257 HZ3 LYS 45 HZ3 LYS 45 10.469 -2.263 0.683 258 H ALA 46 HN ALA 46 3.518 -0.669 5.677 259 HA ALA 46 HA ALA 46 3.629 -2.491 7.767 260 HB1 ALA 46 HB1 ALA 46 2.585 -0.294 7.948 261 HB2 ALA 46 HB2 ALA 46 1.492 -1.570 8.488 262 HB3 ALA 46 HB3 ALA 46 1.270 -0.830 6.902 263 H TYR 47 HN TYR 47 1.253 -2.420 5.083 264 HA TYR 47 HA TYR 47 -0.035 -4.812 5.918 265 HB2 TYR 47 HB2 TYR 47 -1.121 -3.134 4.453 266 HB3 TYR 47 HB1 TYR 47 -0.011 -3.569 3.158 267 HD1 TYR 47 HD1 TYR 47 -0.730 -5.112 1.584 268 HD2 TYR 47 HD2 TYR 47 -2.474 -5.191 5.468 269 HE1 TYR 47 HE1 TYR 47 -2.261 -6.894 0.857 270 HE2 TYR 47 HE2 TYR 47 -4.010 -6.973 4.747 271 HH TYR 47 HH TYR 47 -4.965 -7.883 2.720 272 H CYS 48 HN CYS 48 2.586 -4.129 3.678 273 HA CYS 48 HA CYS 48 2.772 -6.683 2.509 274 HB2 CYS 48 HB2 CYS 48 3.892 -4.391 1.895 275 HB3 CYS 48 HB1 CYS 48 5.192 -4.974 2.930 276 HG CYS 48 HG CYS 48 5.775 -7.206 1.429 277 H GLU 49 HN GLU 49 4.464 -5.250 5.286 278 HA GLU 49 HA GLU 49 6.071 -7.496 5.876 279 HB2 GLU 49 HB2 GLU 49 5.126 -5.167 7.542 280 HB3 GLU 49 HB1 GLU 49 6.188 -6.410 8.188 281 HG2 GLU 49 HG2 GLU 49 6.837 -4.770 5.749 282 HG3 GLU 49 HG1 GLU 49 7.317 -4.321 7.384 283 H ARG 50 HN ARG 50 2.771 -6.728 6.539 284 HA ARG 50 HA ARG 50 2.346 -8.497 8.715 285 HB2 ARG 50 HB2 ARG 50 0.585 -7.075 6.765 286 HB3 ARG 50 HB1 ARG 50 -0.101 -8.319 7.805 287 HG2 ARG 50 HG2 ARG 50 0.667 -7.105 9.769 288 HG3 ARG 50 HG1 ARG 50 1.367 -5.864 8.726 289 HD2 ARG 50 HD2 ARG 50 -0.696 -5.086 8.049 290 HD3 ARG 50 HD1 ARG 50 -1.510 -6.592 8.464 291 HE ARG 50 HE ARG 50 -0.395 -5.109 10.688 292 HH11 ARG 50 HH11 ARG 50 -3.193 -5.841 8.705 293 HH12 ARG 50 HH12 ARG 50 -4.375 -5.238 9.934 294 HH21 ARG 50 HH21 ARG 50 -3.623 -4.435 11.933 295 HH22 ARG 50 HH22 ARG 50 -1.849 -4.405 12.297 296 H GLN 51 HN GLN 51 1.882 -8.813 5.225 297 HA GLN 51 HA GLN 51 0.891 -11.504 5.447 298 HB2 GLN 51 HB2 GLN 51 1.881 -10.130 2.950 299 HB3 GLN 51 HB1 GLN 51 0.768 -11.488 3.056 300 HG2 GLN 51 HG2 GLN 51 0.248 -8.633 3.869 301 HG3 GLN 51 HG1 GLN 51 -0.467 -9.511 2.519 302 HE21 GLN 51 HE21 GLN 51 -2.092 -11.009 2.915 303 HE22 GLN 51 HE22 GLN 51 -2.935 -11.075 4.424 304 H GLY 52 HN GLY 52 3.944 -10.075 5.469 305 HA2 GLY 52 HA2 GLY 52 6.030 -11.040 5.675 306 HA3 GLY 52 HA1 GLY 52 5.262 -12.617 5.559 307 H LEU 53 HN LEU 53 5.160 -9.939 3.269 308 HA LEU 53 HA LEU 53 6.648 -11.586 1.340 309 HB2 LEU 53 HB2 LEU 53 4.222 -9.911 0.687 310 HB3 LEU 53 HB1 LEU 53 5.131 -10.908 -0.430 311 HG LEU 53 HG LEU 53 3.575 -12.002 1.917 312 HD11 LEU 53 HD11 LEU 53 2.807 -11.890 -0.995 313 HD12 LEU 53 HD12 LEU 53 2.080 -10.936 0.297 314 HD13 LEU 53 HD13 LEU 53 1.904 -12.690 0.290 315 HD21 LEU 53 HD21 LEU 53 5.373 -13.459 1.224 316 HD22 LEU 53 HD22 LEU 53 4.871 -13.324 -0.463 317 HD23 LEU 53 HD23 LEU 53 3.828 -14.134 0.706 318 H SER 54 HN SER 54 7.620 -10.314 -0.402 319 HA SER 54 HA SER 54 8.686 -7.836 0.615 320 HB2 SER 54 HB2 SER 54 10.195 -9.365 -0.537 321 HB3 SER 54 HB1 SER 54 9.188 -9.318 -1.981 322 HG SER 54 HG SER 54 10.975 -7.422 -0.980 323 H MET 55 HN MET 55 8.352 -5.791 -0.226 324 HA MET 55 HA MET 55 5.812 -5.263 -1.337 325 HB2 MET 55 HB2 MET 55 7.726 -3.768 -0.057 326 HB3 MET 55 HB1 MET 55 7.802 -3.140 -1.697 327 HG2 MET 55 HG2 MET 55 5.335 -2.802 -1.606 328 HG3 MET 55 HG1 MET 55 5.390 -3.260 0.094 329 HE1 MET 55 HE1 MET 55 7.137 0.571 -1.754 330 HE2 MET 55 HE2 MET 55 6.088 -0.580 -2.578 331 HE3 MET 55 HE3 MET 55 7.750 -1.023 -2.190 332 H ARG 56 HN ARG 56 8.688 -6.245 -2.790 333 HA ARG 56 HA ARG 56 8.182 -4.994 -5.350 334 HB2 ARG 56 HB2 ARG 56 10.480 -5.547 -4.332 335 HB3 ARG 56 HB1 ARG 56 10.152 -7.205 -4.806 336 HG2 ARG 56 HG2 ARG 56 10.075 -6.602 -7.114 337 HG3 ARG 56 HG1 ARG 56 10.154 -4.883 -6.720 338 HD2 ARG 56 HD2 ARG 56 12.380 -5.156 -5.819 339 HD3 ARG 56 HD1 ARG 56 12.304 -6.897 -6.081 340 HE ARG 56 HE ARG 56 11.886 -5.666 -8.542 341 HH11 ARG 56 HH11 ARG 56 15.746 -5.792 -7.317 342 HH12 ARG 56 HH12 ARG 56 14.413 -5.958 -6.114 343 HH21 ARG 56 HH21 ARG 56 15.268 -5.516 -9.538 344 HH22 ARG 56 HH22 ARG 56 13.555 -5.450 -10.101 345 H GLN 57 HN GLN 57 7.038 -7.666 -3.682 346 HA GLN 57 HA GLN 57 6.616 -9.338 -6.028 347 HB2 GLN 57 HB2 GLN 57 7.179 -10.482 -3.978 348 HB3 GLN 57 HB1 GLN 57 5.864 -9.689 -3.120 349 HG2 GLN 57 HG2 GLN 57 4.278 -10.855 -4.672 350 HG3 GLN 57 HG1 GLN 57 5.655 -11.772 -5.280 351 HE21 GLN 57 HE21 GLN 57 3.247 -12.676 -3.900 352 HE22 GLN 57 HE22 GLN 57 3.801 -13.533 -2.499 353 H ILE 58 HN ILE 58 4.746 -7.344 -3.792 354 HA ILE 58 HA ILE 58 2.353 -7.853 -5.405 355 HB ILE 58 HB ILE 58 1.119 -6.712 -3.548 356 HG12 ILE 58 HG12 ILE 58 3.780 -6.965 -2.122 357 HG13 ILE 58 HG11 ILE 58 3.009 -5.454 -2.593 358 HG21 ILE 58 HG21 ILE 58 1.293 -9.166 -3.784 359 HG22 ILE 58 HG22 ILE 58 1.124 -8.646 -2.107 360 HG23 ILE 58 HG23 ILE 58 2.700 -9.143 -2.721 361 HD11 ILE 58 HD11 ILE 58 1.859 -7.447 -0.651 362 HD12 ILE 58 HD12 ILE 58 1.187 -5.871 -1.069 363 HD13 ILE 58 HD13 ILE 58 2.725 -5.974 -0.214 364 H ARG 59 HN ARG 59 0.845 -5.843 -5.490 365 HA ARG 59 HA ARG 59 2.406 -3.406 -6.002 366 HB2 ARG 59 HB2 ARG 59 0.487 -4.710 -7.940 367 HB3 ARG 59 HB1 ARG 59 1.054 -3.054 -8.100 368 HG2 ARG 59 HG2 ARG 59 2.812 -5.501 -8.113 369 HG3 ARG 59 HG1 ARG 59 2.277 -4.616 -9.541 370 HD2 ARG 59 HD2 ARG 59 3.401 -2.590 -8.655 371 HD3 ARG 59 HD1 ARG 59 4.006 -3.556 -7.308 372 HE ARG 59 HE ARG 59 4.928 -3.597 -10.056 373 HH11 ARG 59 HH11 ARG 59 6.415 -6.128 -7.263 374 HH12 ARG 59 HH12 ARG 59 4.942 -5.150 -6.890 375 HH21 ARG 59 HH21 ARG 59 6.799 -4.775 -10.545 376 HH22 ARG 59 HH22 ARG 59 7.467 -5.909 -9.310 377 H PHE 60 HN PHE 60 1.338 -1.519 -5.585 378 HA PHE 60 HA PHE 60 -1.411 -1.769 -4.555 379 HB2 PHE 60 HB2 PHE 60 0.837 0.055 -3.681 380 HB3 PHE 60 HB1 PHE 60 -0.832 0.261 -3.166 381 HD1 PHE 60 HD1 PHE 60 2.111 -1.951 -2.981 382 HD2 PHE 60 HD2 PHE 60 -1.768 -1.079 -1.456 383 HE1 PHE 60 HE1 PHE 60 2.505 -3.487 -1.102 384 HE2 PHE 60 HE2 PHE 60 -1.378 -2.617 0.423 385 HZ PHE 60 HZ PHE 60 0.762 -3.822 0.604 386 H ARG 61 HN ARG 61 -2.932 -0.314 -5.264 387 HA ARG 61 HA ARG 61 -2.026 1.834 -7.042 388 HB2 ARG 61 HB2 ARG 61 -3.935 -0.372 -7.727 389 HB3 ARG 61 HB1 ARG 61 -4.129 1.210 -8.465 390 HG2 ARG 61 HG2 ARG 61 -1.810 1.060 -9.301 391 HG3 ARG 61 HG1 ARG 61 -1.709 -0.573 -8.644 392 HD2 ARG 61 HD2 ARG 61 -3.581 -1.250 -10.073 393 HD3 ARG 61 HD1 ARG 61 -3.665 0.383 -10.728 394 HE ARG 61 HE ARG 61 -1.151 -1.082 -11.009 395 HH11 ARG 61 HH11 ARG 61 -3.475 -0.003 -14.152 396 HH12 ARG 61 HH12 ARG 61 -4.122 0.124 -12.474 397 HH21 ARG 61 HH21 ARG 61 -0.318 -1.298 -13.112 398 HH22 ARG 61 HH22 ARG 61 -1.339 -0.798 -14.510 399 H PHE 62 HN PHE 62 -3.363 3.615 -7.163 400 HA PHE 62 HA PHE 62 -5.564 3.701 -5.205 401 HB2 PHE 62 HB2 PHE 62 -3.857 5.092 -4.311 402 HB3 PHE 62 HB1 PHE 62 -3.459 5.757 -5.889 403 HD1 PHE 62 HD1 PHE 62 -6.314 5.578 -3.496 404 HD2 PHE 62 HD2 PHE 62 -4.228 7.859 -6.421 405 HE1 PHE 62 HE1 PHE 62 -7.803 7.488 -3.064 406 HE2 PHE 62 HE2 PHE 62 -5.714 9.773 -5.994 407 HZ PHE 62 HZ PHE 62 -7.504 9.587 -4.314 408 H ASP 63 HN ASP 63 -7.411 3.733 -6.267 409 HA ASP 63 HA ASP 63 -9.053 4.223 -7.747 410 HB2 ASP 63 HB2 ASP 63 -7.935 6.615 -7.085 411 HB3 ASP 63 HB1 ASP 63 -7.769 6.643 -8.838 412 H GLY 64 HN GLY 64 -6.542 2.804 -8.607 413 HA2 GLY 64 HA2 GLY 64 -6.394 1.577 -10.648 414 HA3 GLY 64 HA1 GLY 64 -7.096 2.949 -11.489 415 H GLN 65 HN GLN 65 -5.044 4.494 -9.630 416 HA GLN 65 HA GLN 65 -2.932 4.423 -11.658 417 HB2 GLN 65 HB2 GLN 65 -3.467 6.430 -9.458 418 HB3 GLN 65 HB1 GLN 65 -2.211 6.570 -10.679 419 HG2 GLN 65 HG2 GLN 65 -5.169 6.495 -11.229 420 HG3 GLN 65 HG1 GLN 65 -4.175 7.950 -11.175 421 HE21 GLN 65 HE21 GLN 65 -2.664 8.310 -12.818 422 HE22 GLN 65 HE22 GLN 65 -2.763 7.498 -14.341 423 HA PRO 66 HA PRO 66 -0.189 2.215 -8.975 424 HB2 PRO 66 HB2 PRO 66 2.194 3.086 -9.998 425 HB3 PRO 66 HB1 PRO 66 1.183 1.857 -10.773 426 HG2 PRO 66 HG2 PRO 66 1.411 4.766 -11.392 427 HG3 PRO 66 HG1 PRO 66 1.296 3.385 -12.501 428 HD2 PRO 66 HD2 PRO 66 -0.821 4.950 -11.955 429 HD3 PRO 66 HD1 PRO 66 -0.986 3.209 -12.264 430 H ILE 67 HN ILE 67 0.580 2.589 -6.983 431 HA ILE 67 HA ILE 67 0.970 5.341 -6.123 432 HB ILE 67 HB ILE 67 1.049 2.794 -4.488 433 HG12 ILE 67 HG12 ILE 67 -1.178 4.802 -4.895 434 HG13 ILE 67 HG11 ILE 67 -1.154 3.146 -5.491 435 HG21 ILE 67 HG21 ILE 67 0.849 5.676 -3.615 436 HG22 ILE 67 HG22 ILE 67 2.266 4.640 -3.450 437 HG23 ILE 67 HG23 ILE 67 0.793 4.268 -2.556 438 HD11 ILE 67 HD11 ILE 67 -1.245 4.023 -2.615 439 HD12 ILE 67 HD12 ILE 67 -1.108 2.350 -3.160 440 HD13 ILE 67 HD13 ILE 67 -2.550 3.288 -3.546 441 H ASN 68 HN ASN 68 2.878 6.205 -5.434 442 HA ASN 68 HA ASN 68 5.286 4.599 -5.967 443 HB2 ASN 68 HB2 ASN 68 4.600 7.462 -6.307 444 HB3 ASN 68 HB1 ASN 68 6.233 7.123 -5.735 445 HD21 ASN 68 HD21 ASN 68 3.978 6.782 -8.347 446 HD22 ASN 68 HD22 ASN 68 5.129 6.296 -9.548 447 H GLU 69 HN GLU 69 7.165 5.054 -4.562 448 HA GLU 69 HA GLU 69 6.393 4.847 -1.804 449 HB2 GLU 69 HB2 GLU 69 9.093 4.851 -3.158 450 HB3 GLU 69 HB1 GLU 69 8.871 4.628 -1.426 451 HG2 GLU 69 HG2 GLU 69 7.647 2.606 -1.781 452 HG3 GLU 69 HG1 GLU 69 7.633 2.863 -3.525 453 H THR 70 HN THR 70 6.443 7.464 -3.591 454 HA THR 70 HA THR 70 7.550 9.181 -1.466 455 HB THR 70 HB THR 70 7.758 10.862 -3.458 456 HG1 THR 70 HG1 THR 70 7.139 9.940 -5.272 457 HG21 THR 70 HG21 THR 70 9.661 9.962 -2.183 458 HG22 THR 70 HG22 THR 70 10.040 10.108 -3.899 459 HG23 THR 70 HG23 THR 70 9.661 8.529 -3.212 460 H ASP 71 HN ASP 71 4.767 8.061 -2.397 461 HA ASP 71 HA ASP 71 3.339 10.560 -2.837 462 HB2 ASP 71 HB2 ASP 71 2.483 7.672 -2.876 463 HB3 ASP 71 HB1 ASP 71 1.326 8.996 -2.962 464 H THR 72 HN THR 72 1.548 11.188 -1.577 465 HA THR 72 HA THR 72 1.425 10.134 1.157 466 HB THR 72 HB THR 72 0.989 12.904 1.375 467 HG1 THR 72 HG1 THR 72 3.493 12.485 0.105 468 HG21 THR 72 HG21 THR 72 2.967 12.871 2.788 469 HG22 THR 72 HG22 THR 72 3.471 11.336 2.082 470 HG23 THR 72 HG23 THR 72 2.007 11.418 3.060 471 HA PRO 73 HA PRO 73 -2.974 10.164 0.603 472 HB2 PRO 73 HB2 PRO 73 -3.171 11.481 3.263 473 HB3 PRO 73 HB1 PRO 73 -3.912 9.980 2.692 474 HG2 PRO 73 HG2 PRO 73 -1.856 9.910 4.369 475 HG3 PRO 73 HG1 PRO 73 -2.013 8.725 3.056 476 HD2 PRO 73 HD2 PRO 73 -0.220 11.095 3.253 477 HD3 PRO 73 HD1 PRO 73 0.087 9.498 2.543 478 H ALA 74 HN ALA 74 -1.783 13.115 2.215 479 HA ALA 74 HA ALA 74 -3.913 14.736 1.227 480 HB1 ALA 74 HB1 ALA 74 -2.558 16.615 2.127 481 HB2 ALA 74 HB2 ALA 74 -1.295 15.448 2.526 482 HB3 ALA 74 HB3 ALA 74 -2.879 15.334 3.294 483 H GLN 75 HN GLN 75 -1.035 13.601 -0.160 484 HA GLN 75 HA GLN 75 -0.697 15.855 -1.947 485 HB2 GLN 75 HB2 GLN 75 1.203 14.428 -1.038 486 HB3 GLN 75 HB1 GLN 75 0.658 13.168 -2.135 487 HG2 GLN 75 HG2 GLN 75 2.557 14.543 -2.968 488 HG3 GLN 75 HG1 GLN 75 1.156 14.489 -4.038 489 HE21 GLN 75 HE21 GLN 75 0.056 16.339 -4.482 490 HE22 GLN 75 HE22 GLN 75 0.552 17.906 -3.944 491 H LEU 76 HN LEU 76 -2.001 12.591 -2.016 492 HA LEU 76 HA LEU 76 -2.584 12.765 -4.857 493 HB2 LEU 76 HB2 LEU 76 -2.923 10.638 -2.775 494 HB3 LEU 76 HB1 LEU 76 -3.711 10.499 -4.334 495 HG LEU 76 HG LEU 76 -0.730 10.785 -3.964 496 HD11 LEU 76 HD11 LEU 76 -2.383 8.322 -4.512 497 HD12 LEU 76 HD12 LEU 76 -1.523 8.684 -3.015 498 HD13 LEU 76 HD13 LEU 76 -0.621 8.402 -4.505 499 HD21 LEU 76 HD21 LEU 76 -1.345 11.577 -6.107 500 HD22 LEU 76 HD22 LEU 76 -2.489 10.258 -6.344 501 HD23 LEU 76 HD23 LEU 76 -0.756 9.931 -6.339 502 H GLU 77 HN GLU 77 -3.946 14.205 -2.364 503 HA GLU 77 HA GLU 77 -5.977 15.103 -1.894 504 HB2 GLU 77 HB2 GLU 77 -6.611 14.250 -4.726 505 HB3 GLU 77 HB1 GLU 77 -7.592 15.340 -3.757 506 HG2 GLU 77 HG2 GLU 77 -4.716 15.918 -4.386 507 HG3 GLU 77 HG1 GLU 77 -6.027 16.367 -5.475 508 H MET 78 HN MET 78 -5.500 12.430 -1.107 509 HA MET 78 HA MET 78 -7.833 10.836 -1.665 510 HB2 MET 78 HB2 MET 78 -5.774 10.460 0.516 511 HB3 MET 78 HB1 MET 78 -6.911 9.257 -0.073 512 HG2 MET 78 HG2 MET 78 -5.802 9.159 -2.194 513 HG3 MET 78 HG1 MET 78 -4.754 10.506 -1.754 514 HE1 MET 78 HE1 MET 78 -5.918 7.199 0.105 515 HE2 MET 78 HE2 MET 78 -4.484 6.202 -0.142 516 HE3 MET 78 HE3 MET 78 -5.450 6.716 -1.525 517 H GLU 79 HN GLU 79 -9.316 10.099 0.009 518 HA GLU 79 HA GLU 79 -9.649 12.018 2.204 519 HB2 GLU 79 HB2 GLU 79 -11.457 11.536 -0.041 520 HB3 GLU 79 HB1 GLU 79 -12.240 11.344 1.522 521 HG2 GLU 79 HG2 GLU 79 -10.601 13.762 0.847 522 HG3 GLU 79 HG1 GLU 79 -12.316 13.645 0.454 523 H ASP 80 HN ASP 80 -11.497 11.143 3.684 524 HA ASP 80 HA ASP 80 -10.594 8.644 4.703 525 HB2 ASP 80 HB2 ASP 80 -11.639 10.621 5.984 526 HB3 ASP 80 HB1 ASP 80 -13.188 9.982 5.451 527 H GLU 81 HN GLU 81 -11.697 6.681 4.828 528 HA GLU 81 HA GLU 81 -13.079 4.979 4.230 529 HB2 GLU 81 HB2 GLU 81 -14.798 7.006 2.792 530 HB3 GLU 81 HB1 GLU 81 -15.247 5.364 3.224 531 HG2 GLU 81 HG2 GLU 81 -14.393 6.984 5.494 532 HG3 GLU 81 HG1 GLU 81 -15.822 7.601 4.670 533 H ASP 82 HN ASP 82 -11.105 6.602 2.335 534 HA ASP 82 HA ASP 82 -11.805 5.738 -0.281 535 HB2 ASP 82 HB2 ASP 82 -9.930 7.462 0.744 536 HB3 ASP 82 HB1 ASP 82 -8.938 6.098 0.238 537 H THR 83 HN THR 83 -10.733 4.076 -1.540 538 HA THR 83 HA THR 83 -9.755 1.873 0.157 539 HB THR 83 HB THR 83 -11.087 1.285 -2.448 540 HG1 THR 83 HG1 THR 83 -12.286 2.662 -0.522 541 HG21 THR 83 HG21 THR 83 -11.737 -0.752 -1.282 542 HG22 THR 83 HG22 THR 83 -11.081 -0.122 0.229 543 HG23 THR 83 HG23 THR 83 -10.001 -0.494 -1.115 544 H ILE 84 HN ILE 84 -7.898 0.936 -0.370 545 HA ILE 84 HA ILE 84 -6.500 1.876 -2.774 546 HB ILE 84 HB ILE 84 -5.395 0.470 -0.332 547 HG12 ILE 84 HG12 ILE 84 -5.122 3.378 -1.124 548 HG13 ILE 84 HG11 ILE 84 -6.305 2.794 0.042 549 HG21 ILE 84 HG21 ILE 84 -3.201 1.161 -1.207 550 HG22 ILE 84 HG22 ILE 84 -3.991 1.775 -2.660 551 HG23 ILE 84 HG23 ILE 84 -4.039 0.052 -2.295 552 HD11 ILE 84 HD11 ILE 84 -3.318 2.561 0.308 553 HD12 ILE 84 HD12 ILE 84 -4.513 2.021 1.486 554 HD13 ILE 84 HD13 ILE 84 -4.344 3.738 1.125 555 H ASP 85 HN ASP 85 -5.734 0.472 -4.302 556 HA ASP 85 HA ASP 85 -6.914 -2.192 -4.308 557 HB2 ASP 85 HB2 ASP 85 -5.355 -0.740 -6.455 558 HB3 ASP 85 HB1 ASP 85 -6.207 -2.264 -6.661 559 H VAL 86 HN VAL 86 -5.792 -4.070 -4.215 560 HA VAL 86 HA VAL 86 -2.852 -3.925 -4.096 561 HB VAL 86 HB VAL 86 -4.574 -5.724 -2.378 562 HG11 VAL 86 HG11 VAL 86 -2.487 -6.281 -1.246 563 HG12 VAL 86 HG12 VAL 86 -1.596 -5.235 -2.355 564 HG13 VAL 86 HG13 VAL 86 -2.402 -6.684 -2.963 565 HG21 VAL 86 HG21 VAL 86 -3.823 -4.348 -0.485 566 HG22 VAL 86 HG22 VAL 86 -4.779 -3.416 -1.640 567 HG23 VAL 86 HG23 VAL 86 -3.023 -3.252 -1.613 568 H PHE 87 HN PHE 87 -1.902 -5.196 -5.544 569 HA PHE 87 HA PHE 87 -3.298 -7.624 -6.453 570 HB2 PHE 87 HB2 PHE 87 -1.770 -5.757 -8.280 571 HB3 PHE 87 HB1 PHE 87 -2.648 -7.208 -8.749 572 HD1 PHE 87 HD1 PHE 87 -5.200 -7.203 -8.141 573 HD2 PHE 87 HD2 PHE 87 -2.792 -3.715 -8.506 574 HE1 PHE 87 HE1 PHE 87 -7.221 -5.853 -8.517 575 HE2 PHE 87 HE2 PHE 87 -4.808 -2.358 -8.881 576 HZ PHE 87 HZ PHE 87 -7.028 -3.426 -8.886 577 H GLN 88 HN GLN 88 -1.619 -8.941 -7.871 578 HA GLN 88 HA GLN 88 0.956 -8.903 -6.442 579 HB2 GLN 88 HB2 GLN 88 -0.681 -11.273 -7.349 580 HB3 GLN 88 HB1 GLN 88 0.996 -11.395 -6.836 581 HG2 GLN 88 HG2 GLN 88 -0.190 -10.015 -4.778 582 HG3 GLN 88 HG1 GLN 88 -1.429 -11.170 -5.257 583 HE21 GLN 88 HE21 GLN 88 -1.211 -12.282 -3.314 584 HE22 GLN 88 HE22 GLN 88 0.143 -13.315 -3.001 585 H GLN 89 HN GLN 89 2.811 -9.445 -7.645 586 HA GLN 89 HA GLN 89 2.583 -8.770 -10.446 587 HB2 GLN 89 HB2 GLN 89 4.413 -7.927 -8.914 588 HB3 GLN 89 HB1 GLN 89 5.071 -9.556 -8.926 589 HG2 GLN 89 HG2 GLN 89 6.229 -8.106 -10.498 590 HG3 GLN 89 HG1 GLN 89 5.411 -9.432 -11.321 591 HE21 GLN 89 HE21 GLN 89 5.369 -8.337 -13.265 592 HE22 GLN 89 HE22 GLN 89 4.316 -6.993 -13.551 593 H GLN 90 HN GLN 90 2.497 -10.150 -12.065 594 HA GLN 90 HA GLN 90 2.185 -12.902 -11.749 595 HB2 GLN 90 HB2 GLN 90 2.778 -11.167 -14.133 596 HB3 GLN 90 HB1 GLN 90 2.664 -12.914 -14.289 597 HG2 GLN 90 HG2 GLN 90 0.555 -12.039 -14.871 598 HG3 GLN 90 HG1 GLN 90 0.377 -12.757 -13.273 599 HE21 GLN 90 HE21 GLN 90 -1.431 -11.525 -12.834 600 HE22 GLN 90 HE22 GLN 90 -1.338 -9.836 -12.476 601 H THR 91 HN THR 91 3.527 -14.609 -11.815 602 HA THR 91 HA THR 91 6.276 -14.257 -11.313 603 HB THR 91 HB THR 91 5.804 -16.919 -12.171 604 HG1 THR 91 HG1 THR 91 3.857 -17.405 -11.357 605 HG21 THR 91 HG21 THR 91 5.898 -15.678 -9.419 606 HG22 THR 91 HG22 THR 91 7.268 -16.305 -10.336 607 HG23 THR 91 HG23 THR 91 6.017 -17.404 -9.756 608 H GLY 92 HN GLY 92 4.471 -15.160 -14.221 609 HA2 GLY 92 HA2 GLY 92 5.909 -14.150 -16.182 610 HA3 GLY 92 HA1 GLY 92 6.969 -15.466 -15.700 611 H ASN 357 HT1 ASN 357 -15.556 -11.317 6.766 612 HA ASN 357 HA ASN 357 -12.980 -10.667 5.475 613 HB2 ASN 357 HB2 ASN 357 -13.846 -8.406 5.246 614 HB3 ASN 357 HB1 ASN 357 -14.914 -9.536 4.426 615 HD21 ASN 357 HD21 ASN 357 -15.428 -6.839 5.430 616 HD22 ASN 357 HD22 ASN 357 -16.765 -6.983 6.518 617 H ASN 358 HN ASN 358 -11.619 -9.320 6.668 618 HA ASN 358 HA ASN 358 -12.307 -9.141 9.515 619 HB2 ASN 358 HB2 ASN 358 -9.890 -9.454 10.045 620 HB3 ASN 358 HB1 ASN 358 -10.620 -10.857 9.274 621 HD21 ASN 358 HD21 ASN 358 -9.877 -11.528 7.328 622 HD22 ASN 358 HD22 ASN 358 -8.524 -10.820 6.514 623 H ARG 359 HN ARG 359 -12.135 -7.187 10.482 624 HA ARG 359 HA ARG 359 -10.663 -5.138 8.951 625 HB2 ARG 359 HB2 ARG 359 -12.321 -3.493 10.034 626 HB3 ARG 359 HB1 ARG 359 -12.891 -4.463 8.684 627 HG2 ARG 359 HG2 ARG 359 -13.914 -6.023 10.311 628 HG3 ARG 359 HG1 ARG 359 -13.411 -4.949 11.612 629 HD2 ARG 359 HD2 ARG 359 -15.040 -3.456 11.187 630 HD3 ARG 359 HD1 ARG 359 -14.904 -3.651 9.439 631 HE ARG 359 HE ARG 359 -16.031 -5.983 10.401 632 HH11 ARG 359 HH11 ARG 359 -16.859 -2.561 10.448 633 HH12 ARG 359 HH12 ARG 359 -18.630 -2.877 10.333 634 HH21 ARG 359 HH21 ARG 359 -18.270 -6.417 10.294 635 HH22 ARG 359 HH22 ARG 359 -19.412 -5.022 10.305 636 H ASP 360 HN ASP 360 -9.006 -4.374 9.963 637 HA ASP 360 HA ASP 360 -9.016 -4.103 12.866 638 HB2 ASP 360 HB2 ASP 360 -7.094 -5.246 13.216 639 HB3 ASP 360 HB1 ASP 360 -7.622 -6.091 11.770 640 HA PRO 361 HA PRO 361 -7.403 -0.139 11.582 641 HB2 PRO 361 HB2 PRO 361 -7.738 1.132 13.934 642 HB3 PRO 361 HB1 PRO 361 -9.118 0.603 12.962 643 HG2 PRO 361 HG2 PRO 361 -8.171 -0.439 15.519 644 HG3 PRO 361 HG1 PRO 361 -9.719 -0.708 14.704 645 HD2 PRO 361 HD2 PRO 361 -7.352 -2.419 14.756 646 HD3 PRO 361 HD1 PRO 361 -9.001 -2.787 14.200 647 H ILE 362 HN ILE 362 -5.419 0.584 11.344 648 HA ILE 362 HA ILE 362 -3.373 0.084 13.410 649 HB ILE 362 HB ILE 362 -2.666 0.444 10.524 650 HG12 ILE 362 HG12 ILE 362 -3.062 -2.342 11.495 651 HG13 ILE 362 HG11 ILE 362 -4.506 -1.430 11.054 652 HG21 ILE 362 HG21 ILE 362 -1.417 -1.161 12.749 653 HG22 ILE 362 HG22 ILE 362 -0.882 0.422 12.179 654 HG23 ILE 362 HG23 ILE 362 -0.780 -0.979 11.114 655 HD11 ILE 362 HD11 ILE 362 -2.124 -1.888 9.277 656 HD12 ILE 362 HD12 ILE 362 -3.602 -1.037 8.838 657 HD13 ILE 362 HD13 ILE 362 -3.650 -2.765 9.191 658 H VAL 363 HN VAL 363 -2.211 1.808 14.117 659 HA VAL 363 HA VAL 363 -2.593 4.334 12.644 660 HB VAL 363 HB VAL 363 -1.973 4.014 15.588 661 HG11 VAL 363 HG11 VAL 363 -1.154 6.097 14.719 662 HG12 VAL 363 HG12 VAL 363 -2.589 6.413 15.692 663 HG13 VAL 363 HG13 VAL 363 -2.697 6.428 13.933 664 HG21 VAL 363 HG21 VAL 363 -4.237 4.464 16.105 665 HG22 VAL 363 HG22 VAL 363 -4.249 3.183 14.890 666 HG23 VAL 363 HG23 VAL 363 -4.620 4.846 14.425 667 H ILE 364 HN ILE 364 -0.837 5.173 11.806 668 HA ILE 364 HA ILE 364 1.798 4.416 12.879 669 HB ILE 364 HB ILE 364 1.135 5.016 9.988 670 HG12 ILE 364 HG12 ILE 364 2.054 2.416 11.222 671 HG13 ILE 364 HG11 ILE 364 0.383 2.771 10.795 672 HG21 ILE 364 HG21 ILE 364 3.753 4.133 11.187 673 HG22 ILE 364 HG22 ILE 364 3.369 5.794 10.734 674 HG23 ILE 364 HG23 ILE 364 3.442 4.536 9.498 675 HD11 ILE 364 HD11 ILE 364 1.042 2.995 8.449 676 HD12 ILE 364 HD12 ILE 364 1.453 1.411 9.098 677 HD13 ILE 364 HD13 ILE 364 2.707 2.627 8.885 678 H SER 365 HN SER 365 3.069 6.080 13.466 679 HA SER 365 HA SER 365 2.277 8.786 12.603 680 HB2 SER 365 HB2 SER 365 3.508 8.050 15.271 681 HB3 SER 365 HB1 SER 365 2.884 9.628 14.785 682 HG SER 365 HG SER 365 1.101 7.548 14.511 683 H ASP 366 HN ASP 366 3.845 9.990 11.655 684 HA ASP 366 HA ASP 366 6.611 8.994 11.871 685 HB2 ASP 366 HB2 ASP 366 5.363 8.759 9.607 686 HB3 ASP 366 HB1 ASP 366 5.626 10.496 9.466 687 H SER 367 HN SER 367 8.118 10.383 12.495 688 HA SER 367 HA SER 367 7.313 13.174 12.928 689 HB2 SER 367 HB2 SER 367 9.713 11.815 14.151 690 HB3 SER 367 HB1 SER 367 8.842 13.239 14.725 691 HG SER 367 HG SER 367 8.426 10.667 15.326 692 HA PRO 368 HA PRO 368 10.274 14.479 9.879 693 HB2 PRO 368 HB2 PRO 368 10.553 17.078 10.591 694 HB3 PRO 368 HB1 PRO 368 9.081 16.458 9.832 695 HG2 PRO 368 HG2 PRO 368 9.597 17.065 12.699 696 HG3 PRO 368 HG1 PRO 368 8.133 17.337 11.734 697 HD2 PRO 368 HD2 PRO 368 8.449 15.238 13.463 698 HD3 PRO 368 HD1 PRO 368 7.370 15.217 12.056 Start of MODEL 3 1 H ASP 16 HT1 ASP 16 -5.377 15.794 12.149 2 HA ASP 16 HA ASP 16 -6.773 13.978 14.001 3 HB2 ASP 16 HB2 ASP 16 -7.825 15.426 11.571 4 HB3 ASP 16 HB1 ASP 16 -8.578 13.966 12.207 5 H HIS 17 HN HIS 17 -7.344 11.953 12.851 6 HA HIS 17 HA HIS 17 -5.158 11.227 11.022 7 HB2 HIS 17 HB2 HIS 17 -6.874 9.553 12.865 8 HB3 HIS 17 HB1 HIS 17 -5.770 8.863 11.679 9 HD2 HIS 17 HD2 HIS 17 -3.065 9.052 12.285 10 HE1 HIS 17 HE1 HIS 17 -3.686 10.521 16.204 11 HE2 HIS 17 HE2 HIS 17 -2.047 9.373 14.649 12 H ILE 18 HN ILE 18 -5.630 9.810 9.231 13 HA ILE 18 HA ILE 18 -8.356 10.232 8.206 14 HB ILE 18 HB ILE 18 -6.571 11.246 6.841 15 HG12 ILE 18 HG12 ILE 18 -7.799 8.881 5.419 16 HG13 ILE 18 HG11 ILE 18 -8.683 10.346 5.828 17 HG21 ILE 18 HG21 ILE 18 -5.578 8.419 6.532 18 HG22 ILE 18 HG22 ILE 18 -4.740 9.758 7.315 19 HG23 ILE 18 HG23 ILE 18 -5.026 9.793 5.575 20 HD11 ILE 18 HD11 ILE 18 -6.284 10.183 4.018 21 HD12 ILE 18 HD12 ILE 18 -7.178 11.650 4.422 22 HD13 ILE 18 HD13 ILE 18 -7.963 10.360 3.511 23 H ASN 19 HN ASN 19 -9.566 8.525 7.490 24 HA ASN 19 HA ASN 19 -8.602 5.885 8.314 25 HB2 ASN 19 HB2 ASN 19 -11.379 6.801 7.527 26 HB3 ASN 19 HB1 ASN 19 -10.965 5.198 8.126 27 HD21 ASN 19 HD21 ASN 19 -11.378 8.551 8.935 28 HD22 ASN 19 HD22 ASN 19 -11.390 8.336 10.657 29 H LEU 20 HN LEU 20 -7.336 5.148 6.653 30 HA LEU 20 HA LEU 20 -8.515 5.111 3.961 31 HB2 LEU 20 HB2 LEU 20 -5.695 4.549 4.887 32 HB3 LEU 20 HB1 LEU 20 -6.237 4.448 3.221 33 HG LEU 20 HG LEU 20 -6.264 6.970 4.884 34 HD11 LEU 20 HD11 LEU 20 -4.364 6.165 2.688 35 HD12 LEU 20 HD12 LEU 20 -3.984 6.154 4.411 36 HD13 LEU 20 HD13 LEU 20 -4.353 7.675 3.599 37 HD21 LEU 20 HD21 LEU 20 -6.657 8.079 2.730 38 HD22 LEU 20 HD22 LEU 20 -7.961 6.966 3.145 39 HD23 LEU 20 HD23 LEU 20 -6.754 6.501 1.944 40 H LYS 21 HN LYS 21 -9.423 3.278 3.237 41 HA LYS 21 HA LYS 21 -8.920 0.821 4.764 42 HB2 LYS 21 HB2 LYS 21 -11.156 1.535 2.860 43 HB3 LYS 21 HB1 LYS 21 -10.987 -0.017 3.670 44 HG2 LYS 21 HG2 LYS 21 -11.203 1.084 5.838 45 HG3 LYS 21 HG1 LYS 21 -11.365 2.644 5.030 46 HD2 LYS 21 HD2 LYS 21 -13.231 0.301 4.658 47 HD3 LYS 21 HD1 LYS 21 -13.537 1.678 5.720 48 HE2 LYS 21 HE2 LYS 21 -13.413 3.176 3.769 49 HE3 LYS 21 HE1 LYS 21 -13.169 1.777 2.727 50 HZ1 LYS 21 HZ1 LYS 21 -15.598 2.712 4.051 51 HZ2 LYS 21 HZ2 LYS 21 -15.393 1.038 3.923 52 HZ3 LYS 21 HZ3 LYS 21 -15.402 1.993 2.528 53 H VAL 22 HN VAL 22 -7.877 -0.844 3.918 54 HA VAL 22 HA VAL 22 -7.281 -0.782 1.028 55 HB VAL 22 HB VAL 22 -5.640 -2.175 3.146 56 HG11 VAL 22 HG11 VAL 22 -5.440 -3.032 0.854 57 HG12 VAL 22 HG12 VAL 22 -3.942 -2.305 1.430 58 HG13 VAL 22 HG13 VAL 22 -4.976 -1.424 0.304 59 HG21 VAL 22 HG21 VAL 22 -4.045 -0.321 2.967 60 HG22 VAL 22 HG22 VAL 22 -5.605 0.224 3.584 61 HG23 VAL 22 HG23 VAL 22 -5.164 0.532 1.907 62 H ALA 23 HN ALA 23 -8.070 -2.404 -0.149 63 HA ALA 23 HA ALA 23 -9.143 -4.735 1.289 64 HB1 ALA 23 HB1 ALA 23 -10.706 -5.006 -0.559 65 HB2 ALA 23 HB2 ALA 23 -9.984 -3.625 -1.389 66 HB3 ALA 23 HB3 ALA 23 -10.837 -3.390 0.137 67 H GLY 24 HN GLY 24 -8.418 -6.705 0.832 68 HA2 GLY 24 HA2 GLY 24 -6.222 -6.959 -1.051 69 HA3 GLY 24 HA1 GLY 24 -6.773 -8.184 0.086 70 H GLN 25 HN GLN 25 -6.477 -9.592 -1.838 71 HA GLN 25 HA GLN 25 -8.507 -9.301 -3.903 72 HB2 GLN 25 HB2 GLN 25 -6.340 -11.381 -3.529 73 HB3 GLN 25 HB1 GLN 25 -7.413 -11.275 -4.920 74 HG2 GLN 25 HG2 GLN 25 -5.789 -8.895 -4.180 75 HG3 GLN 25 HG1 GLN 25 -5.000 -10.254 -4.977 76 HE21 GLN 25 HE21 GLN 25 -5.548 -7.499 -5.885 77 HE22 GLN 25 HE22 GLN 25 -6.412 -7.677 -7.376 78 H ASP 26 HN ASP 26 -8.482 -10.458 -0.861 79 HA ASP 26 HA ASP 26 -10.385 -12.619 -1.459 80 HB2 ASP 26 HB2 ASP 26 -9.851 -13.386 0.929 81 HB3 ASP 26 HB1 ASP 26 -8.611 -13.636 -0.291 82 H GLY 27 HN GLY 27 -10.152 -11.496 1.797 83 HA2 GLY 27 HA2 GLY 27 -12.445 -9.701 1.482 84 HA3 GLY 27 HA1 GLY 27 -12.680 -11.141 2.462 85 H SER 28 HN SER 28 -9.574 -9.632 2.425 86 HA SER 28 HA SER 28 -9.838 -8.989 5.240 87 HB2 SER 28 HB2 SER 28 -7.334 -8.186 4.637 88 HB3 SER 28 HB1 SER 28 -7.734 -9.870 4.974 89 HG SER 28 HG SER 28 -7.773 -10.306 2.798 90 H VAL 29 HN VAL 29 -10.489 -7.034 5.921 91 HA VAL 29 HA VAL 29 -10.023 -4.748 4.097 92 HB VAL 29 HB VAL 29 -12.226 -4.851 6.153 93 HG11 VAL 29 HG11 VAL 29 -13.160 -3.020 4.841 94 HG12 VAL 29 HG12 VAL 29 -11.815 -3.137 3.705 95 HG13 VAL 29 HG13 VAL 29 -11.522 -2.636 5.370 96 HG21 VAL 29 HG21 VAL 29 -12.451 -5.511 3.217 97 HG22 VAL 29 HG22 VAL 29 -13.779 -5.422 4.373 98 HG23 VAL 29 HG23 VAL 29 -12.553 -6.677 4.535 99 H VAL 30 HN VAL 30 -8.026 -4.277 5.017 100 HA VAL 30 HA VAL 30 -7.864 -3.773 7.866 101 HB VAL 30 HB VAL 30 -5.501 -3.201 7.430 102 HG11 VAL 30 HG11 VAL 30 -6.375 -5.766 6.099 103 HG12 VAL 30 HG12 VAL 30 -6.159 -5.528 7.833 104 HG13 VAL 30 HG13 VAL 30 -4.770 -5.422 6.750 105 HG21 VAL 30 HG21 VAL 30 -6.216 -3.741 4.548 106 HG22 VAL 30 HG22 VAL 30 -4.572 -3.571 5.166 107 HG23 VAL 30 HG23 VAL 30 -5.689 -2.205 5.237 108 H GLN 31 HN GLN 31 -7.992 -1.830 8.844 109 HA GLN 31 HA GLN 31 -8.402 0.486 7.063 110 HB2 GLN 31 HB2 GLN 31 -10.311 -0.129 8.534 111 HB3 GLN 31 HB1 GLN 31 -9.290 0.167 9.934 112 HG2 GLN 31 HG2 GLN 31 -9.306 2.444 9.643 113 HG3 GLN 31 HG1 GLN 31 -9.630 2.330 7.914 114 HE21 GLN 31 HE21 GLN 31 -10.964 3.859 10.066 115 HE22 GLN 31 HE22 GLN 31 -12.628 3.400 9.990 116 H PHE 32 HN PHE 32 -6.714 1.725 6.874 117 HA PHE 32 HA PHE 32 -4.713 1.853 8.989 118 HB2 PHE 32 HB2 PHE 32 -4.816 2.693 6.113 119 HB3 PHE 32 HB1 PHE 32 -3.611 3.398 7.183 120 HD1 PHE 32 HD1 PHE 32 -4.788 0.292 5.626 121 HD2 PHE 32 HD2 PHE 32 -1.727 2.153 7.913 122 HE1 PHE 32 HE1 PHE 32 -3.332 -1.655 5.247 123 HE2 PHE 32 HE2 PHE 32 -0.262 0.210 7.544 124 HZ PHE 32 HZ PHE 32 -1.062 -1.700 6.209 125 H LYS 33 HN LYS 33 -5.112 3.257 10.573 126 HA LYS 33 HA LYS 33 -6.365 5.826 9.861 127 HB2 LYS 33 HB2 LYS 33 -7.399 4.369 11.671 128 HB3 LYS 33 HB1 LYS 33 -5.976 4.710 12.641 129 HG2 LYS 33 HG2 LYS 33 -6.489 7.086 12.594 130 HG3 LYS 33 HG1 LYS 33 -7.892 6.774 11.574 131 HD2 LYS 33 HD2 LYS 33 -8.888 5.432 13.360 132 HD3 LYS 33 HD1 LYS 33 -7.478 5.737 14.377 133 HE2 LYS 33 HE2 LYS 33 -7.959 8.118 14.363 134 HE3 LYS 33 HE1 LYS 33 -9.331 7.853 13.287 135 HZ1 LYS 33 HZ1 LYS 33 -9.110 6.670 15.998 136 HZ2 LYS 33 HZ2 LYS 33 -10.462 6.663 14.989 137 HZ3 LYS 33 HZ3 LYS 33 -9.922 8.114 15.665 138 H ILE 34 HN ILE 34 -4.399 6.538 8.951 139 HA ILE 34 HA ILE 34 -2.259 7.145 10.883 140 HB ILE 34 HB ILE 34 -0.731 7.284 8.980 141 HG12 ILE 34 HG12 ILE 34 -3.047 6.355 7.266 142 HG13 ILE 34 HG11 ILE 34 -2.472 8.019 7.318 143 HG21 ILE 34 HG21 ILE 34 -0.630 4.933 8.436 144 HG22 ILE 34 HG22 ILE 34 -2.318 4.723 8.905 145 HG23 ILE 34 HG23 ILE 34 -1.110 5.128 10.125 146 HD11 ILE 34 HD11 ILE 34 -1.646 6.713 5.385 147 HD12 ILE 34 HD12 ILE 34 -0.779 5.669 6.513 148 HD13 ILE 34 HD13 ILE 34 -0.364 7.378 6.396 149 H LYS 35 HN LYS 35 -0.913 9.115 9.920 150 HA LYS 35 HA LYS 35 -2.744 11.349 9.935 151 HB2 LYS 35 HB2 LYS 35 0.275 11.186 9.832 152 HB3 LYS 35 HB1 LYS 35 -0.616 12.700 9.831 153 HG2 LYS 35 HG2 LYS 35 -1.592 12.067 12.026 154 HG3 LYS 35 HG1 LYS 35 -0.549 10.641 12.028 155 HD2 LYS 35 HD2 LYS 35 1.424 12.013 12.010 156 HD3 LYS 35 HD1 LYS 35 0.459 13.472 11.783 157 HE2 LYS 35 HE2 LYS 35 -0.636 12.947 13.998 158 HE3 LYS 35 HE1 LYS 35 0.603 11.710 14.221 159 HZ1 LYS 35 HZ1 LYS 35 2.296 13.436 14.032 160 HZ2 LYS 35 HZ2 LYS 35 1.224 13.776 15.292 161 HZ3 LYS 35 HZ3 LYS 35 1.100 14.613 13.829 162 H ARG 36 HN ARG 36 -2.876 12.921 8.268 163 HA ARG 36 HA ARG 36 -2.825 11.823 5.645 164 HB2 ARG 36 HB2 ARG 36 -4.128 13.920 6.873 165 HB3 ARG 36 HB1 ARG 36 -3.002 14.740 5.799 166 HG2 ARG 36 HG2 ARG 36 -3.947 13.793 3.888 167 HG3 ARG 36 HG1 ARG 36 -4.767 12.531 4.808 168 HD2 ARG 36 HD2 ARG 36 -6.188 14.274 5.843 169 HD3 ARG 36 HD1 ARG 36 -5.419 15.476 4.808 170 HE ARG 36 HE ARG 36 -6.361 13.539 3.102 171 HH11 ARG 36 HH11 ARG 36 -7.772 15.619 5.565 172 HH12 ARG 36 HH12 ARG 36 -9.344 15.764 4.697 173 HH21 ARG 36 HH21 ARG 36 -8.340 13.654 2.001 174 HH22 ARG 36 HH22 ARG 36 -9.683 14.652 2.701 175 H HIS 37 HN HIS 37 -0.432 13.147 7.551 176 HA HIS 37 HA HIS 37 1.147 14.133 5.286 177 HB2 HIS 37 HB2 HIS 37 2.287 14.274 8.014 178 HB3 HIS 37 HB1 HIS 37 2.290 15.477 6.733 179 HD2 HIS 37 HD2 HIS 37 -0.235 16.918 6.540 180 HE1 HIS 37 HE1 HIS 37 -1.093 16.188 10.619 181 HE2 HIS 37 HE2 HIS 37 -1.600 17.662 8.621 182 H THR 38 HN THR 38 0.611 11.272 6.765 183 HA THR 38 HA THR 38 3.355 10.378 7.024 184 HB THR 38 HB THR 38 0.779 8.803 7.234 185 HG1 THR 38 HG1 THR 38 2.255 10.365 9.033 186 HG21 THR 38 HG21 THR 38 2.695 7.360 6.786 187 HG22 THR 38 HG22 THR 38 2.163 7.162 8.457 188 HG23 THR 38 HG23 THR 38 3.597 8.125 8.094 189 HA PRO 39 HA PRO 39 3.777 9.400 2.676 190 HB2 PRO 39 HB2 PRO 39 5.854 7.571 3.765 191 HB3 PRO 39 HB1 PRO 39 5.983 8.791 2.490 192 HG2 PRO 39 HG2 PRO 39 7.017 9.249 4.883 193 HG3 PRO 39 HG1 PRO 39 6.204 10.542 3.980 194 HD2 PRO 39 HD2 PRO 39 5.220 8.963 6.311 195 HD3 PRO 39 HD1 PRO 39 4.962 10.674 5.911 196 H LEU 40 HN LEU 40 2.876 7.907 1.404 197 HA LEU 40 HA LEU 40 1.454 5.725 2.533 198 HB2 LEU 40 HB2 LEU 40 2.027 6.494 -0.321 199 HB3 LEU 40 HB1 LEU 40 0.997 5.147 0.126 200 HG LEU 40 HG LEU 40 0.486 8.015 0.919 201 HD11 LEU 40 HD11 LEU 40 -1.233 8.031 -0.777 202 HD12 LEU 40 HD12 LEU 40 -0.842 6.373 -1.234 203 HD13 LEU 40 HD13 LEU 40 0.325 7.663 -1.515 204 HD21 LEU 40 HD21 LEU 40 -1.133 5.487 1.188 205 HD22 LEU 40 HD22 LEU 40 -1.785 7.109 1.425 206 HD23 LEU 40 HD23 LEU 40 -0.511 6.507 2.484 207 H SER 41 HN SER 41 4.663 6.047 1.475 208 HA SER 41 HA SER 41 5.218 3.482 0.498 209 HB2 SER 41 HB2 SER 41 7.458 4.447 1.980 210 HB3 SER 41 HB1 SER 41 7.213 4.480 0.231 211 HG SER 41 HG SER 41 6.953 6.548 0.386 212 H LYS 42 HN LYS 42 5.128 4.791 3.772 213 HA LYS 42 HA LYS 42 6.090 2.412 5.026 214 HB2 LYS 42 HB2 LYS 42 4.546 4.711 6.254 215 HB3 LYS 42 HB1 LYS 42 5.518 3.522 7.116 216 HG2 LYS 42 HG2 LYS 42 7.502 4.359 5.826 217 HG3 LYS 42 HG1 LYS 42 6.476 5.667 5.239 218 HD2 LYS 42 HD2 LYS 42 6.074 6.372 7.558 219 HD3 LYS 42 HD1 LYS 42 7.126 5.072 8.124 220 HE2 LYS 42 HE2 LYS 42 8.969 6.074 6.771 221 HE3 LYS 42 HE1 LYS 42 7.903 7.428 6.411 222 HZ1 LYS 42 HZ1 LYS 42 7.925 8.137 8.612 223 HZ2 LYS 42 HZ2 LYS 42 9.530 7.668 8.337 224 HZ3 LYS 42 HZ3 LYS 42 8.493 6.653 9.197 225 H LEU 43 HN LEU 43 2.986 3.703 4.117 226 HA LEU 43 HA LEU 43 1.346 1.978 5.635 227 HB2 LEU 43 HB2 LEU 43 0.509 4.028 4.580 228 HB3 LEU 43 HB1 LEU 43 0.811 3.354 2.993 229 HG LEU 43 HG LEU 43 -1.014 1.799 4.733 230 HD11 LEU 43 HD11 LEU 43 -2.913 3.262 4.195 231 HD12 LEU 43 HD12 LEU 43 -1.795 4.451 3.530 232 HD13 LEU 43 HD13 LEU 43 -1.743 4.054 5.248 233 HD21 LEU 43 HD21 LEU 43 -1.134 2.664 1.843 234 HD22 LEU 43 HD22 LEU 43 -2.203 1.503 2.628 235 HD23 LEU 43 HD23 LEU 43 -0.492 1.129 2.429 236 H MET 44 HN MET 44 2.590 1.812 2.324 237 HA MET 44 HA MET 44 1.406 -0.646 1.631 238 HB2 MET 44 HB2 MET 44 3.886 0.730 0.590 239 HB3 MET 44 HB1 MET 44 3.208 -0.720 -0.132 240 HG2 MET 44 HG2 MET 44 1.092 0.531 -0.503 241 HG3 MET 44 HG1 MET 44 1.910 1.983 0.072 242 HE1 MET 44 HE1 MET 44 3.707 3.297 -1.219 243 HE2 MET 44 HE2 MET 44 4.521 2.724 -2.675 244 HE3 MET 44 HE3 MET 44 4.792 1.908 -1.135 245 H LYS 45 HN LYS 45 4.551 0.148 3.039 246 HA LYS 45 HA LYS 45 5.562 -2.489 3.016 247 HB2 LYS 45 HB2 LYS 45 6.313 0.032 4.440 248 HB3 LYS 45 HB1 LYS 45 7.053 -1.487 4.929 249 HG2 LYS 45 HG2 LYS 45 7.618 -1.779 2.441 250 HG3 LYS 45 HG1 LYS 45 7.257 -0.055 2.309 251 HD2 LYS 45 HD2 LYS 45 8.981 0.509 3.847 252 HD3 LYS 45 HD1 LYS 45 9.209 -1.178 4.311 253 HE2 LYS 45 HE2 LYS 45 9.900 -1.633 1.938 254 HE3 LYS 45 HE1 LYS 45 9.878 0.108 1.668 255 HZ1 LYS 45 HZ1 LYS 45 11.528 -1.242 3.731 256 HZ2 LYS 45 HZ2 LYS 45 11.580 0.393 3.304 257 HZ3 LYS 45 HZ3 LYS 45 12.095 -0.783 2.207 258 H ALA 46 HN ALA 46 3.581 -0.720 5.315 259 HA ALA 46 HA ALA 46 3.882 -2.386 7.545 260 HB1 ALA 46 HB1 ALA 46 2.790 -0.235 7.716 261 HB2 ALA 46 HB2 ALA 46 1.695 -1.502 8.275 262 HB3 ALA 46 HB3 ALA 46 1.478 -0.789 6.676 263 H TYR 47 HN TYR 47 1.442 -2.498 4.954 264 HA TYR 47 HA TYR 47 0.197 -4.867 5.908 265 HB2 TYR 47 HB2 TYR 47 -0.820 -3.154 4.335 266 HB3 TYR 47 HB1 TYR 47 0.168 -3.859 3.059 267 HD1 TYR 47 HD1 TYR 47 -0.832 -5.454 1.718 268 HD2 TYR 47 HD2 TYR 47 -2.228 -4.985 5.709 269 HE1 TYR 47 HE1 TYR 47 -2.570 -7.144 1.302 270 HE2 TYR 47 HE2 TYR 47 -3.968 -6.674 5.302 271 HH TYR 47 HH TYR 47 -5.201 -7.615 3.358 272 H CYS 48 HN CYS 48 2.814 -4.189 3.704 273 HA CYS 48 HA CYS 48 3.107 -6.709 2.511 274 HB2 CYS 48 HB2 CYS 48 4.199 -4.587 1.770 275 HB3 CYS 48 HB1 CYS 48 5.280 -4.706 3.150 276 HG CYS 48 HG CYS 48 6.141 -7.354 2.181 277 H GLU 49 HN GLU 49 4.694 -5.305 5.366 278 HA GLU 49 HA GLU 49 6.228 -7.583 6.027 279 HB2 GLU 49 HB2 GLU 49 5.269 -5.252 7.687 280 HB3 GLU 49 HB1 GLU 49 6.348 -6.496 8.305 281 HG2 GLU 49 HG2 GLU 49 6.910 -4.689 5.967 282 HG3 GLU 49 HG1 GLU 49 7.563 -4.506 7.595 283 H ARG 50 HN ARG 50 2.981 -6.598 6.795 284 HA ARG 50 HA ARG 50 2.473 -8.392 8.899 285 HB2 ARG 50 HB2 ARG 50 0.939 -6.663 8.697 286 HB3 ARG 50 HB1 ARG 50 0.777 -6.879 6.960 287 HG2 ARG 50 HG2 ARG 50 -0.448 -8.948 7.323 288 HG3 ARG 50 HG1 ARG 50 -0.285 -8.738 9.069 289 HD2 ARG 50 HD2 ARG 50 -1.615 -6.768 7.230 290 HD3 ARG 50 HD1 ARG 50 -2.470 -7.997 8.164 291 HE ARG 50 HE ARG 50 -0.761 -6.248 9.716 292 HH11 ARG 50 HH11 ARG 50 -3.934 -6.892 8.408 293 HH12 ARG 50 HH12 ARG 50 -4.785 -5.823 9.595 294 HH21 ARG 50 HH21 ARG 50 -3.586 -4.771 11.251 295 HH22 ARG 50 HH22 ARG 50 -1.779 -4.936 11.311 296 H GLN 51 HN GLN 51 1.948 -8.678 5.394 297 HA GLN 51 HA GLN 51 0.899 -11.351 5.660 298 HB2 GLN 51 HB2 GLN 51 1.724 -9.808 3.189 299 HB3 GLN 51 HB1 GLN 51 0.861 -11.338 3.188 300 HG2 GLN 51 HG2 GLN 51 -0.175 -8.779 4.387 301 HG3 GLN 51 HG1 GLN 51 -0.596 -9.392 2.791 302 HE21 GLN 51 HE21 GLN 51 -2.006 -11.103 2.606 303 HE22 GLN 51 HE22 GLN 51 -2.933 -11.702 3.937 304 H GLY 52 HN GLY 52 3.925 -10.060 5.844 305 HA2 GLY 52 HA2 GLY 52 6.018 -10.988 5.883 306 HA3 GLY 52 HA1 GLY 52 5.234 -12.559 5.818 307 H LEU 53 HN LEU 53 4.922 -10.030 3.410 308 HA LEU 53 HA LEU 53 6.251 -11.822 1.489 309 HB2 LEU 53 HB2 LEU 53 4.122 -9.748 0.951 310 HB3 LEU 53 HB1 LEU 53 4.858 -10.800 -0.242 311 HG LEU 53 HG LEU 53 3.147 -11.727 2.068 312 HD11 LEU 53 HD11 LEU 53 1.483 -12.240 0.348 313 HD12 LEU 53 HD12 LEU 53 2.526 -11.518 -0.877 314 HD13 LEU 53 HD13 LEU 53 1.843 -10.514 0.404 315 HD21 LEU 53 HD21 LEU 53 4.787 -13.403 1.459 316 HD22 LEU 53 HD22 LEU 53 4.366 -13.235 -0.245 317 HD23 LEU 53 HD23 LEU 53 3.192 -13.899 0.891 318 H SER 54 HN SER 54 7.042 -10.533 -0.494 319 HA SER 54 HA SER 54 8.836 -8.478 0.508 320 HB2 SER 54 HB2 SER 54 9.918 -10.133 -0.829 321 HB3 SER 54 HB1 SER 54 8.681 -10.028 -2.082 322 HG SER 54 HG SER 54 10.825 -8.311 -1.525 323 H MET 55 HN MET 55 8.924 -6.385 -0.279 324 HA MET 55 HA MET 55 6.476 -5.208 -1.061 325 HB2 MET 55 HB2 MET 55 8.221 -4.044 0.250 326 HB3 MET 55 HB1 MET 55 9.265 -4.045 -1.163 327 HG2 MET 55 HG2 MET 55 7.549 -2.693 -2.352 328 HG3 MET 55 HG1 MET 55 6.648 -2.594 -0.841 329 HE1 MET 55 HE1 MET 55 6.692 0.101 -0.997 330 HE2 MET 55 HE2 MET 55 7.542 -0.076 -2.531 331 HE3 MET 55 HE3 MET 55 8.175 1.010 -1.295 332 H ARG 56 HN ARG 56 9.103 -6.550 -2.827 333 HA ARG 56 HA ARG 56 8.455 -5.206 -5.306 334 HB2 ARG 56 HB2 ARG 56 10.787 -5.975 -4.529 335 HB3 ARG 56 HB1 ARG 56 10.274 -7.586 -5.002 336 HG2 ARG 56 HG2 ARG 56 9.905 -6.804 -7.284 337 HG3 ARG 56 HG1 ARG 56 10.410 -5.181 -6.811 338 HD2 ARG 56 HD2 ARG 56 12.615 -6.077 -6.187 339 HD3 ARG 56 HD1 ARG 56 12.100 -7.677 -6.718 340 HE ARG 56 HE ARG 56 12.082 -6.894 -8.956 341 HH11 ARG 56 HH11 ARG 56 14.190 -3.597 -7.880 342 HH12 ARG 56 HH12 ARG 56 13.340 -4.569 -6.624 343 HH21 ARG 56 HH21 ARG 56 14.102 -4.247 -10.094 344 HH22 ARG 56 HH22 ARG 56 13.164 -5.712 -10.570 345 H GLN 57 HN GLN 57 7.198 -7.771 -3.586 346 HA GLN 57 HA GLN 57 6.495 -9.389 -5.896 347 HB2 GLN 57 HB2 GLN 57 7.144 -10.534 -3.854 348 HB3 GLN 57 HB1 GLN 57 5.871 -9.716 -2.959 349 HG2 GLN 57 HG2 GLN 57 4.299 -10.835 -4.694 350 HG3 GLN 57 HG1 GLN 57 5.666 -11.915 -4.961 351 HE21 GLN 57 HE21 GLN 57 2.981 -12.366 -3.797 352 HE22 GLN 57 HE22 GLN 57 3.278 -13.081 -2.250 353 H ILE 58 HN ILE 58 4.968 -7.150 -3.651 354 HA ILE 58 HA ILE 58 2.409 -7.593 -5.028 355 HB ILE 58 HB ILE 58 1.365 -6.409 -3.111 356 HG12 ILE 58 HG12 ILE 58 4.134 -6.602 -1.900 357 HG13 ILE 58 HG11 ILE 58 3.336 -5.113 -2.394 358 HG21 ILE 58 HG21 ILE 58 1.424 -8.834 -3.183 359 HG22 ILE 58 HG22 ILE 58 1.605 -8.268 -1.524 360 HG23 ILE 58 HG23 ILE 58 3.012 -8.837 -2.420 361 HD11 ILE 58 HD11 ILE 58 2.520 -6.966 -0.172 362 HD12 ILE 58 HD12 ILE 58 1.561 -5.593 -0.720 363 HD13 ILE 58 HD13 ILE 58 3.160 -5.330 -0.026 364 H ARG 59 HN ARG 59 1.024 -5.642 -5.244 365 HA ARG 59 HA ARG 59 2.521 -3.160 -5.723 366 HB2 ARG 59 HB2 ARG 59 0.691 -4.531 -7.707 367 HB3 ARG 59 HB1 ARG 59 1.227 -2.864 -7.862 368 HG2 ARG 59 HG2 ARG 59 2.998 -5.304 -7.865 369 HG3 ARG 59 HG1 ARG 59 2.527 -4.355 -9.275 370 HD2 ARG 59 HD2 ARG 59 3.635 -2.383 -8.261 371 HD3 ARG 59 HD1 ARG 59 4.183 -3.413 -6.938 372 HE ARG 59 HE ARG 59 5.231 -3.302 -9.625 373 HH11 ARG 59 HH11 ARG 59 6.423 -6.190 -7.031 374 HH12 ARG 59 HH12 ARG 59 5.012 -5.137 -6.617 375 HH21 ARG 59 HH21 ARG 59 7.070 -4.567 -10.138 376 HH22 ARG 59 HH22 ARG 59 7.581 -5.856 -8.985 377 H PHE 60 HN PHE 60 1.229 -1.274 -5.595 378 HA PHE 60 HA PHE 60 -1.461 -1.713 -4.481 379 HB2 PHE 60 HB2 PHE 60 0.760 0.077 -3.577 380 HB3 PHE 60 HB1 PHE 60 -0.904 0.587 -3.325 381 HD1 PHE 60 HD1 PHE 60 1.423 -2.236 -2.675 382 HD2 PHE 60 HD2 PHE 60 -2.073 -0.142 -1.467 383 HE1 PHE 60 HE1 PHE 60 1.321 -3.593 -0.624 384 HE2 PHE 60 HE2 PHE 60 -2.183 -1.493 0.582 385 HZ PHE 60 HZ PHE 60 -0.485 -3.222 1.008 386 H ARG 61 HN ARG 61 -3.098 -0.405 -5.199 387 HA ARG 61 HA ARG 61 -2.388 1.660 -7.172 388 HB2 ARG 61 HB2 ARG 61 -4.418 -0.543 -7.464 389 HB3 ARG 61 HB1 ARG 61 -4.491 0.927 -8.426 390 HG2 ARG 61 HG2 ARG 61 -2.224 0.434 -9.279 391 HG3 ARG 61 HG1 ARG 61 -2.247 -1.079 -8.372 392 HD2 ARG 61 HD2 ARG 61 -4.312 -1.709 -9.627 393 HD3 ARG 61 HD1 ARG 61 -4.081 -0.273 -10.623 394 HE ARG 61 HE ARG 61 -1.700 -1.620 -10.761 395 HH11 ARG 61 HH11 ARG 61 -4.633 -3.553 -12.784 396 HH12 ARG 61 HH12 ARG 61 -5.065 -2.367 -11.496 397 HH21 ARG 61 HH21 ARG 61 -1.123 -3.105 -12.390 398 HH22 ARG 61 HH22 ARG 61 -2.434 -3.944 -13.302 399 H PHE 62 HN PHE 62 -3.694 3.417 -7.283 400 HA PHE 62 HA PHE 62 -6.002 3.605 -5.492 401 HB2 PHE 62 HB2 PHE 62 -4.290 4.563 -4.129 402 HB3 PHE 62 HB1 PHE 62 -3.589 5.425 -5.494 403 HD1 PHE 62 HD1 PHE 62 -6.579 5.266 -3.312 404 HD2 PHE 62 HD2 PHE 62 -4.257 7.610 -6.006 405 HE1 PHE 62 HE1 PHE 62 -7.921 7.250 -2.743 406 HE2 PHE 62 HE2 PHE 62 -5.593 9.593 -5.439 407 HZ PHE 62 HZ PHE 62 -7.426 9.416 -3.807 408 H ASP 63 HN ASP 63 -7.670 4.510 -6.527 409 HA ASP 63 HA ASP 63 -8.922 5.558 -8.110 410 HB2 ASP 63 HB2 ASP 63 -7.563 7.518 -7.231 411 HB3 ASP 63 HB1 ASP 63 -6.516 7.310 -8.629 412 H GLY 64 HN GLY 64 -7.045 3.340 -8.798 413 HA2 GLY 64 HA2 GLY 64 -6.984 2.083 -10.776 414 HA3 GLY 64 HA1 GLY 64 -7.367 3.533 -11.688 415 H GLN 65 HN GLN 65 -5.075 4.731 -9.889 416 HA GLN 65 HA GLN 65 -2.964 4.050 -11.816 417 HB2 GLN 65 HB2 GLN 65 -3.128 6.411 -9.938 418 HB3 GLN 65 HB1 GLN 65 -1.964 6.183 -11.234 419 HG2 GLN 65 HG2 GLN 65 -4.932 6.470 -11.631 420 HG3 GLN 65 HG1 GLN 65 -3.765 7.781 -11.781 421 HE21 GLN 65 HE21 GLN 65 -2.292 7.750 -13.495 422 HE22 GLN 65 HE22 GLN 65 -2.574 6.803 -14.915 423 HA PRO 66 HA PRO 66 -0.576 2.105 -8.630 424 HB2 PRO 66 HB2 PRO 66 1.952 2.537 -9.501 425 HB3 PRO 66 HB1 PRO 66 0.850 1.404 -10.301 426 HG2 PRO 66 HG2 PRO 66 1.555 4.201 -11.071 427 HG3 PRO 66 HG1 PRO 66 1.357 2.767 -12.098 428 HD2 PRO 66 HD2 PRO 66 -0.568 4.660 -11.834 429 HD3 PRO 66 HD1 PRO 66 -0.928 2.953 -12.154 430 H ILE 67 HN ILE 67 0.421 2.571 -6.712 431 HA ILE 67 HA ILE 67 0.723 5.390 -6.061 432 HB ILE 67 HB ILE 67 0.964 2.957 -4.282 433 HG12 ILE 67 HG12 ILE 67 -1.318 4.908 -4.679 434 HG13 ILE 67 HG11 ILE 67 -1.294 3.218 -5.178 435 HG21 ILE 67 HG21 ILE 67 0.809 5.889 -3.587 436 HG22 ILE 67 HG22 ILE 67 2.209 4.837 -3.383 437 HG23 ILE 67 HG23 ILE 67 0.752 4.563 -2.426 438 HD11 ILE 67 HD11 ILE 67 -1.201 4.233 -2.348 439 HD12 ILE 67 HD12 ILE 67 -1.155 2.539 -2.835 440 HD13 ILE 67 HD13 ILE 67 -2.592 3.510 -3.156 441 H ASN 68 HN ASN 68 2.615 6.411 -5.689 442 HA ASN 68 HA ASN 68 5.061 4.929 -6.288 443 HB2 ASN 68 HB2 ASN 68 4.667 7.908 -5.900 444 HB3 ASN 68 HB1 ASN 68 6.121 7.121 -6.504 445 HD21 ASN 68 HD21 ASN 68 2.930 8.194 -7.231 446 HD22 ASN 68 HD22 ASN 68 3.002 7.908 -8.940 447 H GLU 69 HN GLU 69 6.995 5.329 -4.977 448 HA GLU 69 HA GLU 69 6.446 4.896 -2.214 449 HB2 GLU 69 HB2 GLU 69 9.053 5.383 -3.660 450 HB3 GLU 69 HB1 GLU 69 8.916 4.871 -1.983 451 HG2 GLU 69 HG2 GLU 69 7.795 2.820 -2.700 452 HG3 GLU 69 HG1 GLU 69 7.958 3.321 -4.382 453 H THR 70 HN THR 70 6.798 7.685 -4.071 454 HA THR 70 HA THR 70 7.553 9.315 -1.751 455 HB THR 70 HB THR 70 7.611 11.113 -3.688 456 HG1 THR 70 HG1 THR 70 7.533 10.296 -5.641 457 HG21 THR 70 HG21 THR 70 9.560 10.437 -2.384 458 HG22 THR 70 HG22 THR 70 9.979 10.557 -4.092 459 HG23 THR 70 HG23 THR 70 9.722 8.975 -3.359 460 H ASP 71 HN ASP 71 4.820 8.105 -2.644 461 HA ASP 71 HA ASP 71 3.267 10.543 -2.997 462 HB2 ASP 71 HB2 ASP 71 2.683 7.627 -3.251 463 HB3 ASP 71 HB1 ASP 71 1.347 8.724 -2.919 464 H THR 72 HN THR 72 1.657 11.219 -1.639 465 HA THR 72 HA THR 72 1.570 10.063 1.058 466 HB THR 72 HB THR 72 1.133 12.737 1.522 467 HG1 THR 72 HG1 THR 72 3.303 12.561 -0.324 468 HG21 THR 72 HG21 THR 72 2.553 11.150 2.817 469 HG22 THR 72 HG22 THR 72 3.279 12.745 2.619 470 HG23 THR 72 HG23 THR 72 3.834 11.394 1.628 471 HA PRO 73 HA PRO 73 -2.842 10.128 0.655 472 HB2 PRO 73 HB2 PRO 73 -2.987 11.558 3.260 473 HB3 PRO 73 HB1 PRO 73 -3.738 10.033 2.771 474 HG2 PRO 73 HG2 PRO 73 -1.654 10.038 4.410 475 HG3 PRO 73 HG1 PRO 73 -1.830 8.793 3.156 476 HD2 PRO 73 HD2 PRO 73 -0.043 11.182 3.211 477 HD3 PRO 73 HD1 PRO 73 0.264 9.554 2.573 478 H ALA 74 HN ALA 74 -1.563 13.133 2.078 479 HA ALA 74 HA ALA 74 -3.692 14.781 1.202 480 HB1 ALA 74 HB1 ALA 74 -2.176 16.652 1.752 481 HB2 ALA 74 HB2 ALA 74 -0.864 15.496 1.973 482 HB3 ALA 74 HB3 ALA 74 -2.268 15.450 3.040 483 H GLN 75 HN GLN 75 -0.621 13.857 -0.224 484 HA GLN 75 HA GLN 75 -0.571 15.730 -2.332 485 HB2 GLN 75 HB2 GLN 75 1.387 14.406 -1.563 486 HB3 GLN 75 HB1 GLN 75 0.656 12.966 -2.261 487 HG2 GLN 75 HG2 GLN 75 2.322 13.795 -3.760 488 HG3 GLN 75 HG1 GLN 75 0.734 14.058 -4.479 489 HE21 GLN 75 HE21 GLN 75 1.463 15.699 -5.804 490 HE22 GLN 75 HE22 GLN 75 1.905 17.259 -5.202 491 H LEU 76 HN LEU 76 -1.764 12.393 -2.168 492 HA LEU 76 HA LEU 76 -2.667 12.451 -4.909 493 HB2 LEU 76 HB2 LEU 76 -2.816 10.449 -2.683 494 HB3 LEU 76 HB1 LEU 76 -3.732 10.214 -4.159 495 HG LEU 76 HG LEU 76 -0.729 10.464 -3.976 496 HD11 LEU 76 HD11 LEU 76 -0.713 8.106 -4.578 497 HD12 LEU 76 HD12 LEU 76 -2.475 8.075 -4.559 498 HD13 LEU 76 HD13 LEU 76 -1.582 8.361 -3.065 499 HD21 LEU 76 HD21 LEU 76 -1.424 11.355 -6.069 500 HD22 LEU 76 HD22 LEU 76 -2.587 10.051 -6.308 501 HD23 LEU 76 HD23 LEU 76 -0.859 9.713 -6.369 502 H GLU 77 HN GLU 77 -3.836 13.938 -2.300 503 HA GLU 77 HA GLU 77 -5.825 14.825 -1.674 504 HB2 GLU 77 HB2 GLU 77 -6.497 14.083 -4.517 505 HB3 GLU 77 HB1 GLU 77 -7.624 14.928 -3.466 506 HG2 GLU 77 HG2 GLU 77 -5.922 16.720 -3.185 507 HG3 GLU 77 HG1 GLU 77 -4.926 15.890 -4.379 508 H MET 78 HN MET 78 -5.304 12.175 -0.932 509 HA MET 78 HA MET 78 -7.538 10.466 -1.340 510 HB2 MET 78 HB2 MET 78 -5.289 10.539 0.654 511 HB3 MET 78 HB1 MET 78 -6.606 9.391 0.835 512 HG2 MET 78 HG2 MET 78 -6.095 8.399 -1.298 513 HG3 MET 78 HG1 MET 78 -4.849 9.610 -1.595 514 HE1 MET 78 HE1 MET 78 -3.336 5.881 -0.763 515 HE2 MET 78 HE2 MET 78 -3.716 6.960 -2.105 516 HE3 MET 78 HE3 MET 78 -5.014 6.146 -1.231 517 H GLU 79 HN GLU 79 -9.469 10.423 -0.351 518 HA GLU 79 HA GLU 79 -9.921 12.353 1.808 519 HB2 GLU 79 HB2 GLU 79 -11.469 11.509 -0.453 520 HB3 GLU 79 HB1 GLU 79 -12.362 11.147 1.018 521 HG2 GLU 79 HG2 GLU 79 -11.358 13.813 0.067 522 HG3 GLU 79 HG1 GLU 79 -13.025 13.306 0.335 523 H ASP 80 HN ASP 80 -11.719 11.563 3.374 524 HA ASP 80 HA ASP 80 -10.635 9.302 4.743 525 HB2 ASP 80 HB2 ASP 80 -11.707 11.373 5.783 526 HB3 ASP 80 HB1 ASP 80 -13.258 10.655 5.362 527 H GLU 81 HN GLU 81 -11.327 7.271 4.848 528 HA GLU 81 HA GLU 81 -12.477 5.368 4.494 529 HB2 GLU 81 HB2 GLU 81 -14.636 7.361 4.138 530 HB3 GLU 81 HB1 GLU 81 -14.921 5.763 3.458 531 HG2 GLU 81 HG2 GLU 81 -13.998 5.115 5.918 532 HG3 GLU 81 HG1 GLU 81 -14.826 6.636 6.259 533 H ASP 82 HN ASP 82 -10.776 6.508 2.490 534 HA ASP 82 HA ASP 82 -12.001 5.932 -0.064 535 HB2 ASP 82 HB2 ASP 82 -9.982 7.569 0.539 536 HB3 ASP 82 HB1 ASP 82 -9.035 6.119 0.219 537 H THR 83 HN THR 83 -10.486 4.382 -1.520 538 HA THR 83 HA THR 83 -10.010 1.939 0.055 539 HB THR 83 HB THR 83 -11.274 1.813 -2.671 540 HG1 THR 83 HG1 THR 83 -12.913 2.781 -1.686 541 HG21 THR 83 HG21 THR 83 -12.023 -0.381 -1.880 542 HG22 THR 83 HG22 THR 83 -11.249 -0.086 -0.322 543 HG23 THR 83 HG23 THR 83 -10.268 -0.234 -1.779 544 H ILE 84 HN ILE 84 -8.112 1.050 -0.304 545 HA ILE 84 HA ILE 84 -6.619 1.800 -2.731 546 HB ILE 84 HB ILE 84 -5.472 0.640 -0.185 547 HG12 ILE 84 HG12 ILE 84 -5.623 3.542 -1.038 548 HG13 ILE 84 HG11 ILE 84 -6.547 2.817 0.272 549 HG21 ILE 84 HG21 ILE 84 -3.353 1.509 -1.073 550 HG22 ILE 84 HG22 ILE 84 -4.192 2.053 -2.524 551 HG23 ILE 84 HG23 ILE 84 -4.086 0.332 -2.160 552 HD11 ILE 84 HD11 ILE 84 -3.551 3.090 0.163 553 HD12 ILE 84 HD12 ILE 84 -4.473 2.374 1.485 554 HD13 ILE 84 HD13 ILE 84 -4.654 4.089 1.112 555 H ASP 85 HN ASP 85 -5.883 0.221 -4.103 556 HA ASP 85 HA ASP 85 -6.921 -2.482 -3.637 557 HB2 ASP 85 HB2 ASP 85 -6.067 -0.980 -6.093 558 HB3 ASP 85 HB1 ASP 85 -6.191 -2.733 -6.118 559 H VAL 86 HN VAL 86 -5.685 -4.306 -3.705 560 HA VAL 86 HA VAL 86 -2.756 -3.942 -3.751 561 HB VAL 86 HB VAL 86 -4.267 -6.113 -2.278 562 HG11 VAL 86 HG11 VAL 86 -2.129 -6.555 -1.201 563 HG12 VAL 86 HG12 VAL 86 -1.376 -5.266 -2.138 564 HG13 VAL 86 HG13 VAL 86 -1.988 -6.704 -2.952 565 HG21 VAL 86 HG21 VAL 86 -3.705 -4.914 -0.218 566 HG22 VAL 86 HG22 VAL 86 -4.754 -3.955 -1.263 567 HG23 VAL 86 HG23 VAL 86 -3.030 -3.595 -1.174 568 H PHE 87 HN PHE 87 -1.680 -5.068 -5.278 569 HA PHE 87 HA PHE 87 -3.081 -7.304 -6.596 570 HB2 PHE 87 HB2 PHE 87 -1.587 -5.004 -7.836 571 HB3 PHE 87 HB1 PHE 87 -1.787 -6.529 -8.693 572 HD1 PHE 87 HD1 PHE 87 -3.950 -7.233 -9.489 573 HD2 PHE 87 HD2 PHE 87 -3.473 -3.540 -7.428 574 HE1 PHE 87 HE1 PHE 87 -6.171 -6.518 -10.262 575 HE2 PHE 87 HE2 PHE 87 -5.694 -2.821 -8.199 576 HZ PHE 87 HZ PHE 87 -7.048 -4.313 -9.616 577 H GLN 88 HN GLN 88 -1.597 -8.752 -7.794 578 HA GLN 88 HA GLN 88 0.930 -9.094 -6.317 579 HB2 GLN 88 HB2 GLN 88 -0.872 -11.096 -7.691 580 HB3 GLN 88 HB1 GLN 88 0.742 -11.490 -7.116 581 HG2 GLN 88 HG2 GLN 88 -1.331 -10.347 -5.283 582 HG3 GLN 88 HG1 GLN 88 -1.255 -12.072 -5.634 583 HE21 GLN 88 HE21 GLN 88 -0.866 -10.729 -3.109 584 HE22 GLN 88 HE22 GLN 88 0.731 -11.128 -2.581 585 H GLN 89 HN GLN 89 2.823 -9.548 -7.465 586 HA GLN 89 HA GLN 89 2.851 -8.559 -10.180 587 HB2 GLN 89 HB2 GLN 89 4.627 -7.953 -8.556 588 HB3 GLN 89 HB1 GLN 89 5.121 -9.639 -8.493 589 HG2 GLN 89 HG2 GLN 89 6.564 -8.275 -9.933 590 HG3 GLN 89 HG1 GLN 89 5.769 -9.580 -10.815 591 HE21 GLN 89 HE21 GLN 89 5.829 -8.654 -12.798 592 HE22 GLN 89 HE22 GLN 89 4.948 -7.227 -13.224 593 H GLN 90 HN GLN 90 3.294 -9.712 -12.013 594 HA GLN 90 HA GLN 90 2.624 -12.489 -11.985 595 HB2 GLN 90 HB2 GLN 90 3.722 -10.818 -14.255 596 HB3 GLN 90 HB1 GLN 90 2.958 -12.393 -14.407 597 HG2 GLN 90 HG2 GLN 90 1.186 -11.094 -14.941 598 HG3 GLN 90 HG1 GLN 90 0.973 -11.128 -13.192 599 HE21 GLN 90 HE21 GLN 90 -0.119 -9.187 -13.178 600 HE22 GLN 90 HE22 GLN 90 0.673 -7.671 -13.444 601 H THR 91 HN THR 91 3.959 -14.091 -11.538 602 HA THR 91 HA THR 91 6.795 -13.689 -11.394 603 HB THR 91 HB THR 91 6.392 -16.389 -11.049 604 HG1 THR 91 HG1 THR 91 4.279 -16.598 -10.853 605 HG21 THR 91 HG21 THR 91 7.627 -14.852 -9.564 606 HG22 THR 91 HG22 THR 91 6.527 -15.893 -8.661 607 HG23 THR 91 HG23 THR 91 6.093 -14.213 -8.972 608 H GLY 92 HN GLY 92 4.790 -14.364 -13.934 609 HA2 GLY 92 HA2 GLY 92 6.574 -14.629 -15.910 610 HA3 GLY 92 HA1 GLY 92 6.498 -16.269 -15.281 611 H ASN 357 HT1 ASN 357 -16.481 -10.603 6.842 612 HA ASN 357 HA ASN 357 -13.840 -10.716 5.520 613 HB2 ASN 357 HB2 ASN 357 -14.135 -8.346 5.090 614 HB3 ASN 357 HB1 ASN 357 -15.473 -9.232 4.376 615 HD21 ASN 357 HD21 ASN 357 -15.333 -6.440 5.101 616 HD22 ASN 357 HD22 ASN 357 -16.603 -6.158 6.241 617 H ASN 358 HN ASN 358 -12.244 -9.358 6.591 618 HA ASN 358 HA ASN 358 -12.818 -9.067 9.456 619 HB2 ASN 358 HB2 ASN 358 -10.442 -9.606 9.919 620 HB3 ASN 358 HB1 ASN 358 -11.311 -10.940 9.175 621 HD21 ASN 358 HD21 ASN 358 -10.711 -11.659 7.164 622 HD22 ASN 358 HD22 ASN 358 -9.288 -11.108 6.350 623 H ARG 359 HN ARG 359 -12.503 -7.105 10.337 624 HA ARG 359 HA ARG 359 -10.884 -5.212 8.760 625 HB2 ARG 359 HB2 ARG 359 -12.316 -3.407 9.593 626 HB3 ARG 359 HB1 ARG 359 -13.260 -4.599 8.716 627 HG2 ARG 359 HG2 ARG 359 -14.123 -5.501 10.746 628 HG3 ARG 359 HG1 ARG 359 -13.018 -4.527 11.718 629 HD2 ARG 359 HD2 ARG 359 -15.119 -3.451 11.823 630 HD3 ARG 359 HD1 ARG 359 -14.135 -2.501 10.713 631 HE ARG 359 HE ARG 359 -15.864 -4.505 9.513 632 HH11 ARG 359 HH11 ARG 359 -15.386 -1.151 10.465 633 HH12 ARG 359 HH12 ARG 359 -16.641 -0.528 9.325 634 HH21 ARG 359 HH21 ARG 359 -17.451 -3.763 8.046 635 HH22 ARG 359 HH22 ARG 359 -17.783 -1.989 7.951 636 H ASP 360 HN ASP 360 -9.112 -4.553 9.725 637 HA ASP 360 HA ASP 360 -9.071 -4.276 12.630 638 HB2 ASP 360 HB2 ASP 360 -7.105 -5.409 12.963 639 HB3 ASP 360 HB1 ASP 360 -7.804 -6.355 11.656 640 HA PRO 361 HA PRO 361 -7.365 -0.403 11.332 641 HB2 PRO 361 HB2 PRO 361 -7.756 0.882 13.659 642 HB3 PRO 361 HB1 PRO 361 -9.113 0.345 12.660 643 HG2 PRO 361 HG2 PRO 361 -8.238 -0.673 15.254 644 HG3 PRO 361 HG1 PRO 361 -9.761 -0.954 14.394 645 HD2 PRO 361 HD2 PRO 361 -7.377 -2.646 14.508 646 HD3 PRO 361 HD1 PRO 361 -9.015 -3.035 13.939 647 H ILE 362 HN ILE 362 -5.417 0.348 11.158 648 HA ILE 362 HA ILE 362 -3.417 -0.146 13.261 649 HB ILE 362 HB ILE 362 -2.814 0.284 10.340 650 HG12 ILE 362 HG12 ILE 362 -2.811 -2.421 11.657 651 HG13 ILE 362 HG11 ILE 362 -4.250 -1.795 10.858 652 HG21 ILE 362 HG21 ILE 362 -1.178 -0.878 12.589 653 HG22 ILE 362 HG22 ILE 362 -0.975 0.716 11.862 654 HG23 ILE 362 HG23 ILE 362 -0.664 -0.735 10.909 655 HD11 ILE 362 HD11 ILE 362 -1.560 -2.230 9.584 656 HD12 ILE 362 HD12 ILE 362 -2.984 -1.572 8.778 657 HD13 ILE 362 HD13 ILE 362 -2.994 -3.235 9.369 658 H VAL 363 HN VAL 363 -2.341 1.599 14.048 659 HA VAL 363 HA VAL 363 -2.866 4.177 12.708 660 HB VAL 363 HB VAL 363 -2.334 3.716 15.651 661 HG11 VAL 363 HG11 VAL 363 -1.603 5.897 14.842 662 HG12 VAL 363 HG12 VAL 363 -2.989 6.046 15.919 663 HG13 VAL 363 HG13 VAL 363 -3.209 6.196 14.177 664 HG21 VAL 363 HG21 VAL 363 -4.703 4.256 16.006 665 HG22 VAL 363 HG22 VAL 363 -4.493 2.790 15.049 666 HG23 VAL 363 HG23 VAL 363 -4.940 4.298 14.258 667 H ILE 364 HN ILE 364 -1.125 5.165 11.976 668 HA ILE 364 HA ILE 364 1.509 4.470 13.085 669 HB ILE 364 HB ILE 364 0.868 5.095 10.191 670 HG12 ILE 364 HG12 ILE 364 1.859 2.523 11.441 671 HG13 ILE 364 HG11 ILE 364 0.197 2.822 10.945 672 HG21 ILE 364 HG21 ILE 364 3.539 4.128 11.112 673 HG22 ILE 364 HG22 ILE 364 3.141 5.842 11.249 674 HG23 ILE 364 HG23 ILE 364 3.107 5.051 9.671 675 HD11 ILE 364 HD11 ILE 364 1.464 1.473 9.327 676 HD12 ILE 364 HD12 ILE 364 2.577 2.823 9.102 677 HD13 ILE 364 HD13 ILE 364 0.884 2.988 8.636 678 H SER 365 HN SER 365 2.692 6.133 13.769 679 HA SER 365 HA SER 365 1.778 8.850 13.063 680 HB2 SER 365 HB2 SER 365 3.173 7.967 15.609 681 HB3 SER 365 HB1 SER 365 2.554 9.582 15.256 682 HG SER 365 HG SER 365 1.166 7.242 15.899 683 H ASP 366 HN ASP 366 3.220 10.133 12.094 684 HA ASP 366 HA ASP 366 6.036 9.294 12.116 685 HB2 ASP 366 HB2 ASP 366 4.491 9.240 9.888 686 HB3 ASP 366 HB1 ASP 366 5.108 10.890 9.803 687 H SER 367 HN SER 367 7.454 10.756 12.762 688 HA SER 367 HA SER 367 6.575 13.560 12.905 689 HB2 SER 367 HB2 SER 367 8.513 12.418 14.889 690 HB3 SER 367 HB1 SER 367 7.420 13.793 15.059 691 HG SER 367 HG SER 367 5.861 11.764 14.646 692 HA PRO 368 HA PRO 368 10.164 14.317 10.405 693 HB2 PRO 368 HB2 PRO 368 10.462 16.984 10.989 694 HB3 PRO 368 HB1 PRO 368 9.311 16.350 9.807 695 HG2 PRO 368 HG2 PRO 368 8.836 17.209 12.617 696 HG3 PRO 368 HG1 PRO 368 7.819 17.434 11.179 697 HD2 PRO 368 HD2 PRO 368 7.285 15.545 13.027 698 HD3 PRO 368 HD1 PRO 368 6.935 15.311 11.302 Start of MODEL 4 1 H ASP 16 HT1 ASP 16 -6.162 16.272 11.679 2 HA ASP 16 HA ASP 16 -6.066 14.335 13.894 3 HB2 ASP 16 HB2 ASP 16 -8.136 15.836 12.822 4 HB3 ASP 16 HB1 ASP 16 -8.319 14.272 12.035 5 H HIS 17 HN HIS 17 -6.832 12.121 13.111 6 HA HIS 17 HA HIS 17 -5.007 11.326 11.007 7 HB2 HIS 17 HB2 HIS 17 -6.683 9.783 12.977 8 HB3 HIS 17 HB1 HIS 17 -5.769 9.000 11.693 9 HD2 HIS 17 HD2 HIS 17 -3.055 8.830 12.071 10 HE1 HIS 17 HE1 HIS 17 -3.061 10.597 15.912 11 HE2 HIS 17 HE2 HIS 17 -1.767 9.141 14.297 12 H ILE 18 HN ILE 18 -5.719 9.648 9.435 13 HA ILE 18 HA ILE 18 -8.443 10.201 8.461 14 HB ILE 18 HB ILE 18 -6.729 11.330 7.079 15 HG12 ILE 18 HG12 ILE 18 -8.037 9.024 5.622 16 HG13 ILE 18 HG11 ILE 18 -8.864 10.503 6.101 17 HG21 ILE 18 HG21 ILE 18 -5.208 10.000 5.683 18 HG22 ILE 18 HG22 ILE 18 -5.727 8.540 6.529 19 HG23 ILE 18 HG23 ILE 18 -4.870 9.809 7.406 20 HD11 ILE 18 HD11 ILE 18 -6.545 10.317 4.194 21 HD12 ILE 18 HD12 ILE 18 -7.381 11.797 4.666 22 HD13 ILE 18 HD13 ILE 18 -8.237 10.551 3.757 23 H ASN 19 HN ASN 19 -9.588 8.472 7.593 24 HA ASN 19 HA ASN 19 -8.520 5.830 8.300 25 HB2 ASN 19 HB2 ASN 19 -11.333 6.738 7.644 26 HB3 ASN 19 HB1 ASN 19 -10.886 5.086 8.049 27 HD21 ASN 19 HD21 ASN 19 -11.288 8.323 9.237 28 HD22 ASN 19 HD22 ASN 19 -11.272 7.918 10.924 29 H LEU 20 HN LEU 20 -7.654 4.639 6.734 30 HA LEU 20 HA LEU 20 -8.735 4.914 4.002 31 HB2 LEU 20 HB2 LEU 20 -5.907 4.210 4.798 32 HB3 LEU 20 HB1 LEU 20 -6.511 4.346 3.157 33 HG LEU 20 HG LEU 20 -6.360 6.631 5.129 34 HD11 LEU 20 HD11 LEU 20 -4.595 5.989 2.774 35 HD12 LEU 20 HD12 LEU 20 -4.144 5.831 4.472 36 HD13 LEU 20 HD13 LEU 20 -4.491 7.422 3.795 37 HD21 LEU 20 HD21 LEU 20 -7.094 6.501 2.207 38 HD22 LEU 20 HD22 LEU 20 -6.731 7.995 3.068 39 HD23 LEU 20 HD23 LEU 20 -8.116 7.018 3.548 40 H LYS 21 HN LYS 21 -9.504 3.097 3.079 41 HA LYS 21 HA LYS 21 -9.314 0.612 4.599 42 HB2 LYS 21 HB2 LYS 21 -10.887 1.137 2.076 43 HB3 LYS 21 HB1 LYS 21 -11.064 -0.227 3.167 44 HG2 LYS 21 HG2 LYS 21 -12.062 1.115 4.834 45 HG3 LYS 21 HG1 LYS 21 -11.606 2.609 4.005 46 HD2 LYS 21 HD2 LYS 21 -13.071 2.028 2.139 47 HD3 LYS 21 HD1 LYS 21 -13.514 0.525 2.947 48 HE2 LYS 21 HE2 LYS 21 -14.842 1.574 4.472 49 HE3 LYS 21 HE1 LYS 21 -13.897 3.064 4.432 50 HZ1 LYS 21 HZ1 LYS 21 -16.164 3.178 3.399 51 HZ2 LYS 21 HZ2 LYS 21 -15.584 2.176 2.165 52 HZ3 LYS 21 HZ3 LYS 21 -14.895 3.702 2.413 53 H VAL 22 HN VAL 22 -7.893 -0.904 4.112 54 HA VAL 22 HA VAL 22 -6.852 -1.017 1.353 55 HB VAL 22 HB VAL 22 -5.416 -1.923 3.855 56 HG11 VAL 22 HG11 VAL 22 -4.780 -3.176 1.868 57 HG12 VAL 22 HG12 VAL 22 -3.468 -2.114 2.380 58 HG13 VAL 22 HG13 VAL 22 -4.474 -1.670 1.000 59 HG21 VAL 22 HG21 VAL 22 -3.943 0.018 3.466 60 HG22 VAL 22 HG22 VAL 22 -5.598 0.489 3.857 61 HG23 VAL 22 HG23 VAL 22 -5.031 0.557 2.187 62 H ALA 23 HN ALA 23 -7.957 -2.584 0.388 63 HA ALA 23 HA ALA 23 -8.346 -5.110 1.848 64 HB1 ALA 23 HB1 ALA 23 -10.351 -5.472 0.492 65 HB2 ALA 23 HB2 ALA 23 -10.093 -3.921 -0.307 66 HB3 ALA 23 HB3 ALA 23 -10.463 -3.974 1.417 67 H GLY 24 HN GLY 24 -7.873 -7.004 0.825 68 HA2 GLY 24 HA2 GLY 24 -6.154 -6.769 -1.523 69 HA3 GLY 24 HA1 GLY 24 -6.316 -8.180 -0.485 70 H GLN 25 HN GLN 25 -6.606 -9.571 -2.244 71 HA GLN 25 HA GLN 25 -8.956 -9.130 -3.934 72 HB2 GLN 25 HB2 GLN 25 -6.783 -11.233 -4.094 73 HB3 GLN 25 HB1 GLN 25 -8.095 -11.035 -5.250 74 HG2 GLN 25 HG2 GLN 25 -5.973 -8.982 -4.659 75 HG3 GLN 25 HG1 GLN 25 -5.979 -10.079 -6.040 76 HE21 GLN 25 HE21 GLN 25 -6.043 -7.137 -5.879 77 HE22 GLN 25 HE22 GLN 25 -7.438 -6.663 -6.788 78 H ASP 26 HN ASP 26 -8.704 -10.147 -1.002 79 HA ASP 26 HA ASP 26 -10.429 -12.496 -1.362 80 HB2 ASP 26 HB2 ASP 26 -9.709 -13.094 1.010 81 HB3 ASP 26 HB1 ASP 26 -8.498 -13.271 -0.251 82 H GLY 27 HN GLY 27 -10.143 -11.158 1.805 83 HA2 GLY 27 HA2 GLY 27 -12.550 -9.533 1.491 84 HA3 GLY 27 HA1 GLY 27 -12.683 -10.951 2.519 85 H SER 28 HN SER 28 -9.564 -9.770 2.732 86 HA SER 28 HA SER 28 -10.033 -8.793 5.388 87 HB2 SER 28 HB2 SER 28 -7.499 -8.238 5.175 88 HB3 SER 28 HB1 SER 28 -7.996 -9.929 5.183 89 HG SER 28 HG SER 28 -7.735 -10.015 2.974 90 H VAL 29 HN VAL 29 -10.569 -6.762 5.929 91 HA VAL 29 HA VAL 29 -9.784 -4.615 4.051 92 HB VAL 29 HB VAL 29 -12.301 -4.502 5.716 93 HG11 VAL 29 HG11 VAL 29 -12.905 -2.711 4.173 94 HG12 VAL 29 HG12 VAL 29 -11.397 -2.948 3.293 95 HG13 VAL 29 HG13 VAL 29 -11.362 -2.368 4.959 96 HG21 VAL 29 HG21 VAL 29 -13.563 -5.044 3.684 97 HG22 VAL 29 HG22 VAL 29 -12.531 -6.385 4.185 98 HG23 VAL 29 HG23 VAL 29 -12.050 -5.359 2.833 99 H VAL 30 HN VAL 30 -7.930 -4.198 5.298 100 HA VAL 30 HA VAL 30 -8.214 -3.597 8.101 101 HB VAL 30 HB VAL 30 -5.832 -3.053 8.067 102 HG11 VAL 30 HG11 VAL 30 -6.542 -5.591 6.597 103 HG12 VAL 30 HG12 VAL 30 -6.452 -5.370 8.342 104 HG13 VAL 30 HG13 VAL 30 -4.988 -5.272 7.364 105 HG21 VAL 30 HG21 VAL 30 -6.031 -3.515 5.093 106 HG22 VAL 30 HG22 VAL 30 -4.525 -3.346 5.996 107 HG23 VAL 30 HG23 VAL 30 -5.652 -1.992 5.904 108 H GLN 31 HN GLN 31 -8.038 -1.607 9.080 109 HA GLN 31 HA GLN 31 -8.630 0.670 7.309 110 HB2 GLN 31 HB2 GLN 31 -10.343 -0.001 9.043 111 HB3 GLN 31 HB1 GLN 31 -9.174 0.437 10.279 112 HG2 GLN 31 HG2 GLN 31 -10.291 2.387 10.208 113 HG3 GLN 31 HG1 GLN 31 -9.176 2.712 8.883 114 HE21 GLN 31 HE21 GLN 31 -11.769 3.849 9.328 115 HE22 GLN 31 HE22 GLN 31 -12.739 3.452 7.949 116 H PHE 32 HN PHE 32 -6.798 1.728 6.889 117 HA PHE 32 HA PHE 32 -4.722 1.925 8.910 118 HB2 PHE 32 HB2 PHE 32 -4.915 2.417 5.997 119 HB3 PHE 32 HB1 PHE 32 -3.782 3.433 6.883 120 HD1 PHE 32 HD1 PHE 32 -4.542 0.058 5.746 121 HD2 PHE 32 HD2 PHE 32 -1.842 2.465 7.985 122 HE1 PHE 32 HE1 PHE 32 -2.895 -1.768 5.713 123 HE2 PHE 32 HE2 PHE 32 -0.189 0.641 7.954 124 HZ PHE 32 HZ PHE 32 -0.718 -1.477 6.819 125 H LYS 33 HN LYS 33 -5.063 3.368 10.450 126 HA LYS 33 HA LYS 33 -6.289 5.938 9.736 127 HB2 LYS 33 HB2 LYS 33 -7.275 4.546 11.603 128 HB3 LYS 33 HB1 LYS 33 -5.799 4.836 12.512 129 HG2 LYS 33 HG2 LYS 33 -6.224 7.208 12.523 130 HG3 LYS 33 HG1 LYS 33 -7.650 6.987 11.508 131 HD2 LYS 33 HD2 LYS 33 -8.668 5.623 13.296 132 HD3 LYS 33 HD1 LYS 33 -7.256 5.932 14.308 133 HE2 LYS 33 HE2 LYS 33 -7.719 8.302 14.297 134 HE3 LYS 33 HE1 LYS 33 -9.057 8.068 13.176 135 HZ1 LYS 33 HZ1 LYS 33 -9.778 8.341 15.488 136 HZ2 LYS 33 HZ2 LYS 33 -8.931 6.945 15.918 137 HZ3 LYS 33 HZ3 LYS 33 -10.241 6.844 14.854 138 H ILE 34 HN ILE 34 -4.314 6.590 8.729 139 HA ILE 34 HA ILE 34 -2.140 7.234 10.598 140 HB ILE 34 HB ILE 34 -0.703 7.481 8.602 141 HG12 ILE 34 HG12 ILE 34 -3.027 6.318 7.049 142 HG13 ILE 34 HG11 ILE 34 -2.591 8.024 7.024 143 HG21 ILE 34 HG21 ILE 34 -0.537 5.094 8.067 144 HG22 ILE 34 HG22 ILE 34 -2.109 4.825 8.821 145 HG23 ILE 34 HG23 ILE 34 -0.745 5.372 9.797 146 HD11 ILE 34 HD11 ILE 34 -1.735 6.842 5.077 147 HD12 ILE 34 HD12 ILE 34 -0.830 5.754 6.128 148 HD13 ILE 34 HD13 ILE 34 -0.424 7.468 6.073 149 H LYS 35 HN LYS 35 -0.853 9.237 9.385 150 HA LYS 35 HA LYS 35 -2.804 11.402 9.564 151 HB2 LYS 35 HB2 LYS 35 0.218 11.510 9.439 152 HB3 LYS 35 HB1 LYS 35 -0.845 12.887 9.694 153 HG2 LYS 35 HG2 LYS 35 -1.676 11.777 11.760 154 HG3 LYS 35 HG1 LYS 35 -0.438 10.541 11.528 155 HD2 LYS 35 HD2 LYS 35 1.291 12.304 11.616 156 HD3 LYS 35 HD1 LYS 35 0.026 13.495 11.932 157 HE2 LYS 35 HE2 LYS 35 -0.604 12.162 13.950 158 HE3 LYS 35 HE1 LYS 35 0.822 11.164 13.665 159 HZ1 LYS 35 HZ1 LYS 35 2.163 13.224 13.824 160 HZ2 LYS 35 HZ2 LYS 35 1.367 12.823 15.260 161 HZ3 LYS 35 HZ3 LYS 35 0.764 14.066 14.281 162 H ARG 36 HN ARG 36 -2.758 13.162 7.991 163 HA ARG 36 HA ARG 36 -2.937 12.164 5.347 164 HB2 ARG 36 HB2 ARG 36 -2.832 15.065 6.175 165 HB3 ARG 36 HB1 ARG 36 -3.518 14.408 4.697 166 HG2 ARG 36 HG2 ARG 36 -5.059 13.084 6.330 167 HG3 ARG 36 HG1 ARG 36 -4.591 14.342 7.475 168 HD2 ARG 36 HD2 ARG 36 -6.473 15.273 6.567 169 HD3 ARG 36 HD1 ARG 36 -5.236 15.944 5.506 170 HE ARG 36 HE ARG 36 -5.866 13.864 4.080 171 HH11 ARG 36 HH11 ARG 36 -8.020 15.940 5.934 172 HH12 ARG 36 HH12 ARG 36 -9.456 15.551 4.910 173 HH21 ARG 36 HH21 ARG 36 -7.658 13.385 2.721 174 HH22 ARG 36 HH22 ARG 36 -9.260 14.141 3.112 175 H HIS 37 HN HIS 37 -0.319 13.418 7.142 176 HA HIS 37 HA HIS 37 1.220 13.882 4.685 177 HB2 HIS 37 HB2 HIS 37 2.885 14.943 6.385 178 HB3 HIS 37 HB1 HIS 37 1.451 15.840 5.905 179 HD2 HIS 37 HD2 HIS 37 -0.423 16.271 7.892 180 HE1 HIS 37 HE1 HIS 37 1.936 14.630 10.991 181 HE2 HIS 37 HE2 HIS 37 -0.029 16.134 10.451 182 H THR 38 HN THR 38 0.566 11.289 6.085 183 HA THR 38 HA THR 38 3.252 10.371 6.789 184 HB THR 38 HB THR 38 0.594 8.925 6.947 185 HG1 THR 38 HG1 THR 38 2.191 10.297 8.855 186 HG21 THR 38 HG21 THR 38 3.314 8.120 7.997 187 HG22 THR 38 HG22 THR 38 2.463 7.364 6.650 188 HG23 THR 38 HG23 THR 38 1.803 7.256 8.281 189 HA PRO 39 HA PRO 39 3.910 9.173 2.517 190 HB2 PRO 39 HB2 PRO 39 5.880 7.398 3.883 191 HB3 PRO 39 HB1 PRO 39 6.106 8.480 2.500 192 HG2 PRO 39 HG2 PRO 39 7.006 9.183 4.890 193 HG3 PRO 39 HG1 PRO 39 6.253 10.375 3.813 194 HD2 PRO 39 HD2 PRO 39 5.139 9.071 6.246 195 HD3 PRO 39 HD1 PRO 39 4.892 10.716 5.626 196 H LEU 40 HN LEU 40 2.826 7.733 1.373 197 HA LEU 40 HA LEU 40 1.454 5.562 2.566 198 HB2 LEU 40 HB2 LEU 40 1.926 6.301 -0.316 199 HB3 LEU 40 HB1 LEU 40 0.912 4.959 0.181 200 HG LEU 40 HG LEU 40 0.421 7.808 1.030 201 HD11 LEU 40 HD11 LEU 40 -1.387 7.780 -0.660 202 HD12 LEU 40 HD12 LEU 40 -0.743 6.259 -1.275 203 HD13 LEU 40 HD13 LEU 40 0.230 7.726 -1.363 204 HD21 LEU 40 HD21 LEU 40 -1.845 6.920 1.512 205 HD22 LEU 40 HD22 LEU 40 -0.585 6.194 2.507 206 HD23 LEU 40 HD23 LEU 40 -1.251 5.300 1.141 207 H SER 41 HN SER 41 4.618 5.883 1.461 208 HA SER 41 HA SER 41 5.204 3.339 0.465 209 HB2 SER 41 HB2 SER 41 7.458 4.238 1.882 210 HB3 SER 41 HB1 SER 41 7.119 4.487 0.167 211 HG SER 41 HG SER 41 7.038 6.523 0.685 212 H LYS 42 HN LYS 42 5.154 4.630 3.746 213 HA LYS 42 HA LYS 42 6.083 2.206 4.951 214 HB2 LYS 42 HB2 LYS 42 4.675 4.532 6.276 215 HB3 LYS 42 HB1 LYS 42 5.651 3.299 7.067 216 HG2 LYS 42 HG2 LYS 42 7.463 4.216 5.335 217 HG3 LYS 42 HG1 LYS 42 6.483 5.670 5.511 218 HD2 LYS 42 HD2 LYS 42 6.782 5.598 7.927 219 HD3 LYS 42 HD1 LYS 42 7.718 4.108 7.778 220 HE2 LYS 42 HE2 LYS 42 9.329 5.368 6.338 221 HE3 LYS 42 HE1 LYS 42 8.443 6.839 6.733 222 HZ1 LYS 42 HZ1 LYS 42 10.338 6.617 8.166 223 HZ2 LYS 42 HZ2 LYS 42 9.859 5.068 8.650 224 HZ3 LYS 42 HZ3 LYS 42 8.928 6.420 9.088 225 H LEU 43 HN LEU 43 3.031 3.516 4.016 226 HA LEU 43 HA LEU 43 1.371 1.857 5.620 227 HB2 LEU 43 HB2 LEU 43 0.504 3.898 4.614 228 HB3 LEU 43 HB1 LEU 43 0.849 3.292 3.008 229 HG LEU 43 HG LEU 43 -1.000 1.658 4.652 230 HD11 LEU 43 HD11 LEU 43 -2.901 3.120 4.062 231 HD12 LEU 43 HD12 LEU 43 -1.756 4.345 3.516 232 HD13 LEU 43 HD13 LEU 43 -1.795 3.866 5.214 233 HD21 LEU 43 HD21 LEU 43 -1.058 2.593 1.783 234 HD22 LEU 43 HD22 LEU 43 -2.130 1.397 2.510 235 HD23 LEU 43 HD23 LEU 43 -0.408 1.052 2.346 236 H MET 44 HN MET 44 2.581 1.678 2.300 237 HA MET 44 HA MET 44 1.369 -0.770 1.612 238 HB2 MET 44 HB2 MET 44 3.931 0.456 0.565 239 HB3 MET 44 HB1 MET 44 3.070 -0.879 -0.187 240 HG2 MET 44 HG2 MET 44 1.094 0.663 -0.396 241 HG3 MET 44 HG1 MET 44 2.169 1.973 0.094 242 HE1 MET 44 HE1 MET 44 4.387 2.621 -1.281 243 HE2 MET 44 HE2 MET 44 4.826 1.891 -2.825 244 HE3 MET 44 HE3 MET 44 4.914 0.940 -1.342 245 H LYS 45 HN LYS 45 4.521 0.024 3.000 246 HA LYS 45 HA LYS 45 5.513 -2.619 3.045 247 HB2 LYS 45 HB2 LYS 45 6.263 -0.122 4.556 248 HB3 LYS 45 HB1 LYS 45 7.084 -1.653 4.831 249 HG2 LYS 45 HG2 LYS 45 7.789 -1.734 2.521 250 HG3 LYS 45 HG1 LYS 45 6.876 -0.269 2.162 251 HD2 LYS 45 HD2 LYS 45 8.311 0.955 3.783 252 HD3 LYS 45 HD1 LYS 45 9.269 -0.514 3.984 253 HE2 LYS 45 HE2 LYS 45 9.820 -0.490 1.603 254 HE3 LYS 45 HE1 LYS 45 8.843 0.960 1.385 255 HZ1 LYS 45 HZ1 LYS 45 10.392 1.970 3.132 256 HZ2 LYS 45 HZ2 LYS 45 10.995 1.752 1.570 257 HZ3 LYS 45 HZ3 LYS 45 11.418 0.668 2.791 258 H ALA 46 HN ALA 46 3.617 -0.733 5.343 259 HA ALA 46 HA ALA 46 3.820 -2.412 7.568 260 HB1 ALA 46 HB1 ALA 46 2.834 -0.187 7.685 261 HB2 ALA 46 HB2 ALA 46 1.729 -1.399 8.330 262 HB3 ALA 46 HB3 ALA 46 1.463 -0.730 6.720 263 H TYR 47 HN TYR 47 1.484 -2.448 4.896 264 HA TYR 47 HA TYR 47 0.058 -4.716 5.864 265 HB2 TYR 47 HB2 TYR 47 -0.823 -2.998 4.222 266 HB3 TYR 47 HB1 TYR 47 0.193 -3.755 3.000 267 HD1 TYR 47 HD1 TYR 47 -0.757 -5.395 1.663 268 HD2 TYR 47 HD2 TYR 47 -2.414 -4.686 5.516 269 HE1 TYR 47 HE1 TYR 47 -2.540 -7.020 1.189 270 HE2 TYR 47 HE2 TYR 47 -4.202 -6.310 5.053 271 HH TYR 47 HH TYR 47 -5.316 -7.338 3.164 272 H CYS 48 HN CYS 48 2.760 -4.218 3.690 273 HA CYS 48 HA CYS 48 2.937 -6.798 2.611 274 HB2 CYS 48 HB2 CYS 48 4.141 -4.691 1.859 275 HB3 CYS 48 HB1 CYS 48 5.281 -4.985 3.166 276 HG CYS 48 HG CYS 48 6.534 -7.071 2.108 277 H GLU 49 HN GLU 49 4.466 -5.375 5.484 278 HA GLU 49 HA GLU 49 6.032 -7.579 6.219 279 HB2 GLU 49 HB2 GLU 49 4.745 -5.466 7.958 280 HB3 GLU 49 HB1 GLU 49 5.977 -6.594 8.508 281 HG2 GLU 49 HG2 GLU 49 6.345 -4.594 6.293 282 HG3 GLU 49 HG1 GLU 49 6.852 -4.352 7.963 283 H ARG 50 HN ARG 50 2.663 -6.818 6.816 284 HA ARG 50 HA ARG 50 2.170 -8.833 8.736 285 HB2 ARG 50 HB2 ARG 50 0.402 -7.260 6.889 286 HB3 ARG 50 HB1 ARG 50 -0.251 -8.516 7.935 287 HG2 ARG 50 HG2 ARG 50 0.474 -7.368 9.888 288 HG3 ARG 50 HG1 ARG 50 1.372 -6.193 8.924 289 HD2 ARG 50 HD2 ARG 50 -0.558 -5.164 8.150 290 HD3 ARG 50 HD1 ARG 50 -1.567 -6.558 8.534 291 HE ARG 50 HE ARG 50 -0.348 -5.174 10.778 292 HH11 ARG 50 HH11 ARG 50 -3.158 -5.686 8.742 293 HH12 ARG 50 HH12 ARG 50 -4.313 -5.010 9.958 294 HH21 ARG 50 HH21 ARG 50 -3.539 -4.283 11.993 295 HH22 ARG 50 HH22 ARG 50 -1.764 -4.366 12.365 296 H GLN 51 HN GLN 51 1.851 -8.754 5.212 297 HA GLN 51 HA GLN 51 0.793 -11.409 5.045 298 HB2 GLN 51 HB2 GLN 51 2.180 -9.906 2.828 299 HB3 GLN 51 HB1 GLN 51 0.981 -11.181 2.677 300 HG2 GLN 51 HG2 GLN 51 0.533 -8.367 3.636 301 HG3 GLN 51 HG1 GLN 51 -0.032 -9.084 2.131 302 HE21 GLN 51 HE21 GLN 51 -1.721 -10.610 2.211 303 HE22 GLN 51 HE22 GLN 51 -2.808 -10.668 3.551 304 H GLY 52 HN GLY 52 3.906 -10.065 5.425 305 HA2 GLY 52 HA2 GLY 52 5.934 -11.087 5.785 306 HA3 GLY 52 HA1 GLY 52 5.124 -12.641 5.644 307 H LEU 53 HN LEU 53 5.116 -10.104 3.214 308 HA LEU 53 HA LEU 53 6.711 -11.862 1.467 309 HB2 LEU 53 HB2 LEU 53 4.509 -10.008 0.568 310 HB3 LEU 53 HB1 LEU 53 5.375 -11.175 -0.413 311 HG LEU 53 HG LEU 53 3.602 -11.960 1.895 312 HD11 LEU 53 HD11 LEU 53 1.859 -12.407 0.313 313 HD12 LEU 53 HD12 LEU 53 2.890 -11.917 -1.031 314 HD13 LEU 53 HD13 LEU 53 2.350 -10.723 0.148 315 HD21 LEU 53 HD21 LEU 53 5.254 -13.623 1.234 316 HD22 LEU 53 HD22 LEU 53 4.711 -13.513 -0.440 317 HD23 LEU 53 HD23 LEU 53 3.627 -14.145 0.799 318 H SER 54 HN SER 54 7.293 -10.374 -0.602 319 HA SER 54 HA SER 54 8.868 -8.188 0.517 320 HB2 SER 54 HB2 SER 54 10.020 -9.861 -0.887 321 HB3 SER 54 HB1 SER 54 8.949 -9.471 -2.229 322 HG SER 54 HG SER 54 11.214 -8.388 -1.825 323 H MET 55 HN MET 55 8.680 -6.062 -0.185 324 HA MET 55 HA MET 55 6.119 -5.223 -1.049 325 HB2 MET 55 HB2 MET 55 7.840 -3.927 0.361 326 HB3 MET 55 HB1 MET 55 8.585 -3.502 -1.175 327 HG2 MET 55 HG2 MET 55 6.261 -2.660 -1.848 328 HG3 MET 55 HG1 MET 55 5.881 -2.749 -0.129 329 HE1 MET 55 HE1 MET 55 7.793 -0.917 -2.954 330 HE2 MET 55 HE2 MET 55 9.151 -1.683 -2.126 331 HE3 MET 55 HE3 MET 55 8.964 0.069 -2.077 332 H ARG 56 HN ARG 56 8.880 -6.259 -2.741 333 HA ARG 56 HA ARG 56 8.224 -4.850 -5.189 334 HB2 ARG 56 HB2 ARG 56 10.549 -6.013 -4.143 335 HB3 ARG 56 HB1 ARG 56 10.114 -7.012 -5.523 336 HG2 ARG 56 HG2 ARG 56 10.074 -5.044 -6.954 337 HG3 ARG 56 HG1 ARG 56 10.475 -4.024 -5.572 338 HD2 ARG 56 HD2 ARG 56 12.507 -4.377 -6.702 339 HD3 ARG 56 HD1 ARG 56 12.554 -5.447 -5.305 340 HE ARG 56 HE ARG 56 11.755 -7.208 -6.981 341 HH11 ARG 56 HH11 ARG 56 14.663 -5.371 -9.126 342 HH12 ARG 56 HH12 ARG 56 13.864 -4.495 -7.768 343 HH21 ARG 56 HH21 ARG 56 14.059 -7.517 -9.631 344 HH22 ARG 56 HH22 ARG 56 12.773 -8.347 -8.676 345 H GLN 57 HN GLN 57 6.961 -7.419 -3.622 346 HA GLN 57 HA GLN 57 6.468 -9.048 -6.001 347 HB2 GLN 57 HB2 GLN 57 7.133 -10.225 -3.981 348 HB3 GLN 57 HB1 GLN 57 5.807 -9.497 -3.086 349 HG2 GLN 57 HG2 GLN 57 4.257 -10.656 -4.717 350 HG3 GLN 57 HG1 GLN 57 5.670 -11.559 -5.265 351 HE21 GLN 57 HE21 GLN 57 3.248 -12.512 -3.968 352 HE22 GLN 57 HE22 GLN 57 3.769 -13.320 -2.527 353 H ILE 58 HN ILE 58 4.749 -7.119 -3.588 354 HA ILE 58 HA ILE 58 2.246 -7.541 -5.050 355 HB ILE 58 HB ILE 58 1.253 -6.225 -3.090 356 HG12 ILE 58 HG12 ILE 58 3.951 -6.922 -1.907 357 HG13 ILE 58 HG11 ILE 58 3.367 -5.297 -2.246 358 HG21 ILE 58 HG21 ILE 58 0.935 -8.605 -3.367 359 HG22 ILE 58 HG22 ILE 58 1.204 -8.232 -1.664 360 HG23 ILE 58 HG23 ILE 58 2.505 -8.929 -2.631 361 HD11 ILE 58 HD11 ILE 58 2.225 -7.229 -0.240 362 HD12 ILE 58 HD12 ILE 58 1.559 -5.639 -0.609 363 HD13 ILE 58 HD13 ILE 58 3.165 -5.777 0.105 364 H ARG 59 HN ARG 59 0.835 -5.650 -5.396 365 HA ARG 59 HA ARG 59 2.344 -3.163 -5.860 366 HB2 ARG 59 HB2 ARG 59 0.425 -4.493 -7.787 367 HB3 ARG 59 HB1 ARG 59 1.067 -2.869 -7.982 368 HG2 ARG 59 HG2 ARG 59 2.714 -5.389 -7.907 369 HG3 ARG 59 HG1 ARG 59 2.230 -4.527 -9.368 370 HD2 ARG 59 HD2 ARG 59 3.452 -2.543 -8.584 371 HD3 ARG 59 HD1 ARG 59 3.948 -3.429 -7.142 372 HE ARG 59 HE ARG 59 4.999 -3.715 -9.822 373 HH11 ARG 59 HH11 ARG 59 6.178 -6.153 -6.810 374 HH12 ARG 59 HH12 ARG 59 4.764 -5.053 -6.566 375 HH21 ARG 59 HH21 ARG 59 6.837 -5.043 -10.125 376 HH22 ARG 59 HH22 ARG 59 7.340 -6.135 -8.778 377 H PHE 60 HN PHE 60 1.199 -1.279 -5.531 378 HA PHE 60 HA PHE 60 -1.557 -1.592 -4.534 379 HB2 PHE 60 HB2 PHE 60 0.650 0.220 -3.547 380 HB3 PHE 60 HB1 PHE 60 -1.038 0.450 -3.116 381 HD1 PHE 60 HD1 PHE 60 1.754 -1.981 -2.928 382 HD2 PHE 60 HD2 PHE 60 -1.984 -0.717 -1.336 383 HE1 PHE 60 HE1 PHE 60 2.024 -3.552 -1.056 384 HE2 PHE 60 HE2 PHE 60 -1.721 -2.288 0.538 385 HZ PHE 60 HZ PHE 60 0.286 -3.708 0.679 386 H ARG 61 HN ARG 61 -3.075 -0.263 -5.350 387 HA ARG 61 HA ARG 61 -2.184 1.939 -7.090 388 HB2 ARG 61 HB2 ARG 61 -4.333 -0.095 -7.711 389 HB3 ARG 61 HB1 ARG 61 -4.064 1.374 -8.635 390 HG2 ARG 61 HG2 ARG 61 -1.785 0.570 -9.170 391 HG3 ARG 61 HG1 ARG 61 -2.162 -0.940 -8.335 392 HD2 ARG 61 HD2 ARG 61 -4.159 -1.125 -9.884 393 HD3 ARG 61 HD1 ARG 61 -3.438 0.186 -10.814 394 HE ARG 61 HE ARG 61 -1.426 -1.607 -10.661 395 HH11 ARG 61 HH11 ARG 61 -4.525 -3.187 -12.736 396 HH12 ARG 61 HH12 ARG 61 -4.806 -1.830 -11.585 397 HH21 ARG 61 HH21 ARG 61 -1.021 -3.333 -12.133 398 HH22 ARG 61 HH22 ARG 61 -2.417 -4.043 -13.033 399 H PHE 62 HN PHE 62 -3.530 3.711 -7.197 400 HA PHE 62 HA PHE 62 -5.818 3.736 -5.346 401 HB2 PHE 62 HB2 PHE 62 -4.076 4.989 -4.254 402 HB3 PHE 62 HB1 PHE 62 -3.688 5.852 -5.739 403 HD1 PHE 62 HD1 PHE 62 -6.543 5.296 -3.400 404 HD2 PHE 62 HD2 PHE 62 -4.544 7.969 -6.049 405 HE1 PHE 62 HE1 PHE 62 -8.103 7.089 -2.768 406 HE2 PHE 62 HE2 PHE 62 -6.103 9.762 -5.416 407 HZ PHE 62 HZ PHE 62 -7.885 9.325 -3.773 408 H ASP 63 HN ASP 63 -7.614 4.051 -6.445 409 HA ASP 63 HA ASP 63 -9.140 4.801 -7.947 410 HB2 ASP 63 HB2 ASP 63 -8.081 7.033 -7.207 411 HB3 ASP 63 HB1 ASP 63 -7.232 6.992 -8.749 412 H GLY 64 HN GLY 64 -6.574 3.204 -8.712 413 HA2 GLY 64 HA2 GLY 64 -6.716 1.848 -10.748 414 HA3 GLY 64 HA1 GLY 64 -7.075 3.330 -11.619 415 H GLN 65 HN GLN 65 -4.962 4.749 -9.982 416 HA GLN 65 HA GLN 65 -2.733 3.936 -11.692 417 HB2 GLN 65 HB2 GLN 65 -3.422 6.465 -10.239 418 HB3 GLN 65 HB1 GLN 65 -1.769 6.166 -10.764 419 HG2 GLN 65 HG2 GLN 65 -4.215 6.300 -12.511 420 HG3 GLN 65 HG1 GLN 65 -2.920 7.492 -12.404 421 HE21 GLN 65 HE21 GLN 65 -0.898 7.008 -13.297 422 HE22 GLN 65 HE22 GLN 65 -0.700 5.746 -14.463 423 HA PRO 66 HA PRO 66 -0.538 2.035 -8.346 424 HB2 PRO 66 HB2 PRO 66 1.925 2.818 -9.774 425 HB3 PRO 66 HB1 PRO 66 1.335 1.205 -9.352 426 HG2 PRO 66 HG2 PRO 66 1.298 2.057 -11.878 427 HG3 PRO 66 HG1 PRO 66 0.002 1.035 -11.223 428 HD2 PRO 66 HD2 PRO 66 0.014 3.984 -11.705 429 HD3 PRO 66 HD1 PRO 66 -1.274 2.797 -11.992 430 H ILE 67 HN ILE 67 0.442 2.638 -6.483 431 HA ILE 67 HA ILE 67 0.830 5.484 -6.047 432 HB ILE 67 HB ILE 67 0.917 3.156 -4.119 433 HG12 ILE 67 HG12 ILE 67 -1.225 5.256 -4.512 434 HG13 ILE 67 HG11 ILE 67 -1.297 3.635 -5.194 435 HG21 ILE 67 HG21 ILE 67 0.880 6.119 -3.552 436 HG22 ILE 67 HG22 ILE 67 2.260 5.043 -3.326 437 HG23 ILE 67 HG23 ILE 67 0.807 4.830 -2.348 438 HD11 ILE 67 HD11 ILE 67 -1.148 4.275 -2.258 439 HD12 ILE 67 HD12 ILE 67 -1.335 2.674 -2.978 440 HD13 ILE 67 HD13 ILE 67 -2.620 3.871 -3.142 441 H ASN 68 HN ASN 68 2.745 6.478 -5.666 442 HA ASN 68 HA ASN 68 5.176 4.927 -6.116 443 HB2 ASN 68 HB2 ASN 68 4.734 7.910 -5.851 444 HB3 ASN 68 HB1 ASN 68 6.284 7.154 -6.201 445 HD21 ASN 68 HD21 ASN 68 3.130 7.934 -7.404 446 HD22 ASN 68 HD22 ASN 68 3.471 7.616 -9.076 447 H GLU 69 HN GLU 69 7.075 5.316 -4.736 448 HA GLU 69 HA GLU 69 6.424 4.918 -1.996 449 HB2 GLU 69 HB2 GLU 69 9.061 5.340 -3.401 450 HB3 GLU 69 HB1 GLU 69 8.925 4.996 -1.682 451 HG2 GLU 69 HG2 GLU 69 7.777 2.879 -2.238 452 HG3 GLU 69 HG1 GLU 69 8.046 3.218 -3.949 453 H THR 70 HN THR 70 6.731 7.720 -3.816 454 HA THR 70 HA THR 70 7.434 9.322 -1.454 455 HB THR 70 HB THR 70 7.406 11.088 -3.537 456 HG1 THR 70 HG1 THR 70 7.715 10.050 -5.353 457 HG21 THR 70 HG21 THR 70 9.159 10.836 -1.829 458 HG22 THR 70 HG22 THR 70 9.843 10.958 -3.450 459 HG23 THR 70 HG23 THR 70 9.743 9.388 -2.652 460 H ASP 71 HN ASP 71 4.759 8.130 -2.675 461 HA ASP 71 HA ASP 71 3.204 10.564 -2.932 462 HB2 ASP 71 HB2 ASP 71 2.652 7.656 -3.331 463 HB3 ASP 71 HB1 ASP 71 1.297 8.740 -3.029 464 H THR 72 HN THR 72 1.487 11.126 -1.599 465 HA THR 72 HA THR 72 1.360 9.828 1.029 466 HB THR 72 HB THR 72 1.007 12.345 1.826 467 HG1 THR 72 HG1 THR 72 2.963 12.707 -0.196 468 HG21 THR 72 HG21 THR 72 3.385 12.442 2.454 469 HG22 THR 72 HG22 THR 72 3.723 11.118 1.338 470 HG23 THR 72 HG23 THR 72 2.692 10.846 2.743 471 HA PRO 73 HA PRO 73 -3.049 10.070 0.669 472 HB2 PRO 73 HB2 PRO 73 -3.116 11.558 3.248 473 HB3 PRO 73 HB1 PRO 73 -3.961 10.075 2.780 474 HG2 PRO 73 HG2 PRO 73 -1.881 9.965 4.420 475 HG3 PRO 73 HG1 PRO 73 -2.130 8.726 3.170 476 HD2 PRO 73 HD2 PRO 73 -0.199 11.000 3.217 477 HD3 PRO 73 HD1 PRO 73 0.003 9.357 2.577 478 H ALA 74 HN ALA 74 -1.491 13.011 1.878 479 HA ALA 74 HA ALA 74 -3.541 14.795 1.054 480 HB1 ALA 74 HB1 ALA 74 -1.914 16.549 1.513 481 HB2 ALA 74 HB2 ALA 74 -0.628 15.347 1.609 482 HB3 ALA 74 HB3 ALA 74 -1.924 15.352 2.806 483 H GLN 75 HN GLN 75 -0.478 13.766 -0.401 484 HA GLN 75 HA GLN 75 -0.501 15.496 -2.615 485 HB2 GLN 75 HB2 GLN 75 1.455 14.165 -1.821 486 HB3 GLN 75 HB1 GLN 75 0.687 12.721 -2.462 487 HG2 GLN 75 HG2 GLN 75 2.368 13.507 -3.986 488 HG3 GLN 75 HG1 GLN 75 0.772 13.692 -4.711 489 HE21 GLN 75 HE21 GLN 75 1.607 15.240 -6.142 490 HE22 GLN 75 HE22 GLN 75 1.937 16.856 -5.626 491 H LEU 76 HN LEU 76 -1.827 12.243 -2.177 492 HA LEU 76 HA LEU 76 -2.827 12.196 -4.902 493 HB2 LEU 76 HB2 LEU 76 -3.000 10.253 -2.610 494 HB3 LEU 76 HB1 LEU 76 -3.830 9.992 -4.131 495 HG LEU 76 HG LEU 76 -0.842 10.207 -3.752 496 HD11 LEU 76 HD11 LEU 76 -2.592 7.861 -4.482 497 HD12 LEU 76 HD12 LEU 76 -1.791 8.109 -2.929 498 HD13 LEU 76 HD13 LEU 76 -0.830 7.852 -4.386 499 HD21 LEU 76 HD21 LEU 76 -1.390 11.135 -5.882 500 HD22 LEU 76 HD22 LEU 76 -2.519 9.824 -6.227 501 HD23 LEU 76 HD23 LEU 76 -0.788 9.499 -6.150 502 H GLU 77 HN GLU 77 -3.813 13.744 -2.241 503 HA GLU 77 HA GLU 77 -5.743 14.636 -1.466 504 HB2 GLU 77 HB2 GLU 77 -6.571 14.104 -4.315 505 HB3 GLU 77 HB1 GLU 77 -7.527 15.044 -3.177 506 HG2 GLU 77 HG2 GLU 77 -5.194 16.330 -2.950 507 HG3 GLU 77 HG1 GLU 77 -5.047 15.748 -4.609 508 H MET 78 HN MET 78 -5.410 12.013 -0.782 509 HA MET 78 HA MET 78 -7.799 10.494 -1.306 510 HB2 MET 78 HB2 MET 78 -5.687 10.041 0.811 511 HB3 MET 78 HB1 MET 78 -6.880 8.874 0.256 512 HG2 MET 78 HG2 MET 78 -5.850 8.736 -1.891 513 HG3 MET 78 HG1 MET 78 -4.772 10.078 -1.511 514 HE1 MET 78 HE1 MET 78 -5.606 6.343 -1.066 515 HE2 MET 78 HE2 MET 78 -5.840 6.873 0.600 516 HE3 MET 78 HE3 MET 78 -4.492 5.812 0.193 517 H GLU 79 HN GLU 79 -9.562 10.250 0.001 518 HA GLU 79 HA GLU 79 -9.690 12.113 2.275 519 HB2 GLU 79 HB2 GLU 79 -11.813 11.142 0.378 520 HB3 GLU 79 HB1 GLU 79 -12.206 11.936 1.895 521 HG2 GLU 79 HG2 GLU 79 -10.562 13.118 -0.329 522 HG3 GLU 79 HG1 GLU 79 -12.252 13.483 0.011 523 H ASP 80 HN ASP 80 -11.655 11.357 3.749 524 HA ASP 80 HA ASP 80 -10.712 9.026 5.063 525 HB2 ASP 80 HB2 ASP 80 -11.965 11.125 5.999 526 HB3 ASP 80 HB1 ASP 80 -13.412 10.208 5.597 527 H GLU 81 HN GLU 81 -11.555 7.010 5.199 528 HA GLU 81 HA GLU 81 -12.719 5.141 4.697 529 HB2 GLU 81 HB2 GLU 81 -14.784 7.125 3.754 530 HB3 GLU 81 HB1 GLU 81 -15.032 5.386 3.673 531 HG2 GLU 81 HG2 GLU 81 -14.367 6.810 6.233 532 HG3 GLU 81 HG1 GLU 81 -16.019 6.578 5.665 533 H ASP 82 HN ASP 82 -10.930 6.644 2.753 534 HA ASP 82 HA ASP 82 -11.875 5.977 0.137 535 HB2 ASP 82 HB2 ASP 82 -9.711 7.456 1.186 536 HB3 ASP 82 HB1 ASP 82 -9.001 6.163 0.221 537 H THR 83 HN THR 83 -10.319 4.534 -1.297 538 HA THR 83 HA THR 83 -9.665 2.105 0.231 539 HB THR 83 HB THR 83 -10.994 1.905 -2.455 540 HG1 THR 83 HG1 THR 83 -12.114 2.827 -0.177 541 HG21 THR 83 HG21 THR 83 -11.629 -0.306 -1.638 542 HG22 THR 83 HG22 THR 83 -10.889 0.043 -0.075 543 HG23 THR 83 HG23 THR 83 -9.883 -0.086 -1.517 544 H ILE 84 HN ILE 84 -7.906 0.996 -0.403 545 HA ILE 84 HA ILE 84 -6.435 2.002 -2.752 546 HB ILE 84 HB ILE 84 -5.288 0.655 -0.293 547 HG12 ILE 84 HG12 ILE 84 -5.166 3.564 -1.122 548 HG13 ILE 84 HG11 ILE 84 -6.172 2.924 0.169 549 HG21 ILE 84 HG21 ILE 84 -3.114 1.313 -1.204 550 HG22 ILE 84 HG22 ILE 84 -3.912 1.981 -2.627 551 HG23 ILE 84 HG23 ILE 84 -3.980 0.247 -2.314 552 HD11 ILE 84 HD11 ILE 84 -3.174 3.040 0.075 553 HD12 ILE 84 HD12 ILE 84 -4.083 2.168 1.309 554 HD13 ILE 84 HD13 ILE 84 -4.256 3.916 1.156 555 H ASP 85 HN ASP 85 -5.882 0.559 -4.312 556 HA ASP 85 HA ASP 85 -6.985 -2.126 -4.096 557 HB2 ASP 85 HB2 ASP 85 -5.757 -0.587 -6.384 558 HB3 ASP 85 HB1 ASP 85 -6.250 -2.269 -6.520 559 H VAL 86 HN VAL 86 -5.830 -3.985 -4.013 560 HA VAL 86 HA VAL 86 -2.889 -3.760 -4.007 561 HB VAL 86 HB VAL 86 -4.501 -5.747 -2.396 562 HG11 VAL 86 HG11 VAL 86 -2.362 -6.129 -1.235 563 HG12 VAL 86 HG12 VAL 86 -1.571 -5.032 -2.369 564 HG13 VAL 86 HG13 VAL 86 -2.283 -6.540 -2.948 565 HG21 VAL 86 HG21 VAL 86 -3.892 -4.415 -0.423 566 HG22 VAL 86 HG22 VAL 86 -4.917 -3.514 -1.540 567 HG23 VAL 86 HG23 VAL 86 -3.185 -3.194 -1.480 568 H PHE 87 HN PHE 87 -1.884 -4.940 -5.489 569 HA PHE 87 HA PHE 87 -3.264 -7.297 -6.605 570 HB2 PHE 87 HB2 PHE 87 -1.755 -5.131 -8.072 571 HB3 PHE 87 HB1 PHE 87 -2.081 -6.707 -8.788 572 HD1 PHE 87 HD1 PHE 87 -4.353 -7.364 -9.363 573 HD2 PHE 87 HD2 PHE 87 -3.496 -3.513 -7.770 574 HE1 PHE 87 HE1 PHE 87 -6.567 -6.574 -10.093 575 HE2 PHE 87 HE2 PHE 87 -5.705 -2.716 -8.495 576 HZ PHE 87 HZ PHE 87 -7.246 -4.247 -9.658 577 H GLN 88 HN GLN 88 -1.617 -8.680 -7.892 578 HA GLN 88 HA GLN 88 0.904 -8.818 -6.364 579 HB2 GLN 88 HB2 GLN 88 -0.917 -11.025 -7.313 580 HB3 GLN 88 HB1 GLN 88 0.763 -11.325 -6.895 581 HG2 GLN 88 HG2 GLN 88 -0.626 -9.843 -4.830 582 HG3 GLN 88 HG1 GLN 88 -1.399 -11.386 -5.185 583 HE21 GLN 88 HE21 GLN 88 -0.812 -12.204 -3.171 584 HE22 GLN 88 HE22 GLN 88 0.806 -12.686 -2.811 585 H GLN 89 HN GLN 89 2.773 -9.334 -7.492 586 HA GLN 89 HA GLN 89 2.719 -8.669 -10.294 587 HB2 GLN 89 HB2 GLN 89 4.496 -7.896 -8.700 588 HB3 GLN 89 HB1 GLN 89 5.065 -9.556 -8.605 589 HG2 GLN 89 HG2 GLN 89 6.415 -8.235 -10.130 590 HG3 GLN 89 HG1 GLN 89 5.580 -9.532 -10.981 591 HE21 GLN 89 HE21 GLN 89 5.667 -8.541 -12.964 592 HE22 GLN 89 HE22 GLN 89 4.728 -7.137 -13.348 593 H GLN 90 HN GLN 90 3.151 -9.998 -12.004 594 HA GLN 90 HA GLN 90 2.502 -12.747 -11.747 595 HB2 GLN 90 HB2 GLN 90 3.696 -11.209 -14.063 596 HB3 GLN 90 HB1 GLN 90 3.133 -12.871 -14.163 597 HG2 GLN 90 HG2 GLN 90 1.395 -11.586 -15.047 598 HG3 GLN 90 HG1 GLN 90 0.871 -11.993 -13.414 599 HE21 GLN 90 HE21 GLN 90 -0.564 -10.241 -13.428 600 HE22 GLN 90 HE22 GLN 90 -0.012 -8.613 -13.233 601 H THR 91 HN THR 91 3.820 -14.582 -12.020 602 HA THR 91 HA THR 91 6.388 -14.421 -10.874 603 HB THR 91 HB THR 91 5.322 -16.735 -12.487 604 HG1 THR 91 HG1 THR 91 4.839 -15.968 -9.780 605 HG21 THR 91 HG21 THR 91 7.184 -16.717 -10.112 606 HG22 THR 91 HG22 THR 91 7.734 -16.747 -11.787 607 HG23 THR 91 HG23 THR 91 6.779 -18.083 -11.149 608 H GLY 92 HN GLY 92 5.376 -15.052 -14.244 609 HA2 GLY 92 HA2 GLY 92 8.017 -14.088 -15.093 610 HA3 GLY 92 HA1 GLY 92 7.445 -15.643 -15.680 611 H ASN 357 HT1 ASN 357 -16.093 -10.369 6.748 612 HA ASN 357 HA ASN 357 -13.416 -9.888 5.603 613 HB2 ASN 357 HB2 ASN 357 -14.175 -7.602 5.288 614 HB3 ASN 357 HB1 ASN 357 -15.288 -8.694 4.477 615 HD21 ASN 357 HD21 ASN 357 -15.508 -5.919 5.634 616 HD22 ASN 357 HD22 ASN 357 -16.925 -5.983 6.627 617 H ASN 358 HN ASN 358 -11.949 -8.887 6.917 618 HA ASN 358 HA ASN 358 -12.846 -8.384 9.667 619 HB2 ASN 358 HB2 ASN 358 -10.815 -9.240 10.543 620 HB3 ASN 358 HB1 ASN 358 -11.364 -10.416 9.360 621 HD21 ASN 358 HD21 ASN 358 -8.741 -8.873 10.487 622 HD22 ASN 358 HD22 ASN 358 -7.721 -8.953 9.094 623 H ARG 359 HN ARG 359 -12.456 -6.425 10.512 624 HA ARG 359 HA ARG 359 -10.532 -4.760 9.034 625 HB2 ARG 359 HB2 ARG 359 -11.883 -2.835 9.337 626 HB3 ARG 359 HB1 ARG 359 -12.941 -4.103 8.737 627 HG2 ARG 359 HG2 ARG 359 -13.756 -4.464 11.030 628 HG3 ARG 359 HG1 ARG 359 -12.729 -3.136 11.582 629 HD2 ARG 359 HD2 ARG 359 -15.058 -3.013 9.676 630 HD3 ARG 359 HD1 ARG 359 -14.911 -2.232 11.251 631 HE ARG 359 HE ARG 359 -12.859 -1.171 9.814 632 HH11 ARG 359 HH11 ARG 359 -16.328 -1.445 9.341 633 HH12 ARG 359 HH12 ARG 359 -16.421 0.009 8.278 634 HH21 ARG 359 HH21 ARG 359 -12.910 0.656 8.425 635 HH22 ARG 359 HH22 ARG 359 -14.504 1.178 7.765 636 H ASP 360 HN ASP 360 -8.902 -4.070 10.071 637 HA ASP 360 HA ASP 360 -8.942 -3.734 12.982 638 HB2 ASP 360 HB2 ASP 360 -7.114 -5.014 13.343 639 HB3 ASP 360 HB1 ASP 360 -7.570 -5.773 11.827 640 HA PRO 361 HA PRO 361 -7.239 0.145 11.590 641 HB2 PRO 361 HB2 PRO 361 -7.504 1.479 13.925 642 HB3 PRO 361 HB1 PRO 361 -8.906 0.947 12.988 643 HG2 PRO 361 HG2 PRO 361 -7.946 -0.045 15.560 644 HG3 PRO 361 HG1 PRO 361 -9.504 -0.315 14.765 645 HD2 PRO 361 HD2 PRO 361 -7.155 -2.049 14.825 646 HD3 PRO 361 HD1 PRO 361 -8.816 -2.414 14.308 647 H ILE 362 HN ILE 362 -5.252 0.810 11.267 648 HA ILE 362 HA ILE 362 -3.175 0.350 13.311 649 HB ILE 362 HB ILE 362 -2.639 0.532 10.356 650 HG12 ILE 362 HG12 ILE 362 -2.348 -2.126 10.910 651 HG13 ILE 362 HG11 ILE 362 -3.759 -1.721 11.883 652 HG21 ILE 362 HG21 ILE 362 -1.049 -0.672 12.612 653 HG22 ILE 362 HG22 ILE 362 -0.726 0.871 11.819 654 HG23 ILE 362 HG23 ILE 362 -0.577 -0.637 10.915 655 HD11 ILE 362 HD11 ILE 362 -3.456 -1.208 8.939 656 HD12 ILE 362 HD12 ILE 362 -4.876 -0.836 9.919 657 HD13 ILE 362 HD13 ILE 362 -4.389 -2.515 9.671 658 H VAL 363 HN VAL 363 -1.987 2.041 13.942 659 HA VAL 363 HA VAL 363 -2.296 4.569 12.448 660 HB VAL 363 HB VAL 363 -1.838 4.208 15.422 661 HG11 VAL 363 HG11 VAL 363 -0.755 6.221 14.558 662 HG12 VAL 363 HG12 VAL 363 -2.137 6.627 15.573 663 HG13 VAL 363 HG13 VAL 363 -2.277 6.727 13.819 664 HG21 VAL 363 HG21 VAL 363 -4.075 5.011 15.740 665 HG22 VAL 363 HG22 VAL 363 -4.120 3.628 14.647 666 HG23 VAL 363 HG23 VAL 363 -4.273 5.262 14.005 667 H ILE 364 HN ILE 364 -0.459 5.472 11.718 668 HA ILE 364 HA ILE 364 2.099 4.498 12.808 669 HB ILE 364 HB ILE 364 1.593 5.399 9.968 670 HG12 ILE 364 HG12 ILE 364 2.172 2.608 10.971 671 HG13 ILE 364 HG11 ILE 364 0.566 3.187 10.538 672 HG21 ILE 364 HG21 ILE 364 4.039 4.079 11.119 673 HG22 ILE 364 HG22 ILE 364 3.864 5.824 10.930 674 HG23 ILE 364 HG23 ILE 364 3.845 4.778 9.509 675 HD11 ILE 364 HD11 ILE 364 1.299 3.528 8.245 676 HD12 ILE 364 HD12 ILE 364 1.588 1.865 8.755 677 HD13 ILE 364 HD13 ILE 364 2.928 3.011 8.676 678 H SER 365 HN SER 365 3.388 6.028 13.628 679 HA SER 365 HA SER 365 2.874 8.813 12.824 680 HB2 SER 365 HB2 SER 365 3.988 9.076 15.297 681 HB3 SER 365 HB1 SER 365 2.251 9.040 14.996 682 HG SER 365 HG SER 365 3.848 6.765 15.584 683 H ASP 366 HN ASP 366 4.548 9.831 11.959 684 HA ASP 366 HA ASP 366 7.258 8.821 12.506 685 HB2 ASP 366 HB2 ASP 366 5.967 8.775 10.037 686 HB3 ASP 366 HB1 ASP 366 7.013 10.189 9.952 687 H SER 367 HN SER 367 8.685 10.332 13.185 688 HA SER 367 HA SER 367 7.702 13.072 13.416 689 HB2 SER 367 HB2 SER 367 10.286 12.107 14.592 690 HB3 SER 367 HB1 SER 367 9.176 13.331 15.201 691 HG SER 367 HG SER 367 9.039 10.537 15.387 692 HA PRO 368 HA PRO 368 10.206 14.388 9.990 693 HB2 PRO 368 HB2 PRO 368 10.217 17.059 11.214 694 HB3 PRO 368 HB1 PRO 368 9.523 16.534 9.677 695 HG2 PRO 368 HG2 PRO 368 7.979 17.201 11.766 696 HG3 PRO 368 HG1 PRO 368 7.518 15.936 10.608 697 HD2 PRO 368 HD2 PRO 368 8.643 15.653 13.360 698 HD3 PRO 368 HD1 PRO 368 7.388 14.699 12.544 Start of MODEL 5 1 H ASP 16 HT1 ASP 16 -7.669 15.506 10.550 2 HA ASP 16 HA ASP 16 -6.575 14.553 13.124 3 HB2 ASP 16 HB2 ASP 16 -9.300 14.051 11.913 4 HB3 ASP 16 HB1 ASP 16 -8.581 12.986 13.115 5 H HIS 17 HN HIS 17 -7.063 11.926 12.792 6 HA HIS 17 HA HIS 17 -5.210 11.207 10.733 7 HB2 HIS 17 HB2 HIS 17 -6.900 9.428 12.503 8 HB3 HIS 17 HB1 HIS 17 -5.527 8.911 11.537 9 HD2 HIS 17 HD2 HIS 17 -3.003 9.948 12.465 10 HE1 HIS 17 HE1 HIS 17 -4.518 10.639 16.356 11 HE2 HIS 17 HE2 HIS 17 -2.423 10.306 14.971 12 H ILE 18 HN ILE 18 -5.630 9.801 8.962 13 HA ILE 18 HA ILE 18 -8.367 10.082 7.924 14 HB ILE 18 HB ILE 18 -6.645 11.108 6.532 15 HG12 ILE 18 HG12 ILE 18 -7.647 8.586 5.202 16 HG13 ILE 18 HG11 ILE 18 -8.641 10.014 5.488 17 HG21 ILE 18 HG21 ILE 18 -4.940 9.737 5.401 18 HG22 ILE 18 HG22 ILE 18 -5.424 8.360 6.391 19 HG23 ILE 18 HG23 ILE 18 -4.726 9.790 7.152 20 HD11 ILE 18 HD11 ILE 18 -6.152 9.914 3.798 21 HD12 ILE 18 HD12 ILE 18 -7.165 11.334 4.069 22 HD13 ILE 18 HD13 ILE 18 -7.812 9.938 3.204 23 H ASN 19 HN ASN 19 -9.584 8.343 7.479 24 HA ASN 19 HA ASN 19 -8.563 5.737 8.277 25 HB2 ASN 19 HB2 ASN 19 -11.302 6.754 7.544 26 HB3 ASN 19 HB1 ASN 19 -10.975 5.043 7.787 27 HD21 ASN 19 HD21 ASN 19 -11.129 8.176 9.286 28 HD22 ASN 19 HD22 ASN 19 -11.211 7.603 10.922 29 H LEU 20 HN LEU 20 -7.190 5.105 6.637 30 HA LEU 20 HA LEU 20 -8.242 5.006 3.919 31 HB2 LEU 20 HB2 LEU 20 -5.525 4.364 5.065 32 HB3 LEU 20 HB1 LEU 20 -5.942 4.134 3.379 33 HG LEU 20 HG LEU 20 -5.972 6.785 4.818 34 HD11 LEU 20 HD11 LEU 20 -4.001 5.677 2.822 35 HD12 LEU 20 HD12 LEU 20 -3.706 5.914 4.543 36 HD13 LEU 20 HD13 LEU 20 -3.990 7.306 3.500 37 HD21 LEU 20 HD21 LEU 20 -6.200 7.691 2.515 38 HD22 LEU 20 HD22 LEU 20 -7.593 6.750 3.042 39 HD23 LEU 20 HD23 LEU 20 -6.423 6.041 1.933 40 H LYS 21 HN LYS 21 -9.072 3.232 3.034 41 HA LYS 21 HA LYS 21 -9.070 0.776 4.630 42 HB2 LYS 21 HB2 LYS 21 -10.706 1.508 2.197 43 HB3 LYS 21 HB1 LYS 21 -10.905 0.063 3.175 44 HG2 LYS 21 HG2 LYS 21 -11.582 1.416 5.074 45 HG3 LYS 21 HG1 LYS 21 -11.331 2.887 4.127 46 HD2 LYS 21 HD2 LYS 21 -13.053 2.175 2.550 47 HD3 LYS 21 HD1 LYS 21 -13.285 0.684 3.464 48 HE2 LYS 21 HE2 LYS 21 -14.033 1.959 5.389 49 HE3 LYS 21 HE1 LYS 21 -13.744 3.468 4.529 50 HZ1 LYS 21 HZ1 LYS 21 -16.013 3.101 4.301 51 HZ2 LYS 21 HZ2 LYS 21 -15.826 1.441 4.031 52 HZ3 LYS 21 HZ3 LYS 21 -15.385 2.541 2.830 53 H VAL 22 HN VAL 22 -7.882 -0.919 4.083 54 HA VAL 22 HA VAL 22 -6.894 -1.080 1.310 55 HB VAL 22 HB VAL 22 -5.491 -2.038 3.820 56 HG11 VAL 22 HG11 VAL 22 -5.078 -3.537 1.950 57 HG12 VAL 22 HG12 VAL 22 -3.631 -2.601 2.324 58 HG13 VAL 22 HG13 VAL 22 -4.624 -2.168 0.933 59 HG21 VAL 22 HG21 VAL 22 -3.820 -0.337 3.301 60 HG22 VAL 22 HG22 VAL 22 -5.407 0.391 3.551 61 HG23 VAL 22 HG23 VAL 22 -4.777 0.190 1.917 62 H ALA 23 HN ALA 23 -8.270 -2.484 0.408 63 HA ALA 23 HA ALA 23 -8.934 -4.931 1.888 64 HB1 ALA 23 HB1 ALA 23 -10.828 -5.152 0.334 65 HB2 ALA 23 HB2 ALA 23 -10.343 -3.645 -0.446 66 HB3 ALA 23 HB3 ALA 23 -10.874 -3.636 1.236 67 H GLY 24 HN GLY 24 -8.027 -6.766 1.289 68 HA2 GLY 24 HA2 GLY 24 -6.347 -6.871 -1.050 69 HA3 GLY 24 HA1 GLY 24 -6.612 -8.168 0.106 70 H GLN 25 HN GLN 25 -6.529 -9.230 -2.174 71 HA GLN 25 HA GLN 25 -9.049 -9.081 -3.603 72 HB2 GLN 25 HB2 GLN 25 -6.754 -10.975 -4.120 73 HB3 GLN 25 HB1 GLN 25 -8.055 -10.553 -5.221 74 HG2 GLN 25 HG2 GLN 25 -5.792 -8.798 -4.308 75 HG3 GLN 25 HG1 GLN 25 -6.082 -9.427 -5.927 76 HE21 GLN 25 HE21 GLN 25 -5.769 -6.692 -4.945 77 HE22 GLN 25 HE22 GLN 25 -7.195 -5.829 -5.442 78 H ASP 26 HN ASP 26 -8.829 -10.135 -0.811 79 HA ASP 26 HA ASP 26 -10.088 -12.745 -1.309 80 HB2 ASP 26 HB2 ASP 26 -9.249 -13.231 1.137 81 HB3 ASP 26 HB1 ASP 26 -8.180 -13.468 -0.236 82 H GLY 27 HN GLY 27 -9.727 -10.754 1.602 83 HA2 GLY 27 HA2 GLY 27 -12.358 -9.716 1.598 84 HA3 GLY 27 HA1 GLY 27 -12.318 -11.193 2.550 85 H SER 28 HN SER 28 -9.359 -9.545 2.557 86 HA SER 28 HA SER 28 -9.669 -8.856 5.341 87 HB2 SER 28 HB2 SER 28 -7.249 -7.997 4.949 88 HB3 SER 28 HB1 SER 28 -7.542 -9.733 4.841 89 HG SER 28 HG SER 28 -7.431 -9.629 2.642 90 H VAL 29 HN VAL 29 -10.253 -6.896 6.119 91 HA VAL 29 HA VAL 29 -10.002 -4.594 4.284 92 HB VAL 29 HB VAL 29 -12.241 -4.847 6.289 93 HG11 VAL 29 HG11 VAL 29 -13.266 -3.084 4.952 94 HG12 VAL 29 HG12 VAL 29 -11.890 -3.109 3.850 95 HG13 VAL 29 HG13 VAL 29 -11.672 -2.592 5.521 96 HG21 VAL 29 HG21 VAL 29 -13.726 -5.510 4.483 97 HG22 VAL 29 HG22 VAL 29 -12.431 -6.694 4.671 98 HG23 VAL 29 HG23 VAL 29 -12.375 -5.526 3.351 99 H VAL 30 HN VAL 30 -7.938 -4.350 5.430 100 HA VAL 30 HA VAL 30 -8.025 -3.662 8.223 101 HB VAL 30 HB VAL 30 -5.636 -3.136 8.003 102 HG11 VAL 30 HG11 VAL 30 -6.476 -5.741 6.739 103 HG12 VAL 30 HG12 VAL 30 -6.267 -5.418 8.462 104 HG13 VAL 30 HG13 VAL 30 -4.869 -5.402 7.383 105 HG21 VAL 30 HG21 VAL 30 -6.081 -3.722 5.082 106 HG22 VAL 30 HG22 VAL 30 -4.496 -3.618 5.848 107 HG23 VAL 30 HG23 VAL 30 -5.546 -2.202 5.799 108 H GLN 31 HN GLN 31 -7.840 -1.659 9.148 109 HA GLN 31 HA GLN 31 -8.394 0.594 7.322 110 HB2 GLN 31 HB2 GLN 31 -10.107 -0.111 9.097 111 HB3 GLN 31 HB1 GLN 31 -8.977 0.531 10.279 112 HG2 GLN 31 HG2 GLN 31 -10.096 2.442 10.012 113 HG3 GLN 31 HG1 GLN 31 -9.167 2.601 8.522 114 HE21 GLN 31 HE21 GLN 31 -11.830 3.600 9.201 115 HE22 GLN 31 HE22 GLN 31 -12.905 2.946 8.014 116 H PHE 32 HN PHE 32 -6.574 1.688 6.943 117 HA PHE 32 HA PHE 32 -4.549 1.896 9.025 118 HB2 PHE 32 HB2 PHE 32 -4.628 2.428 6.091 119 HB3 PHE 32 HB1 PHE 32 -3.427 3.271 7.063 120 HD1 PHE 32 HD1 PHE 32 -4.454 0.086 5.651 121 HD2 PHE 32 HD2 PHE 32 -1.690 2.013 8.251 122 HE1 PHE 32 HE1 PHE 32 -3.002 -1.898 5.574 123 HE2 PHE 32 HE2 PHE 32 -0.237 0.029 8.176 124 HZ PHE 32 HZ PHE 32 -0.892 -1.929 6.836 125 H LYS 33 HN LYS 33 -5.296 3.285 10.525 126 HA LYS 33 HA LYS 33 -6.371 5.869 9.715 127 HB2 LYS 33 HB2 LYS 33 -7.459 4.602 11.552 128 HB3 LYS 33 HB1 LYS 33 -5.970 4.702 12.481 129 HG2 LYS 33 HG2 LYS 33 -6.168 7.093 12.639 130 HG3 LYS 33 HG1 LYS 33 -7.569 7.084 11.568 131 HD2 LYS 33 HD2 LYS 33 -8.922 6.018 13.183 132 HD3 LYS 33 HD1 LYS 33 -7.531 5.594 14.183 133 HE2 LYS 33 HE2 LYS 33 -7.236 7.810 14.902 134 HE3 LYS 33 HE1 LYS 33 -8.243 8.455 13.609 135 HZ1 LYS 33 HZ1 LYS 33 -9.306 8.443 15.835 136 HZ2 LYS 33 HZ2 LYS 33 -9.282 6.752 15.807 137 HZ3 LYS 33 HZ3 LYS 33 -10.183 7.603 14.657 138 H ILE 34 HN ILE 34 -4.326 6.435 8.721 139 HA ILE 34 HA ILE 34 -2.205 7.164 10.626 140 HB ILE 34 HB ILE 34 -0.726 7.364 8.678 141 HG12 ILE 34 HG12 ILE 34 -3.032 6.306 7.028 142 HG13 ILE 34 HG11 ILE 34 -2.569 8.004 7.071 143 HG21 ILE 34 HG21 ILE 34 -0.657 4.972 8.060 144 HG22 ILE 34 HG22 ILE 34 -2.234 4.757 8.822 145 HG23 ILE 34 HG23 ILE 34 -0.843 5.228 9.798 146 HD11 ILE 34 HD11 ILE 34 -0.781 5.751 6.182 147 HD12 ILE 34 HD12 ILE 34 -0.410 7.472 6.135 148 HD13 ILE 34 HD13 ILE 34 -1.685 6.821 5.111 149 H LYS 35 HN LYS 35 -0.916 9.168 9.535 150 HA LYS 35 HA LYS 35 -2.855 11.331 9.577 151 HB2 LYS 35 HB2 LYS 35 0.173 11.386 9.537 152 HB3 LYS 35 HB1 LYS 35 -0.858 12.800 9.691 153 HG2 LYS 35 HG2 LYS 35 -1.751 11.870 11.800 154 HG3 LYS 35 HG1 LYS 35 -0.615 10.528 11.651 155 HD2 LYS 35 HD2 LYS 35 1.255 12.107 11.715 156 HD3 LYS 35 HD1 LYS 35 0.116 13.449 11.859 157 HE2 LYS 35 HE2 LYS 35 -0.728 12.449 13.959 158 HE3 LYS 35 HE1 LYS 35 0.503 11.196 13.825 159 HZ1 LYS 35 HZ1 LYS 35 2.208 12.863 14.015 160 HZ2 LYS 35 HZ2 LYS 35 1.141 13.013 15.315 161 HZ3 LYS 35 HZ3 LYS 35 1.062 14.104 14.028 162 H ARG 36 HN ARG 36 -2.851 12.995 7.928 163 HA ARG 36 HA ARG 36 -2.778 11.894 5.308 164 HB2 ARG 36 HB2 ARG 36 -3.198 14.724 6.279 165 HB3 ARG 36 HB1 ARG 36 -3.344 14.242 4.594 166 HG2 ARG 36 HG2 ARG 36 -5.162 12.748 5.136 167 HG3 ARG 36 HG1 ARG 36 -4.982 13.108 6.853 168 HD2 ARG 36 HD2 ARG 36 -6.766 14.456 6.196 169 HD3 ARG 36 HD1 ARG 36 -5.388 15.552 6.171 170 HE ARG 36 HE ARG 36 -5.373 15.377 3.772 171 HH11 ARG 36 HH11 ARG 36 -8.198 13.997 5.362 172 HH12 ARG 36 HH12 ARG 36 -9.252 14.220 3.911 173 HH21 ARG 36 HH21 ARG 36 -6.700 15.641 1.907 174 HH22 ARG 36 HH22 ARG 36 -8.418 15.086 1.996 175 H HIS 37 HN HIS 37 -0.362 13.153 7.239 176 HA HIS 37 HA HIS 37 1.261 14.068 4.975 177 HB2 HIS 37 HB2 HIS 37 1.976 14.216 7.907 178 HB3 HIS 37 HB1 HIS 37 2.708 15.098 6.572 179 HD2 HIS 37 HD2 HIS 37 1.073 17.174 5.495 180 HE1 HIS 37 HE1 HIS 37 -1.365 17.343 8.949 181 HE2 HIS 37 HE2 HIS 37 -0.833 18.430 6.720 182 H THR 38 HN THR 38 0.692 11.309 6.771 183 HA THR 38 HA THR 38 3.354 10.299 6.991 184 HB THR 38 HB THR 38 0.751 8.757 7.048 185 HG1 THR 38 HG1 THR 38 1.612 9.024 9.480 186 HG21 THR 38 HG21 THR 38 3.480 8.085 8.159 187 HG22 THR 38 HG22 THR 38 2.734 7.345 6.745 188 HG23 THR 38 HG23 THR 38 2.024 7.107 8.342 189 HA PRO 39 HA PRO 39 3.876 9.326 2.638 190 HB2 PRO 39 HB2 PRO 39 5.964 7.540 3.782 191 HB3 PRO 39 HB1 PRO 39 6.098 8.758 2.505 192 HG2 PRO 39 HG2 PRO 39 7.073 9.238 4.927 193 HG3 PRO 39 HG1 PRO 39 6.276 10.514 3.987 194 HD2 PRO 39 HD2 PRO 39 5.242 8.963 6.315 195 HD3 PRO 39 HD1 PRO 39 4.978 10.664 5.875 196 H LEU 40 HN LEU 40 2.821 7.870 1.463 197 HA LEU 40 HA LEU 40 1.527 5.643 2.634 198 HB2 LEU 40 HB2 LEU 40 1.944 6.413 -0.252 199 HB3 LEU 40 HB1 LEU 40 0.931 5.077 0.262 200 HG LEU 40 HG LEU 40 0.476 7.942 1.095 201 HD11 LEU 40 HD11 LEU 40 -1.340 7.960 -0.530 202 HD12 LEU 40 HD12 LEU 40 -0.874 6.348 -1.077 203 HD13 LEU 40 HD13 LEU 40 0.219 7.711 -1.316 204 HD21 LEU 40 HD21 LEU 40 -1.186 5.439 1.344 205 HD22 LEU 40 HD22 LEU 40 -1.771 7.071 1.684 206 HD23 LEU 40 HD23 LEU 40 -0.467 6.380 2.655 207 H SER 41 HN SER 41 4.670 6.044 1.430 208 HA SER 41 HA SER 41 5.259 3.502 0.415 209 HB2 SER 41 HB2 SER 41 7.549 4.460 1.755 210 HB3 SER 41 HB1 SER 41 7.151 4.662 0.047 211 HG SER 41 HG SER 41 7.158 6.709 0.593 212 H LYS 42 HN LYS 42 5.288 4.809 3.680 213 HA LYS 42 HA LYS 42 6.321 2.442 4.903 214 HB2 LYS 42 HB2 LYS 42 4.759 4.606 6.310 215 HB3 LYS 42 HB1 LYS 42 6.015 3.564 6.969 216 HG2 LYS 42 HG2 LYS 42 7.503 4.734 5.161 217 HG3 LYS 42 HG1 LYS 42 6.263 5.982 5.252 218 HD2 LYS 42 HD2 LYS 42 6.664 6.294 7.599 219 HD3 LYS 42 HD1 LYS 42 7.751 4.905 7.645 220 HE2 LYS 42 HE2 LYS 42 9.187 6.128 5.967 221 HE3 LYS 42 HE1 LYS 42 8.179 7.545 6.262 222 HZ1 LYS 42 HZ1 LYS 42 10.326 7.306 7.583 223 HZ2 LYS 42 HZ2 LYS 42 9.517 6.129 8.484 224 HZ3 LYS 42 HZ3 LYS 42 8.927 7.720 8.446 225 H LEU 43 HN LEU 43 3.174 3.693 4.119 226 HA LEU 43 HA LEU 43 1.613 1.970 5.730 227 HB2 LEU 43 HB2 LEU 43 0.632 3.963 4.805 228 HB3 LEU 43 HB1 LEU 43 1.023 3.460 3.173 229 HG LEU 43 HG LEU 43 -0.747 1.608 4.628 230 HD11 LEU 43 HD11 LEU 43 -2.727 3.023 4.333 231 HD12 LEU 43 HD12 LEU 43 -1.690 4.371 3.867 232 HD13 LEU 43 HD13 LEU 43 -1.597 3.710 5.500 233 HD21 LEU 43 HD21 LEU 43 -0.922 2.932 1.919 234 HD22 LEU 43 HD22 LEU 43 -1.912 1.590 2.493 235 HD23 LEU 43 HD23 LEU 43 -0.180 1.365 2.246 236 H MET 44 HN MET 44 2.785 1.790 2.402 237 HA MET 44 HA MET 44 1.547 -0.629 1.688 238 HB2 MET 44 HB2 MET 44 4.105 0.637 0.690 239 HB3 MET 44 HB1 MET 44 3.343 -0.762 -0.056 240 HG2 MET 44 HG2 MET 44 1.314 0.623 -0.434 241 HG3 MET 44 HG1 MET 44 2.208 2.015 0.173 242 HE1 MET 44 HE1 MET 44 2.366 3.634 -1.748 243 HE2 MET 44 HE2 MET 44 3.711 3.425 -2.869 244 HE3 MET 44 HE3 MET 44 3.988 3.323 -1.131 245 H LYS 45 HN LYS 45 4.733 0.056 3.069 246 HA LYS 45 HA LYS 45 5.640 -2.615 3.097 247 HB2 LYS 45 HB2 LYS 45 6.470 -0.059 4.378 248 HB3 LYS 45 HB1 LYS 45 7.097 -1.552 5.067 249 HG2 LYS 45 HG2 LYS 45 8.540 -1.834 3.394 250 HG3 LYS 45 HG1 LYS 45 7.316 -1.489 2.171 251 HD2 LYS 45 HD2 LYS 45 7.628 0.907 2.521 252 HD3 LYS 45 HD1 LYS 45 8.825 0.578 3.775 253 HE2 LYS 45 HE2 LYS 45 10.328 -0.382 2.199 254 HE3 LYS 45 HE1 LYS 45 9.098 -0.384 0.936 255 HZ1 LYS 45 HZ1 LYS 45 10.971 1.531 1.302 256 HZ2 LYS 45 HZ2 LYS 45 9.613 2.221 2.032 257 HZ3 LYS 45 HZ3 LYS 45 9.542 1.726 0.412 258 H ALA 46 HN ALA 46 3.810 -0.680 5.404 259 HA ALA 46 HA ALA 46 3.976 -2.380 7.624 260 HB1 ALA 46 HB1 ALA 46 3.117 -0.091 7.746 261 HB2 ALA 46 HB2 ALA 46 1.983 -1.248 8.445 262 HB3 ALA 46 HB3 ALA 46 1.685 -0.580 6.839 263 H TYR 47 HN TYR 47 1.625 -2.309 4.958 264 HA TYR 47 HA TYR 47 0.062 -4.460 5.977 265 HB2 TYR 47 HB2 TYR 47 -0.809 -2.800 4.351 266 HB3 TYR 47 HB1 TYR 47 0.278 -3.451 3.130 267 HD1 TYR 47 HD1 TYR 47 -0.658 -4.908 1.605 268 HD2 TYR 47 HD2 TYR 47 -2.305 -4.730 5.525 269 HE1 TYR 47 HE1 TYR 47 -2.361 -6.560 0.958 270 HE2 TYR 47 HE2 TYR 47 -4.015 -6.380 4.888 271 HH TYR 47 HH TYR 47 -5.081 -7.290 2.965 272 H CYS 48 HN CYS 48 2.772 -4.207 3.754 273 HA CYS 48 HA CYS 48 2.765 -6.848 2.789 274 HB2 CYS 48 HB2 CYS 48 4.088 -4.778 1.978 275 HB3 CYS 48 HB1 CYS 48 5.276 -5.245 3.189 276 HG CYS 48 HG CYS 48 6.013 -7.594 2.054 277 H GLU 49 HN GLU 49 4.200 -5.386 5.644 278 HA GLU 49 HA GLU 49 5.824 -7.502 6.487 279 HB2 GLU 49 HB2 GLU 49 4.420 -5.264 7.911 280 HB3 GLU 49 HB1 GLU 49 5.304 -6.481 8.824 281 HG2 GLU 49 HG2 GLU 49 6.649 -5.090 6.562 282 HG3 GLU 49 HG1 GLU 49 6.456 -4.260 8.106 283 H ARG 50 HN ARG 50 2.395 -6.957 6.797 284 HA ARG 50 HA ARG 50 1.964 -9.073 8.691 285 HB2 ARG 50 HB2 ARG 50 0.038 -7.499 6.980 286 HB3 ARG 50 HB1 ARG 50 -0.431 -8.633 8.244 287 HG2 ARG 50 HG2 ARG 50 0.462 -7.272 9.939 288 HG3 ARG 50 HG1 ARG 50 1.333 -6.266 8.780 289 HD2 ARG 50 HD2 ARG 50 -0.567 -5.147 8.128 290 HD3 ARG 50 HD1 ARG 50 -1.629 -6.473 8.601 291 HE ARG 50 HE ARG 50 -0.225 -4.994 10.696 292 HH11 ARG 50 HH11 ARG 50 -3.197 -5.758 8.981 293 HH12 ARG 50 HH12 ARG 50 -4.259 -5.073 10.275 294 HH21 ARG 50 HH21 ARG 50 -3.336 -4.190 12.161 295 HH22 ARG 50 HH22 ARG 50 -1.536 -4.153 12.377 296 H GLN 51 HN GLN 51 1.910 -8.720 5.221 297 HA GLN 51 HA GLN 51 0.588 -11.211 4.730 298 HB2 GLN 51 HB2 GLN 51 2.315 -9.600 2.839 299 HB3 GLN 51 HB1 GLN 51 1.167 -10.854 2.396 300 HG2 GLN 51 HG2 GLN 51 0.517 -8.186 3.621 301 HG3 GLN 51 HG1 GLN 51 0.248 -8.671 1.948 302 HE21 GLN 51 HE21 GLN 51 -1.457 -10.026 1.454 303 HE22 GLN 51 HE22 GLN 51 -2.726 -10.371 2.575 304 H GLY 52 HN GLY 52 3.856 -10.144 5.202 305 HA2 GLY 52 HA2 GLY 52 5.697 -11.430 5.778 306 HA3 GLY 52 HA1 GLY 52 4.751 -12.878 5.471 307 H LEU 53 HN LEU 53 5.007 -10.329 3.123 308 HA LEU 53 HA LEU 53 6.839 -11.992 1.527 309 HB2 LEU 53 HB2 LEU 53 4.331 -10.577 0.633 310 HB3 LEU 53 HB1 LEU 53 5.568 -11.110 -0.489 311 HG LEU 53 HG LEU 53 5.069 -13.412 0.906 312 HD11 LEU 53 HD11 LEU 53 2.675 -13.668 1.083 313 HD12 LEU 53 HD12 LEU 53 2.426 -12.008 0.541 314 HD13 LEU 53 HD13 LEU 53 3.205 -12.324 2.094 315 HD21 LEU 53 HD21 LEU 53 5.288 -13.176 -1.512 316 HD22 LEU 53 HD22 LEU 53 3.689 -12.434 -1.591 317 HD23 LEU 53 HD23 LEU 53 3.857 -14.118 -1.091 318 H SER 54 HN SER 54 7.437 -10.515 -0.528 319 HA SER 54 HA SER 54 8.729 -8.185 0.637 320 HB2 SER 54 HB2 SER 54 10.085 -9.755 -0.690 321 HB3 SER 54 HB1 SER 54 9.057 -9.463 -2.092 322 HG SER 54 HG SER 54 11.194 -8.151 -1.469 323 H MET 55 HN MET 55 8.403 -6.101 -0.047 324 HA MET 55 HA MET 55 5.851 -5.417 -1.034 325 HB2 MET 55 HB2 MET 55 7.145 -3.944 0.443 326 HB3 MET 55 HB1 MET 55 8.351 -3.725 -0.816 327 HG2 MET 55 HG2 MET 55 6.629 -2.674 -2.237 328 HG3 MET 55 HG1 MET 55 5.483 -2.817 -0.906 329 HE1 MET 55 HE1 MET 55 6.447 1.038 -1.219 330 HE2 MET 55 HE2 MET 55 5.178 -0.155 -1.482 331 HE3 MET 55 HE3 MET 55 6.567 -0.096 -2.566 332 H ARG 56 HN ARG 56 8.812 -6.162 -2.596 333 HA ARG 56 HA ARG 56 8.262 -4.791 -5.051 334 HB2 ARG 56 HB2 ARG 56 10.535 -5.528 -4.078 335 HB3 ARG 56 HB1 ARG 56 10.156 -7.107 -4.744 336 HG2 ARG 56 HG2 ARG 56 10.151 -6.277 -6.954 337 HG3 ARG 56 HG1 ARG 56 10.172 -4.602 -6.401 338 HD2 ARG 56 HD2 ARG 56 12.408 -5.015 -5.406 339 HD3 ARG 56 HD1 ARG 56 12.383 -6.633 -6.107 340 HE ARG 56 HE ARG 56 12.384 -5.606 -8.293 341 HH11 ARG 56 HH11 ARG 56 14.020 -2.307 -6.597 342 HH12 ARG 56 HH12 ARG 56 13.228 -3.549 -5.558 343 HH21 ARG 56 HH21 ARG 56 14.143 -2.607 -8.873 344 HH22 ARG 56 HH22 ARG 56 13.411 -4.070 -9.636 345 H GLN 57 HN GLN 57 7.007 -7.579 -3.643 346 HA GLN 57 HA GLN 57 6.526 -8.911 -6.202 347 HB2 GLN 57 HB2 GLN 57 7.265 -10.063 -3.984 348 HB3 GLN 57 HB1 GLN 57 5.564 -9.943 -3.557 349 HG2 GLN 57 HG2 GLN 57 4.978 -11.194 -5.582 350 HG3 GLN 57 HG1 GLN 57 6.692 -11.342 -5.969 351 HE21 GLN 57 HE21 GLN 57 4.741 -13.429 -5.479 352 HE22 GLN 57 HE22 GLN 57 5.349 -14.356 -4.154 353 H ILE 58 HN ILE 58 5.005 -6.647 -4.233 354 HA ILE 58 HA ILE 58 2.393 -7.365 -5.392 355 HB ILE 58 HB ILE 58 1.389 -6.095 -3.424 356 HG12 ILE 58 HG12 ILE 58 4.126 -6.651 -2.253 357 HG13 ILE 58 HG11 ILE 58 3.489 -5.054 -2.640 358 HG21 ILE 58 HG21 ILE 58 1.122 -8.455 -3.609 359 HG22 ILE 58 HG22 ILE 58 1.555 -8.094 -1.939 360 HG23 ILE 58 HG23 ILE 58 2.766 -8.743 -3.042 361 HD11 ILE 58 HD11 ILE 58 2.411 -6.960 -0.574 362 HD12 ILE 58 HD12 ILE 58 1.704 -5.398 -0.987 363 HD13 ILE 58 HD13 ILE 58 3.317 -5.474 -0.274 364 H ARG 59 HN ARG 59 0.886 -5.437 -5.504 365 HA ARG 59 HA ARG 59 2.321 -2.940 -6.113 366 HB2 ARG 59 HB2 ARG 59 0.295 -4.245 -7.945 367 HB3 ARG 59 HB1 ARG 59 1.033 -2.671 -8.192 368 HG2 ARG 59 HG2 ARG 59 2.549 -5.268 -8.111 369 HG3 ARG 59 HG1 ARG 59 2.002 -4.469 -9.586 370 HD2 ARG 59 HD2 ARG 59 3.328 -2.478 -8.930 371 HD3 ARG 59 HD1 ARG 59 3.942 -3.385 -7.548 372 HE ARG 59 HE ARG 59 4.602 -3.808 -10.362 373 HH11 ARG 59 HH11 ARG 59 6.398 -5.824 -7.341 374 HH12 ARG 59 HH12 ARG 59 4.944 -4.805 -6.997 375 HH21 ARG 59 HH21 ARG 59 6.418 -5.061 -10.830 376 HH22 ARG 59 HH22 ARG 59 7.219 -5.978 -9.498 377 H PHE 60 HN PHE 60 1.260 -1.141 -5.461 378 HA PHE 60 HA PHE 60 -1.466 -1.495 -4.416 379 HB2 PHE 60 HB2 PHE 60 0.745 0.416 -3.660 380 HB3 PHE 60 HB1 PHE 60 -0.921 0.670 -3.157 381 HD1 PHE 60 HD1 PHE 60 1.787 -1.886 -3.058 382 HD2 PHE 60 HD2 PHE 60 -1.671 -0.256 -1.182 383 HE1 PHE 60 HE1 PHE 60 2.159 -3.340 -1.111 384 HE2 PHE 60 HE2 PHE 60 -1.305 -1.712 0.766 385 HZ PHE 60 HZ PHE 60 0.614 -3.257 0.802 386 H ARG 61 HN ARG 61 -3.111 -0.328 -5.256 387 HA ARG 61 HA ARG 61 -2.406 1.766 -7.208 388 HB2 ARG 61 HB2 ARG 61 -4.140 -0.618 -7.494 389 HB3 ARG 61 HB1 ARG 61 -4.711 0.871 -8.238 390 HG2 ARG 61 HG2 ARG 61 -2.918 0.972 -9.709 391 HG3 ARG 61 HG1 ARG 61 -1.928 -0.115 -8.727 392 HD2 ARG 61 HD2 ARG 61 -2.962 -1.990 -9.517 393 HD3 ARG 61 HD1 ARG 61 -4.486 -1.158 -9.807 394 HE ARG 61 HE ARG 61 -2.124 -0.803 -11.537 395 HH11 ARG 61 HH11 ARG 61 -5.931 -1.297 -12.831 396 HH12 ARG 61 HH12 ARG 61 -5.583 -1.292 -11.063 397 HH21 ARG 61 HH21 ARG 61 -2.543 -0.789 -13.780 398 HH22 ARG 61 HH22 ARG 61 -4.240 -1.030 -14.346 399 H PHE 62 HN PHE 62 -3.649 3.546 -7.312 400 HA PHE 62 HA PHE 62 -5.962 3.754 -5.509 401 HB2 PHE 62 HB2 PHE 62 -4.310 4.893 -4.262 402 HB3 PHE 62 HB1 PHE 62 -3.576 5.591 -5.700 403 HD1 PHE 62 HD1 PHE 62 -6.699 5.684 -3.678 404 HD2 PHE 62 HD2 PHE 62 -4.097 7.758 -6.329 405 HE1 PHE 62 HE1 PHE 62 -8.008 7.737 -3.351 406 HE2 PHE 62 HE2 PHE 62 -5.404 9.819 -6.004 407 HZ PHE 62 HZ PHE 62 -7.364 9.808 -4.514 408 H ASP 63 HN ASP 63 -7.684 4.288 -6.650 409 HA ASP 63 HA ASP 63 -9.058 5.129 -8.244 410 HB2 ASP 63 HB2 ASP 63 -7.965 7.261 -7.334 411 HB3 ASP 63 HB1 ASP 63 -6.976 7.240 -8.790 412 H GLY 64 HN GLY 64 -6.837 3.240 -8.969 413 HA2 GLY 64 HA2 GLY 64 -6.713 2.049 -11.012 414 HA3 GLY 64 HA1 GLY 64 -7.174 3.512 -11.865 415 H GLN 65 HN GLN 65 -4.991 4.716 -9.885 416 HA GLN 65 HA GLN 65 -2.795 4.261 -11.790 417 HB2 GLN 65 HB2 GLN 65 -3.396 6.553 -9.921 418 HB3 GLN 65 HB1 GLN 65 -1.879 6.399 -10.793 419 HG2 GLN 65 HG2 GLN 65 -4.564 6.505 -12.142 420 HG3 GLN 65 HG1 GLN 65 -3.571 7.927 -11.824 421 HE21 GLN 65 HE21 GLN 65 -1.610 8.170 -12.918 422 HE22 GLN 65 HE22 GLN 65 -1.273 7.307 -14.380 423 HA PRO 66 HA PRO 66 -0.552 2.134 -8.590 424 HB2 PRO 66 HB2 PRO 66 1.969 2.441 -9.602 425 HB3 PRO 66 HB1 PRO 66 0.806 1.266 -10.231 426 HG2 PRO 66 HG2 PRO 66 1.527 3.950 -11.308 427 HG3 PRO 66 HG1 PRO 66 1.215 2.435 -12.177 428 HD2 PRO 66 HD2 PRO 66 -0.626 4.404 -12.003 429 HD3 PRO 66 HD1 PRO 66 -1.065 2.686 -12.080 430 H ILE 67 HN ILE 67 0.201 2.794 -6.661 431 HA ILE 67 HA ILE 67 0.749 5.599 -6.253 432 HB ILE 67 HB ILE 67 0.910 3.380 -4.212 433 HG12 ILE 67 HG12 ILE 67 -1.466 5.117 -4.923 434 HG13 ILE 67 HG11 ILE 67 -1.295 3.419 -5.354 435 HG21 ILE 67 HG21 ILE 67 0.494 6.353 -3.936 436 HG22 ILE 67 HG22 ILE 67 1.952 5.457 -3.511 437 HG23 ILE 67 HG23 ILE 67 0.457 5.191 -2.611 438 HD11 ILE 67 HD11 ILE 67 -1.403 4.502 -2.549 439 HD12 ILE 67 HD12 ILE 67 -1.301 2.803 -3.010 440 HD13 ILE 67 HD13 ILE 67 -2.738 3.743 -3.413 441 H ASN 68 HN ASN 68 2.667 6.521 -5.600 442 HA ASN 68 HA ASN 68 5.063 4.896 -6.086 443 HB2 ASN 68 HB2 ASN 68 4.828 7.907 -5.838 444 HB3 ASN 68 HB1 ASN 68 6.250 7.005 -6.349 445 HD21 ASN 68 HD21 ASN 68 3.053 8.060 -7.210 446 HD22 ASN 68 HD22 ASN 68 3.206 7.767 -8.916 447 H GLU 69 HN GLU 69 6.953 5.372 -4.663 448 HA GLU 69 HA GLU 69 6.139 5.139 -1.915 449 HB2 GLU 69 HB2 GLU 69 8.862 5.176 -3.217 450 HB3 GLU 69 HB1 GLU 69 8.596 4.908 -1.499 451 HG2 GLU 69 HG2 GLU 69 7.125 2.963 -2.164 452 HG3 GLU 69 HG1 GLU 69 7.758 3.169 -3.797 453 H THR 70 HN THR 70 6.384 7.743 -3.783 454 HA THR 70 HA THR 70 7.426 9.458 -1.630 455 HB THR 70 HB THR 70 7.509 11.115 -3.706 456 HG1 THR 70 HG1 THR 70 7.334 10.123 -5.564 457 HG21 THR 70 HG21 THR 70 9.436 10.523 -2.353 458 HG22 THR 70 HG22 THR 70 9.863 10.434 -4.060 459 HG23 THR 70 HG23 THR 70 9.549 8.957 -3.152 460 H ASP 71 HN ASP 71 4.642 8.314 -2.448 461 HA ASP 71 HA ASP 71 3.208 10.860 -2.699 462 HB2 ASP 71 HB2 ASP 71 2.422 8.008 -3.242 463 HB3 ASP 71 HB1 ASP 71 1.205 9.262 -3.038 464 H THR 72 HN THR 72 1.654 11.481 -1.281 465 HA THR 72 HA THR 72 1.411 9.958 1.227 466 HB THR 72 HB THR 72 1.098 12.204 2.353 467 HG1 THR 72 HG1 THR 72 2.334 13.875 0.930 468 HG21 THR 72 HG21 THR 72 3.744 11.515 1.088 469 HG22 THR 72 HG22 THR 72 3.181 11.137 2.716 470 HG23 THR 72 HG23 THR 72 3.562 12.800 2.281 471 HA PRO 73 HA PRO 73 -2.987 10.167 0.734 472 HB2 PRO 73 HB2 PRO 73 -3.271 11.513 3.360 473 HB3 PRO 73 HB1 PRO 73 -3.974 9.991 2.800 474 HG2 PRO 73 HG2 PRO 73 -1.975 9.996 4.557 475 HG3 PRO 73 HG1 PRO 73 -2.081 8.764 3.283 476 HD2 PRO 73 HD2 PRO 73 -0.314 11.164 3.443 477 HD3 PRO 73 HD1 PRO 73 0.037 9.540 2.814 478 H ALA 74 HN ALA 74 -1.416 13.068 1.982 479 HA ALA 74 HA ALA 74 -3.521 14.836 1.136 480 HB1 ALA 74 HB1 ALA 74 -2.017 16.632 1.797 481 HB2 ALA 74 HB2 ALA 74 -0.692 15.480 1.968 482 HB3 ALA 74 HB3 ALA 74 -2.082 15.388 3.047 483 H GLN 75 HN GLN 75 -0.477 13.670 -0.168 484 HA GLN 75 HA GLN 75 -0.225 15.510 -2.297 485 HB2 GLN 75 HB2 GLN 75 1.566 13.944 -1.451 486 HB3 GLN 75 HB1 GLN 75 0.727 12.642 -2.281 487 HG2 GLN 75 HG2 GLN 75 2.483 13.329 -3.697 488 HG3 GLN 75 HG1 GLN 75 0.994 13.963 -4.399 489 HE21 GLN 75 HE21 GLN 75 1.984 15.609 -5.502 490 HE22 GLN 75 HE22 GLN 75 2.702 16.972 -4.717 491 H LEU 76 HN LEU 76 -1.625 12.247 -2.136 492 HA LEU 76 HA LEU 76 -2.617 12.411 -4.843 493 HB2 LEU 76 HB2 LEU 76 -2.914 10.375 -2.647 494 HB3 LEU 76 HB1 LEU 76 -3.781 10.236 -4.162 495 HG LEU 76 HG LEU 76 -0.773 10.378 -3.972 496 HD11 LEU 76 HD11 LEU 76 -2.569 7.971 -4.226 497 HD12 LEU 76 HD12 LEU 76 -1.557 8.381 -2.840 498 HD13 LEU 76 HD13 LEU 76 -0.812 7.961 -4.383 499 HD21 LEU 76 HD21 LEU 76 -1.819 11.071 -6.120 500 HD22 LEU 76 HD22 LEU 76 -2.557 9.472 -6.228 501 HD23 LEU 76 HD23 LEU 76 -0.801 9.638 -6.255 502 H GLU 77 HN GLU 77 -3.551 13.756 -2.031 503 HA GLU 77 HA GLU 77 -5.423 14.706 -1.193 504 HB2 GLU 77 HB2 GLU 77 -6.479 14.640 -4.013 505 HB3 GLU 77 HB1 GLU 77 -6.849 15.805 -2.749 506 HG2 GLU 77 HG2 GLU 77 -4.375 16.405 -2.814 507 HG3 GLU 77 HG1 GLU 77 -4.316 15.500 -4.322 508 H MET 78 HN MET 78 -5.436 12.163 -0.645 509 HA MET 78 HA MET 78 -7.877 10.866 -1.516 510 HB2 MET 78 HB2 MET 78 -5.990 9.993 0.678 511 HB3 MET 78 HB1 MET 78 -7.159 9.001 -0.184 512 HG2 MET 78 HG2 MET 78 -5.881 9.098 -2.187 513 HG3 MET 78 HG1 MET 78 -4.806 10.316 -1.510 514 HE1 MET 78 HE1 MET 78 -4.881 5.853 -0.380 515 HE2 MET 78 HE2 MET 78 -5.750 6.569 -1.736 516 HE3 MET 78 HE3 MET 78 -6.254 6.919 -0.082 517 H GLU 79 HN GLU 79 -9.584 10.304 -0.071 518 HA GLU 79 HA GLU 79 -9.753 12.104 2.248 519 HB2 GLU 79 HB2 GLU 79 -11.686 11.446 0.109 520 HB3 GLU 79 HB1 GLU 79 -12.345 11.565 1.735 521 HG2 GLU 79 HG2 GLU 79 -10.837 13.681 0.223 522 HG3 GLU 79 HG1 GLU 79 -12.543 13.695 0.671 523 H ASP 80 HN ASP 80 -11.614 11.256 3.755 524 HA ASP 80 HA ASP 80 -10.662 8.837 4.864 525 HB2 ASP 80 HB2 ASP 80 -12.869 10.736 5.483 526 HB3 ASP 80 HB1 ASP 80 -12.988 9.114 6.159 527 H GLU 81 HN GLU 81 -11.426 6.824 4.820 528 HA GLU 81 HA GLU 81 -12.646 4.999 4.302 529 HB2 GLU 81 HB2 GLU 81 -14.631 6.987 3.223 530 HB3 GLU 81 HB1 GLU 81 -14.858 5.251 3.076 531 HG2 GLU 81 HG2 GLU 81 -14.482 5.274 5.657 532 HG3 GLU 81 HG1 GLU 81 -14.927 6.974 5.502 533 H ASP 82 HN ASP 82 -10.880 6.764 2.354 534 HA ASP 82 HA ASP 82 -11.588 5.778 -0.234 535 HB2 ASP 82 HB2 ASP 82 -9.894 7.728 0.594 536 HB3 ASP 82 HB1 ASP 82 -8.741 6.434 0.283 537 H THR 83 HN THR 83 -10.830 3.972 -1.322 538 HA THR 83 HA THR 83 -9.469 2.013 0.398 539 HB THR 83 HB THR 83 -11.196 1.388 -1.996 540 HG1 THR 83 HG1 THR 83 -12.118 2.470 0.068 541 HG21 THR 83 HG21 THR 83 -11.275 -0.852 -1.038 542 HG22 THR 83 HG22 THR 83 -10.277 -0.326 0.317 543 HG23 THR 83 HG23 THR 83 -9.601 -0.368 -1.311 544 H ILE 84 HN ILE 84 -7.675 1.023 -0.230 545 HA ILE 84 HA ILE 84 -6.504 1.781 -2.825 546 HB ILE 84 HB ILE 84 -5.086 0.757 -0.353 547 HG12 ILE 84 HG12 ILE 84 -5.120 3.588 -1.414 548 HG13 ILE 84 HG11 ILE 84 -6.156 3.029 -0.104 549 HG21 ILE 84 HG21 ILE 84 -3.052 1.526 -1.505 550 HG22 ILE 84 HG22 ILE 84 -4.025 1.934 -2.918 551 HG23 ILE 84 HG23 ILE 84 -3.887 0.253 -2.397 552 HD11 ILE 84 HD11 ILE 84 -3.150 3.136 -0.107 553 HD12 ILE 84 HD12 ILE 84 -4.131 2.455 1.190 554 HD13 ILE 84 HD13 ILE 84 -4.253 4.170 0.802 555 H ASP 85 HN ASP 85 -6.128 0.198 -4.293 556 HA ASP 85 HA ASP 85 -6.890 -2.520 -3.568 557 HB2 ASP 85 HB2 ASP 85 -7.248 -1.004 -5.866 558 HB3 ASP 85 HB1 ASP 85 -5.987 -2.149 -6.316 559 H VAL 86 HN VAL 86 -5.546 -4.250 -3.523 560 HA VAL 86 HA VAL 86 -2.683 -3.729 -3.998 561 HB VAL 86 HB VAL 86 -3.786 -5.659 -1.953 562 HG11 VAL 86 HG11 VAL 86 -1.468 -5.604 -1.087 563 HG12 VAL 86 HG12 VAL 86 -1.008 -4.603 -2.464 564 HG13 VAL 86 HG13 VAL 86 -1.578 -6.251 -2.724 565 HG21 VAL 86 HG21 VAL 86 -3.165 -4.033 -0.245 566 HG22 VAL 86 HG22 VAL 86 -4.371 -3.359 -1.343 567 HG23 VAL 86 HG23 VAL 86 -2.678 -2.890 -1.499 568 H PHE 87 HN PHE 87 -1.981 -4.828 -5.691 569 HA PHE 87 HA PHE 87 -3.194 -7.450 -6.277 570 HB2 PHE 87 HB2 PHE 87 -1.972 -5.386 -8.113 571 HB3 PHE 87 HB1 PHE 87 -2.323 -7.032 -8.630 572 HD1 PHE 87 HD1 PHE 87 -4.760 -7.838 -8.324 573 HD2 PHE 87 HD2 PHE 87 -3.593 -3.746 -8.282 574 HE1 PHE 87 HE1 PHE 87 -7.073 -7.176 -8.849 575 HE2 PHE 87 HE2 PHE 87 -5.900 -3.077 -8.803 576 HZ PHE 87 HZ PHE 87 -7.644 -4.791 -9.087 577 H GLN 88 HN GLN 88 -1.634 -8.923 -7.503 578 HA GLN 88 HA GLN 88 0.997 -8.786 -6.180 579 HB2 GLN 88 HB2 GLN 88 -0.732 -11.139 -6.935 580 HB3 GLN 88 HB1 GLN 88 0.985 -11.319 -6.598 581 HG2 GLN 88 HG2 GLN 88 0.680 -10.495 -4.356 582 HG3 GLN 88 HG1 GLN 88 -1.020 -10.156 -4.677 583 HE21 GLN 88 HE21 GLN 88 -1.653 -11.490 -2.966 584 HE22 GLN 88 HE22 GLN 88 -1.601 -13.214 -3.094 585 H GLN 89 HN GLN 89 2.843 -9.329 -7.371 586 HA GLN 89 HA GLN 89 2.642 -8.754 -10.192 587 HB2 GLN 89 HB2 GLN 89 4.468 -7.763 -8.953 588 HB3 GLN 89 HB1 GLN 89 5.001 -9.342 -8.394 589 HG2 GLN 89 HG2 GLN 89 6.452 -8.548 -10.146 590 HG3 GLN 89 HG1 GLN 89 5.554 -9.961 -10.698 591 HE21 GLN 89 HE21 GLN 89 5.650 -9.542 -12.850 592 HE22 GLN 89 HE22 GLN 89 4.875 -8.186 -13.601 593 H GLN 90 HN GLN 90 2.915 -10.143 -11.858 594 HA GLN 90 HA GLN 90 2.587 -12.942 -11.323 595 HB2 GLN 90 HB2 GLN 90 3.028 -11.517 -13.956 596 HB3 GLN 90 HB1 GLN 90 2.522 -13.187 -13.768 597 HG2 GLN 90 HG2 GLN 90 0.549 -12.073 -14.242 598 HG3 GLN 90 HG1 GLN 90 0.513 -12.230 -12.487 599 HE21 GLN 90 HE21 GLN 90 -0.857 -10.497 -12.215 600 HE22 GLN 90 HE22 GLN 90 -0.359 -8.860 -12.462 601 H THR 91 HN THR 91 4.016 -14.600 -11.709 602 HA THR 91 HA THR 91 6.773 -14.028 -11.367 603 HB THR 91 HB THR 91 6.131 -16.728 -12.304 604 HG1 THR 91 HG1 THR 91 4.419 -17.063 -11.112 605 HG21 THR 91 HG21 THR 91 7.218 -15.668 -9.691 606 HG22 THR 91 HG22 THR 91 8.187 -16.136 -11.091 607 HG23 THR 91 HG23 THR 91 7.243 -17.349 -10.222 608 H GLY 92 HN GLY 92 4.914 -15.379 -14.094 609 HA2 GLY 92 HA2 GLY 92 6.502 -14.119 -16.057 610 HA3 GLY 92 HA1 GLY 92 7.035 -15.783 -15.858 611 H ASN 357 HT1 ASN 357 -15.007 -11.519 7.488 612 HA ASN 357 HA ASN 357 -13.023 -10.031 5.889 613 HB2 ASN 357 HB2 ASN 357 -14.543 -8.060 6.364 614 HB3 ASN 357 HB1 ASN 357 -15.140 -9.221 5.185 615 HD21 ASN 357 HD21 ASN 357 -15.599 -7.849 8.343 616 HD22 ASN 357 HD22 ASN 357 -17.144 -8.565 8.645 617 H ASN 358 HN ASN 358 -11.546 -9.021 7.075 618 HA ASN 358 HA ASN 358 -12.049 -8.815 9.956 619 HB2 ASN 358 HB2 ASN 358 -9.574 -9.123 10.283 620 HB3 ASN 358 HB1 ASN 358 -10.406 -10.536 9.651 621 HD21 ASN 358 HD21 ASN 358 -9.958 -11.253 7.609 622 HD22 ASN 358 HD22 ASN 358 -8.650 -10.641 6.663 623 H ARG 359 HN ARG 359 -11.941 -6.792 10.811 624 HA ARG 359 HA ARG 359 -10.437 -4.802 9.241 625 HB2 ARG 359 HB2 ARG 359 -12.806 -4.324 9.048 626 HB3 ARG 359 HB1 ARG 359 -13.008 -4.436 10.791 627 HG2 ARG 359 HG2 ARG 359 -11.816 -2.418 11.156 628 HG3 ARG 359 HG1 ARG 359 -11.270 -2.363 9.477 629 HD2 ARG 359 HD2 ARG 359 -14.143 -2.520 9.608 630 HD3 ARG 359 HD1 ARG 359 -13.550 -1.173 10.576 631 HE ARG 359 HE ARG 359 -12.278 -0.535 8.485 632 HH11 ARG 359 HH11 ARG 359 -15.383 -2.206 8.426 633 HH12 ARG 359 HH12 ARG 359 -15.779 -1.630 6.765 634 HH21 ARG 359 HH21 ARG 359 -12.756 0.235 6.415 635 HH22 ARG 359 HH22 ARG 359 -14.317 -0.248 5.640 636 H ASP 360 HN ASP 360 -8.748 -4.085 10.272 637 HA ASP 360 HA ASP 360 -8.814 -3.673 13.159 638 HB2 ASP 360 HB2 ASP 360 -6.824 -4.726 13.595 639 HB3 ASP 360 HB1 ASP 360 -7.440 -5.756 12.312 640 HA PRO 361 HA PRO 361 -7.143 0.168 11.666 641 HB2 PRO 361 HB2 PRO 361 -7.499 1.593 13.928 642 HB3 PRO 361 HB1 PRO 361 -8.863 1.000 12.971 643 HG2 PRO 361 HG2 PRO 361 -7.974 0.129 15.610 644 HG3 PRO 361 HG1 PRO 361 -9.503 -0.197 14.778 645 HD2 PRO 361 HD2 PRO 361 -7.130 -1.892 14.985 646 HD3 PRO 361 HD1 PRO 361 -8.770 -2.305 14.435 647 H ILE 362 HN ILE 362 -5.149 0.845 11.375 648 HA ILE 362 HA ILE 362 -3.149 0.562 13.521 649 HB ILE 362 HB ILE 362 -2.437 0.586 10.600 650 HG12 ILE 362 HG12 ILE 362 -2.200 -2.050 11.257 651 HG13 ILE 362 HG11 ILE 362 -3.670 -1.618 12.127 652 HG21 ILE 362 HG21 ILE 362 -1.031 -0.559 13.008 653 HG22 ILE 362 HG22 ILE 362 -0.649 0.972 12.218 654 HG23 ILE 362 HG23 ILE 362 -0.427 -0.546 11.350 655 HD11 ILE 362 HD11 ILE 362 -3.178 -1.220 9.188 656 HD12 ILE 362 HD12 ILE 362 -4.654 -0.794 10.054 657 HD13 ILE 362 HD13 ILE 362 -4.169 -2.485 9.915 658 H VAL 363 HN VAL 363 -1.991 2.334 14.070 659 HA VAL 363 HA VAL 363 -2.391 4.742 12.408 660 HB VAL 363 HB VAL 363 -1.722 4.673 15.354 661 HG11 VAL 363 HG11 VAL 363 -1.042 6.699 14.161 662 HG12 VAL 363 HG12 VAL 363 -2.318 7.020 15.336 663 HG13 VAL 363 HG13 VAL 363 -2.705 6.930 13.617 664 HG21 VAL 363 HG21 VAL 363 -4.026 5.195 15.836 665 HG22 VAL 363 HG22 VAL 363 -3.946 3.689 14.926 666 HG23 VAL 363 HG23 VAL 363 -4.426 5.181 14.121 667 H ILE 364 HN ILE 364 -0.631 5.604 11.546 668 HA ILE 364 HA ILE 364 1.998 4.829 12.613 669 HB ILE 364 HB ILE 364 1.348 5.372 9.710 670 HG12 ILE 364 HG12 ILE 364 2.156 2.758 10.995 671 HG13 ILE 364 HG11 ILE 364 0.486 3.186 10.638 672 HG21 ILE 364 HG21 ILE 364 3.662 4.578 9.319 673 HG22 ILE 364 HG22 ILE 364 3.906 4.528 11.065 674 HG23 ILE 364 HG23 ILE 364 3.595 6.067 10.262 675 HD11 ILE 364 HD11 ILE 364 1.025 3.317 8.264 676 HD12 ILE 364 HD12 ILE 364 1.426 1.733 8.927 677 HD13 ILE 364 HD13 ILE 364 2.703 2.908 8.620 678 H SER 365 HN SER 365 3.318 6.419 13.130 679 HA SER 365 HA SER 365 2.655 9.139 12.233 680 HB2 SER 365 HB2 SER 365 3.601 8.210 14.950 681 HB3 SER 365 HB1 SER 365 3.593 9.899 14.449 682 HG SER 365 HG SER 365 1.646 8.808 15.595 683 H ASP 366 HN ASP 366 4.245 10.288 11.342 684 HA ASP 366 HA ASP 366 6.968 9.172 11.442 685 HB2 ASP 366 HB2 ASP 366 5.731 9.081 9.215 686 HB3 ASP 366 HB1 ASP 366 5.835 10.839 9.186 687 H SER 367 HN SER 367 8.547 10.475 12.126 688 HA SER 367 HA SER 367 7.835 13.036 13.230 689 HB2 SER 367 HB2 SER 367 10.666 12.164 13.173 690 HB3 SER 367 HB1 SER 367 9.708 12.801 14.511 691 HG SER 367 HG SER 367 10.316 10.280 14.012 692 HA PRO 368 HA PRO 368 9.225 15.466 9.784 693 HB2 PRO 368 HB2 PRO 368 9.469 17.857 11.046 694 HB3 PRO 368 HB1 PRO 368 7.904 17.148 10.628 695 HG2 PRO 368 HG2 PRO 368 9.302 17.198 13.254 696 HG3 PRO 368 HG1 PRO 368 7.577 17.385 12.890 697 HD2 PRO 368 HD2 PRO 368 8.671 15.064 13.815 698 HD3 PRO 368 HD1 PRO 368 7.210 15.136 12.812 Start of MODEL 6 1 H ASP 16 HT1 ASP 16 -4.215 15.418 12.885 2 HA ASP 16 HA ASP 16 -6.122 14.269 13.678 3 HB2 ASP 16 HB2 ASP 16 -7.418 15.800 11.511 4 HB3 ASP 16 HB1 ASP 16 -7.961 14.132 11.674 5 H HIS 17 HN HIS 17 -7.097 12.222 12.568 6 HA HIS 17 HA HIS 17 -5.005 11.173 10.782 7 HB2 HIS 17 HB2 HIS 17 -6.744 9.837 12.846 8 HB3 HIS 17 HB1 HIS 17 -5.902 8.914 11.609 9 HD2 HIS 17 HD2 HIS 17 -3.084 8.938 11.819 10 HE1 HIS 17 HE1 HIS 17 -3.133 10.393 15.791 11 HE2 HIS 17 HE2 HIS 17 -1.781 9.147 14.049 12 H ILE 18 HN ILE 18 -5.605 9.776 9.082 13 HA ILE 18 HA ILE 18 -8.385 10.134 8.167 14 HB ILE 18 HB ILE 18 -6.853 11.379 6.747 15 HG12 ILE 18 HG12 ILE 18 -7.749 8.852 5.343 16 HG13 ILE 18 HG11 ILE 18 -8.781 10.236 5.695 17 HG21 ILE 18 HG21 ILE 18 -5.088 10.254 5.453 18 HG22 ILE 18 HG22 ILE 18 -5.400 8.768 6.349 19 HG23 ILE 18 HG23 ILE 18 -4.793 10.193 7.190 20 HD11 ILE 18 HD11 ILE 18 -6.333 10.301 3.943 21 HD12 ILE 18 HD12 ILE 18 -7.446 11.634 4.243 22 HD13 ILE 18 HD13 ILE 18 -7.999 10.205 3.372 23 H ASN 19 HN ASN 19 -9.508 8.325 7.621 24 HA ASN 19 HA ASN 19 -8.199 5.777 8.182 25 HB2 ASN 19 HB2 ASN 19 -11.116 6.413 7.704 26 HB3 ASN 19 HB1 ASN 19 -10.479 4.846 8.184 27 HD21 ASN 19 HD21 ASN 19 -11.178 8.093 9.176 28 HD22 ASN 19 HD22 ASN 19 -10.979 7.826 10.883 29 H LEU 20 HN LEU 20 -7.181 4.883 6.530 30 HA LEU 20 HA LEU 20 -8.468 4.944 3.878 31 HB2 LEU 20 HB2 LEU 20 -5.580 4.461 4.626 32 HB3 LEU 20 HB1 LEU 20 -6.216 4.419 2.992 33 HG LEU 20 HG LEU 20 -6.207 6.856 4.779 34 HD11 LEU 20 HD11 LEU 20 -4.436 6.110 2.457 35 HD12 LEU 20 HD12 LEU 20 -3.952 6.261 4.148 36 HD13 LEU 20 HD13 LEU 20 -4.473 7.687 3.249 37 HD21 LEU 20 HD21 LEU 20 -6.728 8.013 2.619 38 HD22 LEU 20 HD22 LEU 20 -8.023 7.000 3.252 39 HD23 LEU 20 HD23 LEU 20 -7.028 6.425 1.913 40 H LYS 21 HN LYS 21 -9.429 3.108 3.275 41 HA LYS 21 HA LYS 21 -8.836 0.659 4.721 42 HB2 LYS 21 HB2 LYS 21 -11.003 1.532 2.856 43 HB3 LYS 21 HB1 LYS 21 -10.732 -0.183 3.128 44 HG2 LYS 21 HG2 LYS 21 -11.044 0.187 5.549 45 HG3 LYS 21 HG1 LYS 21 -11.424 1.880 5.209 46 HD2 LYS 21 HD2 LYS 21 -13.282 1.145 3.776 47 HD3 LYS 21 HD1 LYS 21 -12.916 -0.532 4.182 48 HE2 LYS 21 HE2 LYS 21 -13.797 -0.358 6.264 49 HE3 LYS 21 HE1 LYS 21 -13.331 1.335 6.439 50 HZ1 LYS 21 HZ1 LYS 21 -15.151 2.018 5.128 51 HZ2 LYS 21 HZ2 LYS 21 -15.774 0.904 6.244 52 HZ3 LYS 21 HZ3 LYS 21 -15.505 0.434 4.643 53 H VAL 22 HN VAL 22 -7.682 -0.973 3.976 54 HA VAL 22 HA VAL 22 -6.896 -0.944 1.131 55 HB VAL 22 HB VAL 22 -5.353 -2.189 3.419 56 HG11 VAL 22 HG11 VAL 22 -4.967 -3.231 1.244 57 HG12 VAL 22 HG12 VAL 22 -3.538 -2.362 1.801 58 HG13 VAL 22 HG13 VAL 22 -4.569 -1.656 0.558 59 HG21 VAL 22 HG21 VAL 22 -4.793 0.404 1.986 60 HG22 VAL 22 HG22 VAL 22 -3.810 -0.326 3.254 61 HG23 VAL 22 HG23 VAL 22 -5.431 0.263 3.623 62 H ALA 23 HN ALA 23 -7.810 -2.532 -0.005 63 HA ALA 23 HA ALA 23 -8.680 -4.946 1.442 64 HB1 ALA 23 HB1 ALA 23 -10.442 -5.191 -0.193 65 HB2 ALA 23 HB2 ALA 23 -9.840 -3.796 -1.089 66 HB3 ALA 23 HB3 ALA 23 -10.513 -3.585 0.526 67 H GLY 24 HN GLY 24 -7.992 -6.880 0.803 68 HA2 GLY 24 HA2 GLY 24 -5.992 -6.985 -1.304 69 HA3 GLY 24 HA1 GLY 24 -6.385 -8.271 -0.172 70 H GLN 25 HN GLN 25 -6.442 -9.785 -1.866 71 HA GLN 25 HA GLN 25 -8.554 -9.448 -3.868 72 HB2 GLN 25 HB2 GLN 25 -6.372 -11.529 -3.625 73 HB3 GLN 25 HB1 GLN 25 -7.534 -11.437 -4.939 74 HG2 GLN 25 HG2 GLN 25 -5.539 -9.296 -4.249 75 HG3 GLN 25 HG1 GLN 25 -5.351 -10.490 -5.534 76 HE21 GLN 25 HE21 GLN 25 -5.536 -7.524 -5.569 77 HE22 GLN 25 HE22 GLN 25 -6.821 -7.175 -6.680 78 H ASP 26 HN ASP 26 -7.957 -10.895 -0.902 79 HA ASP 26 HA ASP 26 -9.845 -13.073 -1.260 80 HB2 ASP 26 HB2 ASP 26 -9.219 -13.531 1.173 81 HB3 ASP 26 HB1 ASP 26 -7.926 -13.689 -0.013 82 H GLY 27 HN GLY 27 -9.641 -11.266 1.749 83 HA2 GLY 27 HA2 GLY 27 -12.064 -9.776 1.318 84 HA3 GLY 27 HA1 GLY 27 -12.312 -11.201 2.318 85 H SER 28 HN SER 28 -9.256 -9.613 2.427 86 HA SER 28 HA SER 28 -9.686 -8.897 5.203 87 HB2 SER 28 HB2 SER 28 -7.159 -8.142 4.767 88 HB3 SER 28 HB1 SER 28 -7.587 -9.836 5.017 89 HG SER 28 HG SER 28 -7.344 -10.245 2.902 90 H VAL 29 HN VAL 29 -10.203 -6.873 5.878 91 HA VAL 29 HA VAL 29 -9.660 -4.669 3.979 92 HB VAL 29 HB VAL 29 -12.043 -4.670 5.824 93 HG11 VAL 29 HG11 VAL 29 -12.856 -2.946 4.290 94 HG12 VAL 29 HG12 VAL 29 -11.388 -3.111 3.328 95 HG13 VAL 29 HG13 VAL 29 -11.293 -2.509 4.983 96 HG21 VAL 29 HG21 VAL 29 -13.441 -5.321 3.922 97 HG22 VAL 29 HG22 VAL 29 -12.291 -6.593 4.336 98 HG23 VAL 29 HG23 VAL 29 -11.995 -5.558 2.939 99 H VAL 30 HN VAL 30 -7.703 -4.348 5.177 100 HA VAL 30 HA VAL 30 -7.825 -3.718 7.972 101 HB VAL 30 HB VAL 30 -5.456 -3.011 7.702 102 HG11 VAL 30 HG11 VAL 30 -6.176 -5.711 6.565 103 HG12 VAL 30 HG12 VAL 30 -5.983 -5.305 8.271 104 HG13 VAL 30 HG13 VAL 30 -4.591 -5.261 7.191 105 HG21 VAL 30 HG21 VAL 30 -5.931 -3.764 4.822 106 HG22 VAL 30 HG22 VAL 30 -4.340 -3.526 5.545 107 HG23 VAL 30 HG23 VAL 30 -5.475 -2.181 5.446 108 H GLN 31 HN GLN 31 -7.808 -1.752 8.955 109 HA GLN 31 HA GLN 31 -8.417 0.537 7.209 110 HB2 GLN 31 HB2 GLN 31 -10.167 -0.182 8.824 111 HB3 GLN 31 HB1 GLN 31 -9.053 0.151 10.140 112 HG2 GLN 31 HG2 GLN 31 -9.100 2.473 9.719 113 HG3 GLN 31 HG1 GLN 31 -9.901 2.246 8.162 114 HE21 GLN 31 HE21 GLN 31 -10.688 3.813 10.550 115 HE22 GLN 31 HE22 GLN 31 -12.265 3.232 10.970 116 H PHE 32 HN PHE 32 -6.552 1.568 6.821 117 HA PHE 32 HA PHE 32 -4.557 1.840 8.900 118 HB2 PHE 32 HB2 PHE 32 -4.684 2.395 5.984 119 HB3 PHE 32 HB1 PHE 32 -3.553 3.349 6.941 120 HD1 PHE 32 HD1 PHE 32 -4.360 0.029 5.665 121 HD2 PHE 32 HD2 PHE 32 -1.668 2.301 8.050 122 HE1 PHE 32 HE1 PHE 32 -2.757 -1.835 5.622 123 HE2 PHE 32 HE2 PHE 32 -0.057 0.440 8.008 124 HZ PHE 32 HZ PHE 32 -0.602 -1.630 6.794 125 H LYS 33 HN LYS 33 -4.809 3.309 10.394 126 HA LYS 33 HA LYS 33 -6.166 5.826 9.720 127 HB2 LYS 33 HB2 LYS 33 -7.088 4.424 11.574 128 HB3 LYS 33 HB1 LYS 33 -5.574 4.637 12.441 129 HG2 LYS 33 HG2 LYS 33 -5.959 7.015 12.599 130 HG3 LYS 33 HG1 LYS 33 -7.431 6.866 11.635 131 HD2 LYS 33 HD2 LYS 33 -8.386 5.398 13.372 132 HD3 LYS 33 HD1 LYS 33 -6.933 5.632 14.343 133 HE2 LYS 33 HE2 LYS 33 -7.382 7.974 14.567 134 HE3 LYS 33 HE1 LYS 33 -8.717 7.874 13.419 135 HZ1 LYS 33 HZ1 LYS 33 -9.523 7.950 15.682 136 HZ2 LYS 33 HZ2 LYS 33 -8.623 6.580 16.090 137 HZ3 LYS 33 HZ3 LYS 33 -9.897 6.456 14.986 138 H ILE 34 HN ILE 34 -4.271 6.610 8.682 139 HA ILE 34 HA ILE 34 -2.054 7.311 10.489 140 HB ILE 34 HB ILE 34 -0.684 7.626 8.465 141 HG12 ILE 34 HG12 ILE 34 -2.969 6.409 6.908 142 HG13 ILE 34 HG11 ILE 34 -2.695 8.146 6.986 143 HG21 ILE 34 HG21 ILE 34 -0.391 5.295 7.914 144 HG22 ILE 34 HG22 ILE 34 -2.006 4.917 8.514 145 HG23 ILE 34 HG23 ILE 34 -0.753 5.450 9.635 146 HD11 ILE 34 HD11 ILE 34 -1.790 7.010 4.955 147 HD12 ILE 34 HD12 ILE 34 -0.634 6.190 6.008 148 HD13 ILE 34 HD13 ILE 34 -0.613 7.948 5.872 149 H LYS 35 HN LYS 35 -0.899 9.397 9.470 150 HA LYS 35 HA LYS 35 -2.973 11.447 9.512 151 HB2 LYS 35 HB2 LYS 35 0.036 11.563 9.748 152 HB3 LYS 35 HB1 LYS 35 -0.958 13.006 9.612 153 HG2 LYS 35 HG2 LYS 35 -2.120 12.425 11.668 154 HG3 LYS 35 HG1 LYS 35 -1.170 10.945 11.795 155 HD2 LYS 35 HD2 LYS 35 0.878 12.273 11.979 156 HD3 LYS 35 HD1 LYS 35 -0.067 13.755 11.840 157 HE2 LYS 35 HE2 LYS 35 -1.236 13.240 13.898 158 HE3 LYS 35 HE1 LYS 35 -0.392 11.698 14.019 159 HZ1 LYS 35 HZ1 LYS 35 1.682 12.867 14.300 160 HZ2 LYS 35 HZ2 LYS 35 0.570 13.399 15.454 161 HZ3 LYS 35 HZ3 LYS 35 0.914 14.360 14.107 162 H ARG 36 HN ARG 36 -2.833 13.246 7.928 163 HA ARG 36 HA ARG 36 -2.722 12.194 5.278 164 HB2 ARG 36 HB2 ARG 36 -3.060 15.043 6.246 165 HB3 ARG 36 HB1 ARG 36 -3.261 14.521 4.578 166 HG2 ARG 36 HG2 ARG 36 -5.089 13.043 5.274 167 HG3 ARG 36 HG1 ARG 36 -4.906 13.614 6.933 168 HD2 ARG 36 HD2 ARG 36 -6.689 14.862 6.031 169 HD3 ARG 36 HD1 ARG 36 -5.300 15.946 6.016 170 HE ARG 36 HE ARG 36 -5.177 15.717 3.668 171 HH11 ARG 36 HH11 ARG 36 -7.943 14.057 5.093 172 HH12 ARG 36 HH12 ARG 36 -8.856 13.994 3.534 173 HH21 ARG 36 HH21 ARG 36 -6.294 15.637 1.677 174 HH22 ARG 36 HH22 ARG 36 -7.920 14.844 1.627 175 H HIS 37 HN HIS 37 -0.384 13.354 7.339 176 HA HIS 37 HA HIS 37 1.393 14.322 5.224 177 HB2 HIS 37 HB2 HIS 37 2.230 14.224 8.091 178 HB3 HIS 37 HB1 HIS 37 2.587 15.430 6.859 179 HD2 HIS 37 HD2 HIS 37 0.995 17.617 6.862 180 HE1 HIS 37 HE1 HIS 37 -1.750 16.230 9.768 181 HE2 HIS 37 HE2 HIS 37 -0.933 18.251 8.475 182 H THR 38 HN THR 38 0.648 11.468 6.794 183 HA THR 38 HA THR 38 3.297 10.397 7.076 184 HB THR 38 HB THR 38 0.688 8.881 7.048 185 HG1 THR 38 HG1 THR 38 1.757 10.643 8.887 186 HG21 THR 38 HG21 THR 38 3.342 8.292 8.368 187 HG22 THR 38 HG22 THR 38 2.716 7.499 6.920 188 HG23 THR 38 HG23 THR 38 1.889 7.291 8.465 189 HA PRO 39 HA PRO 39 3.803 9.385 2.739 190 HB2 PRO 39 HB2 PRO 39 5.874 7.559 3.822 191 HB3 PRO 39 HB1 PRO 39 6.024 8.835 2.606 192 HG2 PRO 39 HG2 PRO 39 7.004 9.175 5.054 193 HG3 PRO 39 HG1 PRO 39 6.239 10.512 4.173 194 HD2 PRO 39 HD2 PRO 39 5.147 8.855 6.400 195 HD3 PRO 39 HD1 PRO 39 4.952 10.590 6.077 196 H LEU 40 HN LEU 40 2.847 7.890 1.515 197 HA LEU 40 HA LEU 40 1.467 5.711 2.690 198 HB2 LEU 40 HB2 LEU 40 1.973 6.422 -0.193 199 HB3 LEU 40 HB1 LEU 40 0.932 5.108 0.315 200 HG LEU 40 HG LEU 40 0.510 8.042 0.884 201 HD11 LEU 40 HD11 LEU 40 -1.424 7.829 -0.548 202 HD12 LEU 40 HD12 LEU 40 -1.077 6.119 -0.805 203 HD13 LEU 40 HD13 LEU 40 0.029 7.343 -1.422 204 HD21 LEU 40 HD21 LEU 40 -1.061 5.620 1.742 205 HD22 LEU 40 HD22 LEU 40 -1.682 7.270 1.802 206 HD23 LEU 40 HD23 LEU 40 -0.284 6.818 2.777 207 H SER 41 HN SER 41 4.669 6.001 1.598 208 HA SER 41 HA SER 41 5.188 3.437 0.597 209 HB2 SER 41 HB2 SER 41 7.555 3.978 1.621 210 HB3 SER 41 HB1 SER 41 6.942 4.921 0.260 211 HG SER 41 HG SER 41 7.598 6.399 1.728 212 H LYS 42 HN LYS 42 5.350 4.718 3.889 213 HA LYS 42 HA LYS 42 6.158 2.267 5.088 214 HB2 LYS 42 HB2 LYS 42 4.801 4.606 6.442 215 HB3 LYS 42 HB1 LYS 42 5.838 3.396 7.190 216 HG2 LYS 42 HG2 LYS 42 7.711 4.213 5.779 217 HG3 LYS 42 HG1 LYS 42 6.657 5.505 5.207 218 HD2 LYS 42 HD2 LYS 42 6.455 6.383 7.450 219 HD3 LYS 42 HD1 LYS 42 7.395 5.031 8.094 220 HE2 LYS 42 HE2 LYS 42 9.286 5.756 6.628 221 HE3 LYS 42 HE1 LYS 42 8.346 7.187 6.212 222 HZ1 LYS 42 HZ1 LYS 42 10.067 7.337 8.083 223 HZ2 LYS 42 HZ2 LYS 42 8.912 6.546 9.031 224 HZ3 LYS 42 HZ3 LYS 42 8.551 8.047 8.330 225 H LEU 43 HN LEU 43 3.117 3.709 4.254 226 HA LEU 43 HA LEU 43 1.435 2.086 5.861 227 HB2 LEU 43 HB2 LEU 43 0.603 4.148 4.903 228 HB3 LEU 43 HB1 LEU 43 0.947 3.585 3.281 229 HG LEU 43 HG LEU 43 -0.955 1.941 4.846 230 HD11 LEU 43 HD11 LEU 43 -2.813 3.474 4.334 231 HD12 LEU 43 HD12 LEU 43 -1.648 4.689 3.817 232 HD13 LEU 43 HD13 LEU 43 -1.678 4.157 5.496 233 HD21 LEU 43 HD21 LEU 43 -0.946 2.997 2.018 234 HD22 LEU 43 HD22 LEU 43 -2.080 1.820 2.680 235 HD23 LEU 43 HD23 LEU 43 -0.371 1.411 2.527 236 H MET 44 HN MET 44 2.540 1.893 2.507 237 HA MET 44 HA MET 44 1.219 -0.523 1.872 238 HB2 MET 44 HB2 MET 44 3.664 0.768 0.656 239 HB3 MET 44 HB1 MET 44 2.832 -0.615 -0.036 240 HG2 MET 44 HG2 MET 44 0.792 0.745 -0.239 241 HG3 MET 44 HG1 MET 44 1.681 2.133 0.385 242 HE1 MET 44 HE1 MET 44 3.526 3.428 -0.902 243 HE2 MET 44 HE2 MET 44 4.226 2.908 -2.437 244 HE3 MET 44 HE3 MET 44 4.508 1.965 -0.973 245 H LYS 45 HN LYS 45 4.436 0.208 3.111 246 HA LYS 45 HA LYS 45 5.445 -2.426 2.957 247 HB2 LYS 45 HB2 LYS 45 6.565 -0.029 3.464 248 HB3 LYS 45 HB1 LYS 45 6.457 -0.654 5.105 249 HG2 LYS 45 HG2 LYS 45 7.817 -2.510 4.597 250 HG3 LYS 45 HG1 LYS 45 7.688 -2.222 2.860 251 HD2 LYS 45 HD2 LYS 45 8.859 -0.029 3.246 252 HD3 LYS 45 HD1 LYS 45 9.163 -0.568 4.898 253 HE2 LYS 45 HE2 LYS 45 10.356 -2.527 4.035 254 HE3 LYS 45 HE1 LYS 45 10.057 -1.982 2.387 255 HZ1 LYS 45 HZ1 LYS 45 11.321 0.048 2.926 256 HZ2 LYS 45 HZ2 LYS 45 12.257 -1.351 3.040 257 HZ3 LYS 45 HZ3 LYS 45 11.690 -0.598 4.441 258 H ALA 46 HN ALA 46 3.673 -0.672 5.443 259 HA ALA 46 HA ALA 46 3.983 -2.497 7.548 260 HB1 ALA 46 HB1 ALA 46 3.106 -0.238 7.864 261 HB2 ALA 46 HB2 ALA 46 2.012 -1.450 8.529 262 HB3 ALA 46 HB3 ALA 46 1.643 -0.680 6.984 263 H TYR 47 HN TYR 47 1.469 -2.272 5.036 264 HA TYR 47 HA TYR 47 0.008 -4.524 5.972 265 HB2 TYR 47 HB2 TYR 47 -0.974 -2.788 4.487 266 HB3 TYR 47 HB1 TYR 47 0.059 -3.355 3.178 267 HD1 TYR 47 HD1 TYR 47 -1.002 -4.675 1.611 268 HD2 TYR 47 HD2 TYR 47 -2.300 -4.889 5.657 269 HE1 TYR 47 HE1 TYR 47 -2.705 -6.330 0.971 270 HE2 TYR 47 HE2 TYR 47 -4.006 -6.544 5.028 271 HH TYR 47 HH TYR 47 -5.251 -7.240 3.021 272 H CYS 48 HN CYS 48 2.579 -4.065 3.629 273 HA CYS 48 HA CYS 48 2.622 -6.619 2.492 274 HB2 CYS 48 HB2 CYS 48 3.851 -4.651 1.622 275 HB3 CYS 48 HB1 CYS 48 4.956 -4.756 2.989 276 HG CYS 48 HG CYS 48 5.819 -7.383 2.218 277 H GLU 49 HN GLU 49 4.294 -5.324 5.333 278 HA GLU 49 HA GLU 49 5.726 -7.695 5.939 279 HB2 GLU 49 HB2 GLU 49 5.011 -5.243 7.539 280 HB3 GLU 49 HB1 GLU 49 5.921 -6.575 8.235 281 HG2 GLU 49 HG2 GLU 49 6.739 -4.930 5.850 282 HG3 GLU 49 HG1 GLU 49 7.388 -4.789 7.484 283 H ARG 50 HN ARG 50 2.476 -6.693 6.504 284 HA ARG 50 HA ARG 50 1.980 -8.467 8.706 285 HB2 ARG 50 HB2 ARG 50 0.357 -6.638 7.020 286 HB3 ARG 50 HB1 ARG 50 -0.485 -7.937 7.855 287 HG2 ARG 50 HG2 ARG 50 0.222 -7.155 9.976 288 HG3 ARG 50 HG1 ARG 50 1.349 -6.004 9.247 289 HD2 ARG 50 HD2 ARG 50 -0.353 -4.591 8.556 290 HD3 ARG 50 HD1 ARG 50 -1.567 -5.868 8.615 291 HE ARG 50 HE ARG 50 -0.358 -4.925 11.110 292 HH11 ARG 50 HH11 ARG 50 -3.131 -5.177 8.968 293 HH12 ARG 50 HH12 ARG 50 -4.323 -4.740 10.257 294 HH21 ARG 50 HH21 ARG 50 -3.591 -4.267 12.373 295 HH22 ARG 50 HH22 ARG 50 -1.828 -4.390 12.782 296 H GLN 51 HN GLN 51 1.695 -8.620 5.226 297 HA GLN 51 HA GLN 51 0.294 -11.164 5.340 298 HB2 GLN 51 HB2 GLN 51 1.411 -9.772 2.904 299 HB3 GLN 51 HB1 GLN 51 0.213 -11.055 2.938 300 HG2 GLN 51 HG2 GLN 51 -0.130 -8.215 3.861 301 HG3 GLN 51 HG1 GLN 51 -0.901 -8.996 2.482 302 HE21 GLN 51 HE21 GLN 51 -2.577 -10.489 2.861 303 HE22 GLN 51 HE22 GLN 51 -3.427 -10.523 4.363 304 H GLY 52 HN GLY 52 3.425 -10.121 5.604 305 HA2 GLY 52 HA2 GLY 52 5.420 -11.258 5.732 306 HA3 GLY 52 HA1 GLY 52 4.509 -12.747 5.527 307 H LEU 53 HN LEU 53 4.714 -9.987 3.326 308 HA LEU 53 HA LEU 53 5.991 -11.780 1.363 309 HB2 LEU 53 HB2 LEU 53 3.938 -9.625 0.856 310 HB3 LEU 53 HB1 LEU 53 4.752 -10.549 -0.391 311 HG LEU 53 HG LEU 53 2.929 -11.739 1.700 312 HD11 LEU 53 HD11 LEU 53 1.293 -11.942 -0.089 313 HD12 LEU 53 HD12 LEU 53 2.386 -11.113 -1.202 314 HD13 LEU 53 HD13 LEU 53 1.715 -10.252 0.185 315 HD21 LEU 53 HD21 LEU 53 4.600 -13.300 0.862 316 HD22 LEU 53 HD22 LEU 53 4.148 -12.913 -0.798 317 HD23 LEU 53 HD23 LEU 53 2.997 -13.719 0.266 318 H SER 54 HN SER 54 6.896 -10.412 -0.519 319 HA SER 54 HA SER 54 8.696 -8.455 0.646 320 HB2 SER 54 HB2 SER 54 9.747 -10.098 -0.751 321 HB3 SER 54 HB1 SER 54 8.591 -9.817 -2.050 322 HG SER 54 HG SER 54 10.898 -8.507 -1.478 323 H MET 55 HN MET 55 8.736 -6.312 0.121 324 HA MET 55 HA MET 55 6.374 -5.074 -0.739 325 HB2 MET 55 HB2 MET 55 8.095 -4.015 0.707 326 HB3 MET 55 HB1 MET 55 9.160 -3.893 -0.688 327 HG2 MET 55 HG2 MET 55 7.519 -2.451 -1.799 328 HG3 MET 55 HG1 MET 55 6.483 -2.550 -0.375 329 HE1 MET 55 HE1 MET 55 6.510 0.205 -0.532 330 HE2 MET 55 HE2 MET 55 7.660 0.115 -1.866 331 HE3 MET 55 HE3 MET 55 8.006 1.138 -0.471 332 H ARG 56 HN ARG 56 9.024 -6.350 -2.529 333 HA ARG 56 HA ARG 56 8.338 -4.824 -4.917 334 HB2 ARG 56 HB2 ARG 56 10.739 -5.628 -4.000 335 HB3 ARG 56 HB1 ARG 56 10.359 -6.989 -5.046 336 HG2 ARG 56 HG2 ARG 56 10.201 -5.590 -6.957 337 HG3 ARG 56 HG1 ARG 56 10.261 -4.129 -5.968 338 HD2 ARG 56 HD2 ARG 56 12.553 -4.968 -5.200 339 HD3 ARG 56 HD1 ARG 56 12.457 -6.092 -6.552 340 HE ARG 56 HE ARG 56 12.123 -3.974 -7.938 341 HH11 ARG 56 HH11 ARG 56 15.128 -2.780 -5.488 342 HH12 ARG 56 HH12 ARG 56 14.038 -4.125 -4.985 343 HH21 ARG 56 HH21 ARG 56 14.829 -1.748 -7.513 344 HH22 ARG 56 HH22 ARG 56 13.496 -2.270 -8.608 345 H GLN 57 HN GLN 57 7.166 -7.492 -3.429 346 HA GLN 57 HA GLN 57 6.782 -9.088 -5.840 347 HB2 GLN 57 HB2 GLN 57 7.352 -10.234 -3.739 348 HB3 GLN 57 HB1 GLN 57 5.892 -9.598 -2.997 349 HG2 GLN 57 HG2 GLN 57 4.576 -10.816 -4.743 350 HG3 GLN 57 HG1 GLN 57 6.084 -11.573 -5.257 351 HE21 GLN 57 HE21 GLN 57 3.628 -12.723 -4.128 352 HE22 GLN 57 HE22 GLN 57 4.135 -13.615 -2.733 353 H ILE 58 HN ILE 58 4.985 -6.976 -3.705 354 HA ILE 58 HA ILE 58 2.570 -7.508 -5.299 355 HB ILE 58 HB ILE 58 1.356 -6.356 -3.387 356 HG12 ILE 58 HG12 ILE 58 3.960 -6.940 -1.957 357 HG13 ILE 58 HG11 ILE 58 3.354 -5.334 -2.348 358 HG21 ILE 58 HG21 ILE 58 1.215 -8.737 -3.746 359 HG22 ILE 58 HG22 ILE 58 1.328 -8.408 -2.016 360 HG23 ILE 58 HG23 ILE 58 2.742 -8.988 -2.897 361 HD11 ILE 58 HD11 ILE 58 2.027 -7.315 -0.515 362 HD12 ILE 58 HD12 ILE 58 1.437 -5.699 -0.896 363 HD13 ILE 58 HD13 ILE 58 2.955 -5.901 -0.019 364 H ARG 59 HN ARG 59 1.115 -5.617 -5.594 365 HA ARG 59 HA ARG 59 2.580 -3.074 -5.830 366 HB2 ARG 59 HB2 ARG 59 0.864 -4.356 -7.969 367 HB3 ARG 59 HB1 ARG 59 1.426 -2.692 -8.017 368 HG2 ARG 59 HG2 ARG 59 3.185 -5.137 -8.006 369 HG3 ARG 59 HG1 ARG 59 2.782 -4.159 -9.418 370 HD2 ARG 59 HD2 ARG 59 3.847 -2.216 -8.350 371 HD3 ARG 59 HD1 ARG 59 4.283 -3.223 -6.973 372 HE ARG 59 HE ARG 59 5.561 -3.148 -9.555 373 HH11 ARG 59 HH11 ARG 59 6.504 -6.003 -6.832 374 HH12 ARG 59 HH12 ARG 59 5.053 -4.955 -6.575 375 HH21 ARG 59 HH21 ARG 59 7.442 -4.416 -9.879 376 HH22 ARG 59 HH22 ARG 59 7.856 -5.671 -8.653 377 H PHE 60 HN PHE 60 1.383 -1.283 -5.336 378 HA PHE 60 HA PHE 60 -1.390 -1.777 -4.492 379 HB2 PHE 60 HB2 PHE 60 0.657 0.227 -3.530 380 HB3 PHE 60 HB1 PHE 60 -1.046 0.312 -3.094 381 HD1 PHE 60 HD1 PHE 60 1.936 -1.897 -2.917 382 HD2 PHE 60 HD2 PHE 60 -1.862 -0.887 -1.279 383 HE1 PHE 60 HE1 PHE 60 2.350 -3.414 -1.025 384 HE2 PHE 60 HE2 PHE 60 -1.455 -2.403 0.613 385 HZ PHE 60 HZ PHE 60 0.656 -3.669 0.741 386 H ARG 61 HN ARG 61 -3.006 -0.678 -5.431 387 HA ARG 61 HA ARG 61 -2.286 1.566 -7.200 388 HB2 ARG 61 HB2 ARG 61 -4.317 -0.611 -7.725 389 HB3 ARG 61 HB1 ARG 61 -4.135 0.837 -8.706 390 HG2 ARG 61 HG2 ARG 61 -1.758 0.128 -9.119 391 HG3 ARG 61 HG1 ARG 61 -2.168 -1.408 -8.355 392 HD2 ARG 61 HD2 ARG 61 -4.030 -1.628 -10.025 393 HD3 ARG 61 HD1 ARG 61 -3.368 -0.217 -10.848 394 HE ARG 61 HE ARG 61 -1.447 -2.317 -10.435 395 HH11 ARG 61 HH11 ARG 61 -3.373 -1.956 -13.980 396 HH12 ARG 61 HH12 ARG 61 -4.007 -1.116 -12.517 397 HH21 ARG 61 HH21 ARG 61 -0.604 -3.398 -12.252 398 HH22 ARG 61 HH22 ARG 61 -1.453 -3.234 -13.833 399 H PHE 62 HN PHE 62 -3.643 3.298 -7.245 400 HA PHE 62 HA PHE 62 -6.013 3.238 -5.514 401 HB2 PHE 62 HB2 PHE 62 -4.498 4.279 -4.063 402 HB3 PHE 62 HB1 PHE 62 -3.646 5.084 -5.373 403 HD1 PHE 62 HD1 PHE 62 -6.862 5.087 -3.512 404 HD2 PHE 62 HD2 PHE 62 -4.128 7.289 -5.921 405 HE1 PHE 62 HE1 PHE 62 -8.148 7.146 -3.092 406 HE2 PHE 62 HE2 PHE 62 -5.407 9.344 -5.504 407 HZ PHE 62 HZ PHE 62 -7.419 9.274 -4.088 408 H ASP 63 HN ASP 63 -7.721 3.898 -6.627 409 HA ASP 63 HA ASP 63 -9.057 4.902 -8.167 410 HB2 ASP 63 HB2 ASP 63 -8.068 6.944 -7.037 411 HB3 ASP 63 HB1 ASP 63 -6.922 7.036 -8.369 412 H GLY 64 HN GLY 64 -6.928 3.027 -8.989 413 HA2 GLY 64 HA2 GLY 64 -6.658 2.027 -11.097 414 HA3 GLY 64 HA1 GLY 64 -7.131 3.539 -11.852 415 H GLN 65 HN GLN 65 -5.007 4.627 -9.739 416 HA GLN 65 HA GLN 65 -2.764 4.328 -11.621 417 HB2 GLN 65 HB2 GLN 65 -3.671 6.558 -9.842 418 HB3 GLN 65 HB1 GLN 65 -1.968 6.436 -10.264 419 HG2 GLN 65 HG2 GLN 65 -4.239 6.613 -12.232 420 HG3 GLN 65 HG1 GLN 65 -3.199 7.953 -11.743 421 HE21 GLN 65 HE21 GLN 65 -0.987 7.887 -12.328 422 HE22 GLN 65 HE22 GLN 65 -0.453 6.958 -13.683 423 HA PRO 66 HA PRO 66 -0.547 2.118 -8.476 424 HB2 PRO 66 HB2 PRO 66 1.996 2.559 -9.351 425 HB3 PRO 66 HB1 PRO 66 0.895 1.403 -10.116 426 HG2 PRO 66 HG2 PRO 66 1.567 4.187 -10.950 427 HG3 PRO 66 HG1 PRO 66 1.372 2.732 -11.946 428 HD2 PRO 66 HD2 PRO 66 -0.567 4.594 -11.739 429 HD3 PRO 66 HD1 PRO 66 -0.925 2.865 -11.937 430 H ILE 67 HN ILE 67 0.318 2.588 -6.517 431 HA ILE 67 HA ILE 67 0.643 5.382 -5.834 432 HB ILE 67 HB ILE 67 0.984 2.955 -4.066 433 HG12 ILE 67 HG12 ILE 67 -1.455 4.681 -4.558 434 HG13 ILE 67 HG11 ILE 67 -1.259 3.003 -5.050 435 HG21 ILE 67 HG21 ILE 67 0.457 5.840 -3.360 436 HG22 ILE 67 HG22 ILE 67 2.007 5.013 -3.200 437 HG23 ILE 67 HG23 ILE 67 0.631 4.500 -2.224 438 HD11 ILE 67 HD11 ILE 67 -1.392 4.036 -2.229 439 HD12 ILE 67 HD12 ILE 67 -1.117 2.356 -2.686 440 HD13 ILE 67 HD13 ILE 67 -2.643 3.139 -3.089 441 H ASN 68 HN ASN 68 2.520 6.409 -5.301 442 HA ASN 68 HA ASN 68 4.986 4.964 -5.943 443 HB2 ASN 68 HB2 ASN 68 4.282 7.890 -5.800 444 HB3 ASN 68 HB1 ASN 68 5.954 7.347 -5.863 445 HD21 ASN 68 HD21 ASN 68 3.064 7.868 -7.613 446 HD22 ASN 68 HD22 ASN 68 3.656 7.402 -9.171 447 H GLU 69 HN GLU 69 6.939 5.694 -4.613 448 HA GLU 69 HA GLU 69 6.467 4.939 -1.923 449 HB2 GLU 69 HB2 GLU 69 8.955 6.133 -3.152 450 HB3 GLU 69 HB1 GLU 69 8.866 5.294 -1.607 451 HG2 GLU 69 HG2 GLU 69 8.073 3.275 -2.863 452 HG3 GLU 69 HG1 GLU 69 8.462 4.140 -4.349 453 H THR 70 HN THR 70 7.609 8.006 -3.335 454 HA THR 70 HA THR 70 7.270 9.368 -0.814 455 HB THR 70 HB THR 70 7.739 10.817 -3.389 456 HG1 THR 70 HG1 THR 70 9.470 9.650 -3.742 457 HG21 THR 70 HG21 THR 70 8.914 11.098 -0.616 458 HG22 THR 70 HG22 THR 70 7.586 12.062 -1.266 459 HG23 THR 70 HG23 THR 70 9.194 12.180 -1.980 460 H ASP 71 HN ASP 71 4.867 8.247 -1.656 461 HA ASP 71 HA ASP 71 3.276 10.530 -2.601 462 HB2 ASP 71 HB2 ASP 71 2.997 7.607 -2.826 463 HB3 ASP 71 HB1 ASP 71 1.507 8.446 -2.412 464 H THR 72 HN THR 72 1.410 11.168 -1.443 465 HA THR 72 HA THR 72 1.157 10.151 1.289 466 HB THR 72 HB THR 72 0.747 12.788 1.752 467 HG1 THR 72 HG1 THR 72 3.094 12.968 0.251 468 HG21 THR 72 HG21 THR 72 3.434 11.410 1.855 469 HG22 THR 72 HG22 THR 72 2.170 11.288 3.078 470 HG23 THR 72 HG23 THR 72 2.963 12.834 2.781 471 HA PRO 73 HA PRO 73 -3.210 10.270 0.625 472 HB2 PRO 73 HB2 PRO 73 -3.448 11.761 3.191 473 HB3 PRO 73 HB1 PRO 73 -4.225 10.252 2.690 474 HG2 PRO 73 HG2 PRO 73 -2.223 10.222 4.437 475 HG3 PRO 73 HG1 PRO 73 -2.385 8.957 3.201 476 HD2 PRO 73 HD2 PRO 73 -0.495 11.258 3.305 477 HD3 PRO 73 HD1 PRO 73 -0.248 9.614 2.684 478 H ALA 74 HN ALA 74 -1.807 13.271 1.906 479 HA ALA 74 HA ALA 74 -3.893 14.948 0.937 480 HB1 ALA 74 HB1 ALA 74 -2.387 16.793 1.516 481 HB2 ALA 74 HB2 ALA 74 -1.079 15.642 1.775 482 HB3 ALA 74 HB3 ALA 74 -2.501 15.610 2.817 483 H GLN 75 HN GLN 75 -0.779 13.914 -0.332 484 HA GLN 75 HA GLN 75 -0.636 15.719 -2.502 485 HB2 GLN 75 HB2 GLN 75 1.256 14.371 -1.546 486 HB3 GLN 75 HB1 GLN 75 0.575 12.957 -2.337 487 HG2 GLN 75 HG2 GLN 75 2.369 13.823 -3.665 488 HG3 GLN 75 HG1 GLN 75 0.845 14.082 -4.512 489 HE21 GLN 75 HE21 GLN 75 1.737 15.725 -5.756 490 HE22 GLN 75 HE22 GLN 75 2.069 17.294 -5.104 491 H LEU 76 HN LEU 76 -1.960 12.455 -2.188 492 HA LEU 76 HA LEU 76 -2.742 12.419 -4.986 493 HB2 LEU 76 HB2 LEU 76 -3.099 10.420 -2.758 494 HB3 LEU 76 HB1 LEU 76 -3.698 10.174 -4.387 495 HG LEU 76 HG LEU 76 -0.798 10.506 -3.614 496 HD11 LEU 76 HD11 LEU 76 -1.676 8.372 -2.884 497 HD12 LEU 76 HD12 LEU 76 -0.618 8.141 -4.277 498 HD13 LEU 76 HD13 LEU 76 -2.369 8.083 -4.479 499 HD21 LEU 76 HD21 LEU 76 -1.174 11.402 -5.823 500 HD22 LEU 76 HD22 LEU 76 -2.099 9.973 -6.284 501 HD23 LEU 76 HD23 LEU 76 -0.371 9.838 -5.963 502 H GLU 77 HN GLU 77 -3.937 13.977 -2.470 503 HA GLU 77 HA GLU 77 -5.934 14.858 -1.864 504 HB2 GLU 77 HB2 GLU 77 -6.516 14.160 -4.738 505 HB3 GLU 77 HB1 GLU 77 -7.632 15.068 -3.726 506 HG2 GLU 77 HG2 GLU 77 -6.261 16.917 -3.642 507 HG3 GLU 77 HG1 GLU 77 -4.809 15.983 -4.001 508 H MET 78 HN MET 78 -5.543 12.211 -1.089 509 HA MET 78 HA MET 78 -7.962 10.705 -1.582 510 HB2 MET 78 HB2 MET 78 -5.907 10.175 0.565 511 HB3 MET 78 HB1 MET 78 -7.025 9.029 -0.157 512 HG2 MET 78 HG2 MET 78 -5.827 9.057 -2.222 513 HG3 MET 78 HG1 MET 78 -4.799 10.372 -1.659 514 HE1 MET 78 HE1 MET 78 -6.044 7.053 0.094 515 HE2 MET 78 HE2 MET 78 -4.641 6.018 -0.170 516 HE3 MET 78 HE3 MET 78 -5.590 6.582 -1.544 517 H GLU 79 HN GLU 79 -9.557 10.246 0.012 518 HA GLU 79 HA GLU 79 -9.551 12.145 2.257 519 HB2 GLU 79 HB2 GLU 79 -11.763 11.468 0.352 520 HB3 GLU 79 HB1 GLU 79 -12.135 12.001 1.985 521 HG2 GLU 79 HG2 GLU 79 -10.762 13.508 -0.209 522 HG3 GLU 79 HG1 GLU 79 -12.221 13.936 0.682 523 H ASP 80 HN ASP 80 -11.408 11.464 3.830 524 HA ASP 80 HA ASP 80 -10.574 9.057 5.027 525 HB2 ASP 80 HB2 ASP 80 -11.572 11.077 6.181 526 HB3 ASP 80 HB1 ASP 80 -13.143 10.536 5.600 527 H GLU 81 HN GLU 81 -11.369 7.052 5.020 528 HA GLU 81 HA GLU 81 -12.613 5.230 4.544 529 HB2 GLU 81 HB2 GLU 81 -14.620 7.361 4.205 530 HB3 GLU 81 HB1 GLU 81 -14.955 5.873 3.333 531 HG2 GLU 81 HG2 GLU 81 -14.449 6.116 6.289 532 HG3 GLU 81 HG1 GLU 81 -16.014 5.874 5.514 533 H ASP 82 HN ASP 82 -10.695 6.251 2.730 534 HA ASP 82 HA ASP 82 -11.823 5.828 0.087 535 HB2 ASP 82 HB2 ASP 82 -9.788 7.409 0.826 536 HB3 ASP 82 HB1 ASP 82 -8.871 5.950 0.460 537 H THR 83 HN THR 83 -10.095 4.348 -1.302 538 HA THR 83 HA THR 83 -9.721 1.846 0.181 539 HB THR 83 HB THR 83 -10.888 1.571 -2.531 540 HG1 THR 83 HG1 THR 83 -12.372 2.411 -0.240 541 HG21 THR 83 HG21 THR 83 -10.245 -0.382 -1.185 542 HG22 THR 83 HG22 THR 83 -11.982 -0.357 -1.492 543 HG23 THR 83 HG23 THR 83 -11.357 0.132 0.084 544 H ILE 84 HN ILE 84 -7.962 0.729 -0.391 545 HA ILE 84 HA ILE 84 -6.479 1.594 -2.788 546 HB ILE 84 HB ILE 84 -5.372 0.528 -0.179 547 HG12 ILE 84 HG12 ILE 84 -5.011 3.269 -1.406 548 HG13 ILE 84 HG11 ILE 84 -6.227 2.904 -0.187 549 HG21 ILE 84 HG21 ILE 84 -3.165 1.039 -1.166 550 HG22 ILE 84 HG22 ILE 84 -3.960 1.397 -2.696 551 HG23 ILE 84 HG23 ILE 84 -4.023 -0.234 -2.033 552 HD11 ILE 84 HD11 ILE 84 -3.265 2.554 0.198 553 HD12 ILE 84 HD12 ILE 84 -4.525 2.362 1.418 554 HD13 ILE 84 HD13 ILE 84 -4.200 3.952 0.732 555 H ASP 85 HN ASP 85 -5.942 0.045 -4.236 556 HA ASP 85 HA ASP 85 -6.877 -2.677 -3.702 557 HB2 ASP 85 HB2 ASP 85 -6.392 -1.066 -6.163 558 HB3 ASP 85 HB1 ASP 85 -6.225 -2.813 -6.280 559 H VAL 86 HN VAL 86 -5.560 -4.387 -3.535 560 HA VAL 86 HA VAL 86 -2.672 -3.933 -3.907 561 HB VAL 86 HB VAL 86 -3.899 -6.093 -2.195 562 HG11 VAL 86 HG11 VAL 86 -1.689 -6.143 -1.152 563 HG12 VAL 86 HG12 VAL 86 -1.142 -4.867 -2.240 564 HG13 VAL 86 HG13 VAL 86 -1.585 -6.448 -2.887 565 HG21 VAL 86 HG21 VAL 86 -3.414 -4.641 -0.253 566 HG22 VAL 86 HG22 VAL 86 -4.667 -3.985 -1.306 567 HG23 VAL 86 HG23 VAL 86 -3.032 -3.326 -1.364 568 H PHE 87 HN PHE 87 -1.728 -5.008 -5.516 569 HA PHE 87 HA PHE 87 -3.019 -7.473 -6.494 570 HB2 PHE 87 HB2 PHE 87 -1.604 -5.321 -8.076 571 HB3 PHE 87 HB1 PHE 87 -2.087 -6.876 -8.743 572 HD1 PHE 87 HD1 PHE 87 -4.559 -7.468 -8.695 573 HD2 PHE 87 HD2 PHE 87 -3.094 -3.534 -8.021 574 HE1 PHE 87 HE1 PHE 87 -6.779 -6.552 -9.231 575 HE2 PHE 87 HE2 PHE 87 -5.311 -2.613 -8.551 576 HZ PHE 87 HZ PHE 87 -7.153 -4.122 -9.158 577 H GLN 88 HN GLN 88 -1.539 -8.973 -7.580 578 HA GLN 88 HA GLN 88 1.079 -9.014 -6.242 579 HB2 GLN 88 HB2 GLN 88 -0.743 -11.180 -7.260 580 HB3 GLN 88 HB1 GLN 88 0.968 -11.496 -7.004 581 HG2 GLN 88 HG2 GLN 88 -0.264 -10.197 -4.721 582 HG3 GLN 88 HG1 GLN 88 -1.048 -11.720 -5.136 583 HE21 GLN 88 HE21 GLN 88 -0.284 -12.657 -3.217 584 HE22 GLN 88 HE22 GLN 88 1.364 -13.148 -3.053 585 H GLN 89 HN GLN 89 2.943 -9.604 -7.438 586 HA GLN 89 HA GLN 89 2.968 -8.544 -10.093 587 HB2 GLN 89 HB2 GLN 89 4.832 -8.380 -8.376 588 HB3 GLN 89 HB1 GLN 89 5.193 -10.063 -8.734 589 HG2 GLN 89 HG2 GLN 89 6.644 -8.479 -9.932 590 HG3 GLN 89 HG1 GLN 89 5.721 -9.524 -11.009 591 HE21 GLN 89 HE21 GLN 89 5.869 -8.133 -12.741 592 HE22 GLN 89 HE22 GLN 89 5.020 -6.625 -12.804 593 H GLN 90 HN GLN 90 3.656 -9.639 -11.992 594 HA GLN 90 HA GLN 90 2.372 -12.129 -12.409 595 HB2 GLN 90 HB2 GLN 90 4.192 -10.432 -14.101 596 HB3 GLN 90 HB1 GLN 90 3.605 -11.988 -14.662 597 HG2 GLN 90 HG2 GLN 90 2.153 -10.413 -15.593 598 HG3 GLN 90 HG1 GLN 90 1.268 -11.096 -14.235 599 HE21 GLN 90 HE21 GLN 90 0.687 -9.802 -12.551 600 HE22 GLN 90 HE22 GLN 90 0.929 -8.089 -12.532 601 H THR 91 HN THR 91 3.152 -14.164 -12.505 602 HA THR 91 HA THR 91 5.837 -14.628 -11.478 603 HB THR 91 HB THR 91 4.623 -17.093 -11.865 604 HG1 THR 91 HG1 THR 91 2.485 -16.710 -10.994 605 HG21 THR 91 HG21 THR 91 4.542 -15.295 -9.436 606 HG22 THR 91 HG22 THR 91 5.841 -16.409 -9.864 607 HG23 THR 91 HG23 THR 91 4.251 -17.034 -9.428 608 H GLY 92 HN GLY 92 4.636 -14.119 -14.432 609 HA2 GLY 92 HA2 GLY 92 6.463 -14.521 -16.160 610 HA3 GLY 92 HA1 GLY 92 6.229 -16.215 -15.746 611 H ASN 357 HT1 ASN 357 -15.575 -11.202 7.156 612 HA ASN 357 HA ASN 357 -13.935 -10.153 5.757 613 HB2 ASN 357 HB2 ASN 357 -14.050 -7.810 5.225 614 HB3 ASN 357 HB1 ASN 357 -15.551 -8.559 4.696 615 HD21 ASN 357 HD21 ASN 357 -14.985 -5.777 5.300 616 HD22 ASN 357 HD22 ASN 357 -16.093 -5.309 6.545 617 H ASN 358 HN ASN 358 -12.204 -8.816 6.697 618 HA ASN 358 HA ASN 358 -12.586 -8.504 9.593 619 HB2 ASN 358 HB2 ASN 358 -10.138 -9.096 9.801 620 HB3 ASN 358 HB1 ASN 358 -11.184 -10.414 9.291 621 HD21 ASN 358 HD21 ASN 358 -11.084 -11.123 7.141 622 HD22 ASN 358 HD22 ASN 358 -9.716 -10.784 6.141 623 H ARG 359 HN ARG 359 -12.278 -6.534 10.373 624 HA ARG 359 HA ARG 359 -10.482 -4.753 8.870 625 HB2 ARG 359 HB2 ARG 359 -12.129 -2.964 10.029 626 HB3 ARG 359 HB1 ARG 359 -12.359 -3.588 8.401 627 HG2 ARG 359 HG2 ARG 359 -13.915 -5.266 9.276 628 HG3 ARG 359 HG1 ARG 359 -13.699 -4.608 10.898 629 HD2 ARG 359 HD2 ARG 359 -14.637 -2.938 8.581 630 HD3 ARG 359 HD1 ARG 359 -15.750 -3.834 9.612 631 HE ARG 359 HE ARG 359 -14.123 -2.322 11.283 632 HH11 ARG 359 HH11 ARG 359 -16.494 -1.774 8.742 633 HH12 ARG 359 HH12 ARG 359 -17.073 -0.224 9.464 634 HH21 ARG 359 HH21 ARG 359 -14.806 -0.334 12.204 635 HH22 ARG 359 HH22 ARG 359 -16.115 0.592 11.375 636 H ASP 360 HN ASP 360 -8.825 -4.123 10.010 637 HA ASP 360 HA ASP 360 -9.101 -3.664 12.883 638 HB2 ASP 360 HB2 ASP 360 -7.251 -4.847 13.494 639 HB3 ASP 360 HB1 ASP 360 -7.726 -5.807 12.104 640 HA PRO 361 HA PRO 361 -7.187 0.104 11.506 641 HB2 PRO 361 HB2 PRO 361 -7.616 1.570 13.714 642 HB3 PRO 361 HB1 PRO 361 -8.952 0.999 12.708 643 HG2 PRO 361 HG2 PRO 361 -8.166 0.124 15.393 644 HG3 PRO 361 HG1 PRO 361 -9.707 -0.094 14.541 645 HD2 PRO 361 HD2 PRO 361 -7.510 -1.976 14.824 646 HD3 PRO 361 HD1 PRO 361 -9.131 -2.240 14.150 647 H ILE 362 HN ILE 362 -5.223 0.757 11.325 648 HA ILE 362 HA ILE 362 -3.258 0.314 13.477 649 HB ILE 362 HB ILE 362 -2.573 0.518 10.553 650 HG12 ILE 362 HG12 ILE 362 -2.342 -2.152 11.080 651 HG13 ILE 362 HG11 ILE 362 -3.807 -1.747 11.972 652 HG21 ILE 362 HG21 ILE 362 -1.132 -0.769 12.861 653 HG22 ILE 362 HG22 ILE 362 -0.747 0.800 12.150 654 HG23 ILE 362 HG23 ILE 362 -0.559 -0.673 11.198 655 HD11 ILE 362 HD11 ILE 362 -3.317 -1.196 9.054 656 HD12 ILE 362 HD12 ILE 362 -4.796 -0.835 9.946 657 HD13 ILE 362 HD13 ILE 362 -4.294 -2.511 9.706 658 H VAL 363 HN VAL 363 -2.073 2.030 14.135 659 HA VAL 363 HA VAL 363 -2.448 4.544 12.631 660 HB VAL 363 HB VAL 363 -1.946 4.249 15.603 661 HG11 VAL 363 HG11 VAL 363 -1.070 6.335 14.673 662 HG12 VAL 363 HG12 VAL 363 -2.459 6.629 15.722 663 HG13 VAL 363 HG13 VAL 363 -2.650 6.689 13.969 664 HG21 VAL 363 HG21 VAL 363 -4.240 4.857 15.956 665 HG22 VAL 363 HG22 VAL 363 -4.178 3.440 14.906 666 HG23 VAL 363 HG23 VAL 363 -4.502 5.033 14.221 667 H ILE 364 HN ILE 364 -0.693 5.469 11.879 668 HA ILE 364 HA ILE 364 1.931 4.667 12.948 669 HB ILE 364 HB ILE 364 1.256 5.420 10.102 670 HG12 ILE 364 HG12 ILE 364 2.310 2.790 11.136 671 HG13 ILE 364 HG11 ILE 364 0.597 3.105 10.896 672 HG21 ILE 364 HG21 ILE 364 3.917 4.546 11.210 673 HG22 ILE 364 HG22 ILE 364 3.476 6.220 10.869 674 HG23 ILE 364 HG23 ILE 364 3.557 5.045 9.555 675 HD11 ILE 364 HD11 ILE 364 0.933 3.383 8.532 676 HD12 ILE 364 HD12 ILE 364 1.653 1.858 9.046 677 HD13 ILE 364 HD13 ILE 364 2.682 3.255 8.728 678 H SER 365 HN SER 365 3.192 6.270 13.643 679 HA SER 365 HA SER 365 2.431 9.026 12.936 680 HB2 SER 365 HB2 SER 365 3.447 9.594 15.213 681 HB3 SER 365 HB1 SER 365 1.915 8.723 15.251 682 HG SER 365 HG SER 365 4.379 7.350 15.310 683 H ASP 366 HN ASP 366 3.968 10.174 11.970 684 HA ASP 366 HA ASP 366 6.745 9.230 12.175 685 HB2 ASP 366 HB2 ASP 366 5.435 8.895 9.929 686 HB3 ASP 366 HB1 ASP 366 5.755 10.616 9.711 687 H SER 367 HN SER 367 8.227 10.703 12.710 688 HA SER 367 HA SER 367 7.339 13.495 12.931 689 HB2 SER 367 HB2 SER 367 9.600 12.128 14.416 690 HB3 SER 367 HB1 SER 367 9.001 13.762 14.692 691 HG SER 367 HG SER 367 8.163 11.505 15.796 692 HA PRO 368 HA PRO 368 10.244 14.585 9.766 693 HB2 PRO 368 HB2 PRO 368 10.752 17.174 10.498 694 HB3 PRO 368 HB1 PRO 368 9.277 16.666 9.665 695 HG2 PRO 368 HG2 PRO 368 9.702 17.231 12.558 696 HG3 PRO 368 HG1 PRO 368 8.306 17.609 11.528 697 HD2 PRO 368 HD2 PRO 368 8.319 15.525 13.255 698 HD3 PRO 368 HD1 PRO 368 7.412 15.506 11.730 Start of MODEL 7 1 H ASP 16 HT1 ASP 16 -5.394 15.775 12.485 2 HA ASP 16 HA ASP 16 -6.335 13.774 14.450 3 HB2 ASP 16 HB2 ASP 16 -7.758 15.111 12.143 4 HB3 ASP 16 HB1 ASP 16 -8.339 13.642 12.919 5 H HIS 17 HN HIS 17 -7.345 11.942 12.817 6 HA HIS 17 HA HIS 17 -5.105 11.250 11.030 7 HB2 HIS 17 HB2 HIS 17 -6.770 9.516 12.848 8 HB3 HIS 17 HB1 HIS 17 -5.853 8.841 11.510 9 HD2 HIS 17 HD2 HIS 17 -2.980 9.795 11.756 10 HE1 HIS 17 HE1 HIS 17 -3.282 9.204 15.932 11 HE2 HIS 17 HE2 HIS 17 -1.710 9.251 13.951 12 H ILE 18 HN ILE 18 -5.738 9.625 9.336 13 HA ILE 18 HA ILE 18 -8.469 10.153 8.359 14 HB ILE 18 HB ILE 18 -6.837 11.414 7.025 15 HG12 ILE 18 HG12 ILE 18 -7.937 9.049 5.493 16 HG13 ILE 18 HG11 ILE 18 -8.865 10.474 5.950 17 HG21 ILE 18 HG21 ILE 18 -5.196 10.211 5.616 18 HG22 ILE 18 HG22 ILE 18 -5.590 8.725 6.481 19 HG23 ILE 18 HG23 ILE 18 -4.860 10.081 7.343 20 HD11 ILE 18 HD11 ILE 18 -6.462 10.461 4.136 21 HD12 ILE 18 HD12 ILE 18 -7.440 11.866 4.563 22 HD13 ILE 18 HD13 ILE 18 -8.148 10.553 3.620 23 H ASN 19 HN ASN 19 -9.600 8.411 7.612 24 HA ASN 19 HA ASN 19 -8.478 5.799 8.209 25 HB2 ASN 19 HB2 ASN 19 -11.235 6.690 7.350 26 HB3 ASN 19 HB1 ASN 19 -10.804 5.004 7.606 27 HD21 ASN 19 HD21 ASN 19 -11.385 8.079 9.094 28 HD22 ASN 19 HD22 ASN 19 -11.485 7.493 10.726 29 H LEU 20 HN LEU 20 -7.438 4.633 6.735 30 HA LEU 20 HA LEU 20 -8.231 4.928 3.906 31 HB2 LEU 20 HB2 LEU 20 -5.486 4.295 5.005 32 HB3 LEU 20 HB1 LEU 20 -5.906 4.377 3.305 33 HG LEU 20 HG LEU 20 -6.000 6.701 5.234 34 HD11 LEU 20 HD11 LEU 20 -4.038 6.042 3.043 35 HD12 LEU 20 HD12 LEU 20 -3.722 5.995 4.778 36 HD13 LEU 20 HD13 LEU 20 -4.070 7.532 3.987 37 HD21 LEU 20 HD21 LEU 20 -6.294 8.044 3.175 38 HD22 LEU 20 HD22 LEU 20 -7.652 6.968 3.502 39 HD23 LEU 20 HD23 LEU 20 -6.473 6.545 2.262 40 H LYS 21 HN LYS 21 -9.217 3.153 3.173 41 HA LYS 21 HA LYS 21 -8.863 0.636 4.598 42 HB2 LYS 21 HB2 LYS 21 -10.720 1.326 2.320 43 HB3 LYS 21 HB1 LYS 21 -10.734 -0.168 3.242 44 HG2 LYS 21 HG2 LYS 21 -11.484 0.936 5.194 45 HG3 LYS 21 HG1 LYS 21 -11.190 2.527 4.486 46 HD2 LYS 21 HD2 LYS 21 -12.921 2.092 2.809 47 HD3 LYS 21 HD1 LYS 21 -13.218 0.508 3.531 48 HE2 LYS 21 HE2 LYS 21 -14.037 1.471 5.528 49 HE3 LYS 21 HE1 LYS 21 -13.459 3.075 5.077 50 HZ1 LYS 21 HZ1 LYS 21 -15.773 3.040 4.701 51 HZ2 LYS 21 HZ2 LYS 21 -15.704 1.558 3.880 52 HZ3 LYS 21 HZ3 LYS 21 -15.054 2.947 3.169 53 H VAL 22 HN VAL 22 -7.528 -0.874 3.964 54 HA VAL 22 HA VAL 22 -6.646 -0.908 1.150 55 HB VAL 22 HB VAL 22 -5.195 -2.044 3.554 56 HG11 VAL 22 HG11 VAL 22 -4.718 -3.249 1.489 57 HG12 VAL 22 HG12 VAL 22 -3.311 -2.325 2.016 58 HG13 VAL 22 HG13 VAL 22 -4.308 -1.733 0.685 59 HG21 VAL 22 HG21 VAL 22 -3.602 -0.200 3.233 60 HG22 VAL 22 HG22 VAL 22 -5.214 0.386 3.642 61 HG23 VAL 22 HG23 VAL 22 -4.643 0.467 1.976 62 H ALA 23 HN ALA 23 -7.863 -2.382 0.121 63 HA ALA 23 HA ALA 23 -8.459 -4.901 1.524 64 HB1 ALA 23 HB1 ALA 23 -10.398 -5.127 0.078 65 HB2 ALA 23 HB2 ALA 23 -9.967 -3.637 -0.760 66 HB3 ALA 23 HB3 ALA 23 -10.443 -3.586 0.936 67 H GLY 24 HN GLY 24 -7.831 -6.782 0.677 68 HA2 GLY 24 HA2 GLY 24 -6.087 -6.700 -1.650 69 HA3 GLY 24 HA1 GLY 24 -6.325 -8.070 -0.574 70 H GLN 25 HN GLN 25 -6.633 -9.530 -2.292 71 HA GLN 25 HA GLN 25 -8.988 -9.036 -3.973 72 HB2 GLN 25 HB2 GLN 25 -6.786 -11.090 -4.256 73 HB3 GLN 25 HB1 GLN 25 -8.150 -10.919 -5.352 74 HG2 GLN 25 HG2 GLN 25 -5.937 -8.943 -4.862 75 HG3 GLN 25 HG1 GLN 25 -6.258 -9.853 -6.338 76 HE21 GLN 25 HE21 GLN 25 -6.052 -6.968 -5.866 77 HE22 GLN 25 HE22 GLN 25 -7.540 -6.294 -6.444 78 H ASP 26 HN ASP 26 -8.390 -10.272 -1.093 79 HA ASP 26 HA ASP 26 -10.128 -12.614 -1.381 80 HB2 ASP 26 HB2 ASP 26 -9.379 -13.038 1.041 81 HB3 ASP 26 HB1 ASP 26 -8.181 -13.259 -0.227 82 H GLY 27 HN GLY 27 -9.877 -11.039 1.701 83 HA2 GLY 27 HA2 GLY 27 -12.328 -9.516 1.359 84 HA3 GLY 27 HA1 GLY 27 -12.480 -10.940 2.378 85 H SER 28 HN SER 28 -9.426 -9.389 2.384 86 HA SER 28 HA SER 28 -9.744 -8.668 5.155 87 HB2 SER 28 HB2 SER 28 -7.298 -7.809 4.688 88 HB3 SER 28 HB1 SER 28 -7.625 -9.539 4.773 89 HG SER 28 HG SER 28 -7.433 -9.716 2.621 90 H VAL 29 HN VAL 29 -10.560 -6.780 5.793 91 HA VAL 29 HA VAL 29 -10.150 -4.441 4.027 92 HB VAL 29 HB VAL 29 -12.439 -4.743 5.976 93 HG11 VAL 29 HG11 VAL 29 -13.435 -2.934 4.656 94 HG12 VAL 29 HG12 VAL 29 -11.998 -2.889 3.635 95 HG13 VAL 29 HG13 VAL 29 -11.881 -2.456 5.341 96 HG21 VAL 29 HG21 VAL 29 -13.873 -5.308 4.087 97 HG22 VAL 29 HG22 VAL 29 -12.602 -6.515 4.288 98 HG23 VAL 29 HG23 VAL 29 -12.475 -5.306 3.011 99 H VAL 30 HN VAL 30 -8.127 -4.145 5.188 100 HA VAL 30 HA VAL 30 -8.303 -3.527 8.009 101 HB VAL 30 HB VAL 30 -5.871 -2.997 7.833 102 HG11 VAL 30 HG11 VAL 30 -6.731 -5.685 6.770 103 HG12 VAL 30 HG12 VAL 30 -6.608 -5.219 8.466 104 HG13 VAL 30 HG13 VAL 30 -5.154 -5.321 7.474 105 HG21 VAL 30 HG21 VAL 30 -6.210 -3.911 4.978 106 HG22 VAL 30 HG22 VAL 30 -4.671 -3.603 5.783 107 HG23 VAL 30 HG23 VAL 30 -5.805 -2.278 5.508 108 H GLN 31 HN GLN 31 -8.236 -1.566 8.929 109 HA GLN 31 HA GLN 31 -8.542 0.725 7.103 110 HB2 GLN 31 HB2 GLN 31 -10.434 0.046 8.684 111 HB3 GLN 31 HB1 GLN 31 -9.400 0.602 9.992 112 HG2 GLN 31 HG2 GLN 31 -9.970 2.713 9.638 113 HG3 GLN 31 HG1 GLN 31 -9.593 2.593 7.920 114 HE21 GLN 31 HE21 GLN 31 -11.845 3.816 9.519 115 HE22 GLN 31 HE22 GLN 31 -13.282 3.208 8.761 116 H PHE 32 HN PHE 32 -6.740 1.846 6.928 117 HA PHE 32 HA PHE 32 -4.784 1.874 9.062 118 HB2 PHE 32 HB2 PHE 32 -4.853 2.764 6.219 119 HB3 PHE 32 HB1 PHE 32 -3.684 3.515 7.299 120 HD1 PHE 32 HD1 PHE 32 -4.827 0.265 5.958 121 HD2 PHE 32 HD2 PHE 32 -1.710 2.412 7.903 122 HE1 PHE 32 HE1 PHE 32 -3.326 -1.657 5.658 123 HE2 PHE 32 HE2 PHE 32 -0.199 0.492 7.605 124 HZ PHE 32 HZ PHE 32 -1.008 -1.545 6.479 125 H LYS 33 HN LYS 33 -4.778 3.295 10.615 126 HA LYS 33 HA LYS 33 -6.174 5.859 10.228 127 HB2 LYS 33 HB2 LYS 33 -7.004 4.431 12.066 128 HB3 LYS 33 HB1 LYS 33 -5.398 4.412 12.775 129 HG2 LYS 33 HG2 LYS 33 -5.529 6.827 13.128 130 HG3 LYS 33 HG1 LYS 33 -7.151 6.830 12.430 131 HD2 LYS 33 HD2 LYS 33 -7.978 5.435 14.199 132 HD3 LYS 33 HD1 LYS 33 -6.351 5.204 14.840 133 HE2 LYS 33 HE2 LYS 33 -6.217 7.580 15.369 134 HE3 LYS 33 HE1 LYS 33 -7.831 7.831 14.706 135 HZ1 LYS 33 HZ1 LYS 33 -7.906 7.659 17.098 136 HZ2 LYS 33 HZ2 LYS 33 -7.155 6.147 17.051 137 HZ3 LYS 33 HZ3 LYS 33 -8.704 6.337 16.405 138 H ILE 34 HN ILE 34 -4.372 6.715 9.075 139 HA ILE 34 HA ILE 34 -2.051 7.334 10.784 140 HB ILE 34 HB ILE 34 -0.625 7.362 8.828 141 HG12 ILE 34 HG12 ILE 34 -3.045 6.497 7.225 142 HG13 ILE 34 HG11 ILE 34 -2.381 8.127 7.213 143 HG21 ILE 34 HG21 ILE 34 -2.288 4.847 8.919 144 HG22 ILE 34 HG22 ILE 34 -0.928 5.231 9.974 145 HG23 ILE 34 HG23 ILE 34 -0.663 4.988 8.248 146 HD11 ILE 34 HD11 ILE 34 -1.631 6.921 5.272 147 HD12 ILE 34 HD12 ILE 34 -1.002 5.619 6.283 148 HD13 ILE 34 HD13 ILE 34 -0.261 7.219 6.341 149 H LYS 35 HN LYS 35 -0.803 9.275 9.665 150 HA LYS 35 HA LYS 35 -2.695 11.476 9.673 151 HB2 LYS 35 HB2 LYS 35 0.323 11.355 9.554 152 HB3 LYS 35 HB1 LYS 35 -0.571 12.862 9.432 153 HG2 LYS 35 HG2 LYS 35 -1.505 12.504 11.653 154 HG3 LYS 35 HG1 LYS 35 -0.640 10.969 11.771 155 HD2 LYS 35 HD2 LYS 35 1.486 12.107 11.659 156 HD3 LYS 35 HD1 LYS 35 0.682 13.653 11.375 157 HE2 LYS 35 HE2 LYS 35 -0.356 13.509 13.590 158 HE3 LYS 35 HE1 LYS 35 0.454 11.970 13.868 159 HZ1 LYS 35 HZ1 LYS 35 2.578 13.083 13.716 160 HZ2 LYS 35 HZ2 LYS 35 1.628 13.811 14.910 161 HZ3 LYS 35 HZ3 LYS 35 1.820 14.566 13.412 162 H ARG 36 HN ARG 36 -2.793 13.059 7.972 163 HA ARG 36 HA ARG 36 -2.885 11.893 5.375 164 HB2 ARG 36 HB2 ARG 36 -3.238 14.745 6.315 165 HB3 ARG 36 HB1 ARG 36 -3.484 14.228 4.653 166 HG2 ARG 36 HG2 ARG 36 -5.278 12.763 5.334 167 HG3 ARG 36 HG1 ARG 36 -4.988 13.155 7.029 168 HD2 ARG 36 HD2 ARG 36 -6.904 14.385 6.105 169 HD3 ARG 36 HD1 ARG 36 -5.613 15.460 6.639 170 HE ARG 36 HE ARG 36 -5.078 15.895 4.362 171 HH11 ARG 36 HH11 ARG 36 -8.011 14.011 4.839 172 HH12 ARG 36 HH12 ARG 36 -8.654 14.361 3.185 173 HH21 ARG 36 HH21 ARG 36 -5.864 16.397 2.280 174 HH22 ARG 36 HH22 ARG 36 -7.435 15.685 1.750 175 H HIS 37 HN HIS 37 -0.406 13.291 7.158 176 HA HIS 37 HA HIS 37 1.121 14.091 4.782 177 HB2 HIS 37 HB2 HIS 37 2.077 14.519 7.594 178 HB3 HIS 37 HB1 HIS 37 2.411 15.469 6.152 179 HD2 HIS 37 HD2 HIS 37 0.355 17.272 5.407 180 HE1 HIS 37 HE1 HIS 37 -1.653 16.946 9.116 181 HE2 HIS 37 HE2 HIS 37 -1.642 18.082 6.856 182 H THR 38 HN THR 38 0.613 11.351 6.380 183 HA THR 38 HA THR 38 3.347 10.515 6.815 184 HB THR 38 HB THR 38 0.771 8.934 6.968 185 HG1 THR 38 HG1 THR 38 2.124 10.608 8.721 186 HG21 THR 38 HG21 THR 38 3.519 8.247 8.024 187 HG22 THR 38 HG22 THR 38 2.772 7.521 6.602 188 HG23 THR 38 HG23 THR 38 2.056 7.276 8.195 189 HA PRO 39 HA PRO 39 4.066 9.311 2.572 190 HB2 PRO 39 HB2 PRO 39 5.959 7.442 3.912 191 HB3 PRO 39 HB1 PRO 39 6.250 8.582 2.592 192 HG2 PRO 39 HG2 PRO 39 7.109 9.115 5.046 193 HG3 PRO 39 HG1 PRO 39 6.460 10.394 3.998 194 HD2 PRO 39 HD2 PRO 39 5.203 9.049 6.334 195 HD3 PRO 39 HD1 PRO 39 5.051 10.727 5.774 196 H LEU 40 HN LEU 40 2.917 7.909 1.409 197 HA LEU 40 HA LEU 40 1.471 5.794 2.594 198 HB2 LEU 40 HB2 LEU 40 1.968 6.567 -0.266 199 HB3 LEU 40 HB1 LEU 40 1.005 5.167 0.161 200 HG LEU 40 HG LEU 40 0.387 8.000 1.004 201 HD11 LEU 40 HD11 LEU 40 -1.408 7.916 -0.616 202 HD12 LEU 40 HD12 LEU 40 -0.930 6.289 -1.097 203 HD13 LEU 40 HD13 LEU 40 0.139 7.652 -1.415 204 HD21 LEU 40 HD21 LEU 40 -1.107 5.403 1.338 205 HD22 LEU 40 HD22 LEU 40 -1.819 6.996 1.601 206 HD23 LEU 40 HD23 LEU 40 -0.479 6.453 2.611 207 H SER 41 HN SER 41 4.669 5.952 1.485 208 HA SER 41 HA SER 41 5.110 3.346 0.554 209 HB2 SER 41 HB2 SER 41 7.455 4.059 1.831 210 HB3 SER 41 HB1 SER 41 7.027 4.484 0.172 211 HG SER 41 HG SER 41 7.064 6.473 0.825 212 H LYS 42 HN LYS 42 5.096 4.731 3.797 213 HA LYS 42 HA LYS 42 5.968 2.351 5.105 214 HB2 LYS 42 HB2 LYS 42 4.521 4.771 6.211 215 HB3 LYS 42 HB1 LYS 42 5.288 3.515 7.177 216 HG2 LYS 42 HG2 LYS 42 7.445 4.088 6.045 217 HG3 LYS 42 HG1 LYS 42 6.623 5.470 5.323 218 HD2 LYS 42 HD2 LYS 42 6.256 6.469 7.447 219 HD3 LYS 42 HD1 LYS 42 6.738 4.996 8.296 220 HE2 LYS 42 HE2 LYS 42 9.011 5.250 7.354 221 HE3 LYS 42 HE1 LYS 42 8.512 6.771 6.621 222 HZ1 LYS 42 HZ1 LYS 42 9.709 7.043 8.735 223 HZ2 LYS 42 HZ2 LYS 42 8.469 6.218 9.534 224 HZ3 LYS 42 HZ3 LYS 42 8.150 7.706 8.780 225 H LEU 43 HN LEU 43 2.907 3.660 4.109 226 HA LEU 43 HA LEU 43 1.233 1.953 5.640 227 HB2 LEU 43 HB2 LEU 43 0.259 3.925 4.729 228 HB3 LEU 43 HB1 LEU 43 0.828 3.548 3.115 229 HG LEU 43 HG LEU 43 -1.025 1.554 4.230 230 HD11 LEU 43 HD11 LEU 43 -3.010 2.957 3.854 231 HD12 LEU 43 HD12 LEU 43 -1.962 4.359 3.635 232 HD13 LEU 43 HD13 LEU 43 -2.026 3.540 5.196 233 HD21 LEU 43 HD21 LEU 43 -1.003 3.116 1.646 234 HD22 LEU 43 HD22 LEU 43 -1.951 1.671 1.997 235 HD23 LEU 43 HD23 LEU 43 -0.194 1.570 1.903 236 H MET 44 HN MET 44 2.572 1.820 2.375 237 HA MET 44 HA MET 44 1.384 -0.631 1.619 238 HB2 MET 44 HB2 MET 44 3.929 0.680 0.636 239 HB3 MET 44 HB1 MET 44 3.138 -0.680 -0.144 240 HG2 MET 44 HG2 MET 44 1.104 0.799 -0.371 241 HG3 MET 44 HG1 MET 44 2.135 2.136 0.129 242 HE1 MET 44 HE1 MET 44 4.299 2.958 -1.323 243 HE2 MET 44 HE2 MET 44 4.838 2.096 -2.763 244 HE3 MET 44 HE3 MET 44 4.901 1.304 -1.189 245 H LYS 45 HN LYS 45 4.489 0.195 3.094 246 HA LYS 45 HA LYS 45 5.533 -2.426 3.098 247 HB2 LYS 45 HB2 LYS 45 6.219 0.132 4.462 248 HB3 LYS 45 HB1 LYS 45 6.943 -1.355 5.064 249 HG2 LYS 45 HG2 LYS 45 7.929 -1.809 2.927 250 HG3 LYS 45 HG1 LYS 45 7.074 -0.447 2.201 251 HD2 LYS 45 HD2 LYS 45 8.376 1.127 3.376 252 HD3 LYS 45 HD1 LYS 45 9.011 -0.101 4.474 253 HE2 LYS 45 HE2 LYS 45 10.332 -1.074 2.760 254 HE3 LYS 45 HE1 LYS 45 9.515 -0.141 1.509 255 HZ1 LYS 45 HZ1 LYS 45 11.149 1.092 3.651 256 HZ2 LYS 45 HZ2 LYS 45 10.550 1.835 2.255 257 HZ3 LYS 45 HZ3 LYS 45 11.769 0.671 2.136 258 H ALA 46 HN ALA 46 3.480 -0.683 5.361 259 HA ALA 46 HA ALA 46 3.741 -2.403 7.561 260 HB1 ALA 46 HB1 ALA 46 2.641 -0.226 7.718 261 HB2 ALA 46 HB2 ALA 46 1.592 -1.513 8.314 262 HB3 ALA 46 HB3 ALA 46 1.316 -0.819 6.716 263 H TYR 47 HN TYR 47 1.451 -2.448 4.846 264 HA TYR 47 HA TYR 47 0.110 -4.814 5.667 265 HB2 TYR 47 HB2 TYR 47 -0.764 -3.091 4.035 266 HB3 TYR 47 HB1 TYR 47 0.351 -3.751 2.846 267 HD1 TYR 47 HD1 TYR 47 -0.327 -5.517 1.485 268 HD2 TYR 47 HD2 TYR 47 -2.453 -4.748 5.086 269 HE1 TYR 47 HE1 TYR 47 -2.000 -7.202 0.850 270 HE2 TYR 47 HE2 TYR 47 -4.135 -6.431 4.462 271 HH TYR 47 HH TYR 47 -4.990 -7.553 2.490 272 H CYS 48 HN CYS 48 2.909 -4.120 3.706 273 HA CYS 48 HA CYS 48 3.340 -6.604 2.505 274 HB2 CYS 48 HB2 CYS 48 4.531 -4.596 1.818 275 HB3 CYS 48 HB1 CYS 48 5.292 -4.472 3.397 276 HG CYS 48 HG CYS 48 6.171 -7.377 2.431 277 H GLU 49 HN GLU 49 4.637 -5.290 5.552 278 HA GLU 49 HA GLU 49 6.019 -7.665 6.278 279 HB2 GLU 49 HB2 GLU 49 5.077 -5.372 8.007 280 HB3 GLU 49 HB1 GLU 49 6.238 -6.599 8.490 281 HG2 GLU 49 HG2 GLU 49 6.617 -4.645 6.233 282 HG3 GLU 49 HG1 GLU 49 7.298 -4.479 7.850 283 H ARG 50 HN ARG 50 2.801 -6.433 6.902 284 HA ARG 50 HA ARG 50 2.070 -8.237 8.939 285 HB2 ARG 50 HB2 ARG 50 0.801 -6.223 8.566 286 HB3 ARG 50 HB1 ARG 50 0.396 -6.726 6.932 287 HG2 ARG 50 HG2 ARG 50 -1.149 -8.285 7.650 288 HG3 ARG 50 HG1 ARG 50 -0.431 -8.409 9.258 289 HD2 ARG 50 HD2 ARG 50 -1.827 -5.955 8.210 290 HD3 ARG 50 HD1 ARG 50 -2.607 -7.196 9.188 291 HE ARG 50 HE ARG 50 -0.212 -5.940 10.284 292 HH11 ARG 50 HH11 ARG 50 -3.715 -6.200 10.238 293 HH12 ARG 50 HH12 ARG 50 -3.923 -5.348 11.819 294 HH21 ARG 50 HH21 ARG 50 -2.059 -4.679 12.998 295 HH22 ARG 50 HH22 ARG 50 -0.407 -4.935 12.320 296 H GLN 51 HN GLN 51 1.805 -8.427 5.414 297 HA GLN 51 HA GLN 51 0.441 -10.970 5.536 298 HB2 GLN 51 HB2 GLN 51 1.602 -9.413 3.223 299 HB3 GLN 51 HB1 GLN 51 0.764 -10.948 3.045 300 HG2 GLN 51 HG2 GLN 51 -0.399 -8.397 4.142 301 HG3 GLN 51 HG1 GLN 51 -0.714 -9.093 2.554 302 HE21 GLN 51 HE21 GLN 51 -2.059 -10.880 2.382 303 HE22 GLN 51 HE22 GLN 51 -3.069 -11.408 3.680 304 H GLY 52 HN GLY 52 3.699 -9.867 5.435 305 HA2 GLY 52 HA2 GLY 52 5.632 -11.104 5.777 306 HA3 GLY 52 HA1 GLY 52 4.662 -12.570 5.719 307 H LEU 53 HN LEU 53 5.080 -9.971 3.362 308 HA LEU 53 HA LEU 53 6.293 -11.896 1.505 309 HB2 LEU 53 HB2 LEU 53 4.117 -9.920 0.802 310 HB3 LEU 53 HB1 LEU 53 4.947 -10.970 -0.328 311 HG LEU 53 HG LEU 53 3.389 -12.128 1.959 312 HD11 LEU 53 HD11 LEU 53 1.427 -12.241 0.553 313 HD12 LEU 53 HD12 LEU 53 2.272 -11.393 -0.742 314 HD13 LEU 53 HD13 LEU 53 1.912 -10.558 0.768 315 HD21 LEU 53 HD21 LEU 53 3.191 -14.023 0.426 316 HD22 LEU 53 HD22 LEU 53 4.880 -13.602 0.716 317 HD23 LEU 53 HD23 LEU 53 4.100 -13.133 -0.795 318 H SER 54 HN SER 54 7.190 -10.615 -0.458 319 HA SER 54 HA SER 54 8.717 -8.400 0.638 320 HB2 SER 54 HB2 SER 54 9.919 -10.138 -0.619 321 HB3 SER 54 HB1 SER 54 8.934 -9.797 -2.042 322 HG SER 54 HG SER 54 11.185 -8.627 -1.321 323 H MET 55 HN MET 55 8.704 -6.313 -0.194 324 HA MET 55 HA MET 55 6.228 -5.400 -1.245 325 HB2 MET 55 HB2 MET 55 7.835 -4.117 0.262 326 HB3 MET 55 HB1 MET 55 8.799 -3.818 -1.179 327 HG2 MET 55 HG2 MET 55 6.850 -2.723 -2.217 328 HG3 MET 55 HG1 MET 55 5.947 -2.966 -0.724 329 HE1 MET 55 HE1 MET 55 8.704 -1.022 -2.584 330 HE2 MET 55 HE2 MET 55 9.720 -1.839 -1.396 331 HE3 MET 55 HE3 MET 55 9.495 -0.089 -1.314 332 H ARG 56 HN ARG 56 8.978 -6.700 -2.701 333 HA ARG 56 HA ARG 56 8.733 -5.281 -5.202 334 HB2 ARG 56 HB2 ARG 56 10.895 -6.224 -4.269 335 HB3 ARG 56 HB1 ARG 56 10.281 -7.820 -4.675 336 HG2 ARG 56 HG2 ARG 56 10.043 -6.986 -7.047 337 HG3 ARG 56 HG1 ARG 56 10.964 -5.569 -6.539 338 HD2 ARG 56 HD2 ARG 56 12.772 -7.105 -5.777 339 HD3 ARG 56 HD1 ARG 56 11.866 -8.445 -6.479 340 HE ARG 56 HE ARG 56 12.222 -7.486 -8.646 341 HH11 ARG 56 HH11 ARG 56 15.263 -5.263 -7.137 342 HH12 ARG 56 HH12 ARG 56 14.058 -6.005 -6.022 343 HH21 ARG 56 HH21 ARG 56 15.109 -5.611 -9.399 344 HH22 ARG 56 HH22 ARG 56 13.757 -6.593 -10.083 345 H GLN 57 HN GLN 57 7.065 -7.764 -3.706 346 HA GLN 57 HA GLN 57 6.359 -9.090 -6.219 347 HB2 GLN 57 HB2 GLN 57 6.991 -10.565 -4.409 348 HB3 GLN 57 HB1 GLN 57 5.804 -9.826 -3.343 349 HG2 GLN 57 HG2 GLN 57 4.015 -10.637 -4.838 350 HG3 GLN 57 HG1 GLN 57 5.239 -11.446 -5.815 351 HE21 GLN 57 HE21 GLN 57 2.946 -12.415 -4.171 352 HE22 GLN 57 HE22 GLN 57 3.629 -13.618 -3.126 353 H ILE 58 HN ILE 58 4.799 -7.533 -3.423 354 HA ILE 58 HA ILE 58 2.222 -7.621 -4.732 355 HB ILE 58 HB ILE 58 1.486 -6.267 -2.712 356 HG12 ILE 58 HG12 ILE 58 4.275 -6.992 -1.773 357 HG13 ILE 58 HG11 ILE 58 3.691 -5.365 -2.101 358 HG21 ILE 58 HG21 ILE 58 1.107 -8.651 -2.909 359 HG22 ILE 58 HG22 ILE 58 1.522 -8.235 -1.244 360 HG23 ILE 58 HG23 ILE 58 2.729 -8.981 -2.294 361 HD11 ILE 58 HD11 ILE 58 2.655 -7.205 0.043 362 HD12 ILE 58 HD12 ILE 58 2.083 -5.567 -0.285 363 HD13 ILE 58 HD13 ILE 58 3.734 -5.829 0.280 364 H ARG 59 HN ARG 59 0.940 -5.780 -5.213 365 HA ARG 59 HA ARG 59 2.456 -3.297 -5.679 366 HB2 ARG 59 HB2 ARG 59 0.506 -4.612 -7.581 367 HB3 ARG 59 HB1 ARG 59 1.201 -3.014 -7.805 368 HG2 ARG 59 HG2 ARG 59 2.800 -5.556 -7.638 369 HG3 ARG 59 HG1 ARG 59 2.291 -4.786 -9.141 370 HD2 ARG 59 HD2 ARG 59 3.539 -2.772 -8.537 371 HD3 ARG 59 HD1 ARG 59 4.033 -3.527 -7.022 372 HE ARG 59 HE ARG 59 5.052 -4.093 -9.683 373 HH11 ARG 59 HH11 ARG 59 6.337 -6.082 -6.408 374 HH12 ARG 59 HH12 ARG 59 4.900 -5.000 -6.288 375 HH21 ARG 59 HH21 ARG 59 6.891 -5.444 -9.859 376 HH22 ARG 59 HH22 ARG 59 7.448 -6.333 -8.388 377 H PHE 60 HN PHE 60 1.261 -1.377 -5.488 378 HA PHE 60 HA PHE 60 -1.473 -1.700 -4.440 379 HB2 PHE 60 HB2 PHE 60 0.692 0.171 -3.456 380 HB3 PHE 60 HB1 PHE 60 -0.998 0.282 -2.972 381 HD1 PHE 60 HD1 PHE 60 2.048 -1.775 -2.784 382 HD2 PHE 60 HD2 PHE 60 -1.915 -1.189 -1.347 383 HE1 PHE 60 HE1 PHE 60 2.480 -3.367 -0.962 384 HE2 PHE 60 HE2 PHE 60 -1.491 -2.783 0.480 385 HZ PHE 60 HZ PHE 60 0.710 -3.877 0.673 386 H ARG 61 HN ARG 61 -2.988 -0.424 -5.331 387 HA ARG 61 HA ARG 61 -2.082 1.812 -7.019 388 HB2 ARG 61 HB2 ARG 61 -4.102 -0.316 -7.715 389 HB3 ARG 61 HB1 ARG 61 -3.982 1.208 -8.579 390 HG2 ARG 61 HG2 ARG 61 -1.616 0.638 -9.117 391 HG3 ARG 61 HG1 ARG 61 -1.897 -0.953 -8.405 392 HD2 ARG 61 HD2 ARG 61 -3.803 -1.229 -10.001 393 HD3 ARG 61 HD1 ARG 61 -3.290 0.264 -10.783 394 HE ARG 61 HE ARG 61 -1.044 -1.263 -10.798 395 HH11 ARG 61 HH11 ARG 61 -3.910 -2.887 -13.164 396 HH12 ARG 61 HH12 ARG 61 -4.370 -1.780 -11.816 397 HH21 ARG 61 HH21 ARG 61 -0.414 -2.671 -12.480 398 HH22 ARG 61 HH22 ARG 61 -1.686 -3.388 -13.538 399 H PHE 62 HN PHE 62 -3.449 3.571 -7.149 400 HA PHE 62 HA PHE 62 -5.718 3.550 -5.272 401 HB2 PHE 62 HB2 PHE 62 -4.004 4.972 -4.349 402 HB3 PHE 62 HB1 PHE 62 -3.756 5.767 -5.900 403 HD1 PHE 62 HD1 PHE 62 -6.441 5.166 -3.382 404 HD2 PHE 62 HD2 PHE 62 -4.759 7.802 -6.273 405 HE1 PHE 62 HE1 PHE 62 -8.086 6.887 -2.770 406 HE2 PHE 62 HE2 PHE 62 -6.403 9.529 -5.663 407 HZ PHE 62 HZ PHE 62 -8.069 9.069 -3.910 408 H ASP 63 HN ASP 63 -7.450 3.345 -6.537 409 HA ASP 63 HA ASP 63 -9.038 3.769 -8.101 410 HB2 ASP 63 HB2 ASP 63 -8.697 6.097 -7.085 411 HB3 ASP 63 HB1 ASP 63 -7.741 6.465 -8.517 412 H GLY 64 HN GLY 64 -6.515 2.554 -8.887 413 HA2 GLY 64 HA2 GLY 64 -6.197 1.602 -11.070 414 HA3 GLY 64 HA1 GLY 64 -6.677 3.139 -11.766 415 H GLN 65 HN GLN 65 -5.058 4.855 -10.246 416 HA GLN 65 HA GLN 65 -2.597 4.535 -11.680 417 HB2 GLN 65 HB2 GLN 65 -3.552 6.586 -9.684 418 HB3 GLN 65 HB1 GLN 65 -1.961 6.646 -10.429 419 HG2 GLN 65 HG2 GLN 65 -4.630 6.860 -11.800 420 HG3 GLN 65 HG1 GLN 65 -3.403 8.115 -11.626 421 HE21 GLN 65 HE21 GLN 65 -1.451 7.906 -12.803 422 HE22 GLN 65 HE22 GLN 65 -1.387 6.966 -14.252 423 HA PRO 66 HA PRO 66 -0.415 2.263 -8.551 424 HB2 PRO 66 HB2 PRO 66 2.116 2.727 -9.440 425 HB3 PRO 66 HB1 PRO 66 1.021 1.565 -10.205 426 HG2 PRO 66 HG2 PRO 66 1.682 4.352 -11.041 427 HG3 PRO 66 HG1 PRO 66 1.466 2.899 -12.036 428 HD2 PRO 66 HD2 PRO 66 -0.461 4.780 -11.783 429 HD3 PRO 66 HD1 PRO 66 -0.826 3.058 -12.017 430 H ILE 67 HN ILE 67 0.529 2.703 -6.616 431 HA ILE 67 HA ILE 67 0.844 5.503 -5.916 432 HB ILE 67 HB ILE 67 1.145 3.077 -4.136 433 HG12 ILE 67 HG12 ILE 67 -1.291 4.807 -4.637 434 HG13 ILE 67 HG11 ILE 67 -1.087 3.145 -5.176 435 HG21 ILE 67 HG21 ILE 67 0.650 5.984 -3.483 436 HG22 ILE 67 HG22 ILE 67 2.162 5.105 -3.239 437 HG23 ILE 67 HG23 ILE 67 0.725 4.663 -2.315 438 HD11 ILE 67 HD11 ILE 67 -1.327 4.129 -2.349 439 HD12 ILE 67 HD12 ILE 67 -0.912 2.473 -2.788 440 HD13 ILE 67 HD13 ILE 67 -2.477 3.140 -3.250 441 H ASN 68 HN ASN 68 2.717 6.514 -5.443 442 HA ASN 68 HA ASN 68 5.190 5.039 -5.981 443 HB2 ASN 68 HB2 ASN 68 4.688 8.014 -5.701 444 HB3 ASN 68 HB1 ASN 68 6.238 7.279 -6.106 445 HD21 ASN 68 HD21 ASN 68 3.111 8.172 -7.222 446 HD22 ASN 68 HD22 ASN 68 3.377 7.815 -8.899 447 H GLU 69 HN GLU 69 7.065 5.456 -4.586 448 HA GLU 69 HA GLU 69 6.396 5.036 -1.858 449 HB2 GLU 69 HB2 GLU 69 9.071 5.581 -3.155 450 HB3 GLU 69 HB1 GLU 69 8.852 5.051 -1.494 451 HG2 GLU 69 HG2 GLU 69 7.929 2.967 -2.207 452 HG3 GLU 69 HG1 GLU 69 7.903 3.498 -3.887 453 H THR 70 HN THR 70 6.814 7.863 -3.694 454 HA THR 70 HA THR 70 7.350 9.462 -1.289 455 HB THR 70 HB THR 70 7.273 10.653 -4.039 456 HG1 THR 70 HG1 THR 70 9.784 9.902 -3.340 457 HG21 THR 70 HG21 THR 70 7.551 12.117 -2.103 458 HG22 THR 70 HG22 THR 70 9.016 12.096 -3.083 459 HG23 THR 70 HG23 THR 70 8.947 11.179 -1.578 460 H ASP 71 HN ASP 71 4.748 8.217 -2.640 461 HA ASP 71 HA ASP 71 3.130 10.596 -2.947 462 HB2 ASP 71 HB2 ASP 71 2.706 7.682 -3.331 463 HB3 ASP 71 HB1 ASP 71 1.290 8.646 -2.930 464 H THR 72 HN THR 72 1.347 11.117 -1.658 465 HA THR 72 HA THR 72 1.233 9.911 1.010 466 HB THR 72 HB THR 72 0.820 12.501 1.664 467 HG1 THR 72 HG1 THR 72 2.941 12.629 -0.228 468 HG21 THR 72 HG21 THR 72 3.528 11.170 1.493 469 HG22 THR 72 HG22 THR 72 2.359 10.969 2.801 470 HG23 THR 72 HG23 THR 72 3.118 12.539 2.527 471 HA PRO 73 HA PRO 73 -3.172 10.064 0.601 472 HB2 PRO 73 HB2 PRO 73 -3.296 11.573 3.164 473 HB3 PRO 73 HB1 PRO 73 -4.099 10.065 2.706 474 HG2 PRO 73 HG2 PRO 73 -2.028 10.022 4.365 475 HG3 PRO 73 HG1 PRO 73 -2.236 8.764 3.130 476 HD2 PRO 73 HD2 PRO 73 -0.358 11.078 3.165 477 HD3 PRO 73 HD1 PRO 73 -0.116 9.431 2.546 478 H ALA 74 HN ALA 74 -1.737 13.069 1.844 479 HA ALA 74 HA ALA 74 -3.828 14.754 0.886 480 HB1 ALA 74 HB1 ALA 74 -2.287 16.594 1.444 481 HB2 ALA 74 HB2 ALA 74 -1.009 15.416 1.736 482 HB3 ALA 74 HB3 ALA 74 -2.445 15.428 2.758 483 H GLN 75 HN GLN 75 -0.948 13.431 -0.514 484 HA GLN 75 HA GLN 75 -0.755 15.327 -2.660 485 HB2 GLN 75 HB2 GLN 75 1.242 14.193 -1.941 486 HB3 GLN 75 HB1 GLN 75 0.507 12.623 -2.212 487 HG2 GLN 75 HG2 GLN 75 2.100 13.148 -3.956 488 HG3 GLN 75 HG1 GLN 75 0.468 13.039 -4.613 489 HE21 GLN 75 HE21 GLN 75 1.092 14.246 -6.411 490 HE22 GLN 75 HE22 GLN 75 1.335 15.958 -6.322 491 H LEU 76 HN LEU 76 -1.982 12.017 -2.320 492 HA LEU 76 HA LEU 76 -2.852 11.924 -5.068 493 HB2 LEU 76 HB2 LEU 76 -3.252 10.053 -2.743 494 HB3 LEU 76 HB1 LEU 76 -3.925 9.756 -4.335 495 HG LEU 76 HG LEU 76 -0.999 9.900 -3.605 496 HD11 LEU 76 HD11 LEU 76 -2.698 7.637 -4.647 497 HD12 LEU 76 HD12 LEU 76 -2.144 7.820 -2.984 498 HD13 LEU 76 HD13 LEU 76 -0.975 7.566 -4.279 499 HD21 LEU 76 HD21 LEU 76 -1.241 10.896 -5.772 500 HD22 LEU 76 HD22 LEU 76 -2.330 9.611 -6.296 501 HD23 LEU 76 HD23 LEU 76 -0.632 9.255 -5.982 502 H GLU 77 HN GLU 77 -4.026 13.570 -2.533 503 HA GLU 77 HA GLU 77 -5.999 14.571 -2.029 504 HB2 GLU 77 HB2 GLU 77 -6.803 13.637 -4.791 505 HB3 GLU 77 HB1 GLU 77 -7.657 14.832 -3.828 506 HG2 GLU 77 HG2 GLU 77 -4.803 15.373 -4.295 507 HG3 GLU 77 HG1 GLU 77 -5.847 15.436 -5.716 508 H MET 78 HN MET 78 -5.653 12.098 -0.976 509 HA MET 78 HA MET 78 -8.016 10.485 -1.412 510 HB2 MET 78 HB2 MET 78 -5.869 10.186 0.695 511 HB3 MET 78 HB1 MET 78 -7.047 8.972 0.212 512 HG2 MET 78 HG2 MET 78 -6.029 8.759 -1.947 513 HG3 MET 78 HG1 MET 78 -4.944 10.106 -1.612 514 HE1 MET 78 HE1 MET 78 -5.552 6.265 -1.228 515 HE2 MET 78 HE2 MET 78 -6.168 6.933 0.281 516 HE3 MET 78 HE3 MET 78 -4.725 5.923 0.290 517 H GLU 79 HN GLU 79 -9.635 10.105 0.128 518 HA GLU 79 HA GLU 79 -9.774 12.147 2.248 519 HB2 GLU 79 HB2 GLU 79 -11.779 11.300 0.235 520 HB3 GLU 79 HB1 GLU 79 -12.377 11.627 1.857 521 HG2 GLU 79 HG2 GLU 79 -10.840 13.519 0.092 522 HG3 GLU 79 HG1 GLU 79 -12.551 13.612 0.509 523 H ASP 80 HN ASP 80 -11.675 11.427 3.831 524 HA ASP 80 HA ASP 80 -10.651 9.190 5.204 525 HB2 ASP 80 HB2 ASP 80 -11.897 11.172 6.199 526 HB3 ASP 80 HB1 ASP 80 -13.379 10.390 5.657 527 H GLU 81 HN GLU 81 -11.156 7.143 5.226 528 HA GLU 81 HA GLU 81 -12.115 5.150 4.821 529 HB2 GLU 81 HB2 GLU 81 -14.509 6.867 4.237 530 HB3 GLU 81 HB1 GLU 81 -14.548 5.123 4.011 531 HG2 GLU 81 HG2 GLU 81 -13.720 4.982 6.428 532 HG3 GLU 81 HG1 GLU 81 -14.198 6.674 6.546 533 H ASP 82 HN ASP 82 -10.584 6.625 2.854 534 HA ASP 82 HA ASP 82 -11.652 6.090 0.258 535 HB2 ASP 82 HB2 ASP 82 -9.557 7.598 1.186 536 HB3 ASP 82 HB1 ASP 82 -8.718 6.213 0.493 537 H THR 83 HN THR 83 -10.376 4.565 -1.286 538 HA THR 83 HA THR 83 -9.725 2.093 0.186 539 HB THR 83 HB THR 83 -11.212 2.130 -2.437 540 HG1 THR 83 HG1 THR 83 -12.144 2.860 -0.084 541 HG21 THR 83 HG21 THR 83 -11.734 -0.181 -1.873 542 HG22 THR 83 HG22 THR 83 -10.856 -0.029 -0.351 543 HG23 THR 83 HG23 THR 83 -9.988 0.060 -1.885 544 H ILE 84 HN ILE 84 -8.023 0.947 -0.460 545 HA ILE 84 HA ILE 84 -6.526 1.873 -2.826 546 HB ILE 84 HB ILE 84 -5.465 0.665 -0.259 547 HG12 ILE 84 HG12 ILE 84 -4.952 3.422 -1.368 548 HG13 ILE 84 HG11 ILE 84 -6.275 3.086 -0.258 549 HG21 ILE 84 HG21 ILE 84 -3.229 1.204 -1.228 550 HG22 ILE 84 HG22 ILE 84 -4.029 1.547 -2.760 551 HG23 ILE 84 HG23 ILE 84 -4.089 -0.078 -2.080 552 HD11 ILE 84 HD11 ILE 84 -3.387 2.518 0.356 553 HD12 ILE 84 HD12 ILE 84 -4.754 2.457 1.466 554 HD13 ILE 84 HD13 ILE 84 -4.224 4.002 0.808 555 H ASP 85 HN ASP 85 -5.810 0.341 -4.278 556 HA ASP 85 HA ASP 85 -6.957 -2.340 -3.961 557 HB2 ASP 85 HB2 ASP 85 -6.062 -0.713 -6.318 558 HB3 ASP 85 HB1 ASP 85 -6.187 -2.462 -6.458 559 H VAL 86 HN VAL 86 -5.757 -4.142 -3.798 560 HA VAL 86 HA VAL 86 -2.824 -3.843 -3.908 561 HB VAL 86 HB VAL 86 -4.361 -5.955 -2.386 562 HG11 VAL 86 HG11 VAL 86 -2.221 -6.338 -1.249 563 HG12 VAL 86 HG12 VAL 86 -1.460 -5.130 -2.289 564 HG13 VAL 86 HG13 VAL 86 -2.101 -6.620 -2.987 565 HG21 VAL 86 HG21 VAL 86 -3.821 -4.701 -0.359 566 HG22 VAL 86 HG22 VAL 86 -4.848 -3.763 -1.444 567 HG23 VAL 86 HG23 VAL 86 -3.123 -3.414 -1.339 568 H PHE 87 HN PHE 87 -1.731 -5.036 -5.350 569 HA PHE 87 HA PHE 87 -3.123 -7.293 -6.632 570 HB2 PHE 87 HB2 PHE 87 -1.434 -5.182 -7.991 571 HB3 PHE 87 HB1 PHE 87 -2.011 -6.650 -8.771 572 HD1 PHE 87 HD1 PHE 87 -4.461 -6.997 -9.058 573 HD2 PHE 87 HD2 PHE 87 -2.816 -3.293 -7.757 574 HE1 PHE 87 HE1 PHE 87 -6.567 -5.861 -9.641 575 HE2 PHE 87 HE2 PHE 87 -4.915 -2.152 -8.334 576 HZ PHE 87 HZ PHE 87 -6.791 -3.436 -9.274 577 H GLN 88 HN GLN 88 -1.509 -8.653 -7.915 578 HA GLN 88 HA GLN 88 1.009 -8.905 -6.409 579 HB2 GLN 88 HB2 GLN 88 -0.882 -11.071 -7.334 580 HB3 GLN 88 HB1 GLN 88 0.762 -11.392 -6.798 581 HG2 GLN 88 HG2 GLN 88 -0.856 -9.793 -4.945 582 HG3 GLN 88 HG1 GLN 88 -1.421 -11.442 -5.201 583 HE21 GLN 88 HE21 GLN 88 -0.906 -12.040 -3.109 584 HE22 GLN 88 HE22 GLN 88 0.726 -12.277 -2.591 585 H GLN 89 HN GLN 89 2.800 -8.967 -7.623 586 HA GLN 89 HA GLN 89 2.665 -8.569 -10.420 587 HB2 GLN 89 HB2 GLN 89 4.522 -7.896 -8.733 588 HB3 GLN 89 HB1 GLN 89 5.144 -9.515 -9.018 589 HG2 GLN 89 HG2 GLN 89 6.249 -7.857 -10.421 590 HG3 GLN 89 HG1 GLN 89 5.371 -9.045 -11.383 591 HE21 GLN 89 HE21 GLN 89 5.204 -7.684 -13.155 592 HE22 GLN 89 HE22 GLN 89 4.153 -6.310 -13.172 593 H GLN 90 HN GLN 90 3.000 -9.929 -12.112 594 HA GLN 90 HA GLN 90 2.415 -12.689 -11.718 595 HB2 GLN 90 HB2 GLN 90 3.419 -11.352 -14.236 596 HB3 GLN 90 HB1 GLN 90 2.587 -12.894 -14.125 597 HG2 GLN 90 HG2 GLN 90 0.930 -11.477 -14.859 598 HG3 GLN 90 HG1 GLN 90 0.655 -11.516 -13.118 599 HE21 GLN 90 HE21 GLN 90 -0.450 -9.511 -13.327 600 HE22 GLN 90 HE22 GLN 90 0.430 -8.028 -13.484 601 H THR 91 HN THR 91 3.725 -14.452 -11.904 602 HA THR 91 HA THR 91 6.469 -14.119 -11.243 603 HB THR 91 HB THR 91 6.276 -16.739 -11.890 604 HG1 THR 91 HG1 THR 91 4.182 -17.421 -11.627 605 HG21 THR 91 HG21 THR 91 5.649 -17.115 -9.533 606 HG22 THR 91 HG22 THR 91 5.202 -15.415 -9.393 607 HG23 THR 91 HG23 THR 91 6.881 -15.866 -9.694 608 H GLY 92 HN GLY 92 4.710 -14.704 -14.191 609 HA2 GLY 92 HA2 GLY 92 6.961 -14.042 -15.808 610 HA3 GLY 92 HA1 GLY 92 6.611 -15.765 -15.867 611 H ASN 357 HT1 ASN 357 -15.948 -10.991 4.977 612 HA ASN 357 HA ASN 357 -13.797 -10.027 5.203 613 HB2 ASN 357 HB2 ASN 357 -14.377 -7.655 5.164 614 HB3 ASN 357 HB1 ASN 357 -15.575 -8.589 4.282 615 HD21 ASN 357 HD21 ASN 357 -15.778 -5.937 5.488 616 HD22 ASN 357 HD22 ASN 357 -17.099 -6.013 6.600 617 H ASN 358 HN ASN 358 -12.260 -8.953 6.408 618 HA ASN 358 HA ASN 358 -12.798 -8.855 9.292 619 HB2 ASN 358 HB2 ASN 358 -10.394 -9.448 9.645 620 HB3 ASN 358 HB1 ASN 358 -11.322 -10.723 8.866 621 HD21 ASN 358 HD21 ASN 358 -10.896 -11.256 6.737 622 HD22 ASN 358 HD22 ASN 358 -9.481 -10.704 5.910 623 H ARG 359 HN ARG 359 -12.360 -6.975 10.330 624 HA ARG 359 HA ARG 359 -10.847 -4.985 8.769 625 HB2 ARG 359 HB2 ARG 359 -12.265 -3.265 10.054 626 HB3 ARG 359 HB1 ARG 359 -13.035 -4.147 8.742 627 HG2 ARG 359 HG2 ARG 359 -14.055 -5.660 10.374 628 HG3 ARG 359 HG1 ARG 359 -13.300 -4.743 11.677 629 HD2 ARG 359 HD2 ARG 359 -15.128 -3.465 9.657 630 HD3 ARG 359 HD1 ARG 359 -15.729 -4.198 11.141 631 HE ARG 359 HE ARG 359 -13.720 -2.416 11.856 632 HH11 ARG 359 HH11 ARG 359 -16.875 -2.340 10.314 633 HH12 ARG 359 HH12 ARG 359 -17.303 -0.721 10.991 634 HH21 ARG 359 HH21 ARG 359 -14.221 -0.345 12.742 635 HH22 ARG 359 HH22 ARG 359 -15.824 0.384 12.342 636 H ASP 360 HN ASP 360 -9.060 -4.326 9.652 637 HA ASP 360 HA ASP 360 -8.779 -4.269 12.569 638 HB2 ASP 360 HB2 ASP 360 -7.511 -6.191 11.487 639 HB3 ASP 360 HB1 ASP 360 -6.489 -4.970 10.733 640 HA PRO 361 HA PRO 361 -7.254 -0.228 11.391 641 HB2 PRO 361 HB2 PRO 361 -7.615 1.009 13.736 642 HB3 PRO 361 HB1 PRO 361 -8.997 0.456 12.781 643 HG2 PRO 361 HG2 PRO 361 -7.923 -0.630 15.291 644 HG3 PRO 361 HG1 PRO 361 -9.542 -0.791 14.596 645 HD2 PRO 361 HD2 PRO 361 -7.364 -2.688 14.484 646 HD3 PRO 361 HD1 PRO 361 -9.014 -2.858 13.858 647 H ILE 362 HN ILE 362 -5.285 0.420 11.168 648 HA ILE 362 HA ILE 362 -3.233 -0.184 13.197 649 HB ILE 362 HB ILE 362 -2.812 0.084 10.222 650 HG12 ILE 362 HG12 ILE 362 -2.684 -2.545 11.660 651 HG13 ILE 362 HG11 ILE 362 -4.249 -1.912 11.156 652 HG21 ILE 362 HG21 ILE 362 -0.675 -1.127 10.780 653 HG22 ILE 362 HG22 ILE 362 -1.024 -0.787 12.473 654 HG23 ILE 362 HG23 ILE 362 -0.787 0.542 11.339 655 HD11 ILE 362 HD11 ILE 362 -1.902 -2.438 9.352 656 HD12 ILE 362 HD12 ILE 362 -3.471 -1.813 8.845 657 HD13 ILE 362 HD13 ILE 362 -3.343 -3.446 9.504 658 H VAL 363 HN VAL 363 -1.957 1.462 13.906 659 HA VAL 363 HA VAL 363 -2.357 4.095 12.632 660 HB VAL 363 HB VAL 363 -1.554 3.523 15.486 661 HG11 VAL 363 HG11 VAL 363 -0.684 5.638 14.680 662 HG12 VAL 363 HG12 VAL 363 -1.970 5.901 15.858 663 HG13 VAL 363 HG13 VAL 363 -2.295 6.113 14.138 664 HG21 VAL 363 HG21 VAL 363 -3.738 4.025 16.185 665 HG22 VAL 363 HG22 VAL 363 -3.919 2.892 14.846 666 HG23 VAL 363 HG23 VAL 363 -4.202 4.614 14.589 667 H ILE 364 HN ILE 364 -0.657 5.070 11.832 668 HA ILE 364 HA ILE 364 2.015 4.046 12.485 669 HB ILE 364 HB ILE 364 1.116 5.149 9.820 670 HG12 ILE 364 HG12 ILE 364 2.027 2.368 10.578 671 HG13 ILE 364 HG11 ILE 364 0.356 2.832 10.277 672 HG21 ILE 364 HG21 ILE 364 3.383 4.554 9.060 673 HG22 ILE 364 HG22 ILE 364 3.812 4.139 10.718 674 HG23 ILE 364 HG23 ILE 364 3.400 5.802 10.304 675 HD11 ILE 364 HD11 ILE 364 0.920 3.369 7.969 676 HD12 ILE 364 HD12 ILE 364 1.333 1.700 8.361 677 HD13 ILE 364 HD13 ILE 364 2.599 2.924 8.271 678 H SER 365 HN SER 365 3.518 5.459 13.060 679 HA SER 365 HA SER 365 2.795 8.314 13.036 680 HB2 SER 365 HB2 SER 365 4.703 7.056 15.006 681 HB3 SER 365 HB1 SER 365 3.827 8.582 15.145 682 HG SER 365 HG SER 365 3.052 6.050 15.817 683 H ASP 366 HN ASP 366 4.189 9.655 12.069 684 HA ASP 366 HA ASP 366 6.745 8.516 11.156 685 HB2 ASP 366 HB2 ASP 366 5.167 8.857 9.322 686 HB3 ASP 366 HB1 ASP 366 4.973 10.545 9.782 687 H SER 367 HN SER 367 8.544 9.564 11.646 688 HA SER 367 HA SER 367 8.348 12.058 13.151 689 HB2 SER 367 HB2 SER 367 10.981 10.804 12.925 690 HB3 SER 367 HB1 SER 367 10.085 11.272 14.370 691 HG SER 367 HG SER 367 9.132 9.322 14.433 692 HA PRO 368 HA PRO 368 9.982 14.484 9.822 693 HB2 PRO 368 HB2 PRO 368 11.457 16.321 11.225 694 HB3 PRO 368 HB1 PRO 368 9.696 16.382 11.076 695 HG2 PRO 368 HG2 PRO 368 11.354 15.375 13.336 696 HG3 PRO 368 HG1 PRO 368 9.845 16.309 13.374 697 HD2 PRO 368 HD2 PRO 368 9.897 13.651 13.826 698 HD3 PRO 368 HD1 PRO 368 8.525 14.458 13.041 Start of MODEL 8 1 H ASP 16 HT1 ASP 16 -6.546 15.542 11.344 2 HA ASP 16 HA ASP 16 -6.374 13.889 13.779 3 HB2 ASP 16 HB2 ASP 16 -8.667 14.360 11.878 4 HB3 ASP 16 HB1 ASP 16 -8.547 12.894 12.843 5 H HIS 17 HN HIS 17 -7.134 11.563 12.815 6 HA HIS 17 HA HIS 17 -5.104 10.997 10.796 7 HB2 HIS 17 HB2 HIS 17 -6.678 9.121 12.578 8 HB3 HIS 17 HB1 HIS 17 -5.392 8.639 11.478 9 HD2 HIS 17 HD2 HIS 17 -2.790 9.313 12.300 10 HE1 HIS 17 HE1 HIS 17 -3.972 10.402 16.212 11 HE2 HIS 17 HE2 HIS 17 -2.029 9.678 14.759 12 H ILE 18 HN ILE 18 -5.573 9.662 8.982 13 HA ILE 18 HA ILE 18 -8.359 9.938 8.080 14 HB ILE 18 HB ILE 18 -6.729 11.117 6.688 15 HG12 ILE 18 HG12 ILE 18 -7.776 8.674 5.250 16 HG13 ILE 18 HG11 ILE 18 -8.749 10.079 5.667 17 HG21 ILE 18 HG21 ILE 18 -5.060 9.866 5.374 18 HG22 ILE 18 HG22 ILE 18 -5.461 8.412 6.290 19 HG23 ILE 18 HG23 ILE 18 -4.756 9.805 7.110 20 HD11 ILE 18 HD11 ILE 18 -6.355 10.084 3.845 21 HD12 ILE 18 HD12 ILE 18 -7.357 11.479 4.253 22 HD13 ILE 18 HD13 ILE 18 -8.045 10.134 3.341 23 H ASN 19 HN ASN 19 -9.503 8.178 7.391 24 HA ASN 19 HA ASN 19 -8.401 5.590 8.149 25 HB2 ASN 19 HB2 ASN 19 -11.186 6.347 7.244 26 HB3 ASN 19 HB1 ASN 19 -10.702 4.766 7.845 27 HD21 ASN 19 HD21 ASN 19 -11.314 8.088 8.657 28 HD22 ASN 19 HD22 ASN 19 -11.422 7.852 10.373 29 H LEU 20 HN LEU 20 -6.994 4.999 6.522 30 HA LEU 20 HA LEU 20 -8.034 4.922 3.783 31 HB2 LEU 20 HB2 LEU 20 -5.266 4.327 4.845 32 HB3 LEU 20 HB1 LEU 20 -5.721 4.347 3.151 33 HG LEU 20 HG LEU 20 -5.770 6.729 5.006 34 HD11 LEU 20 HD11 LEU 20 -3.887 6.003 2.763 35 HD12 LEU 20 HD12 LEU 20 -3.500 6.040 4.483 36 HD13 LEU 20 HD13 LEU 20 -3.899 7.534 3.635 37 HD21 LEU 20 HD21 LEU 20 -6.118 7.987 2.874 38 HD22 LEU 20 HD22 LEU 20 -7.481 6.981 3.366 39 HD23 LEU 20 HD23 LEU 20 -6.406 6.440 2.078 40 H LYS 21 HN LYS 21 -9.149 3.155 3.265 41 HA LYS 21 HA LYS 21 -8.678 0.677 4.707 42 HB2 LYS 21 HB2 LYS 21 -10.744 1.422 2.634 43 HB3 LYS 21 HB1 LYS 21 -10.661 -0.140 3.436 44 HG2 LYS 21 HG2 LYS 21 -11.088 0.890 5.574 45 HG3 LYS 21 HG1 LYS 21 -11.057 2.495 4.835 46 HD2 LYS 21 HD2 LYS 21 -12.968 1.792 3.398 47 HD3 LYS 21 HD1 LYS 21 -13.049 0.289 4.318 48 HE2 LYS 21 HE2 LYS 21 -13.578 1.463 6.326 49 HE3 LYS 21 HE1 LYS 21 -13.247 3.019 5.568 50 HZ1 LYS 21 HZ1 LYS 21 -15.558 2.813 5.576 51 HZ2 LYS 21 HZ2 LYS 21 -15.513 1.195 5.071 52 HZ3 LYS 21 HZ3 LYS 21 -15.109 2.423 3.989 53 H VAL 22 HN VAL 22 -7.344 -0.806 4.025 54 HA VAL 22 HA VAL 22 -6.662 -0.929 1.160 55 HB VAL 22 HB VAL 22 -5.131 -2.090 3.496 56 HG11 VAL 22 HG11 VAL 22 -4.732 -3.277 1.421 57 HG12 VAL 22 HG12 VAL 22 -3.307 -2.338 1.870 58 HG13 VAL 22 HG13 VAL 22 -4.381 -1.757 0.596 59 HG21 VAL 22 HG21 VAL 22 -3.582 -0.260 3.293 60 HG22 VAL 22 HG22 VAL 22 -5.203 0.399 3.517 61 HG23 VAL 22 HG23 VAL 22 -4.469 0.391 1.915 62 H ALA 23 HN ALA 23 -7.831 -2.444 0.154 63 HA ALA 23 HA ALA 23 -8.660 -4.806 1.691 64 HB1 ALA 23 HB1 ALA 23 -10.434 -5.083 0.053 65 HB2 ALA 23 HB2 ALA 23 -9.815 -3.707 -0.866 66 HB3 ALA 23 HB3 ALA 23 -10.473 -3.463 0.754 67 H GLY 24 HN GLY 24 -8.045 -6.785 1.165 68 HA2 GLY 24 HA2 GLY 24 -6.111 -7.099 -0.998 69 HA3 GLY 24 HA1 GLY 24 -6.478 -8.279 0.255 70 H GLN 25 HN GLN 25 -6.289 -9.346 -2.145 71 HA GLN 25 HA GLN 25 -8.850 -9.298 -3.509 72 HB2 GLN 25 HB2 GLN 25 -6.462 -11.059 -4.091 73 HB3 GLN 25 HB1 GLN 25 -7.822 -10.730 -5.157 74 HG2 GLN 25 HG2 GLN 25 -5.646 -8.844 -4.310 75 HG3 GLN 25 HG1 GLN 25 -5.988 -9.445 -5.930 76 HE21 GLN 25 HE21 GLN 25 -5.794 -6.716 -4.856 77 HE22 GLN 25 HE22 GLN 25 -7.299 -5.939 -5.251 78 H ASP 26 HN ASP 26 -9.532 -10.058 -1.166 79 HA ASP 26 HA ASP 26 -10.406 -12.772 -1.479 80 HB2 ASP 26 HB2 ASP 26 -9.547 -13.478 0.804 81 HB3 ASP 26 HB1 ASP 26 -8.333 -13.361 -0.465 82 H GLY 27 HN GLY 27 -10.081 -10.066 0.813 83 HA2 GLY 27 HA2 GLY 27 -12.617 -9.241 1.037 84 HA3 GLY 27 HA1 GLY 27 -12.652 -10.709 1.999 85 H SER 28 HN SER 28 -9.668 -9.964 2.601 86 HA SER 28 HA SER 28 -10.192 -8.780 5.120 87 HB2 SER 28 HB2 SER 28 -7.621 -8.539 5.136 88 HB3 SER 28 HB1 SER 28 -8.287 -10.170 5.035 89 HG SER 28 HG SER 28 -7.779 -10.261 2.891 90 H VAL 29 HN VAL 29 -10.282 -6.676 5.732 91 HA VAL 29 HA VAL 29 -9.247 -4.670 3.824 92 HB VAL 29 HB VAL 29 -11.847 -4.351 5.335 93 HG11 VAL 29 HG11 VAL 29 -12.150 -2.391 3.899 94 HG12 VAL 29 HG12 VAL 29 -10.566 -2.674 3.180 95 HG13 VAL 29 HG13 VAL 29 -10.698 -2.255 4.889 96 HG21 VAL 29 HG21 VAL 29 -12.978 -4.598 3.183 97 HG22 VAL 29 HG22 VAL 29 -12.092 -6.062 3.604 98 HG23 VAL 29 HG23 VAL 29 -11.434 -4.949 2.405 99 H VAL 30 HN VAL 30 -7.446 -4.217 5.046 100 HA VAL 30 HA VAL 30 -7.690 -3.668 7.867 101 HB VAL 30 HB VAL 30 -5.275 -2.995 7.702 102 HG11 VAL 30 HG11 VAL 30 -6.048 -5.724 6.681 103 HG12 VAL 30 HG12 VAL 30 -5.887 -5.233 8.364 104 HG13 VAL 30 HG13 VAL 30 -4.465 -5.298 7.326 105 HG21 VAL 30 HG21 VAL 30 -5.116 -2.272 5.434 106 HG22 VAL 30 HG22 VAL 30 -5.662 -3.840 4.837 107 HG23 VAL 30 HG23 VAL 30 -4.088 -3.693 5.618 108 H GLN 31 HN GLN 31 -7.703 -1.707 8.856 109 HA GLN 31 HA GLN 31 -8.171 0.586 7.076 110 HB2 GLN 31 HB2 GLN 31 -9.973 -0.171 8.677 111 HB3 GLN 31 HB1 GLN 31 -8.918 0.328 9.991 112 HG2 GLN 31 HG2 GLN 31 -9.298 2.525 9.643 113 HG3 GLN 31 HG1 GLN 31 -9.449 2.334 7.896 114 HE21 GLN 31 HE21 GLN 31 -11.140 3.709 9.935 115 HE22 GLN 31 HE22 GLN 31 -12.729 3.060 9.691 116 H PHE 32 HN PHE 32 -6.281 1.568 6.760 117 HA PHE 32 HA PHE 32 -4.376 1.876 8.926 118 HB2 PHE 32 HB2 PHE 32 -4.377 2.421 5.986 119 HB3 PHE 32 HB1 PHE 32 -3.221 3.277 7.002 120 HD1 PHE 32 HD1 PHE 32 -4.208 0.044 5.632 121 HD2 PHE 32 HD2 PHE 32 -1.434 2.101 8.110 122 HE1 PHE 32 HE1 PHE 32 -2.703 -1.900 5.555 123 HE2 PHE 32 HE2 PHE 32 0.073 0.163 8.041 124 HZ PHE 32 HZ PHE 32 -0.560 -1.841 6.763 125 H LYS 33 HN LYS 33 -5.062 3.325 10.405 126 HA LYS 33 HA LYS 33 -6.186 5.852 9.452 127 HB2 LYS 33 HB2 LYS 33 -7.123 4.307 11.409 128 HB3 LYS 33 HB1 LYS 33 -5.968 5.237 12.358 129 HG2 LYS 33 HG2 LYS 33 -7.033 7.311 11.573 130 HG3 LYS 33 HG1 LYS 33 -8.216 6.348 10.691 131 HD2 LYS 33 HD2 LYS 33 -8.955 5.344 12.807 132 HD3 LYS 33 HD1 LYS 33 -7.783 6.336 13.676 133 HE2 LYS 33 HE2 LYS 33 -8.895 8.360 12.866 134 HE3 LYS 33 HE1 LYS 33 -10.066 7.370 11.996 135 HZ1 LYS 33 HZ1 LYS 33 -9.682 7.347 14.939 136 HZ2 LYS 33 HZ2 LYS 33 -10.865 6.503 14.075 137 HZ3 LYS 33 HZ3 LYS 33 -10.905 8.191 14.131 138 H ILE 34 HN ILE 34 -4.074 6.411 8.628 139 HA ILE 34 HA ILE 34 -2.141 7.212 10.690 140 HB ILE 34 HB ILE 34 -0.553 7.508 8.806 141 HG12 ILE 34 HG12 ILE 34 -2.692 6.193 7.117 142 HG13 ILE 34 HG11 ILE 34 -2.314 7.909 7.061 143 HG21 ILE 34 HG21 ILE 34 -0.286 5.086 8.309 144 HG22 ILE 34 HG22 ILE 34 -1.847 4.802 9.081 145 HG23 ILE 34 HG23 ILE 34 -0.502 5.448 10.022 146 HD11 ILE 34 HD11 ILE 34 -1.283 6.621 5.240 147 HD12 ILE 34 HD12 ILE 34 -0.366 5.706 6.439 148 HD13 ILE 34 HD13 ILE 34 -0.098 7.440 6.258 149 H LYS 35 HN LYS 35 -0.839 9.266 9.778 150 HA LYS 35 HA LYS 35 -2.803 11.375 9.753 151 HB2 LYS 35 HB2 LYS 35 0.221 11.477 9.695 152 HB3 LYS 35 HB1 LYS 35 -0.832 12.879 9.853 153 HG2 LYS 35 HG2 LYS 35 -1.726 11.954 11.948 154 HG3 LYS 35 HG1 LYS 35 -0.619 10.588 11.801 155 HD2 LYS 35 HD2 LYS 35 1.285 12.037 12.000 156 HD3 LYS 35 HD1 LYS 35 0.257 13.470 11.942 157 HE2 LYS 35 HE2 LYS 35 -0.845 12.641 14.042 158 HE3 LYS 35 HE1 LYS 35 0.400 11.395 14.122 159 HZ1 LYS 35 HZ1 LYS 35 2.054 13.257 14.091 160 HZ2 LYS 35 HZ2 LYS 35 1.111 13.166 15.486 161 HZ3 LYS 35 HZ3 LYS 35 0.769 14.333 14.313 162 H ARG 36 HN ARG 36 -3.015 12.954 8.118 163 HA ARG 36 HA ARG 36 -2.983 11.904 5.500 164 HB2 ARG 36 HB2 ARG 36 -3.802 14.418 6.784 165 HB3 ARG 36 HB1 ARG 36 -3.325 14.577 5.098 166 HG2 ARG 36 HG2 ARG 36 -4.922 12.786 4.518 167 HG3 ARG 36 HG1 ARG 36 -5.446 12.752 6.201 168 HD2 ARG 36 HD2 ARG 36 -6.534 14.754 6.047 169 HD3 ARG 36 HD1 ARG 36 -5.461 15.364 4.787 170 HE ARG 36 HE ARG 36 -6.652 13.923 3.219 171 HH11 ARG 36 HH11 ARG 36 -8.205 14.578 6.312 172 HH12 ARG 36 HH12 ARG 36 -9.854 14.237 5.679 173 HH21 ARG 36 HH21 ARG 36 -8.713 13.480 2.383 174 HH22 ARG 36 HH22 ARG 36 -10.153 13.628 3.478 175 H HIS 37 HN HIS 37 -0.489 13.301 7.275 176 HA HIS 37 HA HIS 37 0.918 14.099 4.822 177 HB2 HIS 37 HB2 HIS 37 2.523 15.196 6.583 178 HB3 HIS 37 HB1 HIS 37 1.025 15.996 6.129 179 HD2 HIS 37 HD2 HIS 37 -1.095 15.612 8.103 180 HE1 HIS 37 HE1 HIS 37 1.749 15.058 11.185 181 HE2 HIS 37 HE2 HIS 37 -0.710 15.367 10.660 182 H THR 38 HN THR 38 0.589 11.423 6.441 183 HA THR 38 HA THR 38 3.394 10.750 6.835 184 HB THR 38 HB THR 38 0.932 9.020 7.186 185 HG1 THR 38 HG1 THR 38 2.246 10.859 8.848 186 HG21 THR 38 HG21 THR 38 3.779 8.665 8.128 187 HG22 THR 38 HG22 THR 38 2.944 7.690 6.917 188 HG23 THR 38 HG23 THR 38 2.420 7.646 8.602 189 HA PRO 39 HA PRO 39 3.924 9.472 2.574 190 HB2 PRO 39 HB2 PRO 39 5.933 7.714 3.912 191 HB3 PRO 39 HB1 PRO 39 6.115 8.754 2.492 192 HG2 PRO 39 HG2 PRO 39 7.095 9.537 4.814 193 HG3 PRO 39 HG1 PRO 39 6.274 10.694 3.749 194 HD2 PRO 39 HD2 PRO 39 5.293 9.417 6.254 195 HD3 PRO 39 HD1 PRO 39 4.996 11.049 5.620 196 H LEU 40 HN LEU 40 2.889 7.992 1.417 197 HA LEU 40 HA LEU 40 1.520 5.821 2.635 198 HB2 LEU 40 HB2 LEU 40 1.952 6.604 -0.238 199 HB3 LEU 40 HB1 LEU 40 1.011 5.199 0.227 200 HG LEU 40 HG LEU 40 0.364 7.991 1.160 201 HD11 LEU 40 HD11 LEU 40 -1.389 7.984 -0.552 202 HD12 LEU 40 HD12 LEU 40 -0.751 6.467 -1.188 203 HD13 LEU 40 HD13 LEU 40 0.225 7.934 -1.259 204 HD21 LEU 40 HD21 LEU 40 -1.227 5.430 1.119 205 HD22 LEU 40 HD22 LEU 40 -1.828 7.005 1.644 206 HD23 LEU 40 HD23 LEU 40 -0.535 6.207 2.544 207 H SER 41 HN SER 41 4.683 6.145 1.486 208 HA SER 41 HA SER 41 5.244 3.602 0.472 209 HB2 SER 41 HB2 SER 41 7.529 4.476 1.851 210 HB3 SER 41 HB1 SER 41 7.152 4.744 0.147 211 HG SER 41 HG SER 41 7.055 6.773 0.665 212 H LYS 42 HN LYS 42 5.258 4.866 3.764 213 HA LYS 42 HA LYS 42 6.231 2.479 4.979 214 HB2 LYS 42 HB2 LYS 42 4.779 4.864 6.145 215 HB3 LYS 42 HB1 LYS 42 5.499 3.571 7.101 216 HG2 LYS 42 HG2 LYS 42 7.626 4.265 6.706 217 HG3 LYS 42 HG1 LYS 42 7.235 4.936 5.124 218 HD2 LYS 42 HD2 LYS 42 5.944 6.731 6.378 219 HD3 LYS 42 HD1 LYS 42 6.738 6.131 7.837 220 HE2 LYS 42 HE2 LYS 42 8.505 6.681 5.537 221 HE3 LYS 42 HE1 LYS 42 7.743 8.088 6.277 222 HZ1 LYS 42 HZ1 LYS 42 9.960 7.416 7.206 223 HZ2 LYS 42 HZ2 LYS 42 9.204 6.058 7.860 224 HZ3 LYS 42 HZ3 LYS 42 8.723 7.609 8.345 225 H LEU 43 HN LEU 43 3.131 3.625 3.980 226 HA LEU 43 HA LEU 43 1.527 1.895 5.572 227 HB2 LEU 43 HB2 LEU 43 0.657 3.934 4.480 228 HB3 LEU 43 HB1 LEU 43 0.929 3.207 2.909 229 HG LEU 43 HG LEU 43 -0.825 1.702 4.764 230 HD11 LEU 43 HD11 LEU 43 -2.760 3.098 4.238 231 HD12 LEU 43 HD12 LEU 43 -1.707 4.256 3.424 232 HD13 LEU 43 HD13 LEU 43 -1.555 3.996 5.162 233 HD21 LEU 43 HD21 LEU 43 -0.260 1.031 2.410 234 HD22 LEU 43 HD22 LEU 43 -1.177 2.435 1.863 235 HD23 LEU 43 HD23 LEU 43 -1.984 1.150 2.760 236 H MET 44 HN MET 44 2.853 1.748 2.308 237 HA MET 44 HA MET 44 1.747 -0.743 1.583 238 HB2 MET 44 HB2 MET 44 4.296 0.562 0.599 239 HB3 MET 44 HB1 MET 44 3.470 -0.779 -0.184 240 HG2 MET 44 HG2 MET 44 1.466 0.744 -0.385 241 HG3 MET 44 HG1 MET 44 2.532 2.058 0.106 242 HE1 MET 44 HE1 MET 44 4.592 2.938 -1.375 243 HE2 MET 44 HE2 MET 44 5.160 2.091 -2.812 244 HE3 MET 44 HE3 MET 44 5.263 1.315 -1.233 245 H LYS 45 HN LYS 45 4.771 0.169 3.122 246 HA LYS 45 HA LYS 45 5.965 -2.375 3.166 247 HB2 LYS 45 HB2 LYS 45 6.342 0.138 4.765 248 HB3 LYS 45 HB1 LYS 45 7.218 -1.326 5.188 249 HG2 LYS 45 HG2 LYS 45 8.320 -1.372 3.081 250 HG3 LYS 45 HG1 LYS 45 7.291 -0.086 2.449 251 HD2 LYS 45 HD2 LYS 45 8.279 1.523 3.911 252 HD3 LYS 45 HD1 LYS 45 9.138 0.267 4.805 253 HE2 LYS 45 HE2 LYS 45 9.640 0.488 1.886 254 HE3 LYS 45 HE1 LYS 45 10.320 1.733 2.932 255 HZ1 LYS 45 HZ1 LYS 45 10.770 -1.192 3.176 256 HZ2 LYS 45 HZ2 LYS 45 11.384 -0.023 4.231 257 HZ3 LYS 45 HZ3 LYS 45 11.890 -0.053 2.618 258 H ALA 46 HN ALA 46 3.809 -0.723 5.424 259 HA ALA 46 HA ALA 46 3.978 -2.618 7.507 260 HB1 ALA 46 HB1 ALA 46 3.118 -0.404 7.915 261 HB2 ALA 46 HB2 ALA 46 1.878 -1.594 8.310 262 HB3 ALA 46 HB3 ALA 46 1.777 -0.683 6.803 263 H TYR 47 HN TYR 47 1.793 -2.306 4.743 264 HA TYR 47 HA TYR 47 0.082 -4.441 5.448 265 HB2 TYR 47 HB2 TYR 47 -0.574 -2.759 3.798 266 HB3 TYR 47 HB1 TYR 47 0.708 -3.294 2.718 267 HD1 TYR 47 HD1 TYR 47 0.384 -5.136 1.258 268 HD2 TYR 47 HD2 TYR 47 -2.484 -4.314 4.288 269 HE1 TYR 47 HE1 TYR 47 -1.151 -6.759 0.237 270 HE2 TYR 47 HE2 TYR 47 -4.029 -5.936 3.272 271 HH TYR 47 HH TYR 47 -4.432 -6.985 1.108 272 H CYS 48 HN CYS 48 2.970 -4.286 3.385 273 HA CYS 48 HA CYS 48 2.871 -6.969 2.538 274 HB2 CYS 48 HB2 CYS 48 4.767 -6.490 1.386 275 HB3 CYS 48 HB1 CYS 48 4.351 -4.836 1.817 276 HG CYS 48 HG CYS 48 6.913 -6.747 2.849 277 H GLU 49 HN GLU 49 4.104 -5.474 5.432 278 HA GLU 49 HA GLU 49 5.666 -7.661 6.336 279 HB2 GLU 49 HB2 GLU 49 4.550 -5.182 7.566 280 HB3 GLU 49 HB1 GLU 49 5.128 -6.457 8.633 281 HG2 GLU 49 HG2 GLU 49 6.728 -5.075 6.493 282 HG3 GLU 49 HG1 GLU 49 6.859 -4.816 8.233 283 H ARG 50 HN ARG 50 2.298 -6.769 6.665 284 HA ARG 50 HA ARG 50 1.617 -8.671 8.656 285 HB2 ARG 50 HB2 ARG 50 0.042 -7.098 6.639 286 HB3 ARG 50 HB1 ARG 50 -0.741 -8.324 7.630 287 HG2 ARG 50 HG2 ARG 50 0.921 -6.292 9.014 288 HG3 ARG 50 HG1 ARG 50 -0.631 -5.778 8.348 289 HD2 ARG 50 HD2 ARG 50 -1.683 -7.702 9.564 290 HD3 ARG 50 HD1 ARG 50 -0.131 -7.966 10.353 291 HE ARG 50 HE ARG 50 -0.389 -5.907 11.494 292 HH11 ARG 50 HH11 ARG 50 -3.181 -6.853 9.571 293 HH12 ARG 50 HH12 ARG 50 -4.276 -5.642 10.352 294 HH21 ARG 50 HH21 ARG 50 -3.490 -4.321 12.054 295 HH22 ARG 50 HH22 ARG 50 -1.746 -4.406 12.543 296 H GLN 51 HN GLN 51 1.468 -8.695 5.123 297 HA GLN 51 HA GLN 51 0.377 -11.338 4.987 298 HB2 GLN 51 HB2 GLN 51 1.786 -9.885 2.753 299 HB3 GLN 51 HB1 GLN 51 0.549 -11.128 2.621 300 HG2 GLN 51 HG2 GLN 51 0.164 -8.318 3.629 301 HG3 GLN 51 HG1 GLN 51 -0.366 -8.960 2.077 302 HE21 GLN 51 HE21 GLN 51 -2.161 -10.277 1.988 303 HE22 GLN 51 HE22 GLN 51 -3.251 -10.460 3.318 304 H GLY 52 HN GLY 52 3.489 -10.052 5.434 305 HA2 GLY 52 HA2 GLY 52 5.493 -11.123 5.833 306 HA3 GLY 52 HA1 GLY 52 4.670 -12.658 5.589 307 H LEU 53 HN LEU 53 4.582 -10.123 3.206 308 HA LEU 53 HA LEU 53 6.375 -11.719 1.498 309 HB2 LEU 53 HB2 LEU 53 3.975 -10.124 0.604 310 HB3 LEU 53 HB1 LEU 53 5.023 -11.082 -0.422 311 HG LEU 53 HG LEU 53 3.327 -12.256 1.781 312 HD11 LEU 53 HD11 LEU 53 1.815 -12.985 0.001 313 HD12 LEU 53 HD12 LEU 53 2.761 -12.070 -1.174 314 HD13 LEU 53 HD13 LEU 53 1.892 -11.225 0.108 315 HD21 LEU 53 HD21 LEU 53 5.257 -13.604 1.144 316 HD22 LEU 53 HD22 LEU 53 4.778 -13.504 -0.550 317 HD23 LEU 53 HD23 LEU 53 3.756 -14.356 0.605 318 H SER 54 HN SER 54 7.523 -10.509 -0.123 319 HA SER 54 HA SER 54 8.605 -8.087 0.882 320 HB2 SER 54 HB2 SER 54 10.006 -9.590 -0.408 321 HB3 SER 54 HB1 SER 54 8.925 -9.468 -1.796 322 HG SER 54 HG SER 54 10.981 -8.074 -1.568 323 H MET 55 HN MET 55 8.408 -5.985 0.083 324 HA MET 55 HA MET 55 5.833 -5.238 -0.810 325 HB2 MET 55 HB2 MET 55 7.492 -3.839 0.545 326 HB3 MET 55 HB1 MET 55 8.290 -3.497 -0.985 327 HG2 MET 55 HG2 MET 55 6.160 -2.564 -1.834 328 HG3 MET 55 HG1 MET 55 5.453 -2.814 -0.239 329 HE1 MET 55 HE1 MET 55 7.622 -0.625 -2.511 330 HE2 MET 55 HE2 MET 55 8.924 -1.393 -1.603 331 HE3 MET 55 HE3 MET 55 8.599 0.329 -1.396 332 H ARG 56 HN ARG 56 8.770 -6.035 -2.465 333 HA ARG 56 HA ARG 56 8.065 -4.798 -4.955 334 HB2 ARG 56 HB2 ARG 56 10.411 -5.306 -4.197 335 HB3 ARG 56 HB1 ARG 56 10.070 -7.005 -4.490 336 HG2 ARG 56 HG2 ARG 56 9.565 -6.417 -6.860 337 HG3 ARG 56 HG1 ARG 56 10.134 -4.781 -6.516 338 HD2 ARG 56 HD2 ARG 56 12.301 -5.792 -5.772 339 HD3 ARG 56 HD1 ARG 56 11.707 -7.343 -6.361 340 HE ARG 56 HE ARG 56 11.827 -6.539 -8.567 341 HH11 ARG 56 HH11 ARG 56 13.815 -3.207 -7.398 342 HH12 ARG 56 HH12 ARG 56 13.008 -4.250 -6.169 343 HH21 ARG 56 HH21 ARG 56 13.741 -3.784 -9.636 344 HH22 ARG 56 HH22 ARG 56 12.861 -5.270 -10.151 345 H GLN 57 HN GLN 57 7.097 -7.632 -3.375 346 HA GLN 57 HA GLN 57 6.555 -9.136 -5.798 347 HB2 GLN 57 HB2 GLN 57 7.285 -10.224 -3.656 348 HB3 GLN 57 HB1 GLN 57 5.733 -9.779 -2.958 349 HG2 GLN 57 HG2 GLN 57 4.602 -11.119 -4.679 350 HG3 GLN 57 HG1 GLN 57 6.173 -11.600 -5.315 351 HE21 GLN 57 HE21 GLN 57 4.013 -13.215 -4.193 352 HE22 GLN 57 HE22 GLN 57 4.726 -14.109 -2.896 353 H ILE 58 HN ILE 58 4.988 -6.741 -3.977 354 HA ILE 58 HA ILE 58 2.399 -7.524 -5.138 355 HB ILE 58 HB ILE 58 1.390 -6.079 -3.295 356 HG12 ILE 58 HG12 ILE 58 4.135 -6.532 -2.100 357 HG13 ILE 58 HG11 ILE 58 3.459 -4.976 -2.566 358 HG21 ILE 58 HG21 ILE 58 1.129 -8.459 -3.302 359 HG22 ILE 58 HG22 ILE 58 1.499 -7.944 -1.657 360 HG23 ILE 58 HG23 ILE 58 2.753 -8.685 -2.651 361 HD11 ILE 58 HD11 ILE 58 2.474 -6.780 -0.373 362 HD12 ILE 58 HD12 ILE 58 1.695 -5.280 -0.872 363 HD13 ILE 58 HD13 ILE 58 3.319 -5.244 -0.188 364 H ARG 59 HN ARG 59 0.899 -5.645 -5.467 365 HA ARG 59 HA ARG 59 2.323 -3.205 -6.301 366 HB2 ARG 59 HB2 ARG 59 0.293 -4.751 -7.929 367 HB3 ARG 59 HB1 ARG 59 0.856 -3.136 -8.332 368 HG2 ARG 59 HG2 ARG 59 2.576 -5.605 -8.176 369 HG3 ARG 59 HG1 ARG 59 1.967 -4.861 -9.656 370 HD2 ARG 59 HD2 ARG 59 3.182 -2.798 -9.088 371 HD3 ARG 59 HD1 ARG 59 3.826 -3.590 -7.651 372 HE ARG 59 HE ARG 59 4.550 -4.139 -10.431 373 HH11 ARG 59 HH11 ARG 59 6.488 -5.734 -7.245 374 HH12 ARG 59 HH12 ARG 59 4.919 -4.866 -7.004 375 HH21 ARG 59 HH21 ARG 59 6.533 -5.225 -10.769 376 HH22 ARG 59 HH22 ARG 59 7.405 -5.908 -9.349 377 H PHE 60 HN PHE 60 1.264 -1.334 -5.831 378 HA PHE 60 HA PHE 60 -1.388 -1.616 -4.584 379 HB2 PHE 60 HB2 PHE 60 0.877 0.298 -4.073 380 HB3 PHE 60 HB1 PHE 60 -0.766 0.663 -3.556 381 HD1 PHE 60 HD1 PHE 60 1.901 -1.910 -3.260 382 HD2 PHE 60 HD2 PHE 60 -1.566 -0.142 -1.530 383 HE1 PHE 60 HE1 PHE 60 2.258 -3.223 -1.212 384 HE2 PHE 60 HE2 PHE 60 -1.212 -1.454 0.522 385 HZ PHE 60 HZ PHE 60 0.702 -2.994 0.683 386 H ARG 61 HN ARG 61 -3.080 -0.630 -5.476 387 HA ARG 61 HA ARG 61 -2.567 1.470 -7.485 388 HB2 ARG 61 HB2 ARG 61 -3.384 -0.961 -8.199 389 HB3 ARG 61 HB1 ARG 61 -4.952 -0.295 -7.762 390 HG2 ARG 61 HG2 ARG 61 -4.583 1.557 -9.342 391 HG3 ARG 61 HG1 ARG 61 -3.041 0.830 -9.802 392 HD2 ARG 61 HD2 ARG 61 -4.307 -1.237 -10.442 393 HD3 ARG 61 HD1 ARG 61 -5.796 -0.332 -10.178 394 HE ARG 61 HE ARG 61 -3.950 0.927 -12.006 395 HH11 ARG 61 HH11 ARG 61 -7.140 -1.171 -13.373 396 HH12 ARG 61 HH12 ARG 61 -6.607 -1.360 -11.662 397 HH21 ARG 61 HH21 ARG 61 -4.573 1.162 -14.190 398 HH22 ARG 61 HH22 ARG 61 -6.004 0.240 -14.786 399 H PHE 62 HN PHE 62 -3.663 3.295 -7.229 400 HA PHE 62 HA PHE 62 -5.990 3.326 -5.425 401 HB2 PHE 62 HB2 PHE 62 -4.377 4.353 -4.081 402 HB3 PHE 62 HB1 PHE 62 -3.561 5.091 -5.455 403 HD1 PHE 62 HD1 PHE 62 -6.735 5.244 -3.515 404 HD2 PHE 62 HD2 PHE 62 -3.942 7.320 -5.965 405 HE1 PHE 62 HE1 PHE 62 -7.936 7.348 -3.101 406 HE2 PHE 62 HE2 PHE 62 -5.142 9.426 -5.550 407 HZ PHE 62 HZ PHE 62 -7.141 9.444 -4.118 408 H ASP 63 HN ASP 63 -7.725 3.881 -6.547 409 HA ASP 63 HA ASP 63 -9.129 4.853 -8.044 410 HB2 ASP 63 HB2 ASP 63 -8.172 6.883 -6.791 411 HB3 ASP 63 HB1 ASP 63 -7.173 7.144 -8.216 412 H GLY 64 HN GLY 64 -6.950 3.143 -9.011 413 HA2 GLY 64 HA2 GLY 64 -6.641 2.313 -11.185 414 HA3 GLY 64 HA1 GLY 64 -7.149 3.864 -11.831 415 H GLN 65 HN GLN 65 -5.078 4.838 -9.601 416 HA GLN 65 HA GLN 65 -2.804 4.735 -11.470 417 HB2 GLN 65 HB2 GLN 65 -3.761 6.793 -9.515 418 HB3 GLN 65 HB1 GLN 65 -2.056 6.733 -9.944 419 HG2 GLN 65 HG2 GLN 65 -4.284 6.967 -11.951 420 HG3 GLN 65 HG1 GLN 65 -3.414 8.342 -11.271 421 HE21 GLN 65 HE21 GLN 65 -1.270 8.675 -11.832 422 HE22 GLN 65 HE22 GLN 65 -0.545 7.906 -13.203 423 HA PRO 66 HA PRO 66 -0.663 2.262 -8.460 424 HB2 PRO 66 HB2 PRO 66 1.868 2.597 -9.411 425 HB3 PRO 66 HB1 PRO 66 0.682 1.531 -10.177 426 HG2 PRO 66 HG2 PRO 66 1.495 4.295 -10.940 427 HG3 PRO 66 HG1 PRO 66 1.164 2.893 -11.977 428 HD2 PRO 66 HD2 PRO 66 -0.630 4.887 -11.606 429 HD3 PRO 66 HD1 PRO 66 -1.109 3.204 -11.901 430 H ILE 67 HN ILE 67 0.331 2.619 -6.523 431 HA ILE 67 HA ILE 67 0.782 5.371 -5.761 432 HB ILE 67 HB ILE 67 1.079 2.865 -4.093 433 HG12 ILE 67 HG12 ILE 67 -1.259 4.758 -4.435 434 HG13 ILE 67 HG11 ILE 67 -1.200 3.066 -4.917 435 HG21 ILE 67 HG21 ILE 67 0.867 5.768 -3.296 436 HG22 ILE 67 HG22 ILE 67 2.293 4.739 -3.155 437 HG23 ILE 67 HG23 ILE 67 0.863 4.401 -2.179 438 HD11 ILE 67 HD11 ILE 67 -2.471 3.258 -2.906 439 HD12 ILE 67 HD12 ILE 67 -1.171 4.154 -2.113 440 HD13 ILE 67 HD13 ILE 67 -0.945 2.454 -2.531 441 H ASN 68 HN ASN 68 2.688 6.325 -5.243 442 HA ASN 68 HA ASN 68 5.128 4.819 -5.911 443 HB2 ASN 68 HB2 ASN 68 4.699 7.815 -5.780 444 HB3 ASN 68 HB1 ASN 68 6.175 7.005 -6.291 445 HD21 ASN 68 HD21 ASN 68 2.911 7.823 -7.119 446 HD22 ASN 68 HD22 ASN 68 3.023 7.417 -8.804 447 H GLU 69 HN GLU 69 7.109 5.585 -4.678 448 HA GLU 69 HA GLU 69 6.622 5.215 -1.887 449 HB2 GLU 69 HB2 GLU 69 9.133 5.790 -3.455 450 HB3 GLU 69 HB1 GLU 69 9.122 5.556 -1.713 451 HG2 GLU 69 HG2 GLU 69 8.094 3.313 -2.106 452 HG3 GLU 69 HG1 GLU 69 8.369 3.557 -3.831 453 H THR 70 HN THR 70 6.995 7.974 -3.915 454 HA THR 70 HA THR 70 7.535 9.721 -1.634 455 HB THR 70 HB THR 70 7.439 11.441 -3.682 456 HG1 THR 70 HG1 THR 70 6.995 10.077 -5.350 457 HG21 THR 70 HG21 THR 70 9.777 9.608 -3.136 458 HG22 THR 70 HG22 THR 70 9.360 11.039 -2.193 459 HG23 THR 70 HG23 THR 70 9.856 11.206 -3.876 460 H ASP 71 HN ASP 71 4.868 8.338 -2.541 461 HA ASP 71 HA ASP 71 3.186 10.678 -2.923 462 HB2 ASP 71 HB2 ASP 71 2.701 7.722 -3.027 463 HB3 ASP 71 HB1 ASP 71 1.343 8.826 -2.842 464 H THR 72 HN THR 72 1.423 11.190 -1.595 465 HA THR 72 HA THR 72 1.437 10.118 1.133 466 HB THR 72 HB THR 72 0.899 12.885 1.363 467 HG1 THR 72 HG1 THR 72 3.244 12.327 -0.163 468 HG21 THR 72 HG21 THR 72 2.805 12.898 2.835 469 HG22 THR 72 HG22 THR 72 3.439 11.431 2.091 470 HG23 THR 72 HG23 THR 72 1.954 11.366 3.038 471 HA PRO 73 HA PRO 73 -2.976 9.980 0.747 472 HB2 PRO 73 HB2 PRO 73 -3.135 11.446 3.336 473 HB3 PRO 73 HB1 PRO 73 -3.873 9.909 2.863 474 HG2 PRO 73 HG2 PRO 73 -1.773 9.937 4.480 475 HG3 PRO 73 HG1 PRO 73 -1.941 8.697 3.222 476 HD2 PRO 73 HD2 PRO 73 -0.182 11.102 3.276 477 HD3 PRO 73 HD1 PRO 73 0.131 9.486 2.616 478 H ALA 74 HN ALA 74 -1.893 13.069 2.171 479 HA ALA 74 HA ALA 74 -4.097 14.537 1.128 480 HB1 ALA 74 HB1 ALA 74 -2.811 16.521 1.852 481 HB2 ALA 74 HB2 ALA 74 -1.455 15.463 2.238 482 HB3 ALA 74 HB3 ALA 74 -2.980 15.300 3.111 483 H GLN 75 HN GLN 75 -0.898 13.773 -0.042 484 HA GLN 75 HA GLN 75 -0.772 15.751 -2.076 485 HB2 GLN 75 HB2 GLN 75 1.176 14.445 -1.114 486 HB3 GLN 75 HB1 GLN 75 0.643 13.086 -2.093 487 HG2 GLN 75 HG2 GLN 75 2.373 14.150 -3.286 488 HG3 GLN 75 HG1 GLN 75 0.866 14.568 -4.100 489 HE21 GLN 75 HE21 GLN 75 1.714 16.419 -5.022 490 HE22 GLN 75 HE22 GLN 75 2.074 17.834 -4.094 491 H LEU 76 HN LEU 76 -1.917 12.406 -1.996 492 HA LEU 76 HA LEU 76 -2.528 12.452 -4.828 493 HB2 LEU 76 HB2 LEU 76 -2.949 10.396 -2.669 494 HB3 LEU 76 HB1 LEU 76 -3.529 10.178 -4.309 495 HG LEU 76 HG LEU 76 -0.654 10.438 -3.435 496 HD11 LEU 76 HD11 LEU 76 -2.216 8.149 -4.622 497 HD12 LEU 76 HD12 LEU 76 -1.620 8.269 -2.967 498 HD13 LEU 76 HD13 LEU 76 -0.481 8.149 -4.306 499 HD21 LEU 76 HD21 LEU 76 -0.890 11.559 -5.550 500 HD22 LEU 76 HD22 LEU 76 -1.832 10.219 -6.203 501 HD23 LEU 76 HD23 LEU 76 -0.125 9.994 -5.818 502 H GLU 77 HN GLU 77 -3.917 13.919 -2.352 503 HA GLU 77 HA GLU 77 -5.957 14.775 -1.882 504 HB2 GLU 77 HB2 GLU 77 -6.020 14.282 -4.788 505 HB3 GLU 77 HB1 GLU 77 -7.590 14.492 -4.025 506 HG2 GLU 77 HG2 GLU 77 -6.552 16.600 -2.976 507 HG3 GLU 77 HG1 GLU 77 -5.316 16.422 -4.220 508 H MET 78 HN MET 78 -5.615 12.307 -0.869 509 HA MET 78 HA MET 78 -7.896 10.642 -1.528 510 HB2 MET 78 HB2 MET 78 -5.914 10.316 0.737 511 HB3 MET 78 HB1 MET 78 -7.011 9.093 0.108 512 HG2 MET 78 HG2 MET 78 -5.800 9.031 -1.984 513 HG3 MET 78 HG1 MET 78 -4.753 10.340 -1.440 514 HE1 MET 78 HE1 MET 78 -5.396 6.529 -1.500 515 HE2 MET 78 HE2 MET 78 -6.149 6.981 0.030 516 HE3 MET 78 HE3 MET 78 -4.695 5.984 0.024 517 H GLU 79 HN GLU 79 -9.603 10.190 -0.103 518 HA GLU 79 HA GLU 79 -9.983 12.240 1.979 519 HB2 GLU 79 HB2 GLU 79 -11.613 11.617 -0.242 520 HB3 GLU 79 HB1 GLU 79 -12.461 11.021 1.178 521 HG2 GLU 79 HG2 GLU 79 -11.381 13.817 0.931 522 HG3 GLU 79 HG1 GLU 79 -13.028 13.359 0.506 523 H ASP 80 HN ASP 80 -11.729 11.462 3.601 524 HA ASP 80 HA ASP 80 -10.656 9.267 5.008 525 HB2 ASP 80 HB2 ASP 80 -12.345 11.330 5.646 526 HB3 ASP 80 HB1 ASP 80 -13.439 9.954 5.657 527 H GLU 81 HN GLU 81 -11.350 7.203 5.272 528 HA GLU 81 HA GLU 81 -12.238 5.197 4.743 529 HB2 GLU 81 HB2 GLU 81 -14.601 6.875 3.878 530 HB3 GLU 81 HB1 GLU 81 -14.610 5.119 3.933 531 HG2 GLU 81 HG2 GLU 81 -13.819 5.587 6.428 532 HG3 GLU 81 HG1 GLU 81 -14.688 7.092 6.137 533 H ASP 82 HN ASP 82 -10.498 6.432 2.900 534 HA ASP 82 HA ASP 82 -11.509 6.055 0.240 535 HB2 ASP 82 HB2 ASP 82 -9.430 7.485 1.176 536 HB3 ASP 82 HB1 ASP 82 -8.574 6.019 0.707 537 H THR 83 HN THR 83 -10.210 4.499 -1.268 538 HA THR 83 HA THR 83 -9.797 1.960 0.169 539 HB THR 83 HB THR 83 -11.217 2.064 -2.485 540 HG1 THR 83 HG1 THR 83 -12.306 3.189 -0.617 541 HG21 THR 83 HG21 THR 83 -11.986 -0.171 -1.798 542 HG22 THR 83 HG22 THR 83 -11.063 -0.024 -0.301 543 HG23 THR 83 HG23 THR 83 -10.225 -0.079 -1.853 544 H ILE 84 HN ILE 84 -8.009 0.939 -0.327 545 HA ILE 84 HA ILE 84 -6.603 1.619 -2.831 546 HB ILE 84 HB ILE 84 -5.368 0.665 -0.239 547 HG12 ILE 84 HG12 ILE 84 -5.224 3.428 -1.458 548 HG13 ILE 84 HG11 ILE 84 -6.332 2.989 -0.162 549 HG21 ILE 84 HG21 ILE 84 -3.241 1.306 -1.348 550 HG22 ILE 84 HG22 ILE 84 -4.145 1.605 -2.830 551 HG23 ILE 84 HG23 ILE 84 -4.075 -0.021 -2.154 552 HD11 ILE 84 HD11 ILE 84 -3.329 2.908 -0.038 553 HD12 ILE 84 HD12 ILE 84 -4.419 2.421 1.258 554 HD13 ILE 84 HD13 ILE 84 -4.379 4.100 0.725 555 H ASP 85 HN ASP 85 -6.144 -0.033 -4.192 556 HA ASP 85 HA ASP 85 -6.918 -2.736 -3.327 557 HB2 ASP 85 HB2 ASP 85 -7.430 -1.256 -5.684 558 HB3 ASP 85 HB1 ASP 85 -6.342 -2.563 -6.139 559 H VAL 86 HN VAL 86 -5.470 -4.368 -3.247 560 HA VAL 86 HA VAL 86 -2.714 -3.744 -4.100 561 HB VAL 86 HB VAL 86 -3.439 -5.707 -1.928 562 HG11 VAL 86 HG11 VAL 86 -1.071 -5.405 -1.300 563 HG12 VAL 86 HG12 VAL 86 -0.857 -4.358 -2.708 564 HG13 VAL 86 HG13 VAL 86 -1.266 -6.063 -2.929 565 HG21 VAL 86 HG21 VAL 86 -2.804 -3.993 -0.309 566 HG22 VAL 86 HG22 VAL 86 -4.210 -3.498 -1.252 567 HG23 VAL 86 HG23 VAL 86 -2.622 -2.824 -1.617 568 H PHE 87 HN PHE 87 -1.866 -4.994 -5.612 569 HA PHE 87 HA PHE 87 -3.100 -7.620 -6.135 570 HB2 PHE 87 HB2 PHE 87 -1.776 -5.754 -8.123 571 HB3 PHE 87 HB1 PHE 87 -2.495 -7.317 -8.500 572 HD1 PHE 87 HD1 PHE 87 -4.949 -7.622 -8.257 573 HD2 PHE 87 HD2 PHE 87 -3.091 -3.806 -7.951 574 HE1 PHE 87 HE1 PHE 87 -7.129 -6.540 -8.601 575 HE2 PHE 87 HE2 PHE 87 -5.270 -2.711 -8.294 576 HZ PHE 87 HZ PHE 87 -7.294 -4.082 -8.616 577 H GLN 88 HN GLN 88 -1.401 -8.949 -7.553 578 HA GLN 88 HA GLN 88 1.169 -8.754 -6.130 579 HB2 GLN 88 HB2 GLN 88 -0.563 -11.096 -6.734 580 HB3 GLN 88 HB1 GLN 88 1.178 -11.330 -6.787 581 HG2 GLN 88 HG2 GLN 88 1.134 -10.200 -4.450 582 HG3 GLN 88 HG1 GLN 88 -0.569 -10.655 -4.468 583 HE21 GLN 88 HE21 GLN 88 -0.369 -12.143 -2.828 584 HE22 GLN 88 HE22 GLN 88 0.463 -13.645 -3.021 585 H GLN 89 HN GLN 89 3.040 -9.518 -7.272 586 HA GLN 89 HA GLN 89 3.009 -8.730 -10.042 587 HB2 GLN 89 HB2 GLN 89 4.929 -8.052 -8.814 588 HB3 GLN 89 HB1 GLN 89 5.169 -9.658 -8.148 589 HG2 GLN 89 HG2 GLN 89 6.846 -9.175 -9.814 590 HG3 GLN 89 HG1 GLN 89 5.801 -10.484 -10.358 591 HE21 GLN 89 HE21 GLN 89 5.982 -10.275 -12.501 592 HE22 GLN 89 HE22 GLN 89 5.503 -8.873 -13.396 593 H GLN 90 HN GLN 90 3.211 -10.017 -11.811 594 HA GLN 90 HA GLN 90 2.311 -12.693 -11.657 595 HB2 GLN 90 HB2 GLN 90 3.614 -11.185 -13.935 596 HB3 GLN 90 HB1 GLN 90 2.870 -12.767 -14.093 597 HG2 GLN 90 HG2 GLN 90 1.263 -11.279 -14.875 598 HG3 GLN 90 HG1 GLN 90 0.737 -11.667 -13.238 599 HE21 GLN 90 HE21 GLN 90 -0.487 -9.740 -13.232 600 HE22 GLN 90 HE22 GLN 90 0.269 -8.206 -12.977 601 H THR 91 HN THR 91 3.401 -14.622 -11.838 602 HA THR 91 HA THR 91 6.125 -14.640 -10.974 603 HB THR 91 HB THR 91 5.632 -17.226 -11.622 604 HG1 THR 91 HG1 THR 91 3.218 -17.172 -10.736 605 HG21 THR 91 HG21 THR 91 4.693 -15.737 -9.171 606 HG22 THR 91 HG22 THR 91 6.284 -16.453 -9.424 607 HG23 THR 91 HG23 THR 91 4.863 -17.488 -9.280 608 H GLY 92 HN GLY 92 4.638 -14.476 -14.003 609 HA2 GLY 92 HA2 GLY 92 7.192 -14.830 -15.333 610 HA3 GLY 92 HA1 GLY 92 5.919 -15.945 -15.815 611 H ASN 357 HT1 ASN 357 -16.377 -9.735 7.728 612 HA ASN 357 HA ASN 357 -14.009 -10.434 6.105 613 HB2 ASN 357 HB2 ASN 357 -14.061 -8.100 5.400 614 HB3 ASN 357 HB1 ASN 357 -15.582 -8.887 5.000 615 HD21 ASN 357 HD21 ASN 357 -15.306 -6.145 5.118 616 HD22 ASN 357 HD22 ASN 357 -16.239 -5.537 6.441 617 H ASN 358 HN ASN 358 -12.157 -8.880 6.693 618 HA ASN 358 HA ASN 358 -12.175 -8.578 9.619 619 HB2 ASN 358 HB2 ASN 358 -10.486 -10.170 8.054 620 HB3 ASN 358 HB1 ASN 358 -9.515 -8.774 8.508 621 HD21 ASN 358 HD21 ASN 358 -8.244 -9.405 10.106 622 HD22 ASN 358 HD22 ASN 358 -8.744 -10.266 11.520 623 H ARG 359 HN ARG 359 -12.002 -6.607 10.338 624 HA ARG 359 HA ARG 359 -10.426 -4.690 8.769 625 HB2 ARG 359 HB2 ARG 359 -13.070 -4.234 10.157 626 HB3 ARG 359 HB1 ARG 359 -12.037 -2.924 9.601 627 HG2 ARG 359 HG2 ARG 359 -12.223 -3.800 7.300 628 HG3 ARG 359 HG1 ARG 359 -13.330 -5.043 7.888 629 HD2 ARG 359 HD2 ARG 359 -13.770 -2.065 8.102 630 HD3 ARG 359 HD1 ARG 359 -14.507 -3.121 6.898 631 HE ARG 359 HE ARG 359 -14.967 -3.628 9.754 632 HH11 ARG 359 HH11 ARG 359 -16.162 -2.734 6.570 633 HH12 ARG 359 HH12 ARG 359 -17.894 -2.876 7.054 634 HH21 ARG 359 HH21 ARG 359 -17.143 -3.856 10.406 635 HH22 ARG 359 HH22 ARG 359 -18.447 -3.497 9.210 636 H ASP 360 HN ASP 360 -8.766 -3.992 9.872 637 HA ASP 360 HA ASP 360 -8.977 -3.649 12.767 638 HB2 ASP 360 HB2 ASP 360 -7.168 -4.896 13.282 639 HB3 ASP 360 HB1 ASP 360 -7.553 -5.709 11.776 640 HA PRO 361 HA PRO 361 -7.191 0.208 11.476 641 HB2 PRO 361 HB2 PRO 361 -7.634 1.571 13.769 642 HB3 PRO 361 HB1 PRO 361 -8.949 1.068 12.701 643 HG2 PRO 361 HG2 PRO 361 -8.287 0.087 15.363 644 HG3 PRO 361 HG1 PRO 361 -9.749 -0.193 14.402 645 HD2 PRO 361 HD2 PRO 361 -7.410 -1.916 14.746 646 HD3 PRO 361 HD1 PRO 361 -9.012 -2.303 14.081 647 H ILE 362 HN ILE 362 -5.209 0.859 11.303 648 HA ILE 362 HA ILE 362 -3.279 0.451 13.498 649 HB ILE 362 HB ILE 362 -2.650 0.513 10.540 650 HG12 ILE 362 HG12 ILE 362 -2.566 -2.052 12.053 651 HG13 ILE 362 HG11 ILE 362 -4.151 -1.448 11.578 652 HG21 ILE 362 HG21 ILE 362 -1.009 -0.618 12.795 653 HG22 ILE 362 HG22 ILE 362 -0.831 1.032 12.192 654 HG23 ILE 362 HG23 ILE 362 -0.517 -0.339 11.125 655 HD11 ILE 362 HD11 ILE 362 -1.840 -1.971 9.719 656 HD12 ILE 362 HD12 ILE 362 -3.438 -1.397 9.247 657 HD13 ILE 362 HD13 ILE 362 -3.249 -3.010 9.935 658 H VAL 363 HN VAL 363 -2.144 2.211 14.186 659 HA VAL 363 HA VAL 363 -2.335 4.657 12.541 660 HB VAL 363 HB VAL 363 -1.967 4.522 15.543 661 HG11 VAL 363 HG11 VAL 363 -1.028 6.523 14.533 662 HG12 VAL 363 HG12 VAL 363 -2.460 6.914 15.485 663 HG13 VAL 363 HG13 VAL 363 -2.561 6.853 13.725 664 HG21 VAL 363 HG21 VAL 363 -4.259 5.232 15.776 665 HG22 VAL 363 HG22 VAL 363 -4.194 3.714 14.883 666 HG23 VAL 363 HG23 VAL 363 -4.472 5.230 14.028 667 H ILE 364 HN ILE 364 -0.500 5.430 11.821 668 HA ILE 364 HA ILE 364 2.028 4.595 13.071 669 HB ILE 364 HB ILE 364 1.728 5.262 10.146 670 HG12 ILE 364 HG12 ILE 364 1.854 2.510 11.399 671 HG13 ILE 364 HG11 ILE 364 0.413 3.226 10.683 672 HG21 ILE 364 HG21 ILE 364 3.953 5.565 10.983 673 HG22 ILE 364 HG22 ILE 364 3.919 4.095 10.009 674 HG23 ILE 364 HG23 ILE 364 3.919 3.987 11.768 675 HD11 ILE 364 HD11 ILE 364 1.570 3.322 8.513 676 HD12 ILE 364 HD12 ILE 364 1.427 1.677 9.137 677 HD13 ILE 364 HD13 ILE 364 2.968 2.532 9.246 678 H SER 365 HN SER 365 3.421 6.169 13.584 679 HA SER 365 HA SER 365 2.736 8.917 12.778 680 HB2 SER 365 HB2 SER 365 4.126 7.992 15.301 681 HB3 SER 365 HB1 SER 365 3.694 9.654 14.898 682 HG SER 365 HG SER 365 1.961 7.474 15.454 683 H ASP 366 HN ASP 366 4.283 10.066 11.756 684 HA ASP 366 HA ASP 366 6.965 8.864 11.589 685 HB2 ASP 366 HB2 ASP 366 5.449 8.746 9.528 686 HB3 ASP 366 HB1 ASP 366 5.667 10.489 9.403 687 H SER 367 HN SER 367 8.624 10.133 12.085 688 HA SER 367 HA SER 367 8.077 12.973 12.608 689 HB2 SER 367 HB2 SER 367 10.278 12.656 14.014 690 HB3 SER 367 HB1 SER 367 8.744 12.074 14.659 691 HG SER 367 HG SER 367 10.721 10.545 13.303 692 HA PRO 368 HA PRO 368 10.812 13.534 9.047 693 HB2 PRO 368 HB2 PRO 368 10.505 16.231 8.896 694 HB3 PRO 368 HB1 PRO 368 9.302 15.090 8.276 695 HG2 PRO 368 HG2 PRO 368 9.302 16.610 10.841 696 HG3 PRO 368 HG1 PRO 368 7.959 16.279 9.730 697 HD2 PRO 368 HD2 PRO 368 8.348 14.888 12.024 698 HD3 PRO 368 HD1 PRO 368 7.595 14.182 10.577 Start of MODEL 9 1 H ASP 16 HT1 ASP 16 -5.918 16.050 11.649 2 HA ASP 16 HA ASP 16 -6.753 14.099 13.707 3 HB2 ASP 16 HB2 ASP 16 -8.186 15.186 11.275 4 HB3 ASP 16 HB1 ASP 16 -8.690 13.728 12.123 5 H HIS 17 HN HIS 17 -7.399 12.016 12.443 6 HA HIS 17 HA HIS 17 -5.144 11.403 10.659 7 HB2 HIS 17 HB2 HIS 17 -6.846 9.520 12.308 8 HB3 HIS 17 HB1 HIS 17 -5.477 9.054 11.305 9 HD2 HIS 17 HD2 HIS 17 -3.180 10.982 12.272 10 HE1 HIS 17 HE1 HIS 17 -4.268 9.834 16.194 11 HE2 HIS 17 HE2 HIS 17 -2.596 11.120 14.794 12 H ILE 18 HN ILE 18 -5.632 9.654 9.042 13 HA ILE 18 HA ILE 18 -8.327 10.054 7.914 14 HB ILE 18 HB ILE 18 -6.628 11.180 6.555 15 HG12 ILE 18 HG12 ILE 18 -7.614 8.681 5.171 16 HG13 ILE 18 HG11 ILE 18 -8.608 10.099 5.494 17 HG21 ILE 18 HG21 ILE 18 -4.893 9.908 5.380 18 HG22 ILE 18 HG22 ILE 18 -5.360 8.458 6.268 19 HG23 ILE 18 HG23 ILE 18 -4.684 9.842 7.128 20 HD11 ILE 18 HD11 ILE 18 -6.143 10.028 3.768 21 HD12 ILE 18 HD12 ILE 18 -7.136 11.449 4.093 22 HD13 ILE 18 HD13 ILE 18 -7.813 10.085 3.203 23 H ASN 19 HN ASN 19 -9.466 8.256 7.388 24 HA ASN 19 HA ASN 19 -8.228 5.691 8.075 25 HB2 ASN 19 HB2 ASN 19 -11.142 6.346 7.592 26 HB3 ASN 19 HB1 ASN 19 -10.507 4.822 8.202 27 HD21 ASN 19 HD21 ASN 19 -11.216 8.128 8.922 28 HD22 ASN 19 HD22 ASN 19 -11.010 8.008 10.643 29 H LEU 20 HN LEU 20 -7.274 4.733 6.430 30 HA LEU 20 HA LEU 20 -8.613 4.770 3.807 31 HB2 LEU 20 HB2 LEU 20 -5.713 4.270 4.499 32 HB3 LEU 20 HB1 LEU 20 -6.387 4.205 2.881 33 HG LEU 20 HG LEU 20 -6.409 6.687 4.598 34 HD11 LEU 20 HD11 LEU 20 -4.490 5.878 2.421 35 HD12 LEU 20 HD12 LEU 20 -4.115 6.082 4.133 36 HD13 LEU 20 HD13 LEU 20 -4.582 7.477 3.158 37 HD21 LEU 20 HD21 LEU 20 -8.133 6.723 2.937 38 HD22 LEU 20 HD22 LEU 20 -7.010 6.178 1.692 39 HD23 LEU 20 HD23 LEU 20 -6.827 7.781 2.402 40 H LYS 21 HN LYS 21 -9.532 2.941 3.161 41 HA LYS 21 HA LYS 21 -9.093 0.509 4.692 42 HB2 LYS 21 HB2 LYS 21 -10.925 0.883 2.326 43 HB3 LYS 21 HB1 LYS 21 -11.003 -0.373 3.551 44 HG2 LYS 21 HG2 LYS 21 -11.978 1.001 5.097 45 HG3 LYS 21 HG1 LYS 21 -11.284 2.467 4.394 46 HD2 LYS 21 HD2 LYS 21 -12.795 2.326 2.512 47 HD3 LYS 21 HD1 LYS 21 -13.429 0.788 3.097 48 HE2 LYS 21 HE2 LYS 21 -14.478 1.807 4.942 49 HE3 LYS 21 HE1 LYS 21 -13.574 3.305 4.726 50 HZ1 LYS 21 HZ1 LYS 21 -15.846 3.552 3.965 51 HZ2 LYS 21 HZ2 LYS 21 -15.662 2.255 2.889 52 HZ3 LYS 21 HZ3 LYS 21 -14.779 3.678 2.653 53 H VAL 22 HN VAL 22 -7.572 -0.897 4.116 54 HA VAL 22 HA VAL 22 -6.741 -0.990 1.293 55 HB VAL 22 HB VAL 22 -5.308 -2.015 3.759 56 HG11 VAL 22 HG11 VAL 22 -4.885 -3.422 1.792 57 HG12 VAL 22 HG12 VAL 22 -3.446 -2.528 2.283 58 HG13 VAL 22 HG13 VAL 22 -4.383 -1.992 0.888 59 HG21 VAL 22 HG21 VAL 22 -3.710 -0.240 3.329 60 HG22 VAL 22 HG22 VAL 22 -5.327 0.434 3.530 61 HG23 VAL 22 HG23 VAL 22 -4.632 0.276 1.919 62 H ALA 23 HN ALA 23 -7.860 -2.467 0.212 63 HA ALA 23 HA ALA 23 -8.565 -4.969 1.589 64 HB1 ALA 23 HB1 ALA 23 -9.865 -3.736 -0.836 65 HB2 ALA 23 HB2 ALA 23 -10.472 -3.632 0.817 66 HB3 ALA 23 HB3 ALA 23 -10.387 -5.196 0.008 67 H GLY 24 HN GLY 24 -7.992 -6.901 0.769 68 HA2 GLY 24 HA2 GLY 24 -6.017 -6.887 -1.378 69 HA3 GLY 24 HA1 GLY 24 -6.378 -8.230 -0.301 70 H GLN 25 HN GLN 25 -6.328 -9.478 -2.335 71 HA GLN 25 HA GLN 25 -8.480 -9.048 -4.207 72 HB2 GLN 25 HB2 GLN 25 -6.424 -11.247 -3.941 73 HB3 GLN 25 HB1 GLN 25 -7.664 -11.234 -5.187 74 HG2 GLN 25 HG2 GLN 25 -5.395 -9.301 -4.819 75 HG3 GLN 25 HG1 GLN 25 -5.683 -10.402 -6.166 76 HE21 GLN 25 HE21 GLN 25 -6.200 -7.302 -4.906 77 HE22 GLN 25 HE22 GLN 25 -7.254 -6.707 -6.143 78 H ASP 26 HN ASP 26 -8.060 -10.710 -1.263 79 HA ASP 26 HA ASP 26 -10.216 -12.591 -1.757 80 HB2 ASP 26 HB2 ASP 26 -9.725 -13.220 0.690 81 HB3 ASP 26 HB1 ASP 26 -8.490 -13.581 -0.510 82 H GLY 27 HN GLY 27 -10.039 -11.342 1.453 83 HA2 GLY 27 HA2 GLY 27 -12.195 -9.433 1.034 84 HA3 GLY 27 HA1 GLY 27 -12.640 -10.887 1.910 85 H SER 28 HN SER 28 -9.488 -9.403 2.174 86 HA SER 28 HA SER 28 -9.919 -8.963 5.020 87 HB2 SER 28 HB2 SER 28 -7.372 -8.140 4.558 88 HB3 SER 28 HB1 SER 28 -7.805 -9.831 4.820 89 HG SER 28 HG SER 28 -7.761 -10.197 2.637 90 H VAL 29 HN VAL 29 -10.285 -6.918 5.926 91 HA VAL 29 HA VAL 29 -9.727 -4.646 4.108 92 HB VAL 29 HB VAL 29 -11.915 -3.865 5.700 93 HG11 VAL 29 HG11 VAL 29 -12.967 -3.482 3.526 94 HG12 VAL 29 HG12 VAL 29 -11.717 -4.455 2.752 95 HG13 VAL 29 HG13 VAL 29 -11.288 -2.939 3.546 96 HG21 VAL 29 HG21 VAL 29 -13.679 -5.384 5.007 97 HG22 VAL 29 HG22 VAL 29 -12.464 -6.245 5.952 98 HG23 VAL 29 HG23 VAL 29 -12.498 -6.414 4.198 99 H VAL 30 HN VAL 30 -7.831 -4.338 5.300 100 HA VAL 30 HA VAL 30 -7.994 -3.749 8.105 101 HB VAL 30 HB VAL 30 -5.623 -3.181 7.948 102 HG11 VAL 30 HG11 VAL 30 -6.314 -5.702 6.436 103 HG12 VAL 30 HG12 VAL 30 -6.268 -5.525 8.193 104 HG13 VAL 30 HG13 VAL 30 -4.785 -5.369 7.250 105 HG21 VAL 30 HG21 VAL 30 -5.935 -3.665 4.988 106 HG22 VAL 30 HG22 VAL 30 -4.415 -3.371 5.833 107 HG23 VAL 30 HG23 VAL 30 -5.640 -2.105 5.755 108 H GLN 31 HN GLN 31 -7.855 -1.751 9.084 109 HA GLN 31 HA GLN 31 -8.516 0.505 7.321 110 HB2 GLN 31 HB2 GLN 31 -10.234 -0.169 8.963 111 HB3 GLN 31 HB1 GLN 31 -9.092 0.137 10.263 112 HG2 GLN 31 HG2 GLN 31 -9.017 2.493 9.654 113 HG3 GLN 31 HG1 GLN 31 -10.147 2.191 8.332 114 HE21 GLN 31 HE21 GLN 31 -10.397 3.928 10.681 115 HE22 GLN 31 HE22 GLN 31 -11.837 3.408 11.488 116 H PHE 32 HN PHE 32 -6.693 1.558 6.879 117 HA PHE 32 HA PHE 32 -4.645 1.882 8.902 118 HB2 PHE 32 HB2 PHE 32 -4.853 2.337 5.976 119 HB3 PHE 32 HB1 PHE 32 -3.737 3.376 6.858 120 HD1 PHE 32 HD1 PHE 32 -4.420 -0.019 5.709 121 HD2 PHE 32 HD2 PHE 32 -1.789 2.441 7.975 122 HE1 PHE 32 HE1 PHE 32 -2.724 -1.801 5.671 123 HE2 PHE 32 HE2 PHE 32 -0.092 0.664 7.939 124 HZ PHE 32 HZ PHE 32 -0.559 -1.459 6.787 125 H LYS 33 HN LYS 33 -4.842 3.419 10.368 126 HA LYS 33 HA LYS 33 -6.185 5.932 9.612 127 HB2 LYS 33 HB2 LYS 33 -7.024 4.416 11.575 128 HB3 LYS 33 HB1 LYS 33 -5.662 5.093 12.453 129 HG2 LYS 33 HG2 LYS 33 -6.534 7.334 12.117 130 HG3 LYS 33 HG1 LYS 33 -7.882 6.684 11.183 131 HD2 LYS 33 HD2 LYS 33 -8.627 5.427 13.160 132 HD3 LYS 33 HD1 LYS 33 -7.291 6.107 14.089 133 HE2 LYS 33 HE2 LYS 33 -8.204 8.378 13.616 134 HE3 LYS 33 HE1 LYS 33 -9.596 7.607 12.855 135 HZ1 LYS 33 HZ1 LYS 33 -10.171 6.588 14.933 136 HZ2 LYS 33 HZ2 LYS 33 -9.989 8.249 15.184 137 HZ3 LYS 33 HZ3 LYS 33 -8.773 7.184 15.673 138 H ILE 34 HN ILE 34 -4.251 6.678 8.632 139 HA ILE 34 HA ILE 34 -2.049 7.278 10.494 140 HB ILE 34 HB ILE 34 -0.593 7.473 8.542 141 HG12 ILE 34 HG12 ILE 34 -2.949 6.559 6.879 142 HG13 ILE 34 HG11 ILE 34 -2.418 8.234 6.973 143 HG21 ILE 34 HG21 ILE 34 -0.559 5.124 7.869 144 HG22 ILE 34 HG22 ILE 34 -2.175 4.908 8.540 145 HG23 ILE 34 HG23 ILE 34 -0.823 5.294 9.604 146 HD11 ILE 34 HD11 ILE 34 -1.568 7.211 4.974 147 HD12 ILE 34 HD12 ILE 34 -0.837 5.909 5.910 148 HD13 ILE 34 HD13 ILE 34 -0.230 7.556 6.072 149 H LYS 35 HN LYS 35 -0.743 9.264 9.434 150 HA LYS 35 HA LYS 35 -2.619 11.482 9.531 151 HB2 LYS 35 HB2 LYS 35 0.411 11.460 9.459 152 HB3 LYS 35 HB1 LYS 35 -0.589 12.888 9.684 153 HG2 LYS 35 HG2 LYS 35 -1.470 11.919 11.766 154 HG3 LYS 35 HG1 LYS 35 -0.404 10.530 11.553 155 HD2 LYS 35 HD2 LYS 35 1.543 11.943 11.721 156 HD3 LYS 35 HD1 LYS 35 0.535 13.390 11.774 157 HE2 LYS 35 HE2 LYS 35 -0.521 12.264 13.857 158 HE3 LYS 35 HE1 LYS 35 0.943 11.285 13.862 159 HZ1 LYS 35 HZ1 LYS 35 0.890 14.252 13.936 160 HZ2 LYS 35 HZ2 LYS 35 2.265 13.273 14.032 161 HZ3 LYS 35 HZ3 LYS 35 1.124 13.252 15.279 162 H ARG 36 HN ARG 36 -2.638 13.135 7.889 163 HA ARG 36 HA ARG 36 -2.638 12.033 5.278 164 HB2 ARG 36 HB2 ARG 36 -3.043 14.854 6.255 165 HB3 ARG 36 HB1 ARG 36 -3.204 14.383 4.570 166 HG2 ARG 36 HG2 ARG 36 -4.960 12.779 5.209 167 HG3 ARG 36 HG1 ARG 36 -4.834 13.338 6.878 168 HD2 ARG 36 HD2 ARG 36 -6.669 14.499 5.963 169 HD3 ARG 36 HD1 ARG 36 -5.342 15.658 5.986 170 HE ARG 36 HE ARG 36 -5.104 15.336 3.610 171 HH11 ARG 36 HH11 ARG 36 -8.044 14.018 5.054 172 HH12 ARG 36 HH12 ARG 36 -8.953 14.038 3.488 173 HH21 ARG 36 HH21 ARG 36 -6.242 15.362 1.612 174 HH22 ARG 36 HH22 ARG 36 -7.929 14.725 1.577 175 H HIS 37 HN HIS 37 -0.095 13.319 7.075 176 HA HIS 37 HA HIS 37 1.370 14.080 4.643 177 HB2 HIS 37 HB2 HIS 37 2.967 15.213 6.104 178 HB3 HIS 37 HB1 HIS 37 1.334 15.783 6.408 179 HD2 HIS 37 HD2 HIS 37 0.492 15.592 8.972 180 HE1 HIS 37 HE1 HIS 37 3.793 13.372 10.411 181 HE2 HIS 37 HE2 HIS 37 1.822 14.826 11.060 182 H THR 38 HN THR 38 0.885 11.417 6.434 183 HA THR 38 HA THR 38 3.600 10.496 6.708 184 HB THR 38 HB THR 38 1.055 8.884 6.931 185 HG1 THR 38 HG1 THR 38 2.052 10.866 8.507 186 HG21 THR 38 HG21 THR 38 3.110 7.547 6.787 187 HG22 THR 38 HG22 THR 38 2.392 7.444 8.394 188 HG23 THR 38 HG23 THR 38 3.803 8.467 8.122 189 HA PRO 39 HA PRO 39 4.061 9.222 2.453 190 HB2 PRO 39 HB2 PRO 39 6.076 7.404 3.669 191 HB3 PRO 39 HB1 PRO 39 6.256 8.562 2.341 192 HG2 PRO 39 HG2 PRO 39 7.260 9.099 4.736 193 HG3 PRO 39 HG1 PRO 39 6.509 10.368 3.749 194 HD2 PRO 39 HD2 PRO 39 5.425 8.945 6.133 195 HD3 PRO 39 HD1 PRO 39 5.236 10.640 5.640 196 H LEU 40 HN LEU 40 2.994 7.747 1.327 197 HA LEU 40 HA LEU 40 1.599 5.634 2.602 198 HB2 LEU 40 HB2 LEU 40 2.023 6.278 -0.312 199 HB3 LEU 40 HB1 LEU 40 0.960 5.003 0.259 200 HG LEU 40 HG LEU 40 0.638 7.909 1.004 201 HD11 LEU 40 HD11 LEU 40 -1.177 7.978 -0.614 202 HD12 LEU 40 HD12 LEU 40 -0.816 6.324 -1.107 203 HD13 LEU 40 HD13 LEU 40 0.354 7.609 -1.406 204 HD21 LEU 40 HD21 LEU 40 -1.163 5.507 1.310 205 HD22 LEU 40 HD22 LEU 40 -1.627 7.174 1.650 206 HD23 LEU 40 HD23 LEU 40 -0.363 6.401 2.607 207 H SER 41 HN SER 41 4.769 5.824 1.452 208 HA SER 41 HA SER 41 5.211 3.219 0.505 209 HB2 SER 41 HB2 SER 41 7.591 3.932 1.672 210 HB3 SER 41 HB1 SER 41 7.082 4.413 0.051 211 HG SER 41 HG SER 41 7.233 6.368 0.802 212 H LYS 42 HN LYS 42 5.348 4.631 3.729 213 HA LYS 42 HA LYS 42 6.248 2.269 5.038 214 HB2 LYS 42 HB2 LYS 42 4.772 4.593 6.290 215 HB3 LYS 42 HB1 LYS 42 5.871 3.471 7.083 216 HG2 LYS 42 HG2 LYS 42 7.650 4.357 5.477 217 HG3 LYS 42 HG1 LYS 42 6.518 5.666 5.149 218 HD2 LYS 42 HD2 LYS 42 6.549 6.357 7.441 219 HD3 LYS 42 HD1 LYS 42 7.491 4.936 7.906 220 HE2 LYS 42 HE2 LYS 42 9.325 5.733 6.440 221 HE3 LYS 42 HE1 LYS 42 8.392 7.191 6.117 222 HZ1 LYS 42 HZ1 LYS 42 10.175 7.236 7.946 223 HZ2 LYS 42 HZ2 LYS 42 9.033 6.426 8.889 224 HZ3 LYS 42 HZ3 LYS 42 8.679 7.960 8.260 225 H LEU 43 HN LEU 43 3.165 3.571 4.117 226 HA LEU 43 HA LEU 43 1.517 1.924 5.738 227 HB2 LEU 43 HB2 LEU 43 0.640 3.945 4.738 228 HB3 LEU 43 HB1 LEU 43 1.012 3.365 3.129 229 HG LEU 43 HG LEU 43 -0.853 1.679 4.687 230 HD11 LEU 43 HD11 LEU 43 -2.759 3.163 4.187 231 HD12 LEU 43 HD12 LEU 43 -1.625 4.421 3.694 232 HD13 LEU 43 HD13 LEU 43 -1.648 3.860 5.366 233 HD21 LEU 43 HD21 LEU 43 -0.846 2.764 1.869 234 HD22 LEU 43 HD22 LEU 43 -1.992 1.589 2.516 235 HD23 LEU 43 HD23 LEU 43 -0.285 1.170 2.373 236 H MET 44 HN MET 44 2.799 1.674 2.458 237 HA MET 44 HA MET 44 1.529 -0.756 1.775 238 HB2 MET 44 HB2 MET 44 4.085 0.477 0.729 239 HB3 MET 44 HB1 MET 44 3.276 -0.903 -0.001 240 HG2 MET 44 HG2 MET 44 1.257 0.570 -0.279 241 HG3 MET 44 HG1 MET 44 2.280 1.921 0.203 242 HE1 MET 44 HE1 MET 44 4.239 2.931 -1.302 243 HE2 MET 44 HE2 MET 44 4.921 2.049 -2.669 244 HE3 MET 44 HE3 MET 44 5.029 1.373 -1.042 245 H LYS 45 HN LYS 45 4.693 -0.016 3.174 246 HA LYS 45 HA LYS 45 5.668 -2.657 3.182 247 HB2 LYS 45 HB2 LYS 45 6.397 -0.174 4.687 248 HB3 LYS 45 HB1 LYS 45 7.152 -1.710 5.094 249 HG2 LYS 45 HG2 LYS 45 7.800 -1.915 2.679 250 HG3 LYS 45 HG1 LYS 45 7.247 -0.255 2.467 251 HD2 LYS 45 HD2 LYS 45 9.112 -0.741 4.703 252 HD3 LYS 45 HD1 LYS 45 9.776 -0.910 3.078 253 HE2 LYS 45 HE2 LYS 45 8.879 1.342 2.540 254 HE3 LYS 45 HE1 LYS 45 8.378 1.503 4.220 255 HZ1 LYS 45 HZ1 LYS 45 10.725 1.185 4.855 256 HZ2 LYS 45 HZ2 LYS 45 10.475 2.577 3.928 257 HZ3 LYS 45 HZ3 LYS 45 11.152 1.199 3.217 258 H ALA 46 HN ALA 46 3.729 -0.851 5.501 259 HA ALA 46 HA ALA 46 3.915 -2.591 7.681 260 HB1 ALA 46 HB1 ALA 46 2.917 -0.383 7.873 261 HB2 ALA 46 HB2 ALA 46 1.780 -1.615 8.421 262 HB3 ALA 46 HB3 ALA 46 1.579 -0.875 6.832 263 H TYR 47 HN TYR 47 1.616 -2.558 4.976 264 HA TYR 47 HA TYR 47 0.206 -4.880 5.833 265 HB2 TYR 47 HB2 TYR 47 -0.693 -3.107 4.272 266 HB3 TYR 47 HB1 TYR 47 0.357 -3.769 3.023 267 HD1 TYR 47 HD1 TYR 47 -0.597 -5.266 1.540 268 HD2 TYR 47 HD2 TYR 47 -2.206 -4.973 5.469 269 HE1 TYR 47 HE1 TYR 47 -2.340 -6.894 0.941 270 HE2 TYR 47 HE2 TYR 47 -3.955 -6.600 4.880 271 HH TYR 47 HH TYR 47 -5.089 -7.440 2.854 272 H CYS 48 HN CYS 48 2.916 -4.259 3.713 273 HA CYS 48 HA CYS 48 3.169 -6.738 2.463 274 HB2 CYS 48 HB2 CYS 48 4.482 -5.035 1.563 275 HB3 CYS 48 HB1 CYS 48 5.067 -4.522 3.137 276 HG CYS 48 HG CYS 48 6.993 -6.392 3.427 277 H GLU 49 HN GLU 49 4.837 -5.555 5.385 278 HA GLU 49 HA GLU 49 6.159 -7.974 5.955 279 HB2 GLU 49 HB2 GLU 49 5.377 -5.725 7.817 280 HB3 GLU 49 HB1 GLU 49 6.515 -7.006 8.204 281 HG2 GLU 49 HG2 GLU 49 6.815 -4.770 6.239 282 HG3 GLU 49 HG1 GLU 49 7.835 -5.183 7.618 283 H ARG 50 HN ARG 50 3.046 -6.696 6.927 284 HA ARG 50 HA ARG 50 2.393 -8.556 8.909 285 HB2 ARG 50 HB2 ARG 50 1.134 -6.520 8.620 286 HB3 ARG 50 HB1 ARG 50 0.646 -6.997 7.001 287 HG2 ARG 50 HG2 ARG 50 -0.677 -8.821 7.921 288 HG3 ARG 50 HG1 ARG 50 -0.161 -8.380 9.552 289 HD2 ARG 50 HD2 ARG 50 -1.262 -6.268 9.403 290 HD3 ARG 50 HD1 ARG 50 -1.606 -6.511 7.692 291 HE ARG 50 HE ARG 50 -2.879 -8.586 8.792 292 HH11 ARG 50 HH11 ARG 50 -2.749 -5.197 9.668 293 HH12 ARG 50 HH12 ARG 50 -4.445 -5.157 10.298 294 HH21 ARG 50 HH21 ARG 50 -5.742 -7.042 10.190 295 HH22 ARG 50 HH22 ARG 50 -5.049 -8.601 9.570 296 H GLN 51 HN GLN 51 1.876 -8.657 5.399 297 HA GLN 51 HA GLN 51 0.528 -11.195 5.526 298 HB2 GLN 51 HB2 GLN 51 1.653 -9.711 3.144 299 HB3 GLN 51 HB1 GLN 51 0.612 -11.127 3.067 300 HG2 GLN 51 HG2 GLN 51 -0.092 -8.393 4.091 301 HG3 GLN 51 HG1 GLN 51 -0.719 -9.198 2.654 302 HE21 GLN 51 HE21 GLN 51 -2.233 -10.852 2.887 303 HE22 GLN 51 HE22 GLN 51 -3.114 -11.083 4.356 304 H GLY 52 HN GLY 52 3.726 -10.251 5.727 305 HA2 GLY 52 HA2 GLY 52 5.656 -11.490 5.871 306 HA3 GLY 52 HA1 GLY 52 4.672 -12.938 5.697 307 H LEU 53 HN LEU 53 4.973 -10.215 3.472 308 HA LEU 53 HA LEU 53 6.224 -12.028 1.517 309 HB2 LEU 53 HB2 LEU 53 3.975 -10.064 1.071 310 HB3 LEU 53 HB1 LEU 53 4.891 -10.791 -0.235 311 HG LEU 53 HG LEU 53 3.288 -12.366 1.780 312 HD11 LEU 53 HD11 LEU 53 1.652 -12.658 -0.018 313 HD12 LEU 53 HD12 LEU 53 2.567 -11.539 -1.029 314 HD13 LEU 53 HD13 LEU 53 1.808 -10.967 0.457 315 HD21 LEU 53 HD21 LEU 53 5.053 -13.678 0.830 316 HD22 LEU 53 HD22 LEU 53 4.662 -13.118 -0.795 317 HD23 LEU 53 HD23 LEU 53 3.534 -14.159 0.073 318 H SER 54 HN SER 54 6.476 -10.140 -0.532 319 HA SER 54 HA SER 54 8.274 -8.157 0.688 320 HB2 SER 54 HB2 SER 54 9.598 -9.824 -0.477 321 HB3 SER 54 HB1 SER 54 8.589 -9.680 -1.914 322 HG SER 54 HG SER 54 10.769 -8.381 -1.461 323 H MET 55 HN MET 55 8.173 -6.076 -0.077 324 HA MET 55 HA MET 55 5.743 -5.259 -1.292 325 HB2 MET 55 HB2 MET 55 7.236 -3.941 0.336 326 HB3 MET 55 HB1 MET 55 8.204 -3.539 -1.075 327 HG2 MET 55 HG2 MET 55 6.215 -2.541 -2.125 328 HG3 MET 55 HG1 MET 55 5.295 -2.887 -0.663 329 HE1 MET 55 HE1 MET 55 8.021 -0.797 -2.375 330 HE2 MET 55 HE2 MET 55 9.039 -1.482 -1.106 331 HE3 MET 55 HE3 MET 55 8.650 0.239 -1.094 332 H ARG 56 HN ARG 56 8.626 -6.425 -2.582 333 HA ARG 56 HA ARG 56 8.514 -4.982 -5.079 334 HB2 ARG 56 HB2 ARG 56 10.646 -5.813 -4.070 335 HB3 ARG 56 HB1 ARG 56 10.101 -7.457 -4.363 336 HG2 ARG 56 HG2 ARG 56 10.089 -7.046 -6.757 337 HG3 ARG 56 HG1 ARG 56 10.590 -5.376 -6.484 338 HD2 ARG 56 HD2 ARG 56 12.688 -6.111 -5.548 339 HD3 ARG 56 HD1 ARG 56 12.179 -7.796 -5.633 340 HE ARG 56 HE ARG 56 12.273 -7.628 -8.049 341 HH11 ARG 56 HH11 ARG 56 14.911 -4.583 -7.587 342 HH12 ARG 56 HH12 ARG 56 13.857 -5.071 -6.210 343 HH21 ARG 56 HH21 ARG 56 14.778 -5.697 -9.590 344 HH22 ARG 56 HH22 ARG 56 13.602 -7.048 -9.800 345 H GLN 57 HN GLN 57 6.905 -7.621 -3.716 346 HA GLN 57 HA GLN 57 6.355 -8.879 -6.301 347 HB2 GLN 57 HB2 GLN 57 7.009 -10.340 -4.443 348 HB3 GLN 57 HB1 GLN 57 5.649 -9.756 -3.498 349 HG2 GLN 57 HG2 GLN 57 4.104 -10.704 -5.140 350 HG3 GLN 57 HG1 GLN 57 5.475 -11.305 -6.071 351 HE21 GLN 57 HE21 GLN 57 3.253 -12.705 -4.753 352 HE22 GLN 57 HE22 GLN 57 3.998 -13.864 -3.701 353 H ILE 58 HN ILE 58 4.754 -7.117 -3.707 354 HA ILE 58 HA ILE 58 2.170 -7.457 -5.009 355 HB ILE 58 HB ILE 58 1.284 -6.161 -3.055 356 HG12 ILE 58 HG12 ILE 58 4.118 -6.489 -2.032 357 HG13 ILE 58 HG11 ILE 58 3.357 -4.963 -2.477 358 HG21 ILE 58 HG21 ILE 58 1.183 -8.576 -3.098 359 HG22 ILE 58 HG22 ILE 58 1.541 -8.024 -1.461 360 HG23 ILE 58 HG23 ILE 58 2.827 -8.686 -2.471 361 HD11 ILE 58 HD11 ILE 58 2.745 -6.748 -0.149 362 HD12 ILE 58 HD12 ILE 58 1.635 -5.489 -0.690 363 HD13 ILE 58 HD13 ILE 58 3.256 -5.060 -0.145 364 H ARG 59 HN ARG 59 0.813 -5.639 -5.484 365 HA ARG 59 HA ARG 59 2.282 -3.154 -6.086 366 HB2 ARG 59 HB2 ARG 59 0.236 -4.529 -7.846 367 HB3 ARG 59 HB1 ARG 59 0.951 -2.957 -8.166 368 HG2 ARG 59 HG2 ARG 59 2.492 -5.541 -7.994 369 HG3 ARG 59 HG1 ARG 59 1.951 -4.780 -9.491 370 HD2 ARG 59 HD2 ARG 59 3.293 -2.813 -9.002 371 HD3 ARG 59 HD1 ARG 59 3.795 -3.515 -7.465 372 HE ARG 59 HE ARG 59 4.683 -4.314 -10.136 373 HH11 ARG 59 HH11 ARG 59 6.302 -5.770 -6.723 374 HH12 ARG 59 HH12 ARG 59 4.774 -4.810 -6.642 375 HH21 ARG 59 HH21 ARG 59 6.611 -5.525 -10.253 376 HH22 ARG 59 HH22 ARG 59 7.338 -6.150 -8.723 377 H PHE 60 HN PHE 60 1.253 -1.312 -5.488 378 HA PHE 60 HA PHE 60 -1.434 -1.606 -4.340 379 HB2 PHE 60 HB2 PHE 60 0.917 0.092 -3.658 380 HB3 PHE 60 HB1 PHE 60 -0.686 0.759 -3.367 381 HD1 PHE 60 HD1 PHE 60 1.343 -2.295 -2.702 382 HD2 PHE 60 HD2 PHE 60 -1.755 0.305 -1.376 383 HE1 PHE 60 HE1 PHE 60 1.219 -3.527 -0.578 384 HE2 PHE 60 HE2 PHE 60 -1.885 -0.930 0.748 385 HZ PHE 60 HZ PHE 60 -0.397 -2.846 1.146 386 H ARG 61 HN ARG 61 -3.104 -0.395 -5.034 387 HA ARG 61 HA ARG 61 -2.563 1.633 -7.100 388 HB2 ARG 61 HB2 ARG 61 -4.230 -0.800 -7.248 389 HB3 ARG 61 HB1 ARG 61 -4.968 0.663 -7.882 390 HG2 ARG 61 HG2 ARG 61 -2.895 0.960 -9.283 391 HG3 ARG 61 HG1 ARG 61 -2.438 -0.672 -8.792 392 HD2 ARG 61 HD2 ARG 61 -4.574 -1.511 -9.685 393 HD3 ARG 61 HD1 ARG 61 -4.970 0.117 -10.224 394 HE ARG 61 HE ARG 61 -2.473 -0.859 -11.254 395 HH11 ARG 61 HH11 ARG 61 -5.854 -1.107 -13.474 396 HH12 ARG 61 HH12 ARG 61 -5.963 -0.781 -11.704 397 HH21 ARG 61 HH21 ARG 61 -2.296 -1.276 -13.493 398 HH22 ARG 61 HH22 ARG 61 -3.804 -1.368 -14.481 399 H PHE 62 HN PHE 62 -3.755 3.439 -7.024 400 HA PHE 62 HA PHE 62 -6.071 3.574 -5.222 401 HB2 PHE 62 HB2 PHE 62 -4.334 4.568 -3.896 402 HB3 PHE 62 HB1 PHE 62 -3.716 5.475 -5.273 403 HD1 PHE 62 HD1 PHE 62 -6.736 5.118 -3.126 404 HD2 PHE 62 HD2 PHE 62 -4.409 7.663 -5.620 405 HE1 PHE 62 HE1 PHE 62 -8.175 7.023 -2.523 406 HE2 PHE 62 HE2 PHE 62 -5.840 9.571 -5.020 407 HZ PHE 62 HZ PHE 62 -7.730 9.251 -3.471 408 H ASP 63 HN ASP 63 -7.768 4.356 -6.279 409 HA ASP 63 HA ASP 63 -9.068 5.353 -7.856 410 HB2 ASP 63 HB2 ASP 63 -7.709 7.375 -6.993 411 HB3 ASP 63 HB1 ASP 63 -6.789 7.227 -8.487 412 H GLY 64 HN GLY 64 -7.063 3.239 -8.490 413 HA2 GLY 64 HA2 GLY 64 -6.896 1.939 -10.428 414 HA3 GLY 64 HA1 GLY 64 -7.398 3.331 -11.375 415 H GLN 65 HN GLN 65 -5.135 4.635 -9.505 416 HA GLN 65 HA GLN 65 -3.033 4.134 -11.497 417 HB2 GLN 65 HB2 GLN 65 -3.168 6.418 -9.528 418 HB3 GLN 65 HB1 GLN 65 -2.140 6.288 -10.948 419 HG2 GLN 65 HG2 GLN 65 -5.141 6.491 -11.013 420 HG3 GLN 65 HG1 GLN 65 -4.032 7.841 -11.231 421 HE21 GLN 65 HE21 GLN 65 -2.825 7.982 -13.116 422 HE22 GLN 65 HE22 GLN 65 -3.216 7.069 -14.528 423 HA PRO 66 HA PRO 66 -0.549 2.113 -8.425 424 HB2 PRO 66 HB2 PRO 66 1.865 3.065 -9.774 425 HB3 PRO 66 HB1 PRO 66 1.228 1.420 -9.658 426 HG2 PRO 66 HG2 PRO 66 1.235 2.789 -11.977 427 HG3 PRO 66 HG1 PRO 66 -0.019 1.604 -11.565 428 HD2 PRO 66 HD2 PRO 66 -0.135 4.587 -11.430 429 HD3 PRO 66 HD1 PRO 66 -1.364 3.431 -11.983 430 H ILE 67 HN ILE 67 0.227 2.674 -6.480 431 HA ILE 67 HA ILE 67 0.643 5.466 -5.877 432 HB ILE 67 HB ILE 67 0.863 3.037 -4.087 433 HG12 ILE 67 HG12 ILE 67 -1.389 5.028 -4.452 434 HG13 ILE 67 HG11 ILE 67 -1.393 3.360 -5.017 435 HG21 ILE 67 HG21 ILE 67 0.693 5.958 -3.358 436 HG22 ILE 67 HG22 ILE 67 2.132 4.947 -3.236 437 HG23 ILE 67 HG23 ILE 67 0.725 4.604 -2.228 438 HD11 ILE 67 HD11 ILE 67 -1.263 4.245 -2.145 439 HD12 ILE 67 HD12 ILE 67 -1.295 2.578 -2.716 440 HD13 ILE 67 HD13 ILE 67 -2.689 3.624 -2.978 441 H ASN 68 HN ASN 68 2.551 6.481 -5.409 442 HA ASN 68 HA ASN 68 4.994 4.999 -6.031 443 HB2 ASN 68 HB2 ASN 68 4.547 7.968 -5.654 444 HB3 ASN 68 HB1 ASN 68 6.071 7.223 -6.122 445 HD21 ASN 68 HD21 ASN 68 2.961 8.256 -7.129 446 HD22 ASN 68 HD22 ASN 68 3.170 7.944 -8.827 447 H GLU 69 HN GLU 69 6.950 5.490 -4.689 448 HA GLU 69 HA GLU 69 6.333 4.972 -1.938 449 HB2 GLU 69 HB2 GLU 69 8.966 5.384 -3.362 450 HB3 GLU 69 HB1 GLU 69 8.828 4.954 -1.664 451 HG2 GLU 69 HG2 GLU 69 7.682 2.886 -2.280 452 HG3 GLU 69 HG1 GLU 69 7.826 3.317 -3.984 453 H THR 70 HN THR 70 6.721 7.803 -3.735 454 HA THR 70 HA THR 70 7.443 9.340 -1.333 455 HB THR 70 HB THR 70 7.431 11.049 -3.576 456 HG1 THR 70 HG1 THR 70 9.113 8.844 -4.141 457 HG21 THR 70 HG21 THR 70 8.911 11.256 -1.652 458 HG22 THR 70 HG22 THR 70 9.859 11.155 -3.136 459 HG23 THR 70 HG23 THR 70 9.717 9.747 -2.086 460 H ASP 71 HN ASP 71 4.746 8.248 -2.457 461 HA ASP 71 HA ASP 71 3.286 10.751 -2.762 462 HB2 ASP 71 HB2 ASP 71 2.784 7.933 -3.431 463 HB3 ASP 71 HB1 ASP 71 1.377 8.798 -2.819 464 H THR 72 HN THR 72 1.527 11.327 -1.484 465 HA THR 72 HA THR 72 1.288 10.002 1.123 466 HB THR 72 HB THR 72 0.991 12.368 2.089 467 HG1 THR 72 HG1 THR 72 2.735 13.369 0.203 468 HG21 THR 72 HG21 THR 72 3.707 11.446 1.149 469 HG22 THR 72 HG22 THR 72 2.913 11.025 2.668 470 HG23 THR 72 HG23 THR 72 3.434 12.684 2.376 471 HA PRO 73 HA PRO 73 -3.097 10.250 0.641 472 HB2 PRO 73 HB2 PRO 73 -3.254 11.674 3.247 473 HB3 PRO 73 HB1 PRO 73 -4.062 10.189 2.724 474 HG2 PRO 73 HG2 PRO 73 -2.017 10.092 4.421 475 HG3 PRO 73 HG1 PRO 73 -2.230 8.860 3.162 476 HD2 PRO 73 HD2 PRO 73 -0.305 11.126 3.273 477 HD3 PRO 73 HD1 PRO 73 -0.099 9.496 2.603 478 H ALA 74 HN ALA 74 -1.675 13.221 2.002 479 HA ALA 74 HA ALA 74 -3.784 14.912 1.096 480 HB1 ALA 74 HB1 ALA 74 -2.429 16.741 1.832 481 HB2 ALA 74 HB2 ALA 74 -0.982 15.733 1.842 482 HB3 ALA 74 HB3 ALA 74 -2.271 15.435 3.006 483 H GLN 75 HN GLN 75 -0.816 13.753 -0.305 484 HA GLN 75 HA GLN 75 -0.702 15.698 -2.405 485 HB2 GLN 75 HB2 GLN 75 1.358 14.709 -1.766 486 HB3 GLN 75 HB1 GLN 75 0.711 13.083 -1.911 487 HG2 GLN 75 HG2 GLN 75 2.249 13.622 -3.718 488 HG3 GLN 75 HG1 GLN 75 0.626 13.292 -4.315 489 HE21 GLN 75 HE21 GLN 75 1.020 14.389 -6.224 490 HE22 GLN 75 HE22 GLN 75 1.103 16.113 -6.305 491 H LEU 76 HN LEU 76 -1.733 12.301 -2.216 492 HA LEU 76 HA LEU 76 -2.563 12.262 -4.973 493 HB2 LEU 76 HB2 LEU 76 -2.706 10.315 -2.706 494 HB3 LEU 76 HB1 LEU 76 -3.617 10.020 -4.173 495 HG LEU 76 HG LEU 76 -0.621 10.315 -3.978 496 HD11 LEU 76 HD11 LEU 76 -2.330 7.903 -4.568 497 HD12 LEU 76 HD12 LEU 76 -1.490 8.214 -3.048 498 HD13 LEU 76 HD13 LEU 76 -0.567 7.954 -4.530 499 HD21 LEU 76 HD21 LEU 76 -1.304 11.164 -6.098 500 HD22 LEU 76 HD22 LEU 76 -2.435 9.832 -6.332 501 HD23 LEU 76 HD23 LEU 76 -0.697 9.529 -6.352 502 H GLU 77 HN GLU 77 -3.891 13.864 -2.541 503 HA GLU 77 HA GLU 77 -5.949 14.702 -2.057 504 HB2 GLU 77 HB2 GLU 77 -6.598 13.655 -4.822 505 HB3 GLU 77 HB1 GLU 77 -7.621 14.741 -3.893 506 HG2 GLU 77 HG2 GLU 77 -4.793 15.467 -4.551 507 HG3 GLU 77 HG1 GLU 77 -6.099 15.728 -5.705 508 H MET 78 HN MET 78 -5.358 12.135 -1.097 509 HA MET 78 HA MET 78 -7.634 10.410 -1.487 510 HB2 MET 78 HB2 MET 78 -5.533 10.256 0.685 511 HB3 MET 78 HB1 MET 78 -6.604 8.965 0.154 512 HG2 MET 78 HG2 MET 78 -5.490 8.880 -1.989 513 HG3 MET 78 HG1 MET 78 -4.470 10.244 -1.542 514 HE1 MET 78 HE1 MET 78 -5.067 6.480 -1.416 515 HE2 MET 78 HE2 MET 78 -5.587 6.844 0.230 516 HE3 MET 78 HE3 MET 78 -4.110 5.920 -0.044 517 H GLU 79 HN GLU 79 -9.409 10.227 -0.217 518 HA GLU 79 HA GLU 79 -9.605 12.159 1.981 519 HB2 GLU 79 HB2 GLU 79 -11.491 11.344 -0.146 520 HB3 GLU 79 HB1 GLU 79 -12.186 11.620 1.446 521 HG2 GLU 79 HG2 GLU 79 -10.455 13.594 -0.021 522 HG3 GLU 79 HG1 GLU 79 -12.219 13.611 -0.022 523 H ASP 80 HN ASP 80 -11.218 11.569 3.650 524 HA ASP 80 HA ASP 80 -10.459 9.164 4.903 525 HB2 ASP 80 HB2 ASP 80 -11.243 11.251 6.057 526 HB3 ASP 80 HB1 ASP 80 -12.878 10.864 5.536 527 H GLU 81 HN GLU 81 -11.373 7.210 5.034 528 HA GLU 81 HA GLU 81 -12.826 5.480 4.794 529 HB2 GLU 81 HB2 GLU 81 -14.641 7.741 4.143 530 HB3 GLU 81 HB1 GLU 81 -15.133 6.129 3.645 531 HG2 GLU 81 HG2 GLU 81 -14.207 6.481 6.435 532 HG3 GLU 81 HG1 GLU 81 -15.780 7.147 5.995 533 H ASP 82 HN ASP 82 -11.008 6.608 2.625 534 HA ASP 82 HA ASP 82 -12.311 5.707 0.196 535 HB2 ASP 82 HB2 ASP 82 -10.352 7.545 0.607 536 HB3 ASP 82 HB1 ASP 82 -9.388 6.147 0.133 537 H THR 83 HN THR 83 -10.716 4.234 -1.254 538 HA THR 83 HA THR 83 -9.863 1.982 0.440 539 HB THR 83 HB THR 83 -11.323 1.530 -2.152 540 HG1 THR 83 HG1 THR 83 -12.599 2.705 -0.487 541 HG21 THR 83 HG21 THR 83 -11.686 -0.689 -1.239 542 HG22 THR 83 HG22 THR 83 -10.923 -0.222 0.278 543 HG23 THR 83 HG23 THR 83 -9.962 -0.311 -1.198 544 H ILE 84 HN ILE 84 -8.104 0.905 -0.163 545 HA ILE 84 HA ILE 84 -6.733 1.743 -2.637 546 HB ILE 84 HB ILE 84 -5.443 0.648 -0.127 547 HG12 ILE 84 HG12 ILE 84 -5.520 3.526 -1.060 548 HG13 ILE 84 HG11 ILE 84 -6.529 2.879 0.229 549 HG21 ILE 84 HG21 ILE 84 -3.375 1.547 -1.159 550 HG22 ILE 84 HG22 ILE 84 -4.305 1.919 -2.610 551 HG23 ILE 84 HG23 ILE 84 -4.119 0.244 -2.086 552 HD11 ILE 84 HD11 ILE 84 -3.524 3.008 0.230 553 HD12 ILE 84 HD12 ILE 84 -4.529 2.347 1.521 554 HD13 ILE 84 HD13 ILE 84 -4.619 4.062 1.126 555 H ASP 85 HN ASP 85 -6.016 0.144 -4.013 556 HA ASP 85 HA ASP 85 -6.938 -2.576 -3.394 557 HB2 ASP 85 HB2 ASP 85 -6.372 -1.143 -5.981 558 HB3 ASP 85 HB1 ASP 85 -6.524 -2.894 -5.918 559 H VAL 86 HN VAL 86 -5.613 -4.316 -3.407 560 HA VAL 86 HA VAL 86 -2.742 -3.821 -3.872 561 HB VAL 86 HB VAL 86 -3.868 -5.915 -2.008 562 HG11 VAL 86 HG11 VAL 86 -1.576 -5.982 -1.143 563 HG12 VAL 86 HG12 VAL 86 -1.093 -4.770 -2.329 564 HG13 VAL 86 HG13 VAL 86 -1.629 -6.361 -2.866 565 HG21 VAL 86 HG21 VAL 86 -2.775 -3.202 -1.275 566 HG22 VAL 86 HG22 VAL 86 -3.293 -4.459 -0.152 567 HG23 VAL 86 HG23 VAL 86 -4.473 -3.676 -1.202 568 H PHE 87 HN PHE 87 -1.952 -4.897 -5.550 569 HA PHE 87 HA PHE 87 -3.327 -7.356 -6.430 570 HB2 PHE 87 HB2 PHE 87 -1.850 -5.266 -8.039 571 HB3 PHE 87 HB1 PHE 87 -2.383 -6.805 -8.700 572 HD1 PHE 87 HD1 PHE 87 -4.712 -7.224 -9.141 573 HD2 PHE 87 HD2 PHE 87 -3.441 -3.521 -7.482 574 HE1 PHE 87 HE1 PHE 87 -6.901 -6.239 -9.671 575 HE2 PHE 87 HE2 PHE 87 -5.630 -2.533 -8.003 576 HZ PHE 87 HZ PHE 87 -7.360 -3.891 -9.099 577 H GLN 88 HN GLN 88 -1.900 -8.863 -7.644 578 HA GLN 88 HA GLN 88 0.745 -9.021 -6.362 579 HB2 GLN 88 HB2 GLN 88 -1.236 -11.104 -7.236 580 HB3 GLN 88 HB1 GLN 88 0.470 -11.512 -7.114 581 HG2 GLN 88 HG2 GLN 88 -0.578 -10.132 -4.764 582 HG3 GLN 88 HG1 GLN 88 -1.348 -11.685 -5.090 583 HE21 GLN 88 HE21 GLN 88 -0.423 -12.582 -3.233 584 HE22 GLN 88 HE22 GLN 88 1.249 -13.028 -3.180 585 H GLN 89 HN GLN 89 2.545 -9.154 -7.632 586 HA GLN 89 HA GLN 89 2.257 -8.540 -10.424 587 HB2 GLN 89 HB2 GLN 89 4.076 -7.648 -8.926 588 HB3 GLN 89 HB1 GLN 89 4.785 -9.256 -8.934 589 HG2 GLN 89 HG2 GLN 89 5.882 -7.755 -10.517 590 HG3 GLN 89 HG1 GLN 89 5.134 -9.135 -11.318 591 HE21 GLN 89 HE21 GLN 89 5.084 -8.044 -13.276 592 HE22 GLN 89 HE22 GLN 89 3.953 -6.777 -13.596 593 H GLN 90 HN GLN 90 2.965 -9.809 -12.185 594 HA GLN 90 HA GLN 90 2.427 -12.603 -11.887 595 HB2 GLN 90 HB2 GLN 90 3.581 -11.248 -14.323 596 HB3 GLN 90 HB1 GLN 90 2.671 -12.750 -14.260 597 HG2 GLN 90 HG2 GLN 90 0.970 -11.456 -14.920 598 HG3 GLN 90 HG1 GLN 90 0.870 -11.039 -13.211 599 HE21 GLN 90 HE21 GLN 90 -0.005 -9.021 -13.647 600 HE22 GLN 90 HE22 GLN 90 0.941 -7.732 -14.305 601 H THR 91 HN THR 91 3.864 -13.969 -11.094 602 HA THR 91 HA THR 91 6.691 -13.372 -11.164 603 HB THR 91 HB THR 91 6.428 -15.914 -10.111 604 HG1 THR 91 HG1 THR 91 4.340 -16.088 -9.738 605 HG21 THR 91 HG21 THR 91 6.257 -13.246 -8.696 606 HG22 THR 91 HG22 THR 91 7.738 -14.095 -9.139 607 HG23 THR 91 HG23 THR 91 6.657 -14.783 -7.930 608 H GLY 92 HN GLY 92 4.535 -14.967 -13.185 609 HA2 GLY 92 HA2 GLY 92 6.704 -15.989 -14.794 610 HA3 GLY 92 HA1 GLY 92 5.665 -17.234 -14.114 611 H ASN 357 HT1 ASN 357 -15.732 -10.958 7.603 612 HA ASN 357 HA ASN 357 -13.164 -10.686 6.163 613 HB2 ASN 357 HB2 ASN 357 -13.922 -8.447 5.622 614 HB3 ASN 357 HB1 ASN 357 -15.132 -9.609 5.091 615 HD21 ASN 357 HD21 ASN 357 -15.422 -6.793 5.645 616 HD22 ASN 357 HD22 ASN 357 -16.624 -6.662 6.883 617 H ASN 358 HN ASN 358 -11.742 -9.035 7.015 618 HA ASN 358 HA ASN 358 -12.074 -8.740 9.914 619 HB2 ASN 358 HB2 ASN 358 -9.766 -9.126 10.272 620 HB3 ASN 358 HB1 ASN 358 -10.272 -10.354 9.119 621 HD21 ASN 358 HD21 ASN 358 -8.158 -7.765 9.732 622 HD22 ASN 358 HD22 ASN 358 -7.417 -7.690 8.174 623 H ARG 359 HN ARG 359 -12.065 -6.772 10.746 624 HA ARG 359 HA ARG 359 -10.808 -4.617 9.176 625 HB2 ARG 359 HB2 ARG 359 -13.346 -4.713 10.785 626 HB3 ARG 359 HB1 ARG 359 -12.503 -3.190 10.572 627 HG2 ARG 359 HG2 ARG 359 -12.948 -4.679 8.095 628 HG3 ARG 359 HG1 ARG 359 -14.416 -4.153 8.921 629 HD2 ARG 359 HD2 ARG 359 -12.687 -1.963 9.040 630 HD3 ARG 359 HD1 ARG 359 -12.502 -2.607 7.412 631 HE ARG 359 HE ARG 359 -15.000 -1.632 8.611 632 HH11 ARG 359 HH11 ARG 359 -13.151 -2.732 5.853 633 HH12 ARG 359 HH12 ARG 359 -14.337 -2.116 4.645 634 HH21 ARG 359 HH21 ARG 359 -16.545 -0.792 7.108 635 HH22 ARG 359 HH22 ARG 359 -16.228 -1.008 5.344 636 H ASP 360 HN ASP 360 -9.027 -4.016 10.173 637 HA ASP 360 HA ASP 360 -9.013 -3.660 13.060 638 HB2 ASP 360 HB2 ASP 360 -6.813 -4.576 13.323 639 HB3 ASP 360 HB1 ASP 360 -7.823 -5.766 12.515 640 HA PRO 361 HA PRO 361 -7.257 0.165 11.619 641 HB2 PRO 361 HB2 PRO 361 -7.490 1.536 13.913 642 HB3 PRO 361 HB1 PRO 361 -8.913 0.975 13.030 643 HG2 PRO 361 HG2 PRO 361 -7.848 0.026 15.592 644 HG3 PRO 361 HG1 PRO 361 -9.457 -0.205 14.884 645 HD2 PRO 361 HD2 PRO 361 -7.182 -2.025 14.862 646 HD3 PRO 361 HD1 PRO 361 -8.866 -2.325 14.384 647 H ILE 362 HN ILE 362 -5.274 0.829 11.288 648 HA ILE 362 HA ILE 362 -3.176 0.329 13.303 649 HB ILE 362 HB ILE 362 -2.882 0.402 10.294 650 HG12 ILE 362 HG12 ILE 362 -2.627 -2.076 11.989 651 HG13 ILE 362 HG11 ILE 362 -4.193 -1.568 11.367 652 HG21 ILE 362 HG21 ILE 362 -0.932 -0.471 12.413 653 HG22 ILE 362 HG22 ILE 362 -0.888 1.072 11.559 654 HG23 ILE 362 HG23 ILE 362 -0.651 -0.435 10.673 655 HD11 ILE 362 HD11 ILE 362 -1.772 -2.179 9.680 656 HD12 ILE 362 HD12 ILE 362 -3.378 -1.754 9.089 657 HD13 ILE 362 HD13 ILE 362 -3.129 -3.268 9.959 658 H VAL 363 HN VAL 363 -2.041 2.083 13.982 659 HA VAL 363 HA VAL 363 -2.405 4.588 12.462 660 HB VAL 363 HB VAL 363 -1.792 4.392 15.414 661 HG11 VAL 363 HG11 VAL 363 -1.202 6.505 14.341 662 HG12 VAL 363 HG12 VAL 363 -2.525 6.706 15.489 663 HG13 VAL 363 HG13 VAL 363 -2.857 6.674 13.757 664 HG21 VAL 363 HG21 VAL 363 -4.125 4.807 15.896 665 HG22 VAL 363 HG22 VAL 363 -3.963 3.326 14.953 666 HG23 VAL 363 HG23 VAL 363 -4.508 4.811 14.173 667 H ILE 364 HN ILE 364 -0.636 5.478 11.660 668 HA ILE 364 HA ILE 364 1.988 4.733 12.785 669 HB ILE 364 HB ILE 364 1.434 5.452 9.899 670 HG12 ILE 364 HG12 ILE 364 2.173 2.744 11.015 671 HG13 ILE 364 HG11 ILE 364 0.522 3.212 10.617 672 HG21 ILE 364 HG21 ILE 364 3.702 5.023 9.461 673 HG22 ILE 364 HG22 ILE 364 3.941 4.238 11.021 674 HG23 ILE 364 HG23 ILE 364 3.700 5.983 10.941 675 HD11 ILE 364 HD11 ILE 364 1.544 1.892 8.840 676 HD12 ILE 364 HD12 ILE 364 2.827 3.092 8.683 677 HD13 ILE 364 HD13 ILE 364 1.164 3.526 8.293 678 H SER 365 HN SER 365 3.250 6.400 13.425 679 HA SER 365 HA SER 365 2.426 9.099 12.566 680 HB2 SER 365 HB2 SER 365 3.707 8.484 15.231 681 HB3 SER 365 HB1 SER 365 2.845 9.946 14.740 682 HG SER 365 HG SER 365 1.180 7.940 14.396 683 H ASP 366 HN ASP 366 3.989 10.237 11.551 684 HA ASP 366 HA ASP 366 6.758 9.358 11.965 685 HB2 ASP 366 HB2 ASP 366 5.613 8.792 9.691 686 HB3 ASP 366 HB1 ASP 366 5.914 10.492 9.332 687 H SER 367 HN SER 367 8.246 10.857 12.361 688 HA SER 367 HA SER 367 7.425 13.680 12.172 689 HB2 SER 367 HB2 SER 367 9.419 12.517 14.129 690 HB3 SER 367 HB1 SER 367 8.722 14.138 14.145 691 HG SER 367 HG SER 367 6.975 11.956 14.238 692 HA PRO 368 HA PRO 368 10.706 13.613 9.062 693 HB2 PRO 368 HB2 PRO 368 10.160 16.528 9.127 694 HB3 PRO 368 HB1 PRO 368 10.182 15.415 7.752 695 HG2 PRO 368 HG2 PRO 368 7.881 16.352 8.697 696 HG3 PRO 368 HG1 PRO 368 8.028 14.682 8.115 697 HD2 PRO 368 HD2 PRO 368 7.940 15.700 10.920 698 HD3 PRO 368 HD1 PRO 368 7.224 14.229 10.227 Start of MODEL 10 1 H ASP 16 HT1 ASP 16 -5.532 16.036 12.558 2 HA ASP 16 HA ASP 16 -6.792 13.940 14.222 3 HB2 ASP 16 HB2 ASP 16 -7.832 15.488 11.845 4 HB3 ASP 16 HB1 ASP 16 -8.549 13.977 12.399 5 H HIS 17 HN HIS 17 -7.304 12.027 12.828 6 HA HIS 17 HA HIS 17 -5.075 11.568 10.962 7 HB2 HIS 17 HB2 HIS 17 -6.570 9.588 12.695 8 HB3 HIS 17 HB1 HIS 17 -5.321 9.161 11.531 9 HD2 HIS 17 HD2 HIS 17 -2.711 10.190 12.212 10 HE1 HIS 17 HE1 HIS 17 -3.716 10.464 16.313 11 HE2 HIS 17 HE2 HIS 17 -1.818 10.240 14.652 12 H ILE 18 HN ILE 18 -5.498 10.089 9.184 13 HA ILE 18 HA ILE 18 -8.267 10.342 8.212 14 HB ILE 18 HB ILE 18 -6.601 11.459 6.790 15 HG12 ILE 18 HG12 ILE 18 -7.644 8.965 5.434 16 HG13 ILE 18 HG11 ILE 18 -8.630 10.377 5.802 17 HG21 ILE 18 HG21 ILE 18 -4.926 10.158 5.558 18 HG22 ILE 18 HG22 ILE 18 -5.367 8.727 6.489 19 HG23 ILE 18 HG23 ILE 18 -4.652 10.119 7.301 20 HD11 ILE 18 HD11 ILE 18 -6.224 10.331 3.993 21 HD12 ILE 18 HD12 ILE 18 -7.227 11.739 4.350 22 HD13 ILE 18 HD13 ILE 18 -7.911 10.364 3.482 23 H ASN 19 HN ASN 19 -9.394 8.534 7.619 24 HA ASN 19 HA ASN 19 -8.114 5.991 8.325 25 HB2 ASN 19 HB2 ASN 19 -11.045 6.645 8.002 26 HB3 ASN 19 HB1 ASN 19 -10.384 5.110 8.558 27 HD21 ASN 19 HD21 ASN 19 -11.055 8.406 9.358 28 HD22 ASN 19 HD22 ASN 19 -10.723 8.271 11.056 29 H LEU 20 HN LEU 20 -7.114 5.260 6.533 30 HA LEU 20 HA LEU 20 -8.587 5.199 4.006 31 HB2 LEU 20 HB2 LEU 20 -5.746 4.379 4.633 32 HB3 LEU 20 HB1 LEU 20 -6.463 4.426 3.037 33 HG LEU 20 HG LEU 20 -6.028 6.831 4.807 34 HD11 LEU 20 HD11 LEU 20 -4.539 5.918 2.353 35 HD12 LEU 20 HD12 LEU 20 -3.928 5.882 4.007 36 HD13 LEU 20 HD13 LEU 20 -4.273 7.425 3.227 37 HD21 LEU 20 HD21 LEU 20 -6.557 8.082 2.724 38 HD22 LEU 20 HD22 LEU 20 -7.921 7.178 3.380 39 HD23 LEU 20 HD23 LEU 20 -7.042 6.557 1.983 40 H LYS 21 HN LYS 21 -8.676 3.148 2.794 41 HA LYS 21 HA LYS 21 -8.798 0.829 4.619 42 HB2 LYS 21 HB2 LYS 21 -10.656 1.648 2.389 43 HB3 LYS 21 HB1 LYS 21 -10.600 -0.004 2.996 44 HG2 LYS 21 HG2 LYS 21 -11.279 0.721 5.183 45 HG3 LYS 21 HG1 LYS 21 -11.186 2.416 4.690 46 HD2 LYS 21 HD2 LYS 21 -12.973 2.064 3.080 47 HD3 LYS 21 HD1 LYS 21 -13.039 0.350 3.496 48 HE2 LYS 21 HE2 LYS 21 -13.860 0.819 5.667 49 HE3 LYS 21 HE1 LYS 21 -13.491 2.537 5.515 50 HZ1 LYS 21 HZ1 LYS 21 -15.611 2.742 4.914 51 HZ2 LYS 21 HZ2 LYS 21 -15.803 1.083 4.649 52 HZ3 LYS 21 HZ3 LYS 21 -15.164 2.058 3.425 53 H VAL 22 HN VAL 22 -7.776 -0.981 3.994 54 HA VAL 22 HA VAL 22 -6.753 -1.073 1.233 55 HB VAL 22 HB VAL 22 -5.358 -1.990 3.753 56 HG11 VAL 22 HG11 VAL 22 -4.996 -3.624 1.994 57 HG12 VAL 22 HG12 VAL 22 -3.520 -2.704 2.288 58 HG13 VAL 22 HG13 VAL 22 -4.517 -2.345 0.878 59 HG21 VAL 22 HG21 VAL 22 -3.652 -0.375 3.131 60 HG22 VAL 22 HG22 VAL 22 -5.220 0.418 3.288 61 HG23 VAL 22 HG23 VAL 22 -4.569 0.061 1.691 62 H ALA 23 HN ALA 23 -7.850 -2.566 0.187 63 HA ALA 23 HA ALA 23 -8.777 -4.938 1.651 64 HB1 ALA 23 HB1 ALA 23 -10.413 -5.220 -0.135 65 HB2 ALA 23 HB2 ALA 23 -9.750 -3.822 -0.981 66 HB3 ALA 23 HB3 ALA 23 -10.537 -3.614 0.584 67 H GLY 24 HN GLY 24 -8.171 -6.933 1.071 68 HA2 GLY 24 HA2 GLY 24 -5.966 -7.152 -0.812 69 HA3 GLY 24 HA1 GLY 24 -6.531 -8.405 0.283 70 H GLN 25 HN GLN 25 -6.257 -9.775 -1.632 71 HA GLN 25 HA GLN 25 -8.211 -9.431 -3.755 72 HB2 GLN 25 HB2 GLN 25 -6.061 -11.503 -3.276 73 HB3 GLN 25 HB1 GLN 25 -7.154 -11.539 -4.651 74 HG2 GLN 25 HG2 GLN 25 -5.347 -9.217 -4.034 75 HG3 GLN 25 HG1 GLN 25 -4.894 -10.552 -5.092 76 HE21 GLN 25 HE21 GLN 25 -5.398 -7.603 -5.519 77 HE22 GLN 25 HE22 GLN 25 -6.515 -7.554 -6.844 78 H ASP 26 HN ASP 26 -7.972 -10.912 -0.749 79 HA ASP 26 HA ASP 26 -9.931 -12.994 -1.303 80 HB2 ASP 26 HB2 ASP 26 -9.563 -13.447 1.211 81 HB3 ASP 26 HB1 ASP 26 -8.227 -13.778 0.113 82 H GLY 27 HN GLY 27 -9.924 -11.317 1.759 83 HA2 GLY 27 HA2 GLY 27 -12.232 -9.685 1.131 84 HA3 GLY 27 HA1 GLY 27 -12.591 -11.083 2.138 85 H SER 28 HN SER 28 -9.499 -9.561 2.369 86 HA SER 28 HA SER 28 -10.037 -8.844 5.129 87 HB2 SER 28 HB2 SER 28 -7.488 -8.129 4.816 88 HB3 SER 28 HB1 SER 28 -7.951 -9.820 5.022 89 HG SER 28 HG SER 28 -7.674 -10.181 2.884 90 H VAL 29 HN VAL 29 -10.439 -6.804 5.844 91 HA VAL 29 HA VAL 29 -9.816 -4.600 3.977 92 HB VAL 29 HB VAL 29 -12.272 -4.557 5.718 93 HG11 VAL 29 HG11 VAL 29 -12.963 -2.766 4.202 94 HG12 VAL 29 HG12 VAL 29 -11.469 -2.963 3.283 95 HG13 VAL 29 HG13 VAL 29 -11.410 -2.404 4.955 96 HG21 VAL 29 HG21 VAL 29 -13.603 -5.117 3.736 97 HG22 VAL 29 HG22 VAL 29 -12.522 -6.439 4.182 98 HG23 VAL 29 HG23 VAL 29 -12.120 -5.393 2.821 99 H VAL 30 HN VAL 30 -7.934 -4.176 5.173 100 HA VAL 30 HA VAL 30 -8.172 -3.586 7.995 101 HB VAL 30 HB VAL 30 -5.781 -3.058 7.915 102 HG11 VAL 30 HG11 VAL 30 -6.520 -5.627 6.517 103 HG12 VAL 30 HG12 VAL 30 -6.456 -5.361 8.258 104 HG13 VAL 30 HG13 VAL 30 -4.974 -5.301 7.302 105 HG21 VAL 30 HG21 VAL 30 -6.062 -3.565 4.957 106 HG22 VAL 30 HG22 VAL 30 -4.522 -3.481 5.812 107 HG23 VAL 30 HG23 VAL 30 -5.569 -2.063 5.743 108 H GLN 31 HN GLN 31 -7.940 -1.598 8.953 109 HA GLN 31 HA GLN 31 -8.509 0.683 7.183 110 HB2 GLN 31 HB2 GLN 31 -10.248 0.108 8.844 111 HB3 GLN 31 HB1 GLN 31 -9.077 0.334 10.133 112 HG2 GLN 31 HG2 GLN 31 -8.892 2.689 9.580 113 HG3 GLN 31 HG1 GLN 31 -10.010 2.476 8.232 114 HE21 GLN 31 HE21 GLN 31 -10.193 4.155 10.649 115 HE22 GLN 31 HE22 GLN 31 -11.680 3.699 11.410 116 H PHE 32 HN PHE 32 -6.831 1.940 6.822 117 HA PHE 32 HA PHE 32 -4.638 2.005 8.746 118 HB2 PHE 32 HB2 PHE 32 -4.921 2.522 5.851 119 HB3 PHE 32 HB1 PHE 32 -3.777 3.555 6.702 120 HD1 PHE 32 HD1 PHE 32 -4.437 0.241 5.415 121 HD2 PHE 32 HD2 PHE 32 -1.856 2.547 7.885 122 HE1 PHE 32 HE1 PHE 32 -2.746 -1.541 5.301 123 HE2 PHE 32 HE2 PHE 32 -0.158 0.770 7.778 124 HZ PHE 32 HZ PHE 32 -0.603 -1.278 6.485 125 H LYS 33 HN LYS 33 -5.074 3.378 10.339 126 HA LYS 33 HA LYS 33 -6.229 6.001 9.717 127 HB2 LYS 33 HB2 LYS 33 -7.312 4.730 11.515 128 HB3 LYS 33 HB1 LYS 33 -5.783 4.599 12.367 129 HG2 LYS 33 HG2 LYS 33 -5.747 7.057 12.612 130 HG3 LYS 33 HG1 LYS 33 -7.336 7.125 11.846 131 HD2 LYS 33 HD2 LYS 33 -8.367 6.000 13.635 132 HD3 LYS 33 HD1 LYS 33 -6.821 5.444 14.280 133 HE2 LYS 33 HE2 LYS 33 -6.231 7.706 14.902 134 HE3 LYS 33 HE1 LYS 33 -7.714 8.323 14.178 135 HZ1 LYS 33 HZ1 LYS 33 -7.818 8.078 16.622 136 HZ2 LYS 33 HZ2 LYS 33 -7.644 6.405 16.443 137 HZ3 LYS 33 HZ3 LYS 33 -9.003 7.186 15.814 138 H ILE 34 HN ILE 34 -4.393 6.913 8.785 139 HA ILE 34 HA ILE 34 -2.135 7.360 10.630 140 HB ILE 34 HB ILE 34 -0.661 7.545 8.679 141 HG12 ILE 34 HG12 ILE 34 -3.014 6.584 7.034 142 HG13 ILE 34 HG11 ILE 34 -2.475 8.260 7.080 143 HG21 ILE 34 HG21 ILE 34 -0.665 5.163 8.038 144 HG22 ILE 34 HG22 ILE 34 -2.244 4.982 8.799 145 HG23 ILE 34 HG23 ILE 34 -0.837 5.403 9.775 146 HD11 ILE 34 HD11 ILE 34 -1.658 7.043 5.112 147 HD12 ILE 34 HD12 ILE 34 -0.799 5.929 6.176 148 HD13 ILE 34 HD13 ILE 34 -0.346 7.633 6.130 149 H LYS 35 HN LYS 35 -0.783 9.341 9.599 150 HA LYS 35 HA LYS 35 -2.623 11.574 9.740 151 HB2 LYS 35 HB2 LYS 35 0.396 11.534 9.491 152 HB3 LYS 35 HB1 LYS 35 -0.584 12.968 9.767 153 HG2 LYS 35 HG2 LYS 35 -1.373 11.921 11.895 154 HG3 LYS 35 HG1 LYS 35 -0.193 10.636 11.631 155 HD2 LYS 35 HD2 LYS 35 1.616 12.246 11.694 156 HD3 LYS 35 HD1 LYS 35 0.466 13.577 11.836 157 HE2 LYS 35 HE2 LYS 35 -0.339 12.495 13.965 158 HE3 LYS 35 HE1 LYS 35 1.043 11.407 13.842 159 HZ1 LYS 35 HZ1 LYS 35 2.504 13.351 13.888 160 HZ2 LYS 35 HZ2 LYS 35 1.549 13.256 15.281 161 HZ3 LYS 35 HZ3 LYS 35 1.162 14.365 14.067 162 H ARG 36 HN ARG 36 -2.767 13.201 8.101 163 HA ARG 36 HA ARG 36 -2.890 12.104 5.487 164 HB2 ARG 36 HB2 ARG 36 -3.229 14.936 6.474 165 HB3 ARG 36 HB1 ARG 36 -3.515 14.440 4.810 166 HG2 ARG 36 HG2 ARG 36 -5.233 12.865 5.597 167 HG3 ARG 36 HG1 ARG 36 -4.971 13.432 7.246 168 HD2 ARG 36 HD2 ARG 36 -6.855 14.606 6.493 169 HD3 ARG 36 HD1 ARG 36 -5.523 15.751 6.364 170 HE ARG 36 HE ARG 36 -5.534 15.440 3.994 171 HH11 ARG 36 HH11 ARG 36 -8.281 14.009 5.698 172 HH12 ARG 36 HH12 ARG 36 -9.295 13.932 4.199 173 HH21 ARG 36 HH21 ARG 36 -6.837 15.347 2.096 174 HH22 ARG 36 HH22 ARG 36 -8.495 14.638 2.227 175 H HIS 37 HN HIS 37 -0.308 13.454 7.187 176 HA HIS 37 HA HIS 37 1.091 14.116 4.687 177 HB2 HIS 37 HB2 HIS 37 2.711 15.351 6.149 178 HB3 HIS 37 HB1 HIS 37 1.081 16.011 6.157 179 HD2 HIS 37 HD2 HIS 37 -0.275 15.857 8.561 180 HE1 HIS 37 HE1 HIS 37 3.042 14.429 10.763 181 HE2 HIS 37 HE2 HIS 37 0.783 15.572 10.907 182 H THR 38 HN THR 38 0.664 11.466 6.227 183 HA THR 38 HA THR 38 3.442 10.708 6.718 184 HB THR 38 HB THR 38 0.924 9.063 7.041 185 HG1 THR 38 HG1 THR 38 2.009 11.044 8.545 186 HG21 THR 38 HG21 THR 38 2.320 7.615 8.438 187 HG22 THR 38 HG22 THR 38 3.726 8.621 8.089 188 HG23 THR 38 HG23 THR 38 2.955 7.704 6.795 189 HA PRO 39 HA PRO 39 3.968 9.352 2.486 190 HB2 PRO 39 HB2 PRO 39 5.986 7.614 3.825 191 HB3 PRO 39 HB1 PRO 39 6.169 8.674 2.419 192 HG2 PRO 39 HG2 PRO 39 7.139 9.406 4.773 193 HG3 PRO 39 HG1 PRO 39 6.363 10.587 3.698 194 HD2 PRO 39 HD2 PRO 39 5.312 9.327 6.184 195 HD3 PRO 39 HD1 PRO 39 5.052 10.962 5.541 196 H LEU 40 HN LEU 40 2.932 7.849 1.374 197 HA LEU 40 HA LEU 40 1.588 5.696 2.657 198 HB2 LEU 40 HB2 LEU 40 2.004 6.361 -0.256 199 HB3 LEU 40 HB1 LEU 40 1.003 5.032 0.298 200 HG LEU 40 HG LEU 40 0.520 7.921 1.027 201 HD11 LEU 40 HD11 LEU 40 -1.304 7.850 -0.592 202 HD12 LEU 40 HD12 LEU 40 -0.822 6.224 -1.071 203 HD13 LEU 40 HD13 LEU 40 0.255 7.589 -1.375 204 HD21 LEU 40 HD21 LEU 40 -1.140 5.425 1.371 205 HD22 LEU 40 HD22 LEU 40 -1.707 7.066 1.678 206 HD23 LEU 40 HD23 LEU 40 -0.399 6.389 2.649 207 H SER 41 HN SER 41 4.741 6.036 1.546 208 HA SER 41 HA SER 41 5.362 3.480 0.595 209 HB2 SER 41 HB2 SER 41 7.562 4.544 2.078 210 HB3 SER 41 HB1 SER 41 7.324 4.539 0.328 211 HG SER 41 HG SER 41 7.281 6.639 0.648 212 H LYS 42 HN LYS 42 5.137 4.820 3.825 213 HA LYS 42 HA LYS 42 6.176 2.540 5.199 214 HB2 LYS 42 HB2 LYS 42 4.281 4.556 6.400 215 HB3 LYS 42 HB1 LYS 42 5.564 3.656 7.196 216 HG2 LYS 42 HG2 LYS 42 6.204 5.648 5.059 217 HG3 LYS 42 HG1 LYS 42 5.891 6.163 6.717 218 HD2 LYS 42 HD2 LYS 42 7.709 4.832 7.536 219 HD3 LYS 42 HD1 LYS 42 7.949 4.096 5.951 220 HE2 LYS 42 HE2 LYS 42 9.006 5.928 5.114 221 HE3 LYS 42 HE1 LYS 42 8.075 7.052 6.097 222 HZ1 LYS 42 HZ1 LYS 42 10.447 6.901 6.713 223 HZ2 LYS 42 HZ2 LYS 42 10.203 5.289 7.171 224 HZ3 LYS 42 HZ3 LYS 42 9.396 6.537 7.988 225 H LEU 43 HN LEU 43 3.033 3.668 4.188 226 HA LEU 43 HA LEU 43 1.398 1.857 5.587 227 HB2 LEU 43 HB2 LEU 43 0.579 3.903 4.482 228 HB3 LEU 43 HB1 LEU 43 0.943 3.210 2.917 229 HG LEU 43 HG LEU 43 -0.933 1.688 4.646 230 HD11 LEU 43 HD11 LEU 43 -2.815 3.098 3.957 231 HD12 LEU 43 HD12 LEU 43 -1.686 4.254 3.251 232 HD13 LEU 43 HD13 LEU 43 -1.688 3.974 4.992 233 HD21 LEU 43 HD21 LEU 43 -0.913 2.388 1.705 234 HD22 LEU 43 HD22 LEU 43 -2.008 1.258 2.501 235 HD23 LEU 43 HD23 LEU 43 -0.285 0.898 2.412 236 H MET 44 HN MET 44 2.814 1.735 2.339 237 HA MET 44 HA MET 44 1.714 -0.722 1.549 238 HB2 MET 44 HB2 MET 44 4.274 0.642 0.704 239 HB3 MET 44 HB1 MET 44 3.624 -0.788 -0.080 240 HG2 MET 44 HG2 MET 44 1.527 0.534 -0.510 241 HG3 MET 44 HG1 MET 44 2.414 1.955 0.032 242 HE1 MET 44 HE1 MET 44 4.325 3.120 -1.287 243 HE2 MET 44 HE2 MET 44 5.165 2.385 -2.652 244 HE3 MET 44 HE3 MET 44 5.286 1.661 -1.047 245 H LYS 45 HN LYS 45 4.798 0.023 3.130 246 HA LYS 45 HA LYS 45 5.731 -2.645 3.177 247 HB2 LYS 45 HB2 LYS 45 6.471 -0.268 4.890 248 HB3 LYS 45 HB1 LYS 45 7.324 -1.804 4.911 249 HG2 LYS 45 HG2 LYS 45 7.596 -1.424 2.370 250 HG3 LYS 45 HG1 LYS 45 7.211 0.253 2.749 251 HD2 LYS 45 HD2 LYS 45 9.445 -1.359 3.971 252 HD3 LYS 45 HD1 LYS 45 9.632 -0.138 2.714 253 HE2 LYS 45 HE2 LYS 45 8.756 1.561 4.240 254 HE3 LYS 45 HE1 LYS 45 8.567 0.339 5.494 255 HZ1 LYS 45 HZ1 LYS 45 10.582 1.533 5.872 256 HZ2 LYS 45 HZ2 LYS 45 11.116 1.267 4.288 257 HZ3 LYS 45 HZ3 LYS 45 10.992 -0.028 5.369 258 H ALA 46 HN ALA 46 3.769 -0.743 5.400 259 HA ALA 46 HA ALA 46 3.867 -2.476 7.605 260 HB1 ALA 46 HB1 ALA 46 2.994 -0.211 7.776 261 HB2 ALA 46 HB2 ALA 46 1.798 -1.377 8.340 262 HB3 ALA 46 HB3 ALA 46 1.629 -0.642 6.745 263 H TYR 47 HN TYR 47 1.637 -2.364 4.842 264 HA TYR 47 HA TYR 47 0.048 -4.557 5.711 265 HB2 TYR 47 HB2 TYR 47 -0.667 -2.840 4.017 266 HB3 TYR 47 HB1 TYR 47 0.444 -3.581 2.871 267 HD1 TYR 47 HD1 TYR 47 -0.333 -5.271 1.471 268 HD2 TYR 47 HD2 TYR 47 -2.449 -4.433 5.069 269 HE1 TYR 47 HE1 TYR 47 -2.081 -6.868 0.808 270 HE2 TYR 47 HE2 TYR 47 -4.201 -6.030 4.414 271 HH TYR 47 HH TYR 47 -5.087 -7.102 2.450 272 H CYS 48 HN CYS 48 2.901 -4.215 3.711 273 HA CYS 48 HA CYS 48 3.072 -6.815 2.691 274 HB2 CYS 48 HB2 CYS 48 4.449 -5.121 1.740 275 HB3 CYS 48 HB1 CYS 48 5.149 -4.713 3.301 276 HG CYS 48 HG CYS 48 6.531 -7.185 3.499 277 H GLU 49 HN GLU 49 4.316 -5.390 5.670 278 HA GLU 49 HA GLU 49 5.776 -7.568 6.639 279 HB2 GLU 49 HB2 GLU 49 4.411 -5.215 7.897 280 HB3 GLU 49 HB1 GLU 49 5.105 -6.461 8.923 281 HG2 GLU 49 HG2 GLU 49 6.699 -5.105 6.776 282 HG3 GLU 49 HG1 GLU 49 6.534 -4.427 8.397 283 H ARG 50 HN ARG 50 2.365 -6.756 6.911 284 HA ARG 50 HA ARG 50 1.718 -8.823 8.747 285 HB2 ARG 50 HB2 ARG 50 0.050 -7.130 6.903 286 HB3 ARG 50 HB1 ARG 50 -0.650 -8.347 7.967 287 HG2 ARG 50 HG2 ARG 50 0.199 -7.202 9.908 288 HG3 ARG 50 HG1 ARG 50 1.042 -6.034 8.888 289 HD2 ARG 50 HD2 ARG 50 -0.935 -5.029 8.192 290 HD3 ARG 50 HD1 ARG 50 -1.913 -6.423 8.650 291 HE ARG 50 HE ARG 50 -0.571 -4.928 10.773 292 HH11 ARG 50 HH11 ARG 50 -3.508 -5.771 9.051 293 HH12 ARG 50 HH12 ARG 50 -4.599 -5.118 10.334 294 HH21 ARG 50 HH21 ARG 50 -3.703 -4.230 12.244 295 HH22 ARG 50 HH22 ARG 50 -1.904 -4.133 12.449 296 H GLN 51 HN GLN 51 1.821 -8.629 5.251 297 HA GLN 51 HA GLN 51 0.443 -11.116 4.856 298 HB2 GLN 51 HB2 GLN 51 2.141 -9.459 2.986 299 HB3 GLN 51 HB1 GLN 51 1.233 -10.884 2.502 300 HG2 GLN 51 HG2 GLN 51 0.083 -8.333 3.606 301 HG3 GLN 51 HG1 GLN 51 0.044 -8.853 1.923 302 HE21 GLN 51 HE21 GLN 51 -1.375 -10.464 1.301 303 HE22 GLN 51 HE22 GLN 51 -2.670 -10.998 2.310 304 H GLY 52 HN GLY 52 3.764 -10.108 5.239 305 HA2 GLY 52 HA2 GLY 52 5.573 -11.453 5.842 306 HA3 GLY 52 HA1 GLY 52 4.574 -12.878 5.569 307 H LEU 53 HN LEU 53 5.048 -10.255 3.319 308 HA LEU 53 HA LEU 53 6.620 -12.032 1.579 309 HB2 LEU 53 HB2 LEU 53 4.413 -10.157 0.710 310 HB3 LEU 53 HB1 LEU 53 5.397 -11.148 -0.351 311 HG LEU 53 HG LEU 53 3.621 -12.338 1.768 312 HD11 LEU 53 HD11 LEU 53 1.995 -12.743 -0.032 313 HD12 LEU 53 HD12 LEU 53 2.968 -11.753 -1.117 314 HD13 LEU 53 HD13 LEU 53 2.209 -11.023 0.299 315 HD21 LEU 53 HD21 LEU 53 5.374 -13.791 0.915 316 HD22 LEU 53 HD22 LEU 53 4.867 -13.456 -0.741 317 HD23 LEU 53 HD23 LEU 53 3.793 -14.329 0.351 318 H SER 54 HN SER 54 6.713 -9.981 -0.493 319 HA SER 54 HA SER 54 8.378 -7.973 0.866 320 HB2 SER 54 HB2 SER 54 9.778 -9.597 -0.358 321 HB3 SER 54 HB1 SER 54 8.887 -9.248 -1.839 322 HG SER 54 HG SER 54 10.955 -7.913 -0.720 323 H MET 55 HN MET 55 8.305 -5.874 0.052 324 HA MET 55 HA MET 55 5.849 -5.041 -1.067 325 HB2 MET 55 HB2 MET 55 7.463 -3.721 0.429 326 HB3 MET 55 HB1 MET 55 8.371 -3.390 -1.038 327 HG2 MET 55 HG2 MET 55 6.164 -2.494 -1.978 328 HG3 MET 55 HG1 MET 55 5.605 -2.505 -0.307 329 HE1 MET 55 HE1 MET 55 7.694 -0.744 -3.009 330 HE2 MET 55 HE2 MET 55 8.997 -1.557 -2.143 331 HE3 MET 55 HE3 MET 55 8.869 0.201 -2.095 332 H ARG 56 HN ARG 56 8.716 -6.203 -2.455 333 HA ARG 56 HA ARG 56 8.424 -4.889 -5.004 334 HB2 ARG 56 HB2 ARG 56 10.585 -5.780 -3.857 335 HB3 ARG 56 HB1 ARG 56 10.097 -7.335 -4.514 336 HG2 ARG 56 HG2 ARG 56 10.260 -6.533 -6.749 337 HG3 ARG 56 HG1 ARG 56 10.478 -4.870 -6.195 338 HD2 ARG 56 HD2 ARG 56 12.580 -5.578 -5.084 339 HD3 ARG 56 HD1 ARG 56 12.377 -7.178 -5.791 340 HE ARG 56 HE ARG 56 12.310 -5.646 -7.970 341 HH11 ARG 56 HH11 ARG 56 15.873 -4.999 -6.149 342 HH12 ARG 56 HH12 ARG 56 14.468 -5.595 -5.190 343 HH21 ARG 56 HH21 ARG 56 15.646 -4.598 -8.401 344 HH22 ARG 56 HH22 ARG 56 14.052 -4.858 -9.211 345 H GLN 57 HN GLN 57 6.902 -7.461 -3.479 346 HA GLN 57 HA GLN 57 6.389 -8.949 -5.943 347 HB2 GLN 57 HB2 GLN 57 6.963 -10.250 -3.969 348 HB3 GLN 57 HB1 GLN 57 5.644 -9.515 -3.067 349 HG2 GLN 57 HG2 GLN 57 4.047 -10.546 -4.649 350 HG3 GLN 57 HG1 GLN 57 5.401 -11.358 -5.434 351 HE21 GLN 57 HE21 GLN 57 3.103 -12.522 -4.120 352 HE22 GLN 57 HE22 GLN 57 3.723 -13.519 -2.850 353 H ILE 58 HN ILE 58 4.702 -7.021 -3.516 354 HA ILE 58 HA ILE 58 2.204 -7.347 -5.003 355 HB ILE 58 HB ILE 58 1.198 -6.083 -3.060 356 HG12 ILE 58 HG12 ILE 58 3.925 -6.631 -1.860 357 HG13 ILE 58 HG11 ILE 58 3.246 -5.044 -2.205 358 HG21 ILE 58 HG21 ILE 58 1.018 -8.504 -3.313 359 HG22 ILE 58 HG22 ILE 58 1.157 -8.049 -1.616 360 HG23 ILE 58 HG23 ILE 58 2.552 -8.710 -2.467 361 HD11 ILE 58 HD11 ILE 58 2.271 -7.030 -0.166 362 HD12 ILE 58 HD12 ILE 58 1.450 -5.521 -0.566 363 HD13 ILE 58 HD13 ILE 58 3.064 -5.485 0.139 364 H ARG 59 HN ARG 59 0.855 -5.457 -5.399 365 HA ARG 59 HA ARG 59 2.380 -2.969 -5.790 366 HB2 ARG 59 HB2 ARG 59 0.542 -4.287 -7.805 367 HB3 ARG 59 HB1 ARG 59 1.181 -2.658 -7.963 368 HG2 ARG 59 HG2 ARG 59 2.856 -5.156 -7.816 369 HG3 ARG 59 HG1 ARG 59 2.397 -4.328 -9.306 370 HD2 ARG 59 HD2 ARG 59 3.556 -2.306 -8.521 371 HD3 ARG 59 HD1 ARG 59 4.038 -3.163 -7.057 372 HE ARG 59 HE ARG 59 5.128 -3.498 -9.732 373 HH11 ARG 59 HH11 ARG 59 6.400 -5.711 -6.585 374 HH12 ARG 59 HH12 ARG 59 4.922 -4.687 -6.417 375 HH21 ARG 59 HH21 ARG 59 7.023 -4.753 -9.957 376 HH22 ARG 59 HH22 ARG 59 7.593 -5.724 -8.546 377 H PHE 60 HN PHE 60 1.276 -1.129 -5.291 378 HA PHE 60 HA PHE 60 -1.491 -1.491 -4.356 379 HB2 PHE 60 HB2 PHE 60 0.664 0.446 -3.512 380 HB3 PHE 60 HB1 PHE 60 -1.026 0.655 -3.067 381 HD1 PHE 60 HD1 PHE 60 1.697 -1.881 -2.923 382 HD2 PHE 60 HD2 PHE 60 -1.783 -0.256 -1.096 383 HE1 PHE 60 HE1 PHE 60 2.031 -3.355 -0.983 384 HE2 PHE 60 HE2 PHE 60 -1.456 -1.727 0.848 385 HZ PHE 60 HZ PHE 60 0.452 -3.280 0.904 386 H ARG 61 HN ARG 61 -3.087 -0.418 -5.322 387 HA ARG 61 HA ARG 61 -2.382 1.782 -7.156 388 HB2 ARG 61 HB2 ARG 61 -4.376 -0.439 -7.595 389 HB3 ARG 61 HB1 ARG 61 -4.288 1.004 -8.591 390 HG2 ARG 61 HG2 ARG 61 -1.970 0.390 -9.198 391 HG3 ARG 61 HG1 ARG 61 -2.162 -1.103 -8.274 392 HD2 ARG 61 HD2 ARG 61 -4.146 -1.629 -9.703 393 HD3 ARG 61 HD1 ARG 61 -3.731 -0.235 -10.699 394 HE ARG 61 HE ARG 61 -1.445 -1.647 -10.718 395 HH11 ARG 61 HH11 ARG 61 -4.400 -3.846 -12.404 396 HH12 ARG 61 HH12 ARG 61 -4.800 -2.515 -11.256 397 HH21 ARG 61 HH21 ARG 61 -0.876 -3.329 -12.197 398 HH22 ARG 61 HH22 ARG 61 -2.210 -4.280 -12.958 399 H PHE 62 HN PHE 62 -3.757 3.479 -7.276 400 HA PHE 62 HA PHE 62 -6.176 3.443 -5.614 401 HB2 PHE 62 HB2 PHE 62 -4.523 4.554 -4.232 402 HB3 PHE 62 HB1 PHE 62 -4.010 5.562 -5.581 403 HD1 PHE 62 HD1 PHE 62 -7.046 4.784 -3.555 404 HD2 PHE 62 HD2 PHE 62 -4.864 7.693 -5.775 405 HE1 PHE 62 HE1 PHE 62 -8.672 6.508 -2.897 406 HE2 PHE 62 HE2 PHE 62 -6.490 9.417 -5.118 407 HZ PHE 62 HZ PHE 62 -8.400 8.826 -3.680 408 H ASP 63 HN ASP 63 -7.820 3.878 -6.906 409 HA ASP 63 HA ASP 63 -9.121 4.744 -8.562 410 HB2 ASP 63 HB2 ASP 63 -8.260 6.905 -7.457 411 HB3 ASP 63 HB1 ASP 63 -7.152 7.017 -8.817 412 H GLY 64 HN GLY 64 -6.875 2.958 -9.156 413 HA2 GLY 64 HA2 GLY 64 -6.376 1.895 -11.185 414 HA3 GLY 64 HA1 GLY 64 -6.846 3.355 -12.044 415 H GLN 65 HN GLN 65 -5.047 4.787 -9.955 416 HA GLN 65 HA GLN 65 -2.641 4.570 -11.595 417 HB2 GLN 65 HB2 GLN 65 -3.456 6.593 -9.503 418 HB3 GLN 65 HB1 GLN 65 -1.958 6.650 -10.419 419 HG2 GLN 65 HG2 GLN 65 -4.750 6.892 -11.517 420 HG3 GLN 65 HG1 GLN 65 -3.555 8.180 -11.360 421 HE21 GLN 65 HE21 GLN 65 -1.661 8.067 -12.656 422 HE22 GLN 65 HE22 GLN 65 -1.688 7.230 -14.176 423 HA PRO 66 HA PRO 66 -0.536 2.315 -8.401 424 HB2 PRO 66 HB2 PRO 66 2.006 2.632 -9.293 425 HB3 PRO 66 HB1 PRO 66 0.853 1.535 -10.064 426 HG2 PRO 66 HG2 PRO 66 1.693 4.267 -10.901 427 HG3 PRO 66 HG1 PRO 66 1.369 2.832 -11.894 428 HD2 PRO 66 HD2 PRO 66 -0.412 4.872 -11.589 429 HD3 PRO 66 HD1 PRO 66 -0.885 3.197 -11.929 430 H ILE 67 HN ILE 67 0.648 2.718 -6.534 431 HA ILE 67 HA ILE 67 1.015 5.553 -5.912 432 HB ILE 67 HB ILE 67 1.038 3.144 -4.083 433 HG12 ILE 67 HG12 ILE 67 -1.087 5.254 -4.518 434 HG13 ILE 67 HG11 ILE 67 -1.159 3.607 -5.134 435 HG21 ILE 67 HG21 ILE 67 1.027 6.090 -3.429 436 HG22 ILE 67 HG22 ILE 67 2.370 4.975 -3.183 437 HG23 ILE 67 HG23 ILE 67 0.880 4.777 -2.261 438 HD11 ILE 67 HD11 ILE 67 -1.065 4.365 -2.223 439 HD12 ILE 67 HD12 ILE 67 -1.233 2.737 -2.875 440 HD13 ILE 67 HD13 ILE 67 -2.517 3.922 -3.119 441 H ASN 68 HN ASN 68 2.947 6.459 -5.373 442 HA ASN 68 HA ASN 68 5.338 4.830 -5.867 443 HB2 ASN 68 HB2 ASN 68 5.050 7.838 -5.613 444 HB3 ASN 68 HB1 ASN 68 6.524 6.982 -6.049 445 HD21 ASN 68 HD21 ASN 68 3.331 7.918 -7.073 446 HD22 ASN 68 HD22 ASN 68 3.571 7.612 -8.768 447 H GLU 69 HN GLU 69 7.296 5.587 -4.478 448 HA GLU 69 HA GLU 69 6.530 5.169 -1.717 449 HB2 GLU 69 HB2 GLU 69 9.236 5.392 -3.045 450 HB3 GLU 69 HB1 GLU 69 8.997 5.060 -1.337 451 HG2 GLU 69 HG2 GLU 69 8.285 2.929 -1.700 452 HG3 GLU 69 HG1 GLU 69 7.624 3.305 -3.291 453 H THR 70 HN THR 70 6.492 7.802 -3.502 454 HA THR 70 HA THR 70 7.455 9.556 -1.343 455 HB THR 70 HB THR 70 7.325 11.089 -3.680 456 HG1 THR 70 HG1 THR 70 8.618 9.873 -5.133 457 HG21 THR 70 HG21 THR 70 8.948 11.389 -1.910 458 HG22 THR 70 HG22 THR 70 9.789 11.151 -3.442 459 HG23 THR 70 HG23 THR 70 9.683 9.828 -2.280 460 H ASP 71 HN ASP 71 4.754 8.308 -2.367 461 HA ASP 71 HA ASP 71 3.211 10.761 -2.692 462 HB2 ASP 71 HB2 ASP 71 2.578 7.846 -3.072 463 HB3 ASP 71 HB1 ASP 71 1.287 9.032 -2.933 464 H THR 72 HN THR 72 1.542 11.348 -1.346 465 HA THR 72 HA THR 72 1.319 9.958 1.236 466 HB THR 72 HB THR 72 0.867 12.381 2.136 467 HG1 THR 72 HG1 THR 72 2.538 13.736 0.838 468 HG21 THR 72 HG21 THR 72 3.639 11.407 1.451 469 HG22 THR 72 HG22 THR 72 2.723 11.041 2.913 470 HG23 THR 72 HG23 THR 72 3.282 12.687 2.611 471 HA PRO 73 HA PRO 73 -3.088 10.010 0.742 472 HB2 PRO 73 HB2 PRO 73 -3.312 11.599 3.254 473 HB3 PRO 73 HB1 PRO 73 -4.091 10.073 2.813 474 HG2 PRO 73 HG2 PRO 73 -2.075 10.088 4.530 475 HG3 PRO 73 HG1 PRO 73 -2.232 8.798 3.319 476 HD2 PRO 73 HD2 PRO 73 -0.373 11.128 3.366 477 HD3 PRO 73 HD1 PRO 73 -0.103 9.475 2.780 478 H ALA 74 HN ALA 74 -1.794 13.083 1.973 479 HA ALA 74 HA ALA 74 -3.880 14.671 0.855 480 HB1 ALA 74 HB1 ALA 74 -2.518 16.573 1.519 481 HB2 ALA 74 HB2 ALA 74 -1.149 15.503 1.824 482 HB3 ALA 74 HB3 ALA 74 -2.602 15.382 2.816 483 H GLN 75 HN GLN 75 -0.797 13.519 -0.284 484 HA GLN 75 HA GLN 75 -0.478 15.365 -2.417 485 HB2 GLN 75 HB2 GLN 75 1.257 13.766 -1.346 486 HB3 GLN 75 HB1 GLN 75 0.609 12.568 -2.458 487 HG2 GLN 75 HG2 GLN 75 2.493 13.473 -3.520 488 HG3 GLN 75 HG1 GLN 75 1.098 14.208 -4.310 489 HE21 GLN 75 HE21 GLN 75 2.240 15.983 -5.008 490 HE22 GLN 75 HE22 GLN 75 2.791 17.219 -3.930 491 H LEU 76 HN LEU 76 -1.911 12.136 -2.191 492 HA LEU 76 HA LEU 76 -2.620 12.180 -5.009 493 HB2 LEU 76 HB2 LEU 76 -3.048 10.144 -2.829 494 HB3 LEU 76 HB1 LEU 76 -3.663 9.948 -4.460 495 HG LEU 76 HG LEU 76 -0.749 10.163 -3.685 496 HD11 LEU 76 HD11 LEU 76 -2.365 7.822 -4.686 497 HD12 LEU 76 HD12 LEU 76 -1.776 8.043 -3.038 498 HD13 LEU 76 HD13 LEU 76 -0.632 7.826 -4.363 499 HD21 LEU 76 HD21 LEU 76 -1.082 11.142 -5.863 500 HD22 LEU 76 HD22 LEU 76 -2.072 9.775 -6.371 501 HD23 LEU 76 HD23 LEU 76 -0.351 9.550 -6.060 502 H GLU 77 HN GLU 77 -3.871 13.744 -2.516 503 HA GLU 77 HA GLU 77 -5.891 14.628 -1.962 504 HB2 GLU 77 HB2 GLU 77 -6.428 13.863 -4.831 505 HB3 GLU 77 HB1 GLU 77 -7.586 14.752 -3.850 506 HG2 GLU 77 HG2 GLU 77 -4.825 15.814 -4.006 507 HG3 GLU 77 HG1 GLU 77 -5.841 15.955 -5.440 508 H MET 78 HN MET 78 -5.492 12.074 -1.056 509 HA MET 78 HA MET 78 -7.861 10.478 -1.596 510 HB2 MET 78 HB2 MET 78 -5.645 10.013 0.416 511 HB3 MET 78 HB1 MET 78 -6.868 8.848 -0.077 512 HG2 MET 78 HG2 MET 78 -5.940 8.640 -2.233 513 HG3 MET 78 HG1 MET 78 -4.917 10.058 -2.010 514 HE1 MET 78 HE1 MET 78 -4.237 5.901 -0.156 515 HE2 MET 78 HE2 MET 78 -5.383 6.262 -1.446 516 HE3 MET 78 HE3 MET 78 -5.683 6.852 0.189 517 H GLU 79 HN GLU 79 -9.462 10.010 -0.086 518 HA GLU 79 HA GLU 79 -9.543 11.830 2.234 519 HB2 GLU 79 HB2 GLU 79 -11.644 11.104 0.229 520 HB3 GLU 79 HB1 GLU 79 -12.126 11.508 1.872 521 HG2 GLU 79 HG2 GLU 79 -10.389 13.304 0.208 522 HG3 GLU 79 HG1 GLU 79 -12.150 13.387 0.187 523 H ASP 80 HN ASP 80 -11.525 10.939 3.691 524 HA ASP 80 HA ASP 80 -10.534 8.523 4.800 525 HB2 ASP 80 HB2 ASP 80 -12.837 10.333 5.403 526 HB3 ASP 80 HB1 ASP 80 -12.795 8.735 6.136 527 H GLU 81 HN GLU 81 -11.401 6.516 4.876 528 HA GLU 81 HA GLU 81 -12.579 4.681 4.314 529 HB2 GLU 81 HB2 GLU 81 -14.602 6.634 3.221 530 HB3 GLU 81 HB1 GLU 81 -14.845 4.897 3.308 531 HG2 GLU 81 HG2 GLU 81 -14.098 5.520 5.865 532 HG3 GLU 81 HG1 GLU 81 -15.051 6.922 5.387 533 H ASP 82 HN ASP 82 -10.856 6.413 2.328 534 HA ASP 82 HA ASP 82 -11.691 5.425 -0.231 535 HB2 ASP 82 HB2 ASP 82 -9.586 7.164 0.791 536 HB3 ASP 82 HB1 ASP 82 -9.005 6.090 -0.480 537 H THR 83 HN THR 83 -11.146 3.550 -1.209 538 HA THR 83 HA THR 83 -9.553 1.696 0.398 539 HB THR 83 HB THR 83 -11.261 0.966 -1.970 540 HG1 THR 83 HG1 THR 83 -12.367 2.090 -0.107 541 HG21 THR 83 HG21 THR 83 -11.287 -1.235 -0.884 542 HG22 THR 83 HG22 THR 83 -10.264 -0.607 0.406 543 HG23 THR 83 HG23 THR 83 -9.639 -0.714 -1.239 544 H ILE 84 HN ILE 84 -7.639 1.030 -0.169 545 HA ILE 84 HA ILE 84 -6.563 1.701 -2.809 546 HB ILE 84 HB ILE 84 -5.105 0.597 -0.397 547 HG12 ILE 84 HG12 ILE 84 -5.267 3.478 -1.311 548 HG13 ILE 84 HG11 ILE 84 -6.164 2.814 0.049 549 HG21 ILE 84 HG21 ILE 84 -3.910 0.204 -2.445 550 HG22 ILE 84 HG22 ILE 84 -3.105 1.490 -1.545 551 HG23 ILE 84 HG23 ILE 84 -4.118 1.888 -2.935 552 HD11 ILE 84 HD11 ILE 84 -3.171 3.036 -0.190 553 HD12 ILE 84 HD12 ILE 84 -4.023 2.269 1.151 554 HD13 ILE 84 HD13 ILE 84 -4.229 3.993 0.849 555 H ASP 85 HN ASP 85 -6.016 0.123 -4.272 556 HA ASP 85 HA ASP 85 -6.886 -2.590 -3.610 557 HB2 ASP 85 HB2 ASP 85 -6.368 -1.158 -6.205 558 HB3 ASP 85 HB1 ASP 85 -6.542 -2.908 -6.140 559 H VAL 86 HN VAL 86 -5.542 -4.243 -3.368 560 HA VAL 86 HA VAL 86 -2.686 -3.789 -3.904 561 HB VAL 86 HB VAL 86 -3.883 -5.861 -2.056 562 HG11 VAL 86 HG11 VAL 86 -1.597 -5.996 -1.162 563 HG12 VAL 86 HG12 VAL 86 -1.060 -4.849 -2.388 564 HG13 VAL 86 HG13 VAL 86 -1.667 -6.434 -2.868 565 HG21 VAL 86 HG21 VAL 86 -3.249 -4.413 -0.208 566 HG22 VAL 86 HG22 VAL 86 -4.400 -3.595 -1.266 567 HG23 VAL 86 HG23 VAL 86 -2.687 -3.185 -1.343 568 H PHE 87 HN PHE 87 -1.907 -4.779 -5.626 569 HA PHE 87 HA PHE 87 -3.187 -7.279 -6.525 570 HB2 PHE 87 HB2 PHE 87 -1.756 -5.123 -8.088 571 HB3 PHE 87 HB1 PHE 87 -2.146 -6.700 -8.769 572 HD1 PHE 87 HD1 PHE 87 -4.409 -7.301 -9.316 573 HD2 PHE 87 HD2 PHE 87 -3.508 -3.520 -7.587 574 HE1 PHE 87 HE1 PHE 87 -6.651 -6.491 -9.920 575 HE2 PHE 87 HE2 PHE 87 -5.746 -2.706 -8.189 576 HZ PHE 87 HZ PHE 87 -7.323 -4.190 -9.357 577 H GLN 88 HN GLN 88 -1.594 -8.706 -7.796 578 HA GLN 88 HA GLN 88 0.985 -8.713 -6.374 579 HB2 GLN 88 HB2 GLN 88 -0.742 -11.039 -7.224 580 HB3 GLN 88 HB1 GLN 88 0.926 -11.215 -6.694 581 HG2 GLN 88 HG2 GLN 88 -0.206 -9.725 -4.684 582 HG3 GLN 88 HG1 GLN 88 -1.501 -10.829 -5.141 583 HE21 GLN 88 HE21 GLN 88 -1.341 -11.917 -3.173 584 HE22 GLN 88 HE22 GLN 88 -0.037 -12.994 -2.824 585 H GLN 89 HN GLN 89 2.818 -9.107 -7.530 586 HA GLN 89 HA GLN 89 2.786 -8.442 -10.277 587 HB2 GLN 89 HB2 GLN 89 4.657 -8.018 -8.630 588 HB3 GLN 89 HB1 GLN 89 5.066 -9.722 -8.765 589 HG2 GLN 89 HG2 GLN 89 6.457 -8.240 -10.176 590 HG3 GLN 89 HG1 GLN 89 5.596 -9.486 -11.080 591 HE21 GLN 89 HE21 GLN 89 5.698 -8.356 -12.991 592 HE22 GLN 89 HE22 GLN 89 4.754 -6.936 -13.287 593 H GLN 90 HN GLN 90 3.026 -9.654 -12.084 594 HA GLN 90 HA GLN 90 2.062 -12.301 -12.089 595 HB2 GLN 90 HB2 GLN 90 3.440 -10.643 -14.203 596 HB3 GLN 90 HB1 GLN 90 2.820 -12.256 -14.510 597 HG2 GLN 90 HG2 GLN 90 1.171 -10.776 -15.284 598 HG3 GLN 90 HG1 GLN 90 0.570 -11.408 -13.754 599 HE21 GLN 90 HE21 GLN 90 -0.806 -9.641 -13.499 600 HE22 GLN 90 HE22 GLN 90 -0.216 -8.082 -13.052 601 H THR 91 HN THR 91 3.074 -14.244 -12.242 602 HA THR 91 HA THR 91 5.797 -14.381 -11.359 603 HB THR 91 HB THR 91 4.350 -16.808 -12.301 604 HG1 THR 91 HG1 THR 91 3.088 -16.762 -10.359 605 HG21 THR 91 HG21 THR 91 5.882 -16.193 -9.769 606 HG22 THR 91 HG22 THR 91 6.575 -16.924 -11.215 607 HG23 THR 91 HG23 THR 91 5.329 -17.779 -10.306 608 H GLY 92 HN GLY 92 4.347 -14.162 -14.399 609 HA2 GLY 92 HA2 GLY 92 5.656 -13.911 -16.375 610 HA3 GLY 92 HA1 GLY 92 6.867 -14.974 -15.669 611 H ASN 357 HT1 ASN 357 -15.133 -11.547 7.193 612 HA ASN 357 HA ASN 357 -13.091 -10.061 5.667 613 HB2 ASN 357 HB2 ASN 357 -14.788 -8.150 6.036 614 HB3 ASN 357 HB1 ASN 357 -15.124 -9.314 4.765 615 HD21 ASN 357 HD21 ASN 357 -17.319 -8.620 4.899 616 HD22 ASN 357 HD22 ASN 357 -18.357 -9.219 6.149 617 H ASN 358 HN ASN 358 -11.655 -9.073 6.925 618 HA ASN 358 HA ASN 358 -12.404 -8.625 9.722 619 HB2 ASN 358 HB2 ASN 358 -9.971 -8.942 10.270 620 HB3 ASN 358 HB1 ASN 358 -10.779 -10.388 9.685 621 HD21 ASN 358 HD21 ASN 358 -8.026 -10.062 9.688 622 HD22 ASN 358 HD22 ASN 358 -7.461 -10.030 8.055 623 H ARG 359 HN ARG 359 -12.319 -6.616 10.480 624 HA ARG 359 HA ARG 359 -10.715 -4.683 8.931 625 HB2 ARG 359 HB2 ARG 359 -12.395 -2.960 9.831 626 HB3 ARG 359 HB1 ARG 359 -12.959 -4.033 8.557 627 HG2 ARG 359 HG2 ARG 359 -14.648 -4.693 9.835 628 HG3 ARG 359 HG1 ARG 359 -13.525 -5.232 11.084 629 HD2 ARG 359 HD2 ARG 359 -15.015 -3.647 12.074 630 HD3 ARG 359 HD1 ARG 359 -13.440 -2.877 11.915 631 HE ARG 359 HE ARG 359 -15.791 -2.336 10.225 632 HH11 ARG 359 HH11 ARG 359 -12.679 -1.415 11.591 633 HH12 ARG 359 HH12 ARG 359 -12.712 0.238 10.862 634 HH21 ARG 359 HH21 ARG 359 -15.903 -0.233 9.327 635 HH22 ARG 359 HH22 ARG 359 -14.529 0.909 9.606 636 H ASP 360 HN ASP 360 -9.058 -4.011 10.012 637 HA ASP 360 HA ASP 360 -9.236 -3.504 12.877 638 HB2 ASP 360 HB2 ASP 360 -7.372 -4.695 13.452 639 HB3 ASP 360 HB1 ASP 360 -7.952 -5.683 12.120 640 HA PRO 361 HA PRO 361 -7.305 0.206 11.389 641 HB2 PRO 361 HB2 PRO 361 -7.575 1.701 13.596 642 HB3 PRO 361 HB1 PRO 361 -8.994 1.127 12.709 643 HG2 PRO 361 HG2 PRO 361 -7.957 0.250 15.319 644 HG3 PRO 361 HG1 PRO 361 -9.594 0.121 14.656 645 HD2 PRO 361 HD2 PRO 361 -7.534 -1.903 14.725 646 HD3 PRO 361 HD1 PRO 361 -9.204 -2.041 14.137 647 H ILE 362 HN ILE 362 -5.307 0.784 11.113 648 HA ILE 362 HA ILE 362 -3.270 0.302 13.194 649 HB ILE 362 HB ILE 362 -2.584 0.510 10.287 650 HG12 ILE 362 HG12 ILE 362 -3.147 -2.203 11.430 651 HG13 ILE 362 HG11 ILE 362 -4.497 -1.242 10.834 652 HG21 ILE 362 HG21 ILE 362 -1.360 -1.100 12.520 653 HG22 ILE 362 HG22 ILE 362 -0.795 0.478 11.972 654 HG23 ILE 362 HG23 ILE 362 -0.719 -0.912 10.889 655 HD11 ILE 362 HD11 ILE 362 -2.070 -2.049 9.257 656 HD12 ILE 362 HD12 ILE 362 -3.407 -1.072 8.654 657 HD13 ILE 362 HD13 ILE 362 -3.680 -2.752 9.122 658 H VAL 363 HN VAL 363 -2.096 2.035 13.875 659 HA VAL 363 HA VAL 363 -2.277 4.488 12.230 660 HB VAL 363 HB VAL 363 -1.817 4.393 15.216 661 HG11 VAL 363 HG11 VAL 363 -0.922 6.366 14.119 662 HG12 VAL 363 HG12 VAL 363 -2.299 6.783 15.139 663 HG13 VAL 363 HG13 VAL 363 -2.493 6.693 13.389 664 HG21 VAL 363 HG21 VAL 363 -4.081 4.979 15.605 665 HG22 VAL 363 HG22 VAL 363 -4.095 3.566 14.555 666 HG23 VAL 363 HG23 VAL 363 -4.400 5.165 13.877 667 H ILE 364 HN ILE 364 -0.426 5.153 11.425 668 HA ILE 364 HA ILE 364 2.043 4.489 12.860 669 HB ILE 364 HB ILE 364 1.706 3.161 10.690 670 HG12 ILE 364 HG12 ILE 364 4.243 4.759 10.703 671 HG13 ILE 364 HG11 ILE 364 3.860 3.678 12.038 672 HG21 ILE 364 HG21 ILE 364 2.595 4.379 8.676 673 HG22 ILE 364 HG22 ILE 364 2.305 5.878 9.558 674 HG23 ILE 364 HG23 ILE 364 0.959 4.807 9.173 675 HD11 ILE 364 HD11 ILE 364 3.716 1.806 10.481 676 HD12 ILE 364 HD12 ILE 364 5.293 2.592 10.418 677 HD13 ILE 364 HD13 ILE 364 4.107 2.894 9.149 678 H SER 365 HN SER 365 3.375 6.115 13.258 679 HA SER 365 HA SER 365 2.796 8.701 11.962 680 HB2 SER 365 HB2 SER 365 3.741 8.202 14.809 681 HB3 SER 365 HB1 SER 365 3.434 9.780 14.081 682 HG SER 365 HG SER 365 1.324 8.094 13.771 683 H ASP 366 HN ASP 366 4.467 9.619 10.932 684 HA ASP 366 HA ASP 366 7.173 8.560 11.440 685 HB2 ASP 366 HB2 ASP 366 5.989 8.016 9.193 686 HB3 ASP 366 HB1 ASP 366 6.267 9.707 8.802 687 H SER 367 HN SER 367 8.718 10.029 11.938 688 HA SER 367 HA SER 367 7.945 12.867 11.820 689 HB2 SER 367 HB2 SER 367 10.176 11.728 13.502 690 HB3 SER 367 HB1 SER 367 9.311 13.249 13.709 691 HG SER 367 HG SER 367 7.812 10.905 13.796 692 HA PRO 368 HA PRO 368 11.117 13.507 8.790 693 HB2 PRO 368 HB2 PRO 368 11.472 16.176 9.054 694 HB3 PRO 368 HB1 PRO 368 10.021 15.479 8.319 695 HG2 PRO 368 HG2 PRO 368 10.403 16.535 11.079 696 HG3 PRO 368 HG1 PRO 368 9.022 16.726 9.986 697 HD2 PRO 368 HD2 PRO 368 9.065 14.933 12.031 698 HD3 PRO 368 HD1 PRO 368 8.129 14.699 10.542 Start of MODEL 11 1 H ASP 16 HT1 ASP 16 -7.252 15.516 11.448 2 HA ASP 16 HA ASP 16 -5.811 14.434 13.786 3 HB2 ASP 16 HB2 ASP 16 -8.646 13.929 12.851 4 HB3 ASP 16 HB1 ASP 16 -7.801 12.910 14.007 5 H HIS 17 HN HIS 17 -6.597 11.801 13.271 6 HA HIS 17 HA HIS 17 -4.836 11.185 11.080 7 HB2 HIS 17 HB2 HIS 17 -6.398 9.497 13.026 8 HB3 HIS 17 HB1 HIS 17 -5.527 8.784 11.676 9 HD2 HIS 17 HD2 HIS 17 -2.698 9.081 11.801 10 HE1 HIS 17 HE1 HIS 17 -2.754 9.884 15.954 11 HE2 HIS 17 HE2 HIS 17 -1.356 9.043 14.020 12 H ILE 18 HN ILE 18 -5.412 9.737 9.337 13 HA ILE 18 HA ILE 18 -8.204 10.089 8.450 14 HB ILE 18 HB ILE 18 -6.622 11.368 7.075 15 HG12 ILE 18 HG12 ILE 18 -7.702 8.951 5.614 16 HG13 ILE 18 HG11 ILE 18 -8.628 10.389 6.031 17 HG21 ILE 18 HG21 ILE 18 -4.946 10.233 5.689 18 HG22 ILE 18 HG22 ILE 18 -5.314 8.713 6.503 19 HG23 ILE 18 HG23 ILE 18 -4.615 10.053 7.412 20 HD11 ILE 18 HD11 ILE 18 -6.258 10.288 4.180 21 HD12 ILE 18 HD12 ILE 18 -7.176 11.734 4.604 22 HD13 ILE 18 HD13 ILE 18 -7.951 10.429 3.706 23 H ASN 19 HN ASN 19 -9.291 8.296 7.722 24 HA ASN 19 HA ASN 19 -7.979 5.733 8.241 25 HB2 ASN 19 HB2 ASN 19 -10.892 6.410 7.776 26 HB3 ASN 19 HB1 ASN 19 -10.279 4.798 8.127 27 HD21 ASN 19 HD21 ASN 19 -10.925 7.963 9.378 28 HD22 ASN 19 HD22 ASN 19 -10.742 7.552 11.056 29 H LEU 20 HN LEU 20 -7.320 4.445 6.682 30 HA LEU 20 HA LEU 20 -8.413 4.829 3.971 31 HB2 LEU 20 HB2 LEU 20 -5.599 4.058 4.759 32 HB3 LEU 20 HB1 LEU 20 -6.200 4.123 3.115 33 HG LEU 20 HG LEU 20 -6.000 6.496 4.972 34 HD11 LEU 20 HD11 LEU 20 -4.262 5.662 2.659 35 HD12 LEU 20 HD12 LEU 20 -3.802 5.689 4.362 36 HD13 LEU 20 HD13 LEU 20 -4.156 7.198 3.518 37 HD21 LEU 20 HD21 LEU 20 -6.785 6.232 2.080 38 HD22 LEU 20 HD22 LEU 20 -6.372 7.762 2.852 39 HD23 LEU 20 HD23 LEU 20 -7.767 6.839 3.414 40 H LYS 21 HN LYS 21 -9.280 3.063 3.054 41 HA LYS 21 HA LYS 21 -9.140 0.567 4.568 42 HB2 LYS 21 HB2 LYS 21 -10.957 1.426 2.314 43 HB3 LYS 21 HB1 LYS 21 -11.038 -0.133 3.120 44 HG2 LYS 21 HG2 LYS 21 -11.662 0.897 5.190 45 HG3 LYS 21 HG1 LYS 21 -11.395 2.508 4.515 46 HD2 LYS 21 HD2 LYS 21 -13.189 2.051 2.859 47 HD3 LYS 21 HD1 LYS 21 -13.501 0.515 3.672 48 HE2 LYS 21 HE2 LYS 21 -14.230 1.596 5.637 49 HE3 LYS 21 HE1 LYS 21 -13.581 3.149 5.118 50 HZ1 LYS 21 HZ1 LYS 21 -15.883 3.275 4.793 51 HZ2 LYS 21 HZ2 LYS 21 -15.967 1.735 4.091 52 HZ3 LYS 21 HZ3 LYS 21 -15.247 3.011 3.249 53 H VAL 22 HN VAL 22 -7.651 -0.840 4.009 54 HA VAL 22 HA VAL 22 -6.839 -1.018 1.187 55 HB VAL 22 HB VAL 22 -5.428 -2.047 3.661 56 HG11 VAL 22 HG11 VAL 22 -5.004 -3.470 1.730 57 HG12 VAL 22 HG12 VAL 22 -3.560 -2.557 2.163 58 HG13 VAL 22 HG13 VAL 22 -4.536 -2.063 0.779 59 HG21 VAL 22 HG21 VAL 22 -3.815 -0.300 3.290 60 HG22 VAL 22 HG22 VAL 22 -5.423 0.419 3.395 61 HG23 VAL 22 HG23 VAL 22 -4.649 0.210 1.824 62 H ALA 23 HN ALA 23 -8.066 -2.458 0.173 63 HA ALA 23 HA ALA 23 -8.923 -4.874 1.597 64 HB1 ALA 23 HB1 ALA 23 -10.584 -5.128 -0.153 65 HB2 ALA 23 HB2 ALA 23 -9.903 -3.757 -1.028 66 HB3 ALA 23 HB3 ALA 23 -10.674 -3.508 0.539 67 H GLY 24 HN GLY 24 -8.352 -6.875 0.961 68 HA2 GLY 24 HA2 GLY 24 -6.170 -7.070 -0.959 69 HA3 GLY 24 HA1 GLY 24 -6.726 -8.342 0.121 70 H GLN 25 HN GLN 25 -6.416 -9.570 -1.960 71 HA GLN 25 HA GLN 25 -8.555 -9.199 -3.902 72 HB2 GLN 25 HB2 GLN 25 -6.212 -11.109 -3.802 73 HB3 GLN 25 HB1 GLN 25 -7.408 -11.092 -5.092 74 HG2 GLN 25 HG2 GLN 25 -5.851 -8.633 -4.383 75 HG3 GLN 25 HG1 GLN 25 -5.190 -9.862 -5.458 76 HE21 GLN 25 HE21 GLN 25 -5.982 -7.052 -5.917 77 HE22 GLN 25 HE22 GLN 25 -7.115 -7.103 -7.225 78 H ASP 26 HN ASP 26 -8.299 -10.601 -0.992 79 HA ASP 26 HA ASP 26 -9.920 -12.956 -1.641 80 HB2 ASP 26 HB2 ASP 26 -9.498 -13.569 0.759 81 HB3 ASP 26 HB1 ASP 26 -8.042 -13.460 -0.227 82 H GLY 27 HN GLY 27 -9.945 -10.013 0.329 83 HA2 GLY 27 HA2 GLY 27 -12.402 -9.128 0.141 84 HA3 GLY 27 HA1 GLY 27 -12.712 -10.565 1.100 85 H SER 28 HN SER 28 -9.983 -10.110 2.414 86 HA SER 28 HA SER 28 -10.903 -8.821 4.726 87 HB2 SER 28 HB2 SER 28 -8.395 -8.675 5.274 88 HB3 SER 28 HB1 SER 28 -9.066 -10.281 5.000 89 HG SER 28 HG SER 28 -8.117 -10.360 3.018 90 H VAL 29 HN VAL 29 -10.782 -6.735 5.492 91 HA VAL 29 HA VAL 29 -9.498 -4.753 3.727 92 HB VAL 29 HB VAL 29 -12.215 -4.355 4.996 93 HG11 VAL 29 HG11 VAL 29 -12.253 -2.303 3.605 94 HG12 VAL 29 HG12 VAL 29 -10.571 -2.613 3.163 95 HG13 VAL 29 HG13 VAL 29 -11.000 -2.286 4.843 96 HG21 VAL 29 HG21 VAL 29 -13.049 -4.326 2.650 97 HG22 VAL 29 HG22 VAL 29 -12.468 -5.902 3.187 98 HG23 VAL 29 HG23 VAL 29 -11.468 -4.908 2.129 99 H VAL 30 HN VAL 30 -7.837 -4.185 5.016 100 HA VAL 30 HA VAL 30 -8.229 -3.836 7.862 101 HB VAL 30 HB VAL 30 -5.829 -3.212 7.923 102 HG11 VAL 30 HG11 VAL 30 -6.450 -5.770 6.451 103 HG12 VAL 30 HG12 VAL 30 -6.491 -5.533 8.198 104 HG13 VAL 30 HG13 VAL 30 -4.960 -5.429 7.331 105 HG21 VAL 30 HG21 VAL 30 -5.944 -3.733 4.957 106 HG22 VAL 30 HG22 VAL 30 -4.470 -3.498 5.898 107 HG23 VAL 30 HG23 VAL 30 -5.634 -2.181 5.737 108 H GLN 31 HN GLN 31 -7.960 -1.921 8.993 109 HA GLN 31 HA GLN 31 -8.631 0.486 7.453 110 HB2 GLN 31 HB2 GLN 31 -10.345 0.035 9.001 111 HB3 GLN 31 HB1 GLN 31 -9.213 -0.438 10.257 112 HG2 GLN 31 HG2 GLN 31 -8.508 1.921 10.451 113 HG3 GLN 31 HG1 GLN 31 -9.745 2.353 9.270 114 HE21 GLN 31 HE21 GLN 31 -10.587 3.711 10.980 115 HE22 GLN 31 HE22 GLN 31 -11.614 3.008 12.181 116 H PHE 32 HN PHE 32 -6.826 1.592 6.993 117 HA PHE 32 HA PHE 32 -4.648 1.690 8.929 118 HB2 PHE 32 HB2 PHE 32 -4.942 2.267 6.037 119 HB3 PHE 32 HB1 PHE 32 -3.758 3.230 6.916 120 HD1 PHE 32 HD1 PHE 32 -4.509 0.028 5.464 121 HD2 PHE 32 HD2 PHE 32 -1.912 2.078 8.136 122 HE1 PHE 32 HE1 PHE 32 -2.891 -1.819 5.304 123 HE2 PHE 32 HE2 PHE 32 -0.291 0.238 7.980 124 HZ PHE 32 HZ PHE 32 -0.779 -1.715 6.562 125 H LYS 33 HN LYS 33 -4.612 3.209 10.407 126 HA LYS 33 HA LYS 33 -5.947 5.772 9.832 127 HB2 LYS 33 HB2 LYS 33 -6.783 4.313 11.749 128 HB3 LYS 33 HB1 LYS 33 -5.263 4.667 12.559 129 HG2 LYS 33 HG2 LYS 33 -5.779 7.000 12.636 130 HG3 LYS 33 HG1 LYS 33 -7.222 6.760 11.646 131 HD2 LYS 33 HD2 LYS 33 -8.209 5.389 13.406 132 HD3 LYS 33 HD1 LYS 33 -6.760 5.591 14.392 133 HE2 LYS 33 HE2 LYS 33 -7.156 7.989 14.511 134 HE3 LYS 33 HE1 LYS 33 -8.566 7.824 13.462 135 HZ1 LYS 33 HZ1 LYS 33 -9.370 7.937 15.648 136 HZ2 LYS 33 HZ2 LYS 33 -8.231 6.835 16.233 137 HZ3 LYS 33 HZ3 LYS 33 -9.476 6.304 15.223 138 H ILE 34 HN ILE 34 -4.223 6.781 8.844 139 HA ILE 34 HA ILE 34 -1.850 7.257 10.536 140 HB ILE 34 HB ILE 34 -0.519 7.531 8.498 141 HG12 ILE 34 HG12 ILE 34 -2.971 6.584 6.996 142 HG13 ILE 34 HG11 ILE 34 -2.417 8.256 7.038 143 HG21 ILE 34 HG21 ILE 34 -0.343 5.214 7.889 144 HG22 ILE 34 HG22 ILE 34 -1.989 4.902 8.442 145 HG23 ILE 34 HG23 ILE 34 -0.733 5.315 9.607 146 HD11 ILE 34 HD11 ILE 34 -1.751 7.103 4.987 147 HD12 ILE 34 HD12 ILE 34 -0.850 5.928 5.946 148 HD13 ILE 34 HD13 ILE 34 -0.358 7.622 5.934 149 H LYS 35 HN LYS 35 -0.650 9.319 9.470 150 HA LYS 35 HA LYS 35 -2.614 11.457 9.702 151 HB2 LYS 35 HB2 LYS 35 0.410 11.502 9.522 152 HB3 LYS 35 HB1 LYS 35 -0.584 12.947 9.651 153 HG2 LYS 35 HG2 LYS 35 -1.410 12.201 11.820 154 HG3 LYS 35 HG1 LYS 35 -0.452 10.727 11.684 155 HD2 LYS 35 HD2 LYS 35 1.602 12.056 11.653 156 HD3 LYS 35 HD1 LYS 35 0.648 13.538 11.761 157 HE2 LYS 35 HE2 LYS 35 -0.234 12.787 13.932 158 HE3 LYS 35 HE1 LYS 35 0.763 11.338 13.823 159 HZ1 LYS 35 HZ1 LYS 35 2.729 12.671 13.917 160 HZ2 LYS 35 HZ2 LYS 35 1.731 13.126 15.205 161 HZ3 LYS 35 HZ3 LYS 35 1.838 14.103 13.833 162 H ARG 36 HN ARG 36 -2.718 13.198 8.094 163 HA ARG 36 HA ARG 36 -2.933 12.160 5.472 164 HB2 ARG 36 HB2 ARG 36 -3.135 14.949 6.575 165 HB3 ARG 36 HB1 ARG 36 -3.310 14.617 4.859 166 HG2 ARG 36 HG2 ARG 36 -5.139 13.006 5.457 167 HG3 ARG 36 HG1 ARG 36 -5.044 13.631 7.104 168 HD2 ARG 36 HD2 ARG 36 -6.752 14.892 6.147 169 HD3 ARG 36 HD1 ARG 36 -5.348 15.944 6.022 170 HE ARG 36 HE ARG 36 -5.214 15.387 3.687 171 HH11 ARG 36 HH11 ARG 36 -8.182 14.412 5.331 172 HH12 ARG 36 HH12 ARG 36 -9.135 14.320 3.796 173 HH21 ARG 36 HH21 ARG 36 -6.391 15.262 1.724 174 HH22 ARG 36 HH22 ARG 36 -8.131 14.771 1.790 175 H HIS 37 HN HIS 37 -0.250 13.445 7.128 176 HA HIS 37 HA HIS 37 1.120 13.987 4.591 177 HB2 HIS 37 HB2 HIS 37 2.815 15.187 5.905 178 HB3 HIS 37 HB1 HIS 37 1.208 15.849 6.165 179 HD2 HIS 37 HD2 HIS 37 0.294 15.798 8.742 180 HE1 HIS 37 HE1 HIS 37 3.712 13.921 10.378 181 HE2 HIS 37 HE2 HIS 37 1.664 15.320 10.888 182 H THR 38 HN THR 38 0.614 11.437 6.460 183 HA THR 38 HA THR 38 3.294 10.471 6.827 184 HB THR 38 HB THR 38 0.655 8.994 6.964 185 HG1 THR 38 HG1 THR 38 2.148 10.519 8.767 186 HG21 THR 38 HG21 THR 38 1.913 7.293 8.231 187 HG22 THR 38 HG22 THR 38 3.408 8.168 7.903 188 HG23 THR 38 HG23 THR 38 2.501 7.445 6.576 189 HA PRO 39 HA PRO 39 3.937 9.304 2.561 190 HB2 PRO 39 HB2 PRO 39 5.885 7.447 3.822 191 HB3 PRO 39 HB1 PRO 39 6.131 8.626 2.526 192 HG2 PRO 39 HG2 PRO 39 7.034 9.112 4.974 193 HG3 PRO 39 HG1 PRO 39 6.336 10.406 3.980 194 HD2 PRO 39 HD2 PRO 39 5.145 8.951 6.288 195 HD3 PRO 39 HD1 PRO 39 4.977 10.653 5.812 196 H LEU 40 HN LEU 40 2.745 7.929 1.432 197 HA LEU 40 HA LEU 40 1.413 5.716 2.586 198 HB2 LEU 40 HB2 LEU 40 1.827 6.545 -0.280 199 HB3 LEU 40 HB1 LEU 40 0.846 5.167 0.181 200 HG LEU 40 HG LEU 40 0.304 7.972 1.147 201 HD11 LEU 40 HD11 LEU 40 0.137 7.915 -1.279 202 HD12 LEU 40 HD12 LEU 40 -1.459 8.056 -0.543 203 HD13 LEU 40 HD13 LEU 40 -0.916 6.504 -1.184 204 HD21 LEU 40 HD21 LEU 40 -1.372 5.464 1.116 205 HD22 LEU 40 HD22 LEU 40 -1.911 7.053 1.657 206 HD23 LEU 40 HD23 LEU 40 -0.637 6.208 2.536 207 H SER 41 HN SER 41 4.518 6.098 1.224 208 HA SER 41 HA SER 41 5.097 3.572 0.224 209 HB2 SER 41 HB2 SER 41 7.327 4.747 1.677 210 HB3 SER 41 HB1 SER 41 7.121 4.521 -0.062 211 HG SER 41 HG SER 41 7.266 6.745 0.514 212 H LYS 42 HN LYS 42 5.217 4.827 3.523 213 HA LYS 42 HA LYS 42 6.274 2.408 4.642 214 HB2 LYS 42 HB2 LYS 42 4.863 4.627 6.126 215 HB3 LYS 42 HB1 LYS 42 6.032 3.478 6.769 216 HG2 LYS 42 HG2 LYS 42 7.600 4.553 4.960 217 HG3 LYS 42 HG1 LYS 42 6.467 5.899 5.096 218 HD2 LYS 42 HD2 LYS 42 6.914 6.123 7.436 219 HD3 LYS 42 HD1 LYS 42 7.859 4.632 7.448 220 HE2 LYS 42 HE2 LYS 42 9.396 5.752 5.778 221 HE3 LYS 42 HE1 LYS 42 8.542 7.252 6.138 222 HZ1 LYS 42 HZ1 LYS 42 10.635 6.857 7.422 223 HZ2 LYS 42 HZ2 LYS 42 9.843 5.601 8.220 224 HZ3 LYS 42 HZ3 LYS 42 9.270 7.193 8.369 225 H LEU 43 HN LEU 43 3.124 3.783 4.093 226 HA LEU 43 HA LEU 43 1.584 2.093 5.732 227 HB2 LEU 43 HB2 LEU 43 0.607 4.086 4.825 228 HB3 LEU 43 HB1 LEU 43 0.958 3.585 3.184 229 HG LEU 43 HG LEU 43 -0.790 1.723 4.619 230 HD11 LEU 43 HD11 LEU 43 -2.767 3.187 4.449 231 HD12 LEU 43 HD12 LEU 43 -1.704 4.543 4.075 232 HD13 LEU 43 HD13 LEU 43 -1.602 3.749 5.647 233 HD21 LEU 43 HD21 LEU 43 -1.034 3.192 1.996 234 HD22 LEU 43 HD22 LEU 43 -2.047 1.854 2.536 235 HD23 LEU 43 HD23 LEU 43 -0.333 1.589 2.219 236 H MET 44 HN MET 44 2.635 1.848 2.372 237 HA MET 44 HA MET 44 1.323 -0.565 1.752 238 HB2 MET 44 HB2 MET 44 3.872 0.610 0.620 239 HB3 MET 44 HB1 MET 44 3.012 -0.754 -0.077 240 HG2 MET 44 HG2 MET 44 1.022 0.730 -0.329 241 HG3 MET 44 HG1 MET 44 2.042 2.078 0.168 242 HE1 MET 44 HE1 MET 44 3.982 3.127 -1.355 243 HE2 MET 44 HE2 MET 44 4.666 2.251 -2.725 244 HE3 MET 44 HE3 MET 44 4.779 1.576 -1.098 245 H LYS 45 HN LYS 45 4.509 0.128 3.094 246 HA LYS 45 HA LYS 45 5.466 -2.525 3.086 247 HB2 LYS 45 HB2 LYS 45 6.237 -0.126 4.742 248 HB3 LYS 45 HB1 LYS 45 7.093 -1.661 4.807 249 HG2 LYS 45 HG2 LYS 45 7.572 -1.464 2.398 250 HG3 LYS 45 HG1 LYS 45 6.778 0.112 2.398 251 HD2 LYS 45 HD2 LYS 45 8.412 0.929 4.031 252 HD3 LYS 45 HD1 LYS 45 9.213 -0.644 4.010 253 HE2 LYS 45 HE2 LYS 45 9.613 -0.349 1.581 254 HE3 LYS 45 HE1 LYS 45 8.927 1.271 1.695 255 HZ1 LYS 45 HZ1 LYS 45 10.686 1.786 3.337 256 HZ2 LYS 45 HZ2 LYS 45 11.289 1.424 1.801 257 HZ3 LYS 45 HZ3 LYS 45 11.380 0.272 3.035 258 H ALA 46 HN ALA 46 3.712 -0.633 5.511 259 HA ALA 46 HA ALA 46 3.916 -2.396 7.662 260 HB1 ALA 46 HB1 ALA 46 3.029 -0.132 7.877 261 HB2 ALA 46 HB2 ALA 46 1.909 -1.318 8.543 262 HB3 ALA 46 HB3 ALA 46 1.597 -0.599 6.964 263 H TYR 47 HN TYR 47 1.547 -2.297 5.026 264 HA TYR 47 HA TYR 47 0.054 -4.530 6.004 265 HB2 TYR 47 HB2 TYR 47 -0.901 -2.793 4.493 266 HB3 TYR 47 HB1 TYR 47 0.135 -3.389 3.201 267 HD1 TYR 47 HD1 TYR 47 -0.758 -4.920 1.713 268 HD2 TYR 47 HD2 TYR 47 -2.427 -4.652 5.618 269 HE1 TYR 47 HE1 TYR 47 -2.484 -6.550 1.081 270 HE2 TYR 47 HE2 TYR 47 -4.158 -6.284 4.993 271 HH TYR 47 HH TYR 47 -5.251 -7.115 2.930 272 H CYS 48 HN CYS 48 2.658 -4.070 3.691 273 HA CYS 48 HA CYS 48 2.692 -6.648 2.587 274 HB2 CYS 48 HB2 CYS 48 3.867 -4.636 1.676 275 HB3 CYS 48 HB1 CYS 48 5.053 -4.800 2.968 276 HG CYS 48 HG CYS 48 6.052 -7.230 2.116 277 H GLU 49 HN GLU 49 4.517 -5.269 5.308 278 HA GLU 49 HA GLU 49 5.994 -7.590 5.914 279 HB2 GLU 49 HB2 GLU 49 5.172 -5.228 7.601 280 HB3 GLU 49 HB1 GLU 49 6.219 -6.505 8.200 281 HG2 GLU 49 HG2 GLU 49 6.800 -4.761 5.816 282 HG3 GLU 49 HG1 GLU 49 7.455 -4.522 7.435 283 H ARG 50 HN ARG 50 2.770 -6.578 6.704 284 HA ARG 50 HA ARG 50 2.279 -8.384 8.830 285 HB2 ARG 50 HB2 ARG 50 0.724 -6.574 7.128 286 HB3 ARG 50 HB1 ARG 50 -0.168 -7.986 7.674 287 HG2 ARG 50 HG2 ARG 50 0.461 -7.423 10.002 288 HG3 ARG 50 HG1 ARG 50 1.209 -5.940 9.394 289 HD2 ARG 50 HD2 ARG 50 -0.889 -5.166 8.532 290 HD3 ARG 50 HD1 ARG 50 -1.662 -6.702 8.916 291 HE ARG 50 HE ARG 50 -0.543 -5.236 11.159 292 HH11 ARG 50 HH11 ARG 50 -3.346 -6.076 9.222 293 HH12 ARG 50 HH12 ARG 50 -4.533 -5.491 10.455 294 HH21 ARG 50 HH21 ARG 50 -3.792 -4.645 12.435 295 HH22 ARG 50 HH22 ARG 50 -2.020 -4.525 12.785 296 H GLN 51 HN GLN 51 1.756 -8.545 5.336 297 HA GLN 51 HA GLN 51 0.597 -11.171 5.451 298 HB2 GLN 51 HB2 GLN 51 1.736 -9.802 3.013 299 HB3 GLN 51 HB1 GLN 51 0.537 -11.086 3.057 300 HG2 GLN 51 HG2 GLN 51 0.174 -8.232 3.933 301 HG3 GLN 51 HG1 GLN 51 -0.534 -9.012 2.523 302 HE21 GLN 51 HE21 GLN 51 -2.268 -10.399 2.789 303 HE22 GLN 51 HE22 GLN 51 -3.188 -10.463 4.250 304 H GLY 52 HN GLY 52 3.682 -9.976 5.741 305 HA2 GLY 52 HA2 GLY 52 5.717 -11.012 5.937 306 HA3 GLY 52 HA1 GLY 52 4.872 -12.549 5.810 307 H LEU 53 HN LEU 53 5.060 -9.882 3.483 308 HA LEU 53 HA LEU 53 6.502 -11.699 1.671 309 HB2 LEU 53 HB2 LEU 53 4.209 -9.867 0.960 310 HB3 LEU 53 HB1 LEU 53 5.188 -10.733 -0.204 311 HG LEU 53 HG LEU 53 3.504 -12.076 1.905 312 HD11 LEU 53 HD11 LEU 53 1.973 -12.611 0.056 313 HD12 LEU 53 HD12 LEU 53 2.922 -11.573 -1.009 314 HD13 LEU 53 HD13 LEU 53 2.068 -10.878 0.368 315 HD21 LEU 53 HD21 LEU 53 5.363 -13.439 1.168 316 HD22 LEU 53 HD22 LEU 53 4.948 -13.137 -0.520 317 HD23 LEU 53 HD23 LEU 53 3.856 -14.072 0.503 318 H SER 54 HN SER 54 7.299 -10.366 -0.304 319 HA SER 54 HA SER 54 8.881 -8.182 0.773 320 HB2 SER 54 HB2 SER 54 10.016 -9.882 -0.574 321 HB3 SER 54 HB1 SER 54 8.929 -9.564 -1.924 322 HG SER 54 HG SER 54 10.986 -8.509 -2.098 323 H MET 55 HN MET 55 8.727 -6.055 0.120 324 HA MET 55 HA MET 55 6.230 -5.150 -0.838 325 HB2 MET 55 HB2 MET 55 8.031 -3.925 0.600 326 HB3 MET 55 HB1 MET 55 8.686 -3.438 -0.959 327 HG2 MET 55 HG2 MET 55 6.212 -2.707 -1.421 328 HG3 MET 55 HG1 MET 55 6.115 -2.687 0.338 329 HE1 MET 55 HE1 MET 55 7.332 -0.923 -2.854 330 HE2 MET 55 HE2 MET 55 8.838 -1.695 -2.361 331 HE3 MET 55 HE3 MET 55 8.688 0.061 -2.305 332 H ARG 56 HN ARG 56 9.017 -6.249 -2.448 333 HA ARG 56 HA ARG 56 8.448 -4.816 -4.907 334 HB2 ARG 56 HB2 ARG 56 10.778 -5.555 -3.939 335 HB3 ARG 56 HB1 ARG 56 10.397 -7.079 -4.726 336 HG2 ARG 56 HG2 ARG 56 10.117 -5.877 -6.862 337 HG3 ARG 56 HG1 ARG 56 10.595 -4.383 -6.053 338 HD2 ARG 56 HD2 ARG 56 12.708 -5.678 -5.376 339 HD3 ARG 56 HD1 ARG 56 12.233 -6.827 -6.623 340 HE ARG 56 HE ARG 56 12.533 -5.121 -8.256 341 HH11 ARG 56 HH11 ARG 56 14.639 -2.907 -5.588 342 HH12 ARG 56 HH12 ARG 56 13.577 -4.247 -5.012 343 HH21 ARG 56 HH21 ARG 56 14.790 -2.436 -7.829 344 HH22 ARG 56 HH22 ARG 56 13.874 -3.421 -9.031 345 H GLN 57 HN GLN 57 7.142 -7.431 -3.393 346 HA GLN 57 HA GLN 57 6.736 -9.021 -5.811 347 HB2 GLN 57 HB2 GLN 57 7.333 -10.150 -3.690 348 HB3 GLN 57 HB1 GLN 57 5.836 -9.558 -2.977 349 HG2 GLN 57 HG2 GLN 57 4.620 -10.785 -4.813 350 HG3 GLN 57 HG1 GLN 57 6.163 -11.536 -5.215 351 HE21 GLN 57 HE21 GLN 57 3.667 -12.715 -4.255 352 HE22 GLN 57 HE22 GLN 57 4.090 -13.595 -2.826 353 H ILE 58 HN ILE 58 4.932 -6.964 -3.591 354 HA ILE 58 HA ILE 58 2.517 -7.491 -5.181 355 HB ILE 58 HB ILE 58 1.296 -6.336 -3.293 356 HG12 ILE 58 HG12 ILE 58 3.962 -6.741 -1.918 357 HG13 ILE 58 HG11 ILE 58 3.193 -5.196 -2.266 358 HG21 ILE 58 HG21 ILE 58 1.241 -8.744 -3.584 359 HG22 ILE 58 HG22 ILE 58 1.308 -8.339 -1.869 360 HG23 ILE 58 HG23 ILE 58 2.757 -8.906 -2.696 361 HD11 ILE 58 HD11 ILE 58 2.174 -7.308 -0.381 362 HD12 ILE 58 HD12 ILE 58 1.355 -5.791 -0.748 363 HD13 ILE 58 HD13 ILE 58 2.920 -5.775 0.063 364 H ARG 59 HN ARG 59 1.052 -5.629 -5.507 365 HA ARG 59 HA ARG 59 2.509 -3.091 -5.852 366 HB2 ARG 59 HB2 ARG 59 0.586 -4.314 -7.849 367 HB3 ARG 59 HB1 ARG 59 1.375 -2.752 -8.003 368 HG2 ARG 59 HG2 ARG 59 2.814 -5.395 -7.912 369 HG3 ARG 59 HG1 ARG 59 2.407 -4.512 -9.384 370 HD2 ARG 59 HD2 ARG 59 3.771 -2.629 -8.640 371 HD3 ARG 59 HD1 ARG 59 4.159 -3.489 -7.152 372 HE ARG 59 HE ARG 59 5.116 -4.147 -9.845 373 HH11 ARG 59 HH11 ARG 59 6.650 -5.716 -6.444 374 HH12 ARG 59 HH12 ARG 59 5.160 -4.700 -6.362 375 HH21 ARG 59 HH21 ARG 59 7.013 -5.418 -9.968 376 HH22 ARG 59 HH22 ARG 59 7.689 -6.108 -8.443 377 H PHE 60 HN PHE 60 1.277 -1.230 -5.541 378 HA PHE 60 HA PHE 60 -1.455 -1.685 -4.536 379 HB2 PHE 60 HB2 PHE 60 0.658 0.232 -3.544 380 HB3 PHE 60 HB1 PHE 60 -1.038 0.363 -3.101 381 HD1 PHE 60 HD1 PHE 60 1.964 -1.756 -2.843 382 HD2 PHE 60 HD2 PHE 60 -1.990 -1.040 -1.449 383 HE1 PHE 60 HE1 PHE 60 2.338 -3.331 -0.991 384 HE2 PHE 60 HE2 PHE 60 -1.625 -2.614 0.405 385 HZ PHE 60 HZ PHE 60 0.544 -3.761 0.637 386 H ARG 61 HN ARG 61 -3.049 -0.374 -5.275 387 HA ARG 61 HA ARG 61 -2.273 1.838 -7.053 388 HB2 ARG 61 HB2 ARG 61 -4.187 -0.405 -7.630 389 HB3 ARG 61 HB1 ARG 61 -4.326 1.144 -8.444 390 HG2 ARG 61 HG2 ARG 61 -1.937 0.844 -9.182 391 HG3 ARG 61 HG1 ARG 61 -2.053 -0.812 -8.581 392 HD2 ARG 61 HD2 ARG 61 -4.157 -0.983 -10.021 393 HD3 ARG 61 HD1 ARG 61 -3.589 0.489 -10.804 394 HE ARG 61 HE ARG 61 -1.443 -1.015 -11.080 395 HH11 ARG 61 HH11 ARG 61 -4.502 -3.126 -12.702 396 HH12 ARG 61 HH12 ARG 61 -4.841 -1.845 -11.477 397 HH21 ARG 61 HH21 ARG 61 -0.975 -2.630 -12.643 398 HH22 ARG 61 HH22 ARG 61 -2.348 -3.555 -13.361 399 H PHE 62 HN PHE 62 -3.757 3.505 -7.260 400 HA PHE 62 HA PHE 62 -6.097 3.491 -5.504 401 HB2 PHE 62 HB2 PHE 62 -4.517 4.599 -4.116 402 HB3 PHE 62 HB1 PHE 62 -3.841 5.497 -5.470 403 HD1 PHE 62 HD1 PHE 62 -7.016 5.088 -3.564 404 HD2 PHE 62 HD2 PHE 62 -4.509 7.675 -5.826 405 HE1 PHE 62 HE1 PHE 62 -8.515 6.972 -3.066 406 HE2 PHE 62 HE2 PHE 62 -6.004 9.563 -5.331 407 HZ PHE 62 HZ PHE 62 -8.007 9.212 -3.953 408 H ASP 63 HN ASP 63 -7.741 3.855 -6.809 409 HA ASP 63 HA ASP 63 -9.060 4.653 -8.470 410 HB2 ASP 63 HB2 ASP 63 -8.550 6.792 -7.220 411 HB3 ASP 63 HB1 ASP 63 -7.308 7.118 -8.426 412 H GLY 64 HN GLY 64 -6.900 3.011 -9.238 413 HA2 GLY 64 HA2 GLY 64 -6.273 2.190 -11.329 414 HA3 GLY 64 HA1 GLY 64 -6.788 3.705 -12.052 415 H GLN 65 HN GLN 65 -5.046 5.014 -9.821 416 HA GLN 65 HA GLN 65 -2.631 5.035 -11.457 417 HB2 GLN 65 HB2 GLN 65 -3.564 6.805 -9.193 418 HB3 GLN 65 HB1 GLN 65 -1.999 6.970 -9.975 419 HG2 GLN 65 HG2 GLN 65 -4.674 7.248 -11.325 420 HG3 GLN 65 HG1 GLN 65 -3.616 8.574 -10.837 421 HE21 GLN 65 HE21 GLN 65 -1.629 8.844 -11.921 422 HE22 GLN 65 HE22 GLN 65 -1.388 8.209 -13.512 423 HA PRO 66 HA PRO 66 -0.558 2.413 -8.517 424 HB2 PRO 66 HB2 PRO 66 1.971 2.722 -9.456 425 HB3 PRO 66 HB1 PRO 66 0.763 1.726 -10.283 426 HG2 PRO 66 HG2 PRO 66 1.660 4.499 -10.910 427 HG3 PRO 66 HG1 PRO 66 1.290 3.160 -12.011 428 HD2 PRO 66 HD2 PRO 66 -0.446 5.195 -11.522 429 HD3 PRO 66 HD1 PRO 66 -0.965 3.554 -11.955 430 H ILE 67 HN ILE 67 0.113 2.851 -6.504 431 HA ILE 67 HA ILE 67 0.749 5.547 -5.756 432 HB ILE 67 HB ILE 67 0.852 3.026 -4.087 433 HG12 ILE 67 HG12 ILE 67 -1.328 5.116 -4.295 434 HG13 ILE 67 HG11 ILE 67 -1.383 3.539 -5.075 435 HG21 ILE 67 HG21 ILE 67 0.761 5.921 -3.234 436 HG22 ILE 67 HG22 ILE 67 2.175 4.869 -3.150 437 HG23 ILE 67 HG23 ILE 67 0.756 4.518 -2.165 438 HD11 ILE 67 HD11 ILE 67 -1.149 3.921 -2.103 439 HD12 ILE 67 HD12 ILE 67 -1.479 2.424 -2.975 440 HD13 ILE 67 HD13 ILE 67 -2.679 3.716 -2.955 441 H ASN 68 HN ASN 68 2.698 6.452 -5.580 442 HA ASN 68 HA ASN 68 5.026 4.752 -6.064 443 HB2 ASN 68 HB2 ASN 68 4.310 7.212 -7.075 444 HB3 ASN 68 HB1 ASN 68 5.495 7.634 -5.841 445 HD21 ASN 68 HD21 ASN 68 5.254 7.170 -8.978 446 HD22 ASN 68 HD22 ASN 68 6.797 6.480 -9.338 447 H GLU 69 HN GLU 69 7.044 5.325 -4.864 448 HA GLU 69 HA GLU 69 6.499 5.155 -2.050 449 HB2 GLU 69 HB2 GLU 69 8.995 5.046 -3.706 450 HB3 GLU 69 HB1 GLU 69 9.067 5.099 -1.952 451 HG2 GLU 69 HG2 GLU 69 7.538 3.076 -1.982 452 HG3 GLU 69 HG1 GLU 69 7.904 2.966 -3.705 453 H THR 70 HN THR 70 5.999 7.734 -3.484 454 HA THR 70 HA THR 70 7.326 9.425 -1.512 455 HB THR 70 HB THR 70 7.163 10.714 -4.146 456 HG1 THR 70 HG1 THR 70 9.303 8.900 -3.830 457 HG21 THR 70 HG21 THR 70 8.226 11.719 -2.165 458 HG22 THR 70 HG22 THR 70 9.363 11.539 -3.503 459 HG23 THR 70 HG23 THR 70 9.407 10.408 -2.150 460 H ASP 71 HN ASP 71 4.580 8.295 -2.343 461 HA ASP 71 HA ASP 71 3.125 10.817 -2.695 462 HB2 ASP 71 HB2 ASP 71 2.332 7.932 -3.064 463 HB3 ASP 71 HB1 ASP 71 1.141 9.225 -3.014 464 H THR 72 HN THR 72 1.387 11.353 -1.363 465 HA THR 72 HA THR 72 1.211 9.957 1.219 466 HB THR 72 HB THR 72 0.813 12.284 2.226 467 HG1 THR 72 HG1 THR 72 2.138 13.876 0.874 468 HG21 THR 72 HG21 THR 72 3.548 11.538 1.189 469 HG22 THR 72 HG22 THR 72 2.840 11.096 2.744 470 HG23 THR 72 HG23 THR 72 3.254 12.777 2.409 471 HA PRO 73 HA PRO 73 -3.197 9.972 0.776 472 HB2 PRO 73 HB2 PRO 73 -3.399 11.581 3.280 473 HB3 PRO 73 HB1 PRO 73 -4.180 10.051 2.858 474 HG2 PRO 73 HG2 PRO 73 -2.140 10.089 4.550 475 HG3 PRO 73 HG1 PRO 73 -2.317 8.786 3.357 476 HD2 PRO 73 HD2 PRO 73 -0.448 11.102 3.358 477 HD3 PRO 73 HD1 PRO 73 -0.200 9.449 2.766 478 H ALA 74 HN ALA 74 -1.993 13.091 2.023 479 HA ALA 74 HA ALA 74 -4.126 14.610 0.897 480 HB1 ALA 74 HB1 ALA 74 -2.821 16.561 1.541 481 HB2 ALA 74 HB2 ALA 74 -1.419 15.539 1.848 482 HB3 ALA 74 HB3 ALA 74 -2.863 15.377 2.847 483 H GLN 75 HN GLN 75 -1.042 13.526 -0.290 484 HA GLN 75 HA GLN 75 -0.795 15.388 -2.435 485 HB2 GLN 75 HB2 GLN 75 1.187 14.310 -1.689 486 HB3 GLN 75 HB1 GLN 75 0.468 12.716 -1.849 487 HG2 GLN 75 HG2 GLN 75 1.939 12.877 -3.646 488 HG3 GLN 75 HG1 GLN 75 0.358 13.203 -4.349 489 HE21 GLN 75 HE21 GLN 75 1.289 14.287 -6.083 490 HE22 GLN 75 HE22 GLN 75 1.975 15.865 -5.922 491 H LEU 76 HN LEU 76 -2.066 12.090 -2.169 492 HA LEU 76 HA LEU 76 -2.780 12.063 -4.982 493 HB2 LEU 76 HB2 LEU 76 -3.050 10.050 -2.768 494 HB3 LEU 76 HB1 LEU 76 -3.726 9.787 -4.362 495 HG LEU 76 HG LEU 76 -0.797 10.136 -3.704 496 HD11 LEU 76 HD11 LEU 76 -2.357 7.750 -4.670 497 HD12 LEU 76 HD12 LEU 76 -1.712 7.979 -3.043 498 HD13 LEU 76 HD13 LEU 76 -0.613 7.817 -4.414 499 HD21 LEU 76 HD21 LEU 76 -1.185 11.118 -5.841 500 HD22 LEU 76 HD22 LEU 76 -2.214 9.774 -6.335 501 HD23 LEU 76 HD23 LEU 76 -0.483 9.521 -6.107 502 H GLU 77 HN GLU 77 -4.128 13.613 -2.547 503 HA GLU 77 HA GLU 77 -6.186 14.438 -2.072 504 HB2 GLU 77 HB2 GLU 77 -6.744 13.420 -4.858 505 HB3 GLU 77 HB1 GLU 77 -7.889 14.375 -3.925 506 HG2 GLU 77 HG2 GLU 77 -5.130 15.257 -4.746 507 HG3 GLU 77 HG1 GLU 77 -6.639 15.739 -5.520 508 H MET 78 HN MET 78 -5.639 12.021 -0.953 509 HA MET 78 HA MET 78 -7.971 10.308 -1.295 510 HB2 MET 78 HB2 MET 78 -5.698 9.990 0.676 511 HB3 MET 78 HB1 MET 78 -6.856 8.765 0.179 512 HG2 MET 78 HG2 MET 78 -5.922 8.755 -2.058 513 HG3 MET 78 HG1 MET 78 -4.795 10.033 -1.608 514 HE1 MET 78 HE1 MET 78 -5.712 6.291 -1.443 515 HE2 MET 78 HE2 MET 78 -5.995 6.734 0.239 516 HE3 MET 78 HE3 MET 78 -4.659 5.660 -0.177 517 H GLU 79 HN GLU 79 -9.618 10.149 0.169 518 HA GLU 79 HA GLU 79 -9.505 12.064 2.405 519 HB2 GLU 79 HB2 GLU 79 -11.783 11.198 0.653 520 HB3 GLU 79 HB1 GLU 79 -12.080 11.878 2.248 521 HG2 GLU 79 HG2 GLU 79 -10.767 13.191 -0.111 522 HG3 GLU 79 HG1 GLU 79 -12.263 13.648 0.698 523 H ASP 80 HN ASP 80 -11.405 11.387 4.030 524 HA ASP 80 HA ASP 80 -10.420 9.107 5.363 525 HB2 ASP 80 HB2 ASP 80 -11.538 11.057 6.466 526 HB3 ASP 80 HB1 ASP 80 -13.073 10.484 5.825 527 H GLU 81 HN GLU 81 -10.949 7.063 5.300 528 HA GLU 81 HA GLU 81 -11.978 5.099 4.884 529 HB2 GLU 81 HB2 GLU 81 -14.334 6.884 4.350 530 HB3 GLU 81 HB1 GLU 81 -14.421 5.141 4.139 531 HG2 GLU 81 HG2 GLU 81 -13.652 4.939 6.533 532 HG3 GLU 81 HG1 GLU 81 -13.920 6.677 6.669 533 H ASP 82 HN ASP 82 -10.464 6.585 2.878 534 HA ASP 82 HA ASP 82 -11.685 6.121 0.341 535 HB2 ASP 82 HB2 ASP 82 -9.547 7.604 1.123 536 HB3 ASP 82 HB1 ASP 82 -8.733 6.202 0.429 537 H THR 83 HN THR 83 -10.366 4.667 -1.315 538 HA THR 83 HA THR 83 -9.934 2.076 0.037 539 HB THR 83 HB THR 83 -11.033 2.216 -2.748 540 HG1 THR 83 HG1 THR 83 -12.257 3.145 -0.523 541 HG21 THR 83 HG21 THR 83 -11.395 0.231 -0.495 542 HG22 THR 83 HG22 THR 83 -10.252 0.061 -1.827 543 HG23 THR 83 HG23 THR 83 -11.986 0.055 -2.148 544 H ILE 84 HN ILE 84 -8.205 0.899 -0.516 545 HA ILE 84 HA ILE 84 -6.526 1.839 -2.755 546 HB ILE 84 HB ILE 84 -5.601 0.571 -0.163 547 HG12 ILE 84 HG12 ILE 84 -5.248 3.409 -1.158 548 HG13 ILE 84 HG11 ILE 84 -6.405 2.916 0.072 549 HG21 ILE 84 HG21 ILE 84 -3.340 1.056 -0.962 550 HG22 ILE 84 HG22 ILE 84 -4.004 1.683 -2.471 551 HG23 ILE 84 HG23 ILE 84 -4.189 -0.024 -2.068 552 HD11 ILE 84 HD11 ILE 84 -3.417 2.665 0.294 553 HD12 ILE 84 HD12 ILE 84 -4.595 2.244 1.535 554 HD13 ILE 84 HD13 ILE 84 -4.404 3.924 1.035 555 H ASP 85 HN ASP 85 -5.857 0.317 -4.210 556 HA ASP 85 HA ASP 85 -6.967 -2.380 -3.894 557 HB2 ASP 85 HB2 ASP 85 -5.983 -0.826 -6.278 558 HB3 ASP 85 HB1 ASP 85 -6.271 -2.558 -6.361 559 H VAL 86 HN VAL 86 -5.751 -4.189 -3.814 560 HA VAL 86 HA VAL 86 -2.822 -3.852 -3.887 561 HB VAL 86 HB VAL 86 -4.348 -5.978 -2.369 562 HG11 VAL 86 HG11 VAL 86 -2.218 -6.404 -1.267 563 HG12 VAL 86 HG12 VAL 86 -1.453 -5.138 -2.229 564 HG13 VAL 86 HG13 VAL 86 -2.066 -6.593 -3.015 565 HG21 VAL 86 HG21 VAL 86 -3.847 -4.726 -0.342 566 HG22 VAL 86 HG22 VAL 86 -4.818 -3.752 -1.446 567 HG23 VAL 86 HG23 VAL 86 -3.085 -3.455 -1.297 568 H PHE 87 HN PHE 87 -1.745 -4.975 -5.385 569 HA PHE 87 HA PHE 87 -3.098 -7.264 -6.660 570 HB2 PHE 87 HB2 PHE 87 -1.484 -5.074 -7.977 571 HB3 PHE 87 HB1 PHE 87 -1.915 -6.580 -8.782 572 HD1 PHE 87 HD1 PHE 87 -4.307 -7.095 -9.220 573 HD2 PHE 87 HD2 PHE 87 -3.036 -3.309 -7.746 574 HE1 PHE 87 HE1 PHE 87 -6.459 -6.111 -9.891 575 HE2 PHE 87 HE2 PHE 87 -5.188 -2.328 -8.415 576 HZ PHE 87 HZ PHE 87 -6.899 -3.726 -9.486 577 H GLN 88 HN GLN 88 -1.589 -8.763 -7.745 578 HA GLN 88 HA GLN 88 0.944 -8.966 -6.254 579 HB2 GLN 88 HB2 GLN 88 -0.981 -11.035 -7.274 580 HB3 GLN 88 HB1 GLN 88 0.708 -11.452 -7.019 581 HG2 GLN 88 HG2 GLN 88 -0.731 -10.103 -4.805 582 HG3 GLN 88 HG1 GLN 88 -1.132 -11.786 -5.150 583 HE21 GLN 88 HE21 GLN 88 -0.268 -12.505 -3.212 584 HE22 GLN 88 HE22 GLN 88 1.433 -12.560 -2.920 585 H GLN 89 HN GLN 89 2.828 -9.490 -7.378 586 HA GLN 89 HA GLN 89 2.847 -8.682 -10.144 587 HB2 GLN 89 HB2 GLN 89 4.658 -8.092 -8.500 588 HB3 GLN 89 HB1 GLN 89 5.136 -9.782 -8.499 589 HG2 GLN 89 HG2 GLN 89 6.578 -8.509 -9.948 590 HG3 GLN 89 HG1 GLN 89 5.616 -9.639 -10.899 591 HE21 GLN 89 HE21 GLN 89 5.784 -8.496 -12.787 592 HE22 GLN 89 HE22 GLN 89 5.011 -6.972 -13.042 593 H GLN 90 HN GLN 90 3.154 -9.926 -11.910 594 HA GLN 90 HA GLN 90 2.300 -12.582 -11.916 595 HB2 GLN 90 HB2 GLN 90 3.847 -10.974 -13.953 596 HB3 GLN 90 HB1 GLN 90 3.286 -12.609 -14.265 597 HG2 GLN 90 HG2 GLN 90 1.716 -11.134 -15.239 598 HG3 GLN 90 HG1 GLN 90 0.959 -11.812 -13.801 599 HE21 GLN 90 HE21 GLN 90 -0.492 -10.099 -13.696 600 HE22 GLN 90 HE22 GLN 90 -0.018 -8.531 -13.146 601 H THR 91 HN THR 91 3.353 -14.536 -12.052 602 HA THR 91 HA THR 91 5.990 -14.614 -10.891 603 HB THR 91 HB THR 91 5.481 -17.199 -11.358 604 HG1 THR 91 HG1 THR 91 3.366 -17.615 -11.586 605 HG21 THR 91 HG21 THR 91 4.129 -15.580 -9.198 606 HG22 THR 91 HG22 THR 91 5.803 -16.136 -9.162 607 HG23 THR 91 HG23 THR 91 4.484 -17.307 -9.139 608 H GLY 92 HN GLY 92 4.484 -15.316 -13.995 609 HA2 GLY 92 HA2 GLY 92 7.094 -15.256 -15.265 610 HA3 GLY 92 HA1 GLY 92 6.234 -16.785 -15.384 611 H ASN 357 HT1 ASN 357 -15.956 -10.079 6.418 612 HA ASN 357 HA ASN 357 -13.172 -10.399 5.467 613 HB2 ASN 357 HB2 ASN 357 -13.212 -8.041 4.906 614 HB3 ASN 357 HB1 ASN 357 -14.481 -8.873 4.017 615 HD21 ASN 357 HD21 ASN 357 -16.594 -8.343 4.381 616 HD22 ASN 357 HD22 ASN 357 -17.080 -7.029 5.398 617 H ASN 358 HN ASN 358 -11.698 -9.018 6.676 618 HA ASN 358 HA ASN 358 -12.670 -8.531 9.392 619 HB2 ASN 358 HB2 ASN 358 -10.401 -9.146 10.222 620 HB3 ASN 358 HB1 ASN 358 -11.256 -10.479 9.456 621 HD21 ASN 358 HD21 ASN 358 -10.506 -11.314 7.551 622 HD22 ASN 358 HD22 ASN 358 -8.944 -10.940 6.902 623 H ARG 359 HN ARG 359 -12.353 -6.563 10.232 624 HA ARG 359 HA ARG 359 -10.435 -4.823 8.829 625 HB2 ARG 359 HB2 ARG 359 -11.953 -2.914 9.434 626 HB3 ARG 359 HB1 ARG 359 -12.620 -4.034 8.253 627 HG2 ARG 359 HG2 ARG 359 -13.913 -5.108 10.057 628 HG3 ARG 359 HG1 ARG 359 -13.287 -3.898 11.182 629 HD2 ARG 359 HD2 ARG 359 -14.347 -2.128 9.951 630 HD3 ARG 359 HD1 ARG 359 -14.828 -3.245 8.677 631 HE ARG 359 HE ARG 359 -16.036 -2.964 11.317 632 HH11 ARG 359 HH11 ARG 359 -15.897 -4.593 8.201 633 HH12 ARG 359 HH12 ARG 359 -17.455 -5.464 8.453 634 HH21 ARG 359 HH21 ARG 359 -18.040 -4.003 11.662 635 HH22 ARG 359 HH22 ARG 359 -18.671 -5.111 10.386 636 H ASP 360 HN ASP 360 -8.864 -4.187 10.054 637 HA ASP 360 HA ASP 360 -9.266 -3.706 12.909 638 HB2 ASP 360 HB2 ASP 360 -7.457 -4.920 13.605 639 HB3 ASP 360 HB1 ASP 360 -7.972 -5.903 12.243 640 HA PRO 361 HA PRO 361 -7.212 -0.016 11.583 641 HB2 PRO 361 HB2 PRO 361 -7.459 1.399 13.873 642 HB3 PRO 361 HB1 PRO 361 -8.857 0.967 12.879 643 HG2 PRO 361 HG2 PRO 361 -8.103 -0.040 15.511 644 HG3 PRO 361 HG1 PRO 361 -9.645 -0.186 14.656 645 HD2 PRO 361 HD2 PRO 361 -7.489 -2.134 14.875 646 HD3 PRO 361 HD1 PRO 361 -9.138 -2.349 14.252 647 H ILE 362 HN ILE 362 -5.238 0.515 11.319 648 HA ILE 362 HA ILE 362 -3.184 -0.023 13.357 649 HB ILE 362 HB ILE 362 -2.600 0.170 10.424 650 HG12 ILE 362 HG12 ILE 362 -3.000 -2.532 11.627 651 HG13 ILE 362 HG11 ILE 362 -4.435 -1.619 11.167 652 HG21 ILE 362 HG21 ILE 362 -1.246 -1.291 12.684 653 HG22 ILE 362 HG22 ILE 362 -0.721 0.230 11.965 654 HG23 ILE 362 HG23 ILE 362 -0.701 -1.253 11.007 655 HD11 ILE 362 HD11 ILE 362 -2.141 -2.324 9.354 656 HD12 ILE 362 HD12 ILE 362 -3.584 -1.421 8.893 657 HD13 ILE 362 HD13 ILE 362 -3.719 -3.111 9.385 658 H VAL 363 HN VAL 363 -1.869 1.645 13.929 659 HA VAL 363 HA VAL 363 -2.272 4.173 12.463 660 HB VAL 363 HB VAL 363 -1.439 3.835 15.346 661 HG11 VAL 363 HG11 VAL 363 -1.865 6.221 15.542 662 HG12 VAL 363 HG12 VAL 363 -2.291 6.300 13.833 663 HG13 VAL 363 HG13 VAL 363 -0.642 5.900 14.315 664 HG21 VAL 363 HG21 VAL 363 -3.686 4.587 15.945 665 HG22 VAL 363 HG22 VAL 363 -3.726 3.067 15.057 666 HG23 VAL 363 HG23 VAL 363 -4.145 4.574 14.244 667 H ILE 364 HN ILE 364 -0.551 5.054 11.548 668 HA ILE 364 HA ILE 364 2.123 4.117 12.353 669 HB ILE 364 HB ILE 364 1.296 4.982 9.577 670 HG12 ILE 364 HG12 ILE 364 2.046 2.218 10.539 671 HG13 ILE 364 HG11 ILE 364 0.389 2.758 10.283 672 HG21 ILE 364 HG21 ILE 364 3.899 3.846 10.590 673 HG22 ILE 364 HG22 ILE 364 3.617 5.519 10.102 674 HG23 ILE 364 HG23 ILE 364 3.522 4.221 8.909 675 HD11 ILE 364 HD11 ILE 364 0.763 3.010 7.942 676 HD12 ILE 364 HD12 ILE 364 1.352 1.418 8.421 677 HD13 ILE 364 HD13 ILE 364 2.494 2.731 8.134 678 H SER 365 HN SER 365 3.526 5.626 12.942 679 HA SER 365 HA SER 365 2.870 8.435 12.344 680 HB2 SER 365 HB2 SER 365 4.347 7.478 14.807 681 HB3 SER 365 HB1 SER 365 3.677 9.081 14.504 682 HG SER 365 HG SER 365 2.156 6.694 14.716 683 H ASP 366 HN ASP 366 4.413 9.584 11.330 684 HA ASP 366 HA ASP 366 7.096 8.383 11.172 685 HB2 ASP 366 HB2 ASP 366 5.724 8.262 9.032 686 HB3 ASP 366 HB1 ASP 366 5.852 10.019 8.962 687 H SER 367 HN SER 367 8.730 9.631 11.733 688 HA SER 367 HA SER 367 8.180 12.478 12.226 689 HB2 SER 367 HB2 SER 367 10.187 12.220 13.822 690 HB3 SER 367 HB1 SER 367 8.666 11.472 14.307 691 HG SER 367 HG SER 367 10.687 10.076 12.894 692 HA PRO 368 HA PRO 368 11.244 12.972 8.960 693 HB2 PRO 368 HB2 PRO 368 10.886 15.625 8.610 694 HB3 PRO 368 HB1 PRO 368 9.741 14.428 7.986 695 HG2 PRO 368 HG2 PRO 368 9.534 16.133 10.418 696 HG3 PRO 368 HG1 PRO 368 8.279 15.670 9.255 697 HD2 PRO 368 HD2 PRO 368 8.606 14.475 11.698 698 HD3 PRO 368 HD1 PRO 368 7.858 13.686 10.296 Start of MODEL 12 1 H ASP 16 HT1 ASP 16 -6.155 15.756 11.478 2 HA ASP 16 HA ASP 16 -6.074 13.936 13.806 3 HB2 ASP 16 HB2 ASP 16 -8.237 14.775 11.894 4 HB3 ASP 16 HB1 ASP 16 -8.296 13.194 12.662 5 H HIS 17 HN HIS 17 -7.165 11.769 12.617 6 HA HIS 17 HA HIS 17 -5.051 11.004 10.735 7 HB2 HIS 17 HB2 HIS 17 -6.902 9.248 12.367 8 HB3 HIS 17 HB1 HIS 17 -5.566 8.693 11.364 9 HD2 HIS 17 HD2 HIS 17 -3.018 9.063 12.429 10 HE1 HIS 17 HE1 HIS 17 -4.407 10.314 16.228 11 HE2 HIS 17 HE2 HIS 17 -2.426 9.409 14.932 12 H ILE 18 HN ILE 18 -5.663 9.426 9.049 13 HA ILE 18 HA ILE 18 -8.355 9.981 7.988 14 HB ILE 18 HB ILE 18 -6.603 11.106 6.675 15 HG12 ILE 18 HG12 ILE 18 -7.693 8.773 5.096 16 HG13 ILE 18 HG11 ILE 18 -8.682 10.137 5.610 17 HG21 ILE 18 HG21 ILE 18 -4.974 9.794 5.378 18 HG22 ILE 18 HG22 ILE 18 -5.500 8.337 6.221 19 HG23 ILE 18 HG23 ILE 18 -4.730 9.644 7.120 20 HD11 ILE 18 HD11 ILE 18 -6.256 10.303 3.835 21 HD12 ILE 18 HD12 ILE 18 -7.282 11.654 4.323 22 HD13 ILE 18 HD13 ILE 18 -7.935 10.372 3.300 23 H ASN 19 HN ASN 19 -9.563 8.230 7.358 24 HA ASN 19 HA ASN 19 -8.433 5.619 8.019 25 HB2 ASN 19 HB2 ASN 19 -11.289 6.401 7.395 26 HB3 ASN 19 HB1 ASN 19 -10.756 4.806 7.919 27 HD21 ASN 19 HD21 ASN 19 -11.360 8.083 8.858 28 HD22 ASN 19 HD22 ASN 19 -11.253 7.827 10.574 29 H LEU 20 HN LEU 20 -7.351 4.718 6.404 30 HA LEU 20 HA LEU 20 -8.543 4.787 3.711 31 HB2 LEU 20 HB2 LEU 20 -5.697 4.136 4.487 32 HB3 LEU 20 HB1 LEU 20 -6.319 4.307 2.856 33 HG LEU 20 HG LEU 20 -6.150 6.535 4.890 34 HD11 LEU 20 HD11 LEU 20 -4.459 6.008 2.451 35 HD12 LEU 20 HD12 LEU 20 -3.944 5.803 4.125 36 HD13 LEU 20 HD13 LEU 20 -4.347 7.407 3.517 37 HD21 LEU 20 HD21 LEU 20 -6.605 7.956 2.875 38 HD22 LEU 20 HD22 LEU 20 -7.963 6.971 3.417 39 HD23 LEU 20 HD23 LEU 20 -7.021 6.476 2.012 40 H LYS 21 HN LYS 21 -9.622 3.001 3.196 41 HA LYS 21 HA LYS 21 -9.151 0.524 4.624 42 HB2 LYS 21 HB2 LYS 21 -11.088 1.079 2.374 43 HB3 LYS 21 HB1 LYS 21 -11.096 -0.314 3.444 44 HG2 LYS 21 HG2 LYS 21 -11.698 1.064 5.319 45 HG3 LYS 21 HG1 LYS 21 -11.540 2.526 4.342 46 HD2 LYS 21 HD2 LYS 21 -13.338 1.645 2.855 47 HD3 LYS 21 HD1 LYS 21 -13.555 0.309 3.987 48 HE2 LYS 21 HE2 LYS 21 -14.233 1.793 5.723 49 HE3 LYS 21 HE1 LYS 21 -13.765 3.204 4.776 50 HZ1 LYS 21 HZ1 LYS 21 -16.086 3.044 4.627 51 HZ2 LYS 21 HZ2 LYS 21 -16.046 1.380 4.305 52 HZ3 LYS 21 HZ3 LYS 21 -15.505 2.478 3.141 53 H VAL 22 HN VAL 22 -7.496 -0.684 3.986 54 HA VAL 22 HA VAL 22 -6.932 -0.899 1.109 55 HB VAL 22 HB VAL 22 -5.223 -1.940 3.372 56 HG11 VAL 22 HG11 VAL 22 -4.837 -2.959 1.181 57 HG12 VAL 22 HG12 VAL 22 -3.458 -1.999 1.710 58 HG13 VAL 22 HG13 VAL 22 -4.561 -1.360 0.492 59 HG21 VAL 22 HG21 VAL 22 -3.822 0.054 3.066 60 HG22 VAL 22 HG22 VAL 22 -5.443 0.463 3.631 61 HG23 VAL 22 HG23 VAL 22 -5.011 0.701 1.939 62 H ALA 23 HN ALA 23 -7.597 -2.664 0.064 63 HA ALA 23 HA ALA 23 -8.112 -5.089 1.652 64 HB1 ALA 23 HB1 ALA 23 -10.075 -5.539 0.239 65 HB2 ALA 23 HB2 ALA 23 -9.836 -3.985 -0.560 66 HB3 ALA 23 HB3 ALA 23 -10.240 -4.040 1.155 67 H GLY 24 HN GLY 24 -7.647 -7.040 0.683 68 HA2 GLY 24 HA2 GLY 24 -5.740 -6.906 -1.491 69 HA3 GLY 24 HA1 GLY 24 -6.186 -8.341 -0.579 70 H GLN 25 HN GLN 25 -6.631 -9.736 -2.202 71 HA GLN 25 HA GLN 25 -8.521 -8.890 -4.278 72 HB2 GLN 25 HB2 GLN 25 -6.786 -11.363 -4.098 73 HB3 GLN 25 HB1 GLN 25 -7.835 -10.955 -5.448 74 HG2 GLN 25 HG2 GLN 25 -5.513 -9.288 -4.512 75 HG3 GLN 25 HG1 GLN 25 -5.466 -10.431 -5.852 76 HE21 GLN 25 HE21 GLN 25 -5.132 -7.462 -5.659 77 HE22 GLN 25 HE22 GLN 25 -6.229 -6.823 -6.834 78 H ASP 26 HN ASP 26 -8.362 -10.616 -1.377 79 HA ASP 26 HA ASP 26 -10.732 -12.207 -2.007 80 HB2 ASP 26 HB2 ASP 26 -10.276 -13.279 0.238 81 HB3 ASP 26 HB1 ASP 26 -9.040 -13.535 -0.986 82 H GLY 27 HN GLY 27 -10.504 -11.646 1.319 83 HA2 GLY 27 HA2 GLY 27 -12.413 -9.403 1.161 84 HA3 GLY 27 HA1 GLY 27 -12.829 -10.849 2.063 85 H SER 28 HN SER 28 -9.524 -10.130 2.278 86 HA SER 28 HA SER 28 -9.775 -9.436 5.055 87 HB2 SER 28 HB2 SER 28 -7.164 -9.078 4.617 88 HB3 SER 28 HB1 SER 28 -7.866 -10.691 4.744 89 HG SER 28 HG SER 28 -7.841 -10.885 2.537 90 H VAL 29 HN VAL 29 -9.918 -7.397 5.921 91 HA VAL 29 HA VAL 29 -9.095 -5.173 4.133 92 HB VAL 29 HB VAL 29 -11.395 -5.071 6.091 93 HG11 VAL 29 HG11 VAL 29 -11.949 -2.979 4.958 94 HG12 VAL 29 HG12 VAL 29 -10.526 -3.158 3.930 95 HG13 VAL 29 HG13 VAL 29 -10.334 -2.919 5.666 96 HG21 VAL 29 HG21 VAL 29 -12.882 -5.162 4.174 97 HG22 VAL 29 HG22 VAL 29 -11.882 -6.613 4.240 98 HG23 VAL 29 HG23 VAL 29 -11.502 -5.333 3.088 99 H VAL 30 HN VAL 30 -7.882 -3.564 4.987 100 HA VAL 30 HA VAL 30 -7.508 -3.561 7.905 101 HB VAL 30 HB VAL 30 -5.151 -2.769 7.498 102 HG11 VAL 30 HG11 VAL 30 -5.806 -5.545 6.510 103 HG12 VAL 30 HG12 VAL 30 -5.666 -5.066 8.203 104 HG13 VAL 30 HG13 VAL 30 -4.251 -5.008 7.149 105 HG21 VAL 30 HG21 VAL 30 -5.868 -3.581 4.694 106 HG22 VAL 30 HG22 VAL 30 -4.199 -3.526 5.261 107 HG23 VAL 30 HG23 VAL 30 -5.178 -2.059 5.258 108 H GLN 31 HN GLN 31 -7.896 -1.694 8.844 109 HA GLN 31 HA GLN 31 -8.490 0.610 7.146 110 HB2 GLN 31 HB2 GLN 31 -10.147 -0.238 8.857 111 HB3 GLN 31 HB1 GLN 31 -9.026 0.285 10.104 112 HG2 GLN 31 HG2 GLN 31 -9.314 2.554 9.560 113 HG3 GLN 31 HG1 GLN 31 -10.104 2.171 8.031 114 HE21 GLN 31 HE21 GLN 31 -11.021 3.804 10.310 115 HE22 GLN 31 HE22 GLN 31 -12.539 3.116 10.785 116 H PHE 32 HN PHE 32 -6.437 1.336 6.687 117 HA PHE 32 HA PHE 32 -4.501 1.802 8.734 118 HB2 PHE 32 HB2 PHE 32 -4.681 2.322 5.813 119 HB3 PHE 32 HB1 PHE 32 -3.549 3.301 6.742 120 HD1 PHE 32 HD1 PHE 32 -4.280 0.001 5.420 121 HD2 PHE 32 HD2 PHE 32 -1.676 2.248 7.925 122 HE1 PHE 32 HE1 PHE 32 -2.651 -1.841 5.376 123 HE2 PHE 32 HE2 PHE 32 -0.046 0.410 7.881 124 HZ PHE 32 HZ PHE 32 -0.533 -1.636 6.607 125 H LYS 33 HN LYS 33 -4.849 3.238 10.233 126 HA LYS 33 HA LYS 33 -6.223 5.746 9.574 127 HB2 LYS 33 HB2 LYS 33 -6.867 4.061 11.509 128 HB3 LYS 33 HB1 LYS 33 -5.584 4.896 12.368 129 HG2 LYS 33 HG2 LYS 33 -6.738 7.023 12.013 130 HG3 LYS 33 HG1 LYS 33 -8.038 6.164 11.180 131 HD2 LYS 33 HD2 LYS 33 -8.287 4.779 13.282 132 HD3 LYS 33 HD1 LYS 33 -7.217 5.946 14.063 133 HE2 LYS 33 HE2 LYS 33 -8.803 7.743 13.403 134 HE3 LYS 33 HE1 LYS 33 -9.896 6.496 12.798 135 HZ1 LYS 33 HZ1 LYS 33 -8.931 6.676 15.597 136 HZ2 LYS 33 HZ2 LYS 33 -10.075 5.582 14.996 137 HZ3 LYS 33 HZ3 LYS 33 -10.433 7.234 15.065 138 H ILE 34 HN ILE 34 -4.086 6.236 8.511 139 HA ILE 34 HA ILE 34 -1.985 7.018 10.389 140 HB ILE 34 HB ILE 34 -0.617 7.460 8.382 141 HG12 ILE 34 HG12 ILE 34 -2.937 6.310 6.808 142 HG13 ILE 34 HG11 ILE 34 -2.564 8.029 6.887 143 HG21 ILE 34 HG21 ILE 34 -0.311 5.144 7.715 144 HG22 ILE 34 HG22 ILE 34 -1.893 4.729 8.376 145 HG23 ILE 34 HG23 ILE 34 -0.600 5.255 9.451 146 HD11 ILE 34 HD11 ILE 34 -1.734 6.947 4.845 147 HD12 ILE 34 HD12 ILE 34 -0.707 5.908 5.833 148 HD13 ILE 34 HD13 ILE 34 -0.441 7.652 5.812 149 H LYS 35 HN LYS 35 -0.816 9.142 9.460 150 HA LYS 35 HA LYS 35 -2.845 11.208 9.701 151 HB2 LYS 35 HB2 LYS 35 0.175 11.321 9.741 152 HB3 LYS 35 HB1 LYS 35 -0.856 12.740 9.868 153 HG2 LYS 35 HG2 LYS 35 -1.835 11.863 11.917 154 HG3 LYS 35 HG1 LYS 35 -0.838 10.413 11.781 155 HD2 LYS 35 HD2 LYS 35 1.160 11.654 12.112 156 HD3 LYS 35 HD1 LYS 35 0.308 13.191 11.948 157 HE2 LYS 35 HE2 LYS 35 -0.995 12.599 13.992 158 HE3 LYS 35 HE1 LYS 35 0.040 11.184 14.180 159 HZ1 LYS 35 HZ1 LYS 35 1.944 12.617 14.411 160 HZ2 LYS 35 HZ2 LYS 35 0.765 13.070 15.535 161 HZ3 LYS 35 HZ3 LYS 35 0.998 13.992 14.139 162 H ARG 36 HN ARG 36 -2.872 13.030 8.252 163 HA ARG 36 HA ARG 36 -2.991 12.247 5.552 164 HB2 ARG 36 HB2 ARG 36 -4.150 14.187 6.951 165 HB3 ARG 36 HB1 ARG 36 -2.834 15.129 6.265 166 HG2 ARG 36 HG2 ARG 36 -3.603 14.878 4.103 167 HG3 ARG 36 HG1 ARG 36 -4.539 13.434 4.495 168 HD2 ARG 36 HD2 ARG 36 -6.135 14.754 5.728 169 HD3 ARG 36 HD1 ARG 36 -5.165 16.205 5.498 170 HE ARG 36 HE ARG 36 -5.660 15.987 3.084 171 HH11 ARG 36 HH11 ARG 36 -7.738 14.343 5.416 172 HH12 ARG 36 HH12 ARG 36 -9.169 14.378 4.316 173 HH21 ARG 36 HH21 ARG 36 -7.461 16.039 1.683 174 HH22 ARG 36 HH22 ARG 36 -9.024 15.319 2.251 175 H HIS 37 HN HIS 37 -0.368 13.328 7.426 176 HA HIS 37 HA HIS 37 1.153 14.160 5.054 177 HB2 HIS 37 HB2 HIS 37 2.273 14.428 7.810 178 HB3 HIS 37 HB1 HIS 37 2.482 15.471 6.410 179 HD2 HIS 37 HD2 HIS 37 0.217 17.183 5.896 180 HE1 HIS 37 HE1 HIS 37 -1.117 16.890 9.901 181 HE2 HIS 37 HE2 HIS 37 -1.481 18.029 7.669 182 H THR 38 HN THR 38 0.549 11.389 6.601 183 HA THR 38 HA THR 38 3.249 10.421 6.962 184 HB THR 38 HB THR 38 0.657 8.864 7.036 185 HG1 THR 38 HG1 THR 38 1.675 10.715 8.717 186 HG21 THR 38 HG21 THR 38 3.379 8.261 8.209 187 HG22 THR 38 HG22 THR 38 2.671 7.470 6.798 188 HG23 THR 38 HG23 THR 38 1.927 7.269 8.386 189 HA PRO 39 HA PRO 39 3.825 9.347 2.662 190 HB2 PRO 39 HB2 PRO 39 5.839 7.510 3.841 191 HB3 PRO 39 HB1 PRO 39 6.033 8.737 2.581 192 HG2 PRO 39 HG2 PRO 39 6.968 9.157 5.030 193 HG3 PRO 39 HG1 PRO 39 6.237 10.468 4.084 194 HD2 PRO 39 HD2 PRO 39 5.099 8.926 6.364 195 HD3 PRO 39 HD1 PRO 39 4.906 10.641 5.941 196 H LEU 40 HN LEU 40 2.777 7.896 1.473 197 HA LEU 40 HA LEU 40 1.439 5.686 2.645 198 HB2 LEU 40 HB2 LEU 40 1.888 6.438 -0.241 199 HB3 LEU 40 HB1 LEU 40 0.853 5.122 0.276 200 HG LEU 40 HG LEU 40 0.441 8.029 0.989 201 HD11 LEU 40 HD11 LEU 40 -1.438 7.943 -0.554 202 HD12 LEU 40 HD12 LEU 40 -1.021 6.283 -0.982 203 HD13 LEU 40 HD13 LEU 40 0.079 7.601 -1.386 204 HD21 LEU 40 HD21 LEU 40 -1.214 5.566 1.507 205 HD22 LEU 40 HD22 LEU 40 -1.786 7.219 1.732 206 HD23 LEU 40 HD23 LEU 40 -0.449 6.610 2.705 207 H SER 41 HN SER 41 4.590 6.091 1.520 208 HA SER 41 HA SER 41 5.226 3.573 0.492 209 HB2 SER 41 HB2 SER 41 7.373 4.751 2.054 210 HB3 SER 41 HB1 SER 41 7.249 4.536 0.306 211 HG SER 41 HG SER 41 7.118 6.650 0.363 212 H LYS 42 HN LYS 42 5.152 4.805 3.802 213 HA LYS 42 HA LYS 42 6.149 2.363 4.935 214 HB2 LYS 42 HB2 LYS 42 4.852 4.775 6.217 215 HB3 LYS 42 HB1 LYS 42 5.518 3.415 7.115 216 HG2 LYS 42 HG2 LYS 42 7.681 3.926 5.778 217 HG3 LYS 42 HG1 LYS 42 6.932 5.501 5.519 218 HD2 LYS 42 HD2 LYS 42 6.905 5.988 7.818 219 HD3 LYS 42 HD1 LYS 42 7.208 4.305 8.263 220 HE2 LYS 42 HE2 LYS 42 9.443 4.468 7.234 221 HE3 LYS 42 HE1 LYS 42 9.134 6.163 6.870 222 HZ1 LYS 42 HZ1 LYS 42 10.460 5.717 8.921 223 HZ2 LYS 42 HZ2 LYS 42 9.060 5.077 9.622 224 HZ3 LYS 42 HZ3 LYS 42 9.097 6.702 9.143 225 H LEU 43 HN LEU 43 3.078 3.693 4.105 226 HA LEU 43 HA LEU 43 1.418 2.025 5.674 227 HB2 LEU 43 HB2 LEU 43 0.499 4.002 4.659 228 HB3 LEU 43 HB1 LEU 43 0.984 3.477 3.061 229 HG LEU 43 HG LEU 43 -0.895 1.665 4.433 230 HD11 LEU 43 HD11 LEU 43 -2.832 3.102 3.965 231 HD12 LEU 43 HD12 LEU 43 -1.737 4.425 3.561 232 HD13 LEU 43 HD13 LEU 43 -1.779 3.785 5.204 233 HD21 LEU 43 HD21 LEU 43 -0.877 2.938 1.695 234 HD22 LEU 43 HD22 LEU 43 -1.906 1.609 2.224 235 HD23 LEU 43 HD23 LEU 43 -0.164 1.378 2.099 236 H MET 44 HN MET 44 2.778 1.781 2.433 237 HA MET 44 HA MET 44 1.590 -0.679 1.714 238 HB2 MET 44 HB2 MET 44 4.160 0.608 0.761 239 HB3 MET 44 HB1 MET 44 3.409 -0.790 0.005 240 HG2 MET 44 HG2 MET 44 1.366 0.648 -0.337 241 HG3 MET 44 HG1 MET 44 2.360 2.018 0.152 242 HE1 MET 44 HE1 MET 44 4.254 3.093 -1.330 243 HE2 MET 44 HE2 MET 44 5.015 2.239 -2.672 244 HE3 MET 44 HE3 MET 44 5.136 1.594 -1.033 245 H LYS 45 HN LYS 45 4.662 0.163 3.225 246 HA LYS 45 HA LYS 45 5.750 -2.433 3.294 247 HB2 LYS 45 HB2 LYS 45 6.279 0.050 4.915 248 HB3 LYS 45 HB1 LYS 45 7.155 -1.448 5.201 249 HG2 LYS 45 HG2 LYS 45 7.980 -1.417 2.912 250 HG3 LYS 45 HG1 LYS 45 7.075 0.066 2.599 251 HD2 LYS 45 HD2 LYS 45 8.392 1.264 4.228 252 HD3 LYS 45 HD1 LYS 45 9.223 -0.220 4.697 253 HE2 LYS 45 HE2 LYS 45 10.118 -0.398 2.400 254 HE3 LYS 45 HE1 LYS 45 9.361 1.144 2.011 255 HZ1 LYS 45 HZ1 LYS 45 11.436 0.708 4.085 256 HZ2 LYS 45 HZ2 LYS 45 10.714 2.191 3.714 257 HZ3 LYS 45 HZ3 LYS 45 11.688 1.414 2.570 258 H ALA 46 HN ALA 46 3.720 -0.666 5.591 259 HA ALA 46 HA ALA 46 3.897 -2.459 7.733 260 HB1 ALA 46 HB1 ALA 46 2.933 -0.244 7.977 261 HB2 ALA 46 HB2 ALA 46 1.787 -1.474 8.509 262 HB3 ALA 46 HB3 ALA 46 1.581 -0.697 6.941 263 H TYR 47 HN TYR 47 1.577 -2.344 5.036 264 HA TYR 47 HA TYR 47 0.137 -4.652 5.866 265 HB2 TYR 47 HB2 TYR 47 -0.768 -2.911 4.315 266 HB3 TYR 47 HB1 TYR 47 0.346 -3.486 3.080 267 HD1 TYR 47 HD1 TYR 47 -0.421 -5.051 1.554 268 HD2 TYR 47 HD2 TYR 47 -2.328 -4.779 5.347 269 HE1 TYR 47 HE1 TYR 47 -2.083 -6.711 0.829 270 HE2 TYR 47 HE2 TYR 47 -3.997 -6.437 4.632 271 HH TYR 47 HH TYR 47 -4.932 -7.382 2.653 272 H CYS 48 HN CYS 48 2.888 -4.064 3.800 273 HA CYS 48 HA CYS 48 3.139 -6.557 2.567 274 HB2 CYS 48 HB2 CYS 48 4.397 -4.455 2.004 275 HB3 CYS 48 HB1 CYS 48 5.388 -4.725 3.431 276 HG CYS 48 HG CYS 48 6.275 -7.278 2.431 277 H GLU 49 HN GLU 49 4.628 -5.324 5.544 278 HA GLU 49 HA GLU 49 5.999 -7.677 6.244 279 HB2 GLU 49 HB2 GLU 49 4.967 -5.398 7.940 280 HB3 GLU 49 HB1 GLU 49 6.023 -6.665 8.544 281 HG2 GLU 49 HG2 GLU 49 6.793 -4.964 6.200 282 HG3 GLU 49 HG1 GLU 49 7.081 -4.446 7.859 283 H ARG 50 HN ARG 50 2.758 -6.516 7.003 284 HA ARG 50 HA ARG 50 2.068 -8.466 8.904 285 HB2 ARG 50 HB2 ARG 50 0.511 -6.667 7.099 286 HB3 ARG 50 HB1 ARG 50 -0.326 -7.917 8.007 287 HG2 ARG 50 HG2 ARG 50 0.432 -6.989 10.085 288 HG3 ARG 50 HG1 ARG 50 1.441 -5.817 9.232 289 HD2 ARG 50 HD2 ARG 50 -0.350 -4.558 8.560 290 HD3 ARG 50 HD1 ARG 50 -1.466 -5.919 8.628 291 HE ARG 50 HE ARG 50 -0.385 -4.746 11.098 292 HH11 ARG 50 HH11 ARG 50 -3.078 -5.702 9.050 293 HH12 ARG 50 HH12 ARG 50 -4.329 -5.255 10.281 294 HH21 ARG 50 HH21 ARG 50 -3.690 -4.412 12.307 295 HH22 ARG 50 HH22 ARG 50 -1.933 -4.200 12.704 296 H GLN 51 HN GLN 51 1.726 -8.428 5.381 297 HA GLN 51 HA GLN 51 0.407 -10.993 5.361 298 HB2 GLN 51 HB2 GLN 51 1.511 -9.314 3.106 299 HB3 GLN 51 HB1 GLN 51 0.602 -10.804 2.888 300 HG2 GLN 51 HG2 GLN 51 -0.343 -8.137 3.846 301 HG3 GLN 51 HG1 GLN 51 -0.988 -9.158 2.565 302 HE21 GLN 51 HE21 GLN 51 -2.196 -11.022 3.157 303 HE22 GLN 51 HE22 GLN 51 -3.001 -11.098 4.683 304 H GLY 52 HN GLY 52 3.539 -10.040 5.779 305 HA2 GLY 52 HA2 GLY 52 5.525 -11.178 5.828 306 HA3 GLY 52 HA1 GLY 52 4.584 -12.653 5.657 307 H LEU 53 HN LEU 53 4.910 -9.895 3.463 308 HA LEU 53 HA LEU 53 6.139 -11.710 1.496 309 HB2 LEU 53 HB2 LEU 53 3.987 -9.652 0.995 310 HB3 LEU 53 HB1 LEU 53 4.852 -10.510 -0.265 311 HG LEU 53 HG LEU 53 3.176 -11.892 1.825 312 HD11 LEU 53 HD11 LEU 53 1.480 -12.114 0.047 313 HD12 LEU 53 HD12 LEU 53 2.426 -11.021 -0.961 314 HD13 LEU 53 HD13 LEU 53 1.730 -10.443 0.551 315 HD21 LEU 53 HD21 LEU 53 4.854 -13.305 0.800 316 HD22 LEU 53 HD22 LEU 53 4.334 -12.802 -0.808 317 HD23 LEU 53 HD23 LEU 53 3.253 -13.750 0.212 318 H SER 54 HN SER 54 6.779 -10.148 -0.486 319 HA SER 54 HA SER 54 8.527 -8.112 0.700 320 HB2 SER 54 HB2 SER 54 9.666 -9.917 -0.539 321 HB3 SER 54 HB1 SER 54 8.716 -9.533 -1.971 322 HG SER 54 HG SER 54 10.913 -8.248 -0.900 323 H MET 55 HN MET 55 8.603 -6.024 -0.172 324 HA MET 55 HA MET 55 6.165 -5.050 -1.263 325 HB2 MET 55 HB2 MET 55 8.105 -3.876 0.162 326 HB3 MET 55 HB1 MET 55 8.628 -3.389 -1.443 327 HG2 MET 55 HG2 MET 55 6.267 -2.537 -1.797 328 HG3 MET 55 HG1 MET 55 6.035 -2.770 -0.066 329 HE1 MET 55 HE1 MET 55 7.480 -0.603 -2.876 330 HE2 MET 55 HE2 MET 55 8.975 -1.381 -2.357 331 HE3 MET 55 HE3 MET 55 8.742 0.346 -2.090 332 H ARG 56 HN ARG 56 8.966 -6.390 -2.599 333 HA ARG 56 HA ARG 56 8.829 -5.133 -5.171 334 HB2 ARG 56 HB2 ARG 56 10.876 -6.192 -4.075 335 HB3 ARG 56 HB1 ARG 56 10.172 -7.748 -4.486 336 HG2 ARG 56 HG2 ARG 56 10.211 -7.114 -6.860 337 HG3 ARG 56 HG1 ARG 56 10.984 -5.589 -6.419 338 HD2 ARG 56 HD2 ARG 56 12.745 -7.053 -5.267 339 HD3 ARG 56 HD1 ARG 56 12.066 -8.378 -6.203 340 HE ARG 56 HE ARG 56 12.809 -7.330 -8.183 341 HH11 ARG 56 HH11 ARG 56 15.089 -4.720 -6.066 342 HH12 ARG 56 HH12 ARG 56 13.795 -5.665 -5.236 343 HH21 ARG 56 HH21 ARG 56 15.467 -5.008 -8.314 344 HH22 ARG 56 HH22 ARG 56 14.460 -6.163 -9.267 345 H GLN 57 HN GLN 57 7.014 -7.499 -3.602 346 HA GLN 57 HA GLN 57 6.285 -8.870 -6.089 347 HB2 GLN 57 HB2 GLN 57 6.827 -10.359 -4.290 348 HB3 GLN 57 HB1 GLN 57 5.746 -9.512 -3.190 349 HG2 GLN 57 HG2 GLN 57 3.853 -10.198 -4.681 350 HG3 GLN 57 HG1 GLN 57 5.001 -11.215 -5.548 351 HE21 GLN 57 HE21 GLN 57 2.595 -11.832 -3.916 352 HE22 GLN 57 HE22 GLN 57 3.142 -12.993 -2.754 353 H ILE 58 HN ILE 58 4.760 -7.120 -3.383 354 HA ILE 58 HA ILE 58 2.188 -7.228 -4.713 355 HB ILE 58 HB ILE 58 1.409 -5.845 -2.768 356 HG12 ILE 58 HG12 ILE 58 4.237 -6.350 -1.818 357 HG13 ILE 58 HG11 ILE 58 3.508 -4.783 -2.155 358 HG21 ILE 58 HG21 ILE 58 1.128 -8.248 -2.819 359 HG22 ILE 58 HG22 ILE 58 1.517 -7.717 -1.180 360 HG23 ILE 58 HG23 ILE 58 2.759 -8.476 -2.180 361 HD11 ILE 58 HD11 ILE 58 2.858 -6.674 0.081 362 HD12 ILE 58 HD12 ILE 58 1.862 -5.280 -0.327 363 HD13 ILE 58 HD13 ILE 58 3.531 -5.048 0.188 364 H ARG 59 HN ARG 59 0.957 -5.426 -5.329 365 HA ARG 59 HA ARG 59 2.464 -2.942 -5.830 366 HB2 ARG 59 HB2 ARG 59 0.585 -4.340 -7.749 367 HB3 ARG 59 HB1 ARG 59 1.294 -2.755 -8.010 368 HG2 ARG 59 HG2 ARG 59 2.870 -5.299 -7.712 369 HG3 ARG 59 HG1 ARG 59 2.411 -4.571 -9.252 370 HD2 ARG 59 HD2 ARG 59 3.650 -2.546 -8.658 371 HD3 ARG 59 HD1 ARG 59 4.110 -3.279 -7.121 372 HE ARG 59 HE ARG 59 5.181 -3.893 -9.749 373 HH11 ARG 59 HH11 ARG 59 6.360 -5.852 -6.409 374 HH12 ARG 59 HH12 ARG 59 4.929 -4.757 -6.340 375 HH21 ARG 59 HH21 ARG 59 7.019 -5.244 -9.854 376 HH22 ARG 59 HH22 ARG 59 7.528 -6.127 -8.361 377 H PHE 60 HN PHE 60 1.438 -1.208 -5.034 378 HA PHE 60 HA PHE 60 -1.372 -1.498 -4.266 379 HB2 PHE 60 HB2 PHE 60 0.789 0.419 -3.405 380 HB3 PHE 60 HB1 PHE 60 -0.904 0.666 -3.000 381 HD1 PHE 60 HD1 PHE 60 1.776 -1.906 -2.751 382 HD2 PHE 60 HD2 PHE 60 -1.737 -0.219 -1.048 383 HE1 PHE 60 HE1 PHE 60 2.051 -3.344 -0.778 384 HE2 PHE 60 HE2 PHE 60 -1.472 -1.655 0.933 385 HZ PHE 60 HZ PHE 60 0.425 -3.219 1.069 386 H ARG 61 HN ARG 61 -2.966 -0.232 -5.075 387 HA ARG 61 HA ARG 61 -2.205 1.909 -6.938 388 HB2 ARG 61 HB2 ARG 61 -4.081 -0.382 -7.459 389 HB3 ARG 61 HB1 ARG 61 -4.224 1.134 -8.336 390 HG2 ARG 61 HG2 ARG 61 -1.729 0.774 -8.901 391 HG3 ARG 61 HG1 ARG 61 -2.030 -0.896 -8.416 392 HD2 ARG 61 HD2 ARG 61 -3.909 -0.966 -10.038 393 HD3 ARG 61 HD1 ARG 61 -3.454 0.648 -10.576 394 HE ARG 61 HE ARG 61 -1.525 -1.558 -10.732 395 HH11 ARG 61 HH11 ARG 61 -2.677 0.699 -13.890 396 HH12 ARG 61 HH12 ARG 61 -3.441 0.968 -12.275 397 HH21 ARG 61 HH21 ARG 61 -0.520 -1.886 -12.762 398 HH22 ARG 61 HH22 ARG 61 -1.045 -0.868 -14.155 399 H PHE 62 HN PHE 62 -3.578 3.634 -7.043 400 HA PHE 62 HA PHE 62 -5.836 3.638 -5.147 401 HB2 PHE 62 HB2 PHE 62 -4.094 5.044 -4.238 402 HB3 PHE 62 HB1 PHE 62 -3.859 5.840 -5.790 403 HD1 PHE 62 HD1 PHE 62 -6.738 5.150 -3.506 404 HD2 PHE 62 HD2 PHE 62 -4.639 7.991 -5.880 405 HE1 PHE 62 HE1 PHE 62 -8.358 6.886 -2.859 406 HE2 PHE 62 HE2 PHE 62 -6.254 9.728 -5.234 407 HZ PHE 62 HZ PHE 62 -8.115 9.176 -3.721 408 H ASP 63 HN ASP 63 -7.643 3.624 -6.287 409 HA ASP 63 HA ASP 63 -9.293 4.225 -7.729 410 HB2 ASP 63 HB2 ASP 63 -8.765 6.559 -7.471 411 HB3 ASP 63 HB1 ASP 63 -7.367 6.413 -8.531 412 H GLY 64 HN GLY 64 -6.114 4.436 -9.254 413 HA2 GLY 64 HA2 GLY 64 -6.575 2.195 -10.937 414 HA3 GLY 64 HA1 GLY 64 -6.773 3.696 -11.835 415 H GLN 65 HN GLN 65 -4.845 5.197 -10.385 416 HA GLN 65 HA GLN 65 -2.475 4.295 -11.755 417 HB2 GLN 65 HB2 GLN 65 -2.781 6.678 -9.920 418 HB3 GLN 65 HB1 GLN 65 -1.503 6.407 -11.093 419 HG2 GLN 65 HG2 GLN 65 -4.402 6.958 -11.671 420 HG3 GLN 65 HG1 GLN 65 -3.036 8.033 -11.951 421 HE21 GLN 65 HE21 GLN 65 -1.587 7.557 -13.636 422 HE22 GLN 65 HE22 GLN 65 -2.052 6.533 -14.949 423 HA PRO 66 HA PRO 66 -0.604 2.269 -8.295 424 HB2 PRO 66 HB2 PRO 66 2.003 2.426 -8.992 425 HB3 PRO 66 HB1 PRO 66 0.864 1.363 -9.828 426 HG2 PRO 66 HG2 PRO 66 1.882 4.042 -10.657 427 HG3 PRO 66 HG1 PRO 66 1.619 2.586 -11.637 428 HD2 PRO 66 HD2 PRO 66 -0.130 4.665 -11.582 429 HD3 PRO 66 HD1 PRO 66 -0.624 2.986 -11.876 430 H ILE 67 HN ILE 67 0.390 2.712 -6.355 431 HA ILE 67 HA ILE 67 0.678 5.509 -5.704 432 HB ILE 67 HB ILE 67 1.020 3.041 -3.989 433 HG12 ILE 67 HG12 ILE 67 -1.258 5.017 -4.265 434 HG13 ILE 67 HG11 ILE 67 -1.269 3.333 -4.775 435 HG21 ILE 67 HG21 ILE 67 0.906 5.944 -3.177 436 HG22 ILE 67 HG22 ILE 67 2.323 4.896 -3.100 437 HG23 ILE 67 HG23 ILE 67 0.925 4.568 -2.073 438 HD11 ILE 67 HD11 ILE 67 -1.112 4.352 -1.947 439 HD12 ILE 67 HD12 ILE 67 -1.018 2.657 -2.415 440 HD13 ILE 67 HD13 ILE 67 -2.492 3.572 -2.719 441 H ASN 68 HN ASN 68 2.525 6.621 -5.505 442 HA ASN 68 HA ASN 68 5.006 5.305 -6.223 443 HB2 ASN 68 HB2 ASN 68 4.401 8.209 -5.608 444 HB3 ASN 68 HB1 ASN 68 5.953 7.603 -6.176 445 HD21 ASN 68 HD21 ASN 68 2.642 8.257 -7.007 446 HD22 ASN 68 HD22 ASN 68 2.848 8.125 -8.729 447 H GLU 69 HN GLU 69 6.967 5.595 -4.963 448 HA GLU 69 HA GLU 69 6.537 4.964 -2.211 449 HB2 GLU 69 HB2 GLU 69 9.092 5.458 -3.747 450 HB3 GLU 69 HB1 GLU 69 9.014 4.837 -2.104 451 HG2 GLU 69 HG2 GLU 69 7.695 2.910 -2.968 452 HG3 GLU 69 HG1 GLU 69 7.984 3.510 -4.600 453 H THR 70 HN THR 70 6.381 7.850 -3.657 454 HA THR 70 HA THR 70 7.355 9.264 -1.266 455 HB THR 70 HB THR 70 7.356 10.745 -3.838 456 HG1 THR 70 HG1 THR 70 8.700 9.415 -4.778 457 HG21 THR 70 HG21 THR 70 8.048 11.813 -1.753 458 HG22 THR 70 HG22 THR 70 9.405 11.706 -2.876 459 HG23 THR 70 HG23 THR 70 9.290 10.583 -1.520 460 H ASP 71 HN ASP 71 4.701 8.204 -2.268 461 HA ASP 71 HA ASP 71 3.201 10.675 -2.655 462 HB2 ASP 71 HB2 ASP 71 2.631 7.787 -3.070 463 HB3 ASP 71 HB1 ASP 71 1.269 8.840 -2.700 464 H THR 72 HN THR 72 1.373 11.182 -1.416 465 HA THR 72 HA THR 72 1.190 9.994 1.252 466 HB THR 72 HB THR 72 0.794 12.515 1.982 467 HG1 THR 72 HG1 THR 72 2.784 12.874 -0.008 468 HG21 THR 72 HG21 THR 72 2.489 11.055 2.961 469 HG22 THR 72 HG22 THR 72 3.151 12.664 2.670 470 HG23 THR 72 HG23 THR 72 3.549 11.338 1.579 471 HA PRO 73 HA PRO 73 -3.206 10.210 0.741 472 HB2 PRO 73 HB2 PRO 73 -3.372 11.875 3.205 473 HB3 PRO 73 HB1 PRO 73 -4.207 10.366 2.807 474 HG2 PRO 73 HG2 PRO 73 -2.189 10.357 4.527 475 HG3 PRO 73 HG1 PRO 73 -2.396 9.041 3.353 476 HD2 PRO 73 HD2 PRO 73 -0.451 11.299 3.331 477 HD3 PRO 73 HD1 PRO 73 -0.244 9.619 2.799 478 H ALA 74 HN ALA 74 -1.774 13.271 1.857 479 HA ALA 74 HA ALA 74 -3.818 14.907 0.736 480 HB1 ALA 74 HB1 ALA 74 -2.321 16.772 1.244 481 HB2 ALA 74 HB2 ALA 74 -1.018 15.635 1.590 482 HB3 ALA 74 HB3 ALA 74 -2.455 15.665 2.611 483 H GLN 75 HN GLN 75 -0.682 13.759 -0.392 484 HA GLN 75 HA GLN 75 -0.459 15.451 -2.646 485 HB2 GLN 75 HB2 GLN 75 1.404 14.118 -1.630 486 HB3 GLN 75 HB1 GLN 75 0.685 12.673 -2.325 487 HG2 GLN 75 HG2 GLN 75 2.459 13.366 -3.743 488 HG3 GLN 75 HG1 GLN 75 0.941 13.698 -4.573 489 HE21 GLN 75 HE21 GLN 75 1.827 15.258 -5.888 490 HE22 GLN 75 HE22 GLN 75 2.320 16.809 -5.304 491 H LEU 76 HN LEU 76 -1.867 12.235 -2.209 492 HA LEU 76 HA LEU 76 -2.572 12.086 -5.022 493 HB2 LEU 76 HB2 LEU 76 -2.956 10.216 -2.701 494 HB3 LEU 76 HB1 LEU 76 -3.670 9.911 -4.273 495 HG LEU 76 HG LEU 76 -0.730 10.062 -3.612 496 HD11 LEU 76 HD11 LEU 76 -2.437 7.815 -4.663 497 HD12 LEU 76 HD12 LEU 76 -1.858 7.976 -3.007 498 HD13 LEU 76 HD13 LEU 76 -0.709 7.744 -4.323 499 HD21 LEU 76 HD21 LEU 76 -0.989 11.100 -5.745 500 HD22 LEU 76 HD22 LEU 76 -2.112 9.852 -6.281 501 HD23 LEU 76 HD23 LEU 76 -0.414 9.457 -6.017 502 H GLU 77 HN GLU 77 -3.816 13.822 -2.647 503 HA GLU 77 HA GLU 77 -5.826 14.763 -2.166 504 HB2 GLU 77 HB2 GLU 77 -6.709 13.788 -4.883 505 HB3 GLU 77 HB1 GLU 77 -7.328 15.169 -3.989 506 HG2 GLU 77 HG2 GLU 77 -4.482 15.391 -4.445 507 HG3 GLU 77 HG1 GLU 77 -5.374 15.189 -5.952 508 H MET 78 HN MET 78 -5.516 12.287 -1.083 509 HA MET 78 HA MET 78 -7.871 10.679 -1.622 510 HB2 MET 78 HB2 MET 78 -5.833 10.344 0.586 511 HB3 MET 78 HB1 MET 78 -6.981 9.141 0.015 512 HG2 MET 78 HG2 MET 78 -5.841 9.025 -2.117 513 HG3 MET 78 HG1 MET 78 -4.727 10.291 -1.604 514 HE1 MET 78 HE1 MET 78 -6.129 7.021 0.246 515 HE2 MET 78 HE2 MET 78 -4.793 5.938 -0.140 516 HE3 MET 78 HE3 MET 78 -5.775 6.621 -1.436 517 H GLU 79 HN GLU 79 -9.409 10.138 0.058 518 HA GLU 79 HA GLU 79 -9.643 12.227 2.114 519 HB2 GLU 79 HB2 GLU 79 -11.408 11.771 -0.098 520 HB3 GLU 79 HB1 GLU 79 -12.258 11.429 1.402 521 HG2 GLU 79 HG2 GLU 79 -10.967 13.990 0.531 522 HG3 GLU 79 HG1 GLU 79 -12.653 13.696 0.953 523 H ASP 80 HN ASP 80 -11.572 11.531 3.634 524 HA ASP 80 HA ASP 80 -10.674 9.190 4.958 525 HB2 ASP 80 HB2 ASP 80 -11.780 11.232 5.997 526 HB3 ASP 80 HB1 ASP 80 -13.312 10.582 5.424 527 H GLU 81 HN GLU 81 -11.662 7.202 5.229 528 HA GLU 81 HA GLU 81 -12.878 5.353 4.708 529 HB2 GLU 81 HB2 GLU 81 -14.791 7.407 3.601 530 HB3 GLU 81 HB1 GLU 81 -15.133 5.684 3.626 531 HG2 GLU 81 HG2 GLU 81 -14.344 6.960 6.180 532 HG3 GLU 81 HG1 GLU 81 -15.945 7.330 5.536 533 H ASP 82 HN ASP 82 -10.841 6.449 2.927 534 HA ASP 82 HA ASP 82 -11.762 5.969 0.240 535 HB2 ASP 82 HB2 ASP 82 -9.593 7.321 1.340 536 HB3 ASP 82 HB1 ASP 82 -8.876 5.922 0.541 537 H THR 83 HN THR 83 -10.207 4.465 -1.130 538 HA THR 83 HA THR 83 -9.810 1.949 0.338 539 HB THR 83 HB THR 83 -11.153 1.993 -2.363 540 HG1 THR 83 HG1 THR 83 -12.201 2.742 -0.027 541 HG21 THR 83 HG21 THR 83 -11.816 -0.291 -1.724 542 HG22 THR 83 HG22 THR 83 -10.932 -0.115 -0.208 543 HG23 THR 83 HG23 THR 83 -10.062 -0.103 -1.742 544 H ILE 84 HN ILE 84 -8.023 0.898 -0.161 545 HA ILE 84 HA ILE 84 -6.543 1.660 -2.600 546 HB ILE 84 HB ILE 84 -5.321 0.719 0.005 547 HG12 ILE 84 HG12 ILE 84 -5.371 3.523 -1.130 548 HG13 ILE 84 HG11 ILE 84 -6.357 2.969 0.218 549 HG21 ILE 84 HG21 ILE 84 -3.214 1.531 -1.050 550 HG22 ILE 84 HG22 ILE 84 -4.117 1.772 -2.547 551 HG23 ILE 84 HG23 ILE 84 -3.950 0.152 -1.870 552 HD11 ILE 84 HD11 ILE 84 -3.350 3.091 0.160 553 HD12 ILE 84 HD12 ILE 84 -4.336 2.535 1.512 554 HD13 ILE 84 HD13 ILE 84 -4.426 4.216 0.991 555 H ASP 85 HN ASP 85 -5.848 -0.023 -3.885 556 HA ASP 85 HA ASP 85 -6.665 -2.707 -2.991 557 HB2 ASP 85 HB2 ASP 85 -6.514 -1.443 -5.710 558 HB3 ASP 85 HB1 ASP 85 -6.508 -3.194 -5.530 559 H VAL 86 HN VAL 86 -5.339 -4.466 -3.257 560 HA VAL 86 HA VAL 86 -2.502 -3.854 -3.786 561 HB VAL 86 HB VAL 86 -3.526 -6.065 -2.002 562 HG11 VAL 86 HG11 VAL 86 -1.224 -6.131 -1.193 563 HG12 VAL 86 HG12 VAL 86 -0.787 -4.838 -2.308 564 HG13 VAL 86 HG13 VAL 86 -1.293 -6.406 -2.935 565 HG21 VAL 86 HG21 VAL 86 -2.914 -4.667 -0.097 566 HG22 VAL 86 HG22 VAL 86 -4.177 -3.902 -1.064 567 HG23 VAL 86 HG23 VAL 86 -2.509 -3.343 -1.192 568 H PHE 87 HN PHE 87 -1.785 -4.747 -5.590 569 HA PHE 87 HA PHE 87 -3.074 -7.195 -6.592 570 HB2 PHE 87 HB2 PHE 87 -1.429 -5.098 -8.026 571 HB3 PHE 87 HB1 PHE 87 -2.017 -6.577 -8.775 572 HD1 PHE 87 HD1 PHE 87 -4.338 -6.848 -9.344 573 HD2 PHE 87 HD2 PHE 87 -2.951 -3.301 -7.442 574 HE1 PHE 87 HE1 PHE 87 -6.446 -5.721 -9.918 575 HE2 PHE 87 HE2 PHE 87 -5.062 -2.171 -8.007 576 HZ PHE 87 HZ PHE 87 -6.810 -3.378 -9.248 577 H GLN 88 HN GLN 88 -1.706 -8.840 -7.535 578 HA GLN 88 HA GLN 88 0.896 -9.004 -6.169 579 HB2 GLN 88 HB2 GLN 88 -0.789 -11.240 -7.312 580 HB3 GLN 88 HB1 GLN 88 0.703 -11.429 -6.405 581 HG2 GLN 88 HG2 GLN 88 -1.838 -10.243 -5.317 582 HG3 GLN 88 HG1 GLN 88 -1.316 -11.908 -5.088 583 HE21 GLN 88 HE21 GLN 88 -1.847 -9.893 -3.101 584 HE22 GLN 88 HE22 GLN 88 -0.384 -9.688 -2.202 585 H GLN 89 HN GLN 89 2.730 -9.188 -7.325 586 HA GLN 89 HA GLN 89 2.768 -8.616 -10.075 587 HB2 GLN 89 HB2 GLN 89 4.611 -8.214 -8.379 588 HB3 GLN 89 HB1 GLN 89 4.998 -9.922 -8.514 589 HG2 GLN 89 HG2 GLN 89 6.449 -8.472 -9.876 590 HG3 GLN 89 HG1 GLN 89 5.569 -9.667 -10.825 591 HE21 GLN 89 HE21 GLN 89 5.908 -8.402 -12.675 592 HE22 GLN 89 HE22 GLN 89 4.982 -6.972 -12.974 593 H GLN 90 HN GLN 90 3.069 -9.875 -11.868 594 HA GLN 90 HA GLN 90 2.096 -12.545 -11.746 595 HB2 GLN 90 HB2 GLN 90 3.314 -10.951 -14.002 596 HB3 GLN 90 HB1 GLN 90 2.635 -12.559 -14.200 597 HG2 GLN 90 HG2 GLN 90 0.906 -11.184 -14.869 598 HG3 GLN 90 HG1 GLN 90 0.495 -11.527 -13.191 599 HE21 GLN 90 HE21 GLN 90 -0.781 -9.646 -13.152 600 HE22 GLN 90 HE22 GLN 90 -0.063 -8.077 -13.021 601 H THR 91 HN THR 91 3.143 -14.447 -11.830 602 HA THR 91 HA THR 91 5.904 -14.525 -11.121 603 HB THR 91 HB THR 91 5.448 -17.077 -11.547 604 HG1 THR 91 HG1 THR 91 3.349 -17.613 -11.747 605 HG21 THR 91 HG21 THR 91 4.113 -15.474 -9.364 606 HG22 THR 91 HG22 THR 91 5.737 -16.156 -9.335 607 HG23 THR 91 HG23 THR 91 4.335 -17.221 -9.328 608 H GLY 92 HN GLY 92 4.113 -14.791 -14.076 609 HA2 GLY 92 HA2 GLY 92 6.611 -15.484 -15.490 610 HA3 GLY 92 HA1 GLY 92 5.021 -16.006 -16.034 611 H ASN 357 HT1 ASN 357 -16.222 -10.367 7.209 612 HA ASN 357 HA ASN 357 -13.641 -10.582 5.792 613 HB2 ASN 357 HB2 ASN 357 -13.882 -8.250 5.210 614 HB3 ASN 357 HB1 ASN 357 -15.281 -9.125 4.606 615 HD21 ASN 357 HD21 ASN 357 -14.909 -6.273 5.248 616 HD22 ASN 357 HD22 ASN 357 -16.154 -5.886 6.388 617 H ASN 358 HN ASN 358 -12.027 -9.108 6.763 618 HA ASN 358 HA ASN 358 -12.538 -8.692 9.628 619 HB2 ASN 358 HB2 ASN 358 -10.341 -9.414 10.197 620 HB3 ASN 358 HB1 ASN 358 -10.938 -10.612 9.052 621 HD21 ASN 358 HD21 ASN 358 -8.473 -8.393 9.746 622 HD22 ASN 358 HD22 ASN 358 -7.642 -8.476 8.234 623 H ARG 359 HN ARG 359 -12.244 -6.669 10.358 624 HA ARG 359 HA ARG 359 -10.525 -4.912 8.735 625 HB2 ARG 359 HB2 ARG 359 -12.052 -3.020 9.395 626 HB3 ARG 359 HB1 ARG 359 -12.756 -4.187 8.285 627 HG2 ARG 359 HG2 ARG 359 -13.789 -5.290 10.295 628 HG3 ARG 359 HG1 ARG 359 -13.259 -3.886 11.221 629 HD2 ARG 359 HD2 ARG 359 -15.026 -3.757 8.786 630 HD3 ARG 359 HD1 ARG 359 -15.610 -3.748 10.448 631 HE ARG 359 HE ARG 359 -13.740 -1.689 10.184 632 HH11 ARG 359 HH11 ARG 359 -16.922 -2.590 9.008 633 HH12 ARG 359 HH12 ARG 359 -17.471 -0.882 8.822 634 HH21 ARG 359 HH21 ARG 359 -14.399 0.510 9.955 635 HH22 ARG 359 HH22 ARG 359 -16.072 0.848 9.375 636 H ASP 360 HN ASP 360 -8.833 -4.247 9.857 637 HA ASP 360 HA ASP 360 -9.156 -3.623 12.691 638 HB2 ASP 360 HB2 ASP 360 -7.402 -4.843 13.440 639 HB3 ASP 360 HB1 ASP 360 -7.879 -5.854 12.091 640 HA PRO 361 HA PRO 361 -7.112 0.057 11.256 641 HB2 PRO 361 HB2 PRO 361 -7.548 1.553 13.443 642 HB3 PRO 361 HB1 PRO 361 -8.873 0.998 12.417 643 HG2 PRO 361 HG2 PRO 361 -8.174 0.156 15.132 644 HG3 PRO 361 HG1 PRO 361 -9.684 -0.078 14.235 645 HD2 PRO 361 HD2 PRO 361 -7.477 -1.942 14.606 646 HD3 PRO 361 HD1 PRO 361 -9.095 -2.236 13.936 647 H ILE 362 HN ILE 362 -5.132 0.698 11.091 648 HA ILE 362 HA ILE 362 -3.191 0.319 13.283 649 HB ILE 362 HB ILE 362 -2.458 0.427 10.365 650 HG12 ILE 362 HG12 ILE 362 -2.316 -2.238 10.979 651 HG13 ILE 362 HG11 ILE 362 -3.799 -1.765 11.800 652 HG21 ILE 362 HG21 ILE 362 -1.112 -0.940 12.681 653 HG22 ILE 362 HG22 ILE 362 -0.726 0.689 12.127 654 HG23 ILE 362 HG23 ILE 362 -0.467 -0.690 11.059 655 HD11 ILE 362 HD11 ILE 362 -3.192 -1.345 8.883 656 HD12 ILE 362 HD12 ILE 362 -4.686 -0.889 9.703 657 HD13 ILE 362 HD13 ILE 362 -4.244 -2.592 9.557 658 H VAL 363 HN VAL 363 -2.014 2.093 13.899 659 HA VAL 363 HA VAL 363 -2.351 4.528 12.257 660 HB VAL 363 HB VAL 363 -1.898 4.348 15.247 661 HG11 VAL 363 HG11 VAL 363 -0.891 6.341 14.265 662 HG12 VAL 363 HG12 VAL 363 -2.280 6.754 15.272 663 HG13 VAL 363 HG13 VAL 363 -2.433 6.757 13.514 664 HG21 VAL 363 HG21 VAL 363 -4.152 4.974 15.577 665 HG22 VAL 363 HG22 VAL 363 -4.179 3.654 14.408 666 HG23 VAL 363 HG23 VAL 363 -4.380 5.318 13.862 667 H ILE 364 HN ILE 364 -0.567 5.352 11.418 668 HA ILE 364 HA ILE 364 2.031 4.739 12.669 669 HB ILE 364 HB ILE 364 1.554 5.150 9.709 670 HG12 ILE 364 HG12 ILE 364 2.415 2.576 11.014 671 HG13 ILE 364 HG11 ILE 364 0.714 2.952 10.749 672 HG21 ILE 364 HG21 ILE 364 4.046 4.314 11.192 673 HG22 ILE 364 HG22 ILE 364 3.745 5.915 10.520 674 HG23 ILE 364 HG23 ILE 364 3.890 4.524 9.446 675 HD11 ILE 364 HD11 ILE 364 1.127 3.129 8.353 676 HD12 ILE 364 HD12 ILE 364 1.613 1.549 8.972 677 HD13 ILE 364 HD13 ILE 364 2.834 2.774 8.618 678 H SER 365 HN SER 365 3.164 6.499 13.265 679 HA SER 365 HA SER 365 2.509 9.052 11.956 680 HB2 SER 365 HB2 SER 365 3.127 8.679 14.898 681 HB3 SER 365 HB1 SER 365 2.799 10.212 14.090 682 HG SER 365 HG SER 365 0.915 8.210 13.736 683 H ASP 366 HN ASP 366 4.217 10.085 11.099 684 HA ASP 366 HA ASP 366 6.883 9.335 12.096 685 HB2 ASP 366 HB2 ASP 366 6.018 8.669 9.615 686 HB3 ASP 366 HB1 ASP 366 6.733 10.247 9.292 687 H SER 367 HN SER 367 8.217 10.945 12.633 688 HA SER 367 HA SER 367 7.302 13.694 12.097 689 HB2 SER 367 HB2 SER 367 8.911 14.073 14.179 690 HB3 SER 367 HB1 SER 367 7.242 13.552 14.406 691 HG SER 367 HG SER 367 9.521 11.858 14.279 692 HA PRO 368 HA PRO 368 11.330 13.582 9.975 693 HB2 PRO 368 HB2 PRO 368 10.461 15.228 7.901 694 HB3 PRO 368 HB1 PRO 368 10.437 13.463 7.889 695 HG2 PRO 368 HG2 PRO 368 8.201 15.210 7.905 696 HG3 PRO 368 HG1 PRO 368 8.195 13.442 7.991 697 HD2 PRO 368 HD2 PRO 368 7.882 15.422 10.158 698 HD3 PRO 368 HD1 PRO 368 7.334 13.734 10.075 Start of MODEL 13 1 H ASP 16 HT1 ASP 16 -4.757 16.219 11.317 2 HA ASP 16 HA ASP 16 -6.108 14.654 13.432 3 HB2 ASP 16 HB2 ASP 16 -7.030 16.333 11.225 4 HB3 ASP 16 HB1 ASP 16 -7.690 14.703 11.152 5 H HIS 17 HN HIS 17 -7.022 12.600 12.546 6 HA HIS 17 HA HIS 17 -4.997 11.314 10.861 7 HB2 HIS 17 HB2 HIS 17 -6.934 10.252 12.908 8 HB3 HIS 17 HB1 HIS 17 -6.107 9.188 11.778 9 HD2 HIS 17 HD2 HIS 17 -3.271 9.117 12.093 10 HE1 HIS 17 HE1 HIS 17 -3.454 10.657 16.027 11 HE2 HIS 17 HE2 HIS 17 -2.073 9.316 14.383 12 H ILE 18 HN ILE 18 -5.605 9.876 9.215 13 HA ILE 18 HA ILE 18 -8.301 10.363 8.127 14 HB ILE 18 HB ILE 18 -6.560 11.349 6.708 15 HG12 ILE 18 HG12 ILE 18 -7.717 8.855 5.443 16 HG13 ILE 18 HG11 ILE 18 -8.588 10.369 5.669 17 HG21 ILE 18 HG21 ILE 18 -4.906 9.934 5.567 18 HG22 ILE 18 HG22 ILE 18 -5.436 8.556 6.532 19 HG23 ILE 18 HG23 ILE 18 -4.681 9.946 7.316 20 HD11 ILE 18 HD11 ILE 18 -6.139 9.976 3.968 21 HD12 ILE 18 HD12 ILE 18 -7.000 11.497 4.200 22 HD13 ILE 18 HD13 ILE 18 -7.797 10.146 3.394 23 H ASN 19 HN ASN 19 -9.490 8.600 7.452 24 HA ASN 19 HA ASN 19 -8.430 6.004 8.314 25 HB2 ASN 19 HB2 ASN 19 -11.257 6.934 7.789 26 HB3 ASN 19 HB1 ASN 19 -10.828 5.275 8.201 27 HD21 ASN 19 HD21 ASN 19 -11.048 8.554 9.333 28 HD22 ASN 19 HD22 ASN 19 -10.933 8.186 11.023 29 H LEU 20 HN LEU 20 -7.292 5.188 6.639 30 HA LEU 20 HA LEU 20 -8.579 5.070 3.998 31 HB2 LEU 20 HB2 LEU 20 -5.741 4.471 4.850 32 HB3 LEU 20 HB1 LEU 20 -6.339 4.340 3.209 33 HG LEU 20 HG LEU 20 -6.298 6.915 4.781 34 HD11 LEU 20 HD11 LEU 20 -4.370 5.954 2.674 35 HD12 LEU 20 HD12 LEU 20 -4.027 6.078 4.399 36 HD13 LEU 20 HD13 LEU 20 -4.363 7.531 3.460 37 HD21 LEU 20 HD21 LEU 20 -6.635 7.934 2.576 38 HD22 LEU 20 HD22 LEU 20 -7.966 6.867 3.021 39 HD23 LEU 20 HD23 LEU 20 -6.756 6.326 1.860 40 H LYS 21 HN LYS 21 -8.938 3.068 2.968 41 HA LYS 21 HA LYS 21 -8.652 0.736 4.749 42 HB2 LYS 21 HB2 LYS 21 -10.923 1.603 3.013 43 HB3 LYS 21 HB1 LYS 21 -10.662 -0.114 3.280 44 HG2 LYS 21 HG2 LYS 21 -10.867 0.193 5.668 45 HG3 LYS 21 HG1 LYS 21 -11.041 1.936 5.450 46 HD2 LYS 21 HD2 LYS 21 -13.124 1.650 4.309 47 HD3 LYS 21 HD1 LYS 21 -12.903 -0.098 4.233 48 HE2 LYS 21 HE2 LYS 21 -13.244 -0.347 6.547 49 HE3 LYS 21 HE1 LYS 21 -13.054 1.380 6.843 50 HZ1 LYS 21 HZ1 LYS 21 -15.121 1.778 5.655 51 HZ2 LYS 21 HZ2 LYS 21 -15.368 0.717 6.952 52 HZ3 LYS 21 HZ3 LYS 21 -15.302 0.116 5.375 53 H VAL 22 HN VAL 22 -7.629 -0.978 4.010 54 HA VAL 22 HA VAL 22 -6.914 -1.044 1.148 55 HB VAL 22 HB VAL 22 -5.394 -2.250 3.474 56 HG11 VAL 22 HG11 VAL 22 -5.183 -3.523 1.387 57 HG12 VAL 22 HG12 VAL 22 -3.665 -2.753 1.844 58 HG13 VAL 22 HG13 VAL 22 -4.649 -2.061 0.557 59 HG21 VAL 22 HG21 VAL 22 -3.714 -0.545 3.057 60 HG22 VAL 22 HG22 VAL 22 -5.268 0.204 3.425 61 HG23 VAL 22 HG23 VAL 22 -4.695 0.131 1.758 62 H ALA 23 HN ALA 23 -8.134 -2.486 0.125 63 HA ALA 23 HA ALA 23 -8.993 -4.889 1.591 64 HB1 ALA 23 HB1 ALA 23 -10.853 -5.031 0.040 65 HB2 ALA 23 HB2 ALA 23 -10.243 -3.634 -0.848 66 HB3 ALA 23 HB3 ALA 23 -10.815 -3.443 0.810 67 H GLY 24 HN GLY 24 -8.167 -6.768 1.024 68 HA2 GLY 24 HA2 GLY 24 -6.423 -6.958 -1.275 69 HA3 GLY 24 HA1 GLY 24 -6.745 -8.226 -0.097 70 H GLN 25 HN GLN 25 -6.643 -9.190 -2.499 71 HA GLN 25 HA GLN 25 -9.169 -9.036 -3.896 72 HB2 GLN 25 HB2 GLN 25 -6.671 -10.670 -4.343 73 HB3 GLN 25 HB1 GLN 25 -8.093 -10.772 -5.376 74 HG2 GLN 25 HG2 GLN 25 -6.673 -8.178 -4.851 75 HG3 GLN 25 HG1 GLN 25 -6.201 -9.271 -6.151 76 HE21 GLN 25 HE21 GLN 25 -7.435 -6.506 -6.057 77 HE22 GLN 25 HE22 GLN 25 -8.797 -6.630 -7.115 78 H ASP 26 HN ASP 26 -9.293 -9.991 -1.194 79 HA ASP 26 HA ASP 26 -10.540 -12.588 -1.698 80 HB2 ASP 26 HB2 ASP 26 -9.705 -13.169 0.734 81 HB3 ASP 26 HB1 ASP 26 -8.673 -13.459 -0.660 82 H GLY 27 HN GLY 27 -10.040 -10.921 1.380 83 HA2 GLY 27 HA2 GLY 27 -12.610 -9.654 1.386 84 HA3 GLY 27 HA1 GLY 27 -12.625 -11.144 2.314 85 H SER 28 HN SER 28 -9.585 -9.675 2.352 86 HA SER 28 HA SER 28 -9.982 -8.880 5.116 87 HB2 SER 28 HB2 SER 28 -7.454 -8.440 4.945 88 HB3 SER 28 HB1 SER 28 -7.985 -10.114 4.793 89 HG SER 28 HG SER 28 -7.757 -9.954 2.550 90 H VAL 29 HN VAL 29 -10.449 -6.831 5.697 91 HA VAL 29 HA VAL 29 -9.579 -4.695 3.847 92 HB VAL 29 HB VAL 29 -12.184 -4.620 5.375 93 HG11 VAL 29 HG11 VAL 29 -12.674 -2.693 3.962 94 HG12 VAL 29 HG12 VAL 29 -11.107 -2.861 3.172 95 HG13 VAL 29 HG13 VAL 29 -11.191 -2.437 4.881 96 HG21 VAL 29 HG21 VAL 29 -13.298 -4.973 3.215 97 HG22 VAL 29 HG22 VAL 29 -12.314 -6.361 3.677 98 HG23 VAL 29 HG23 VAL 29 -11.729 -5.233 2.455 99 H VAL 30 HN VAL 30 -7.779 -4.280 5.132 100 HA VAL 30 HA VAL 30 -8.103 -3.676 7.934 101 HB VAL 30 HB VAL 30 -5.711 -3.079 7.893 102 HG11 VAL 30 HG11 VAL 30 -6.404 -5.699 6.570 103 HG12 VAL 30 HG12 VAL 30 -6.308 -5.379 8.300 104 HG13 VAL 30 HG13 VAL 30 -4.848 -5.326 7.315 105 HG21 VAL 30 HG21 VAL 30 -5.856 -3.750 4.954 106 HG22 VAL 30 HG22 VAL 30 -4.387 -3.401 5.865 107 HG23 VAL 30 HG23 VAL 30 -5.600 -2.143 5.635 108 H GLN 31 HN GLN 31 -7.709 -1.648 8.891 109 HA GLN 31 HA GLN 31 -8.287 0.620 7.102 110 HB2 GLN 31 HB2 GLN 31 -10.114 -0.020 8.691 111 HB3 GLN 31 HB1 GLN 31 -9.028 0.356 10.019 112 HG2 GLN 31 HG2 GLN 31 -9.134 2.614 9.651 113 HG3 GLN 31 HG1 GLN 31 -9.545 2.426 7.945 114 HE21 GLN 31 HE21 GLN 31 -10.852 4.010 10.032 115 HE22 GLN 31 HE22 GLN 31 -12.494 3.468 10.061 116 H PHE 32 HN PHE 32 -6.621 1.900 6.877 117 HA PHE 32 HA PHE 32 -4.561 1.990 8.946 118 HB2 PHE 32 HB2 PHE 32 -4.644 2.649 6.034 119 HB3 PHE 32 HB1 PHE 32 -3.470 3.483 7.049 120 HD1 PHE 32 HD1 PHE 32 -4.436 0.314 5.548 121 HD2 PHE 32 HD2 PHE 32 -1.675 2.253 8.140 122 HE1 PHE 32 HE1 PHE 32 -2.932 -1.626 5.393 123 HE2 PHE 32 HE2 PHE 32 -0.165 0.318 7.986 124 HZ PHE 32 HZ PHE 32 -0.791 -1.625 6.610 125 H LYS 33 HN LYS 33 -5.065 3.380 10.503 126 HA LYS 33 HA LYS 33 -6.280 5.957 9.782 127 HB2 LYS 33 HB2 LYS 33 -7.242 4.483 11.628 128 HB3 LYS 33 HB1 LYS 33 -5.802 4.867 12.560 129 HG2 LYS 33 HG2 LYS 33 -6.404 7.290 12.300 130 HG3 LYS 33 HG1 LYS 33 -7.946 6.754 11.632 131 HD2 LYS 33 HD2 LYS 33 -8.315 5.442 13.724 132 HD3 LYS 33 HD1 LYS 33 -6.856 6.181 14.384 133 HE2 LYS 33 HE2 LYS 33 -7.872 8.401 14.082 134 HE3 LYS 33 HE1 LYS 33 -9.342 7.628 13.488 135 HZ1 LYS 33 HZ1 LYS 33 -9.425 6.442 15.669 136 HZ2 LYS 33 HZ2 LYS 33 -9.678 8.108 15.759 137 HZ3 LYS 33 HZ3 LYS 33 -8.182 7.455 16.210 138 H ILE 34 HN ILE 34 -4.296 6.673 8.828 139 HA ILE 34 HA ILE 34 -2.164 7.289 10.765 140 HB ILE 34 HB ILE 34 -0.629 7.429 8.884 141 HG12 ILE 34 HG12 ILE 34 -2.956 6.594 7.131 142 HG13 ILE 34 HG11 ILE 34 -2.331 8.239 7.223 143 HG21 ILE 34 HG21 ILE 34 -0.676 5.059 8.188 144 HG22 ILE 34 HG22 ILE 34 -2.295 4.915 8.877 145 HG23 ILE 34 HG23 ILE 34 -0.921 5.267 9.923 146 HD11 ILE 34 HD11 ILE 34 -1.512 7.005 5.265 147 HD12 ILE 34 HD12 ILE 34 -0.746 5.836 6.342 148 HD13 ILE 34 HD13 ILE 34 -0.208 7.515 6.334 149 H LYS 35 HN LYS 35 -0.803 9.241 9.696 150 HA LYS 35 HA LYS 35 -2.664 11.480 9.715 151 HB2 LYS 35 HB2 LYS 35 0.357 11.351 9.868 152 HB3 LYS 35 HB1 LYS 35 -0.562 12.850 9.874 153 HG2 LYS 35 HG2 LYS 35 -1.615 12.270 11.951 154 HG3 LYS 35 HG1 LYS 35 -0.894 10.663 11.916 155 HD2 LYS 35 HD2 LYS 35 1.318 11.604 12.170 156 HD3 LYS 35 HD1 LYS 35 0.666 13.239 12.061 157 HE2 LYS 35 HE2 LYS 35 -0.559 12.926 14.125 158 HE3 LYS 35 HE1 LYS 35 -0.035 11.247 14.216 159 HZ1 LYS 35 HZ1 LYS 35 1.878 13.505 14.201 160 HZ2 LYS 35 HZ2 LYS 35 2.169 11.902 14.642 161 HZ3 LYS 35 HZ3 LYS 35 1.216 12.893 15.629 162 H ARG 36 HN ARG 36 -2.541 13.150 8.067 163 HA ARG 36 HA ARG 36 -2.429 11.973 5.473 164 HB2 ARG 36 HB2 ARG 36 -3.204 14.618 6.568 165 HB3 ARG 36 HB1 ARG 36 -2.809 14.526 4.857 166 HG2 ARG 36 HG2 ARG 36 -4.483 12.783 4.553 167 HG3 ARG 36 HG1 ARG 36 -4.869 12.846 6.273 168 HD2 ARG 36 HD2 ARG 36 -5.940 14.874 6.091 169 HD3 ARG 36 HD1 ARG 36 -5.026 15.348 4.659 170 HE ARG 36 HE ARG 36 -6.378 13.619 3.459 171 HH11 ARG 36 HH11 ARG 36 -7.604 15.214 6.353 172 HH12 ARG 36 HH12 ARG 36 -9.326 14.935 5.900 173 HH21 ARG 36 HH21 ARG 36 -8.530 13.238 2.869 174 HH22 ARG 36 HH22 ARG 36 -9.845 13.856 3.941 175 H HIS 37 HN HIS 37 -0.020 13.374 7.358 176 HA HIS 37 HA HIS 37 1.510 14.167 4.988 177 HB2 HIS 37 HB2 HIS 37 2.990 15.382 6.424 178 HB3 HIS 37 HB1 HIS 37 1.346 15.785 6.897 179 HD2 HIS 37 HD2 HIS 37 0.611 15.040 9.455 180 HE1 HIS 37 HE1 HIS 37 4.446 13.614 10.545 181 HE2 HIS 37 HE2 HIS 37 2.221 14.475 11.411 182 H THR 38 HN THR 38 0.978 11.454 6.658 183 HA THR 38 HA THR 38 3.699 10.515 6.929 184 HB THR 38 HB THR 38 1.126 8.941 7.163 185 HG1 THR 38 HG1 THR 38 2.279 10.824 8.796 186 HG21 THR 38 HG21 THR 38 2.504 7.481 8.619 187 HG22 THR 38 HG22 THR 38 3.922 8.438 8.190 188 HG23 THR 38 HG23 THR 38 3.073 7.517 6.951 189 HA PRO 39 HA PRO 39 4.108 9.343 2.629 190 HB2 PRO 39 HB2 PRO 39 6.055 7.431 3.816 191 HB3 PRO 39 HB1 PRO 39 6.271 8.582 2.490 192 HG2 PRO 39 HG2 PRO 39 7.308 9.096 4.871 193 HG3 PRO 39 HG1 PRO 39 6.570 10.387 3.901 194 HD2 PRO 39 HD2 PRO 39 5.489 8.976 6.292 195 HD3 PRO 39 HD1 PRO 39 5.323 10.675 5.808 196 H LEU 40 HN LEU 40 3.084 7.891 1.409 197 HA LEU 40 HA LEU 40 1.608 5.778 2.620 198 HB2 LEU 40 HB2 LEU 40 2.042 6.616 -0.233 199 HB3 LEU 40 HB1 LEU 40 1.112 5.187 0.179 200 HG LEU 40 HG LEU 40 0.458 7.986 1.115 201 HD11 LEU 40 HD11 LEU 40 -1.411 7.848 -0.463 202 HD12 LEU 40 HD12 LEU 40 -0.777 6.316 -1.065 203 HD13 LEU 40 HD13 LEU 40 0.152 7.801 -1.275 204 HD21 LEU 40 HD21 LEU 40 -1.014 5.365 1.368 205 HD22 LEU 40 HD22 LEU 40 -1.710 6.943 1.734 206 HD23 LEU 40 HD23 LEU 40 -0.347 6.343 2.676 207 H SER 41 HN SER 41 4.788 5.994 1.534 208 HA SER 41 HA SER 41 5.249 3.413 0.533 209 HB2 SER 41 HB2 SER 41 7.572 4.174 1.884 210 HB3 SER 41 HB1 SER 41 7.196 4.496 0.190 211 HG SER 41 HG SER 41 7.139 6.526 0.704 212 H LYS 42 HN LYS 42 5.208 4.758 3.786 213 HA LYS 42 HA LYS 42 6.084 2.408 5.119 214 HB2 LYS 42 HB2 LYS 42 5.083 5.054 5.855 215 HB3 LYS 42 HB1 LYS 42 4.545 3.794 6.956 216 HG2 LYS 42 HG2 LYS 42 6.508 3.823 7.965 217 HG3 LYS 42 HG1 LYS 42 7.308 3.398 6.452 218 HD2 LYS 42 HD2 LYS 42 7.490 5.734 5.847 219 HD3 LYS 42 HD1 LYS 42 6.578 6.209 7.280 220 HE2 LYS 42 HE2 LYS 42 8.326 5.424 8.720 221 HE3 LYS 42 HE1 LYS 42 9.194 4.726 7.358 222 HZ1 LYS 42 HZ1 LYS 42 9.631 6.891 6.498 223 HZ2 LYS 42 HZ2 LYS 42 10.107 6.870 8.121 224 HZ3 LYS 42 HZ3 LYS 42 8.661 7.631 7.675 225 H LEU 43 HN LEU 43 2.965 3.691 4.170 226 HA LEU 43 HA LEU 43 1.308 1.917 5.581 227 HB2 LEU 43 HB2 LEU 43 0.497 3.965 4.490 228 HB3 LEU 43 HB1 LEU 43 0.844 3.276 2.917 229 HG LEU 43 HG LEU 43 -1.001 1.701 4.604 230 HD11 LEU 43 HD11 LEU 43 -2.906 3.152 4.130 231 HD12 LEU 43 HD12 LEU 43 -1.823 4.353 3.428 232 HD13 LEU 43 HD13 LEU 43 -1.720 3.970 5.146 233 HD21 LEU 43 HD21 LEU 43 -1.098 2.624 1.730 234 HD22 LEU 43 HD22 LEU 43 -2.162 1.434 2.480 235 HD23 LEU 43 HD23 LEU 43 -0.444 1.085 2.290 236 H MET 44 HN MET 44 2.701 1.756 2.337 237 HA MET 44 HA MET 44 1.561 -0.715 1.604 238 HB2 MET 44 HB2 MET 44 4.074 0.664 0.643 239 HB3 MET 44 HB1 MET 44 3.401 -0.777 -0.105 240 HG2 MET 44 HG2 MET 44 1.291 0.519 -0.482 241 HG3 MET 44 HG1 MET 44 2.162 1.955 0.053 242 HE1 MET 44 HE1 MET 44 3.993 3.184 -1.306 243 HE2 MET 44 HE2 MET 44 4.814 2.494 -2.707 244 HE3 MET 44 HE3 MET 44 5.015 1.758 -1.116 245 H LYS 45 HN LYS 45 4.692 0.107 3.045 246 HA LYS 45 HA LYS 45 5.704 -2.523 3.103 247 HB2 LYS 45 HB2 LYS 45 6.390 -0.082 4.736 248 HB3 LYS 45 HB1 LYS 45 7.268 -1.599 4.855 249 HG2 LYS 45 HG2 LYS 45 7.702 -1.406 2.379 250 HG3 LYS 45 HG1 LYS 45 7.061 0.233 2.483 251 HD2 LYS 45 HD2 LYS 45 9.398 -0.826 4.073 252 HD3 LYS 45 HD1 LYS 45 9.526 0.158 2.616 253 HE2 LYS 45 HE2 LYS 45 8.170 1.909 3.820 254 HE3 LYS 45 HE1 LYS 45 8.378 0.951 5.283 255 HZ1 LYS 45 HZ1 LYS 45 10.835 1.122 4.839 256 HZ2 LYS 45 HZ2 LYS 45 10.066 2.555 5.306 257 HZ3 LYS 45 HZ3 LYS 45 10.466 2.301 3.681 258 H ALA 46 HN ALA 46 3.778 -0.667 5.408 259 HA ALA 46 HA ALA 46 3.981 -2.423 7.588 260 HB1 ALA 46 HB1 ALA 46 3.096 -0.161 7.804 261 HB2 ALA 46 HB2 ALA 46 1.947 -1.350 8.422 262 HB3 ALA 46 HB3 ALA 46 1.689 -0.612 6.840 263 H TYR 47 HN TYR 47 1.504 -2.213 5.031 264 HA TYR 47 HA TYR 47 0.001 -4.424 5.932 265 HB2 TYR 47 HB2 TYR 47 -0.821 -2.698 4.318 266 HB3 TYR 47 HB1 TYR 47 0.228 -3.401 3.091 267 HD1 TYR 47 HD1 TYR 47 -0.722 -4.920 1.624 268 HD2 TYR 47 HD2 TYR 47 -2.419 -4.483 5.502 269 HE1 TYR 47 HE1 TYR 47 -2.495 -6.512 1.022 270 HE2 TYR 47 HE2 TYR 47 -4.197 -6.076 4.907 271 HH TYR 47 HH TYR 47 -5.300 -6.929 2.858 272 H CYS 48 HN CYS 48 2.653 -4.120 3.631 273 HA CYS 48 HA CYS 48 2.659 -6.750 2.667 274 HB2 CYS 48 HB2 CYS 48 3.917 -4.743 1.754 275 HB3 CYS 48 HB1 CYS 48 5.107 -5.026 3.021 276 HG CYS 48 HG CYS 48 6.455 -6.795 1.764 277 H GLU 49 HN GLU 49 4.341 -5.271 5.403 278 HA GLU 49 HA GLU 49 5.887 -7.469 6.169 279 HB2 GLU 49 HB2 GLU 49 5.279 -4.883 7.170 280 HB3 GLU 49 HB1 GLU 49 5.031 -6.023 8.482 281 HG2 GLU 49 HG2 GLU 49 7.330 -6.931 7.944 282 HG3 GLU 49 HG1 GLU 49 7.542 -5.511 6.921 283 H ARG 50 HN ARG 50 2.560 -6.614 6.901 284 HA ARG 50 HA ARG 50 2.195 -8.633 8.881 285 HB2 ARG 50 HB2 ARG 50 0.137 -7.127 7.269 286 HB3 ARG 50 HB1 ARG 50 -0.172 -8.046 8.740 287 HG2 ARG 50 HG2 ARG 50 1.183 -6.533 10.025 288 HG3 ARG 50 HG1 ARG 50 1.659 -5.667 8.563 289 HD2 ARG 50 HD2 ARG 50 -0.055 -4.308 8.966 290 HD3 ARG 50 HD1 ARG 50 -1.095 -5.642 8.470 291 HE ARG 50 HE ARG 50 -0.320 -5.685 11.251 292 HH11 ARG 50 HH11 ARG 50 -2.638 -4.643 8.850 293 HH12 ARG 50 HH12 ARG 50 -3.968 -4.390 10.052 294 HH21 ARG 50 HH21 ARG 50 -3.598 -4.818 12.281 295 HH22 ARG 50 HH22 ARG 50 -1.976 -5.413 12.832 296 H GLN 51 HN GLN 51 1.988 -8.562 5.421 297 HA GLN 51 HA GLN 51 0.530 -11.063 5.287 298 HB2 GLN 51 HB2 GLN 51 1.915 -9.526 3.078 299 HB3 GLN 51 HB1 GLN 51 0.809 -10.876 2.863 300 HG2 GLN 51 HG2 GLN 51 0.119 -8.180 4.007 301 HG3 GLN 51 HG1 GLN 51 -0.287 -8.764 2.397 302 HE21 GLN 51 HE21 GLN 51 -1.949 -10.231 2.150 303 HE22 GLN 51 HE22 GLN 51 -3.071 -10.586 3.414 304 H GLY 52 HN GLY 52 3.773 -9.961 5.457 305 HA2 GLY 52 HA2 GLY 52 5.692 -11.207 5.861 306 HA3 GLY 52 HA1 GLY 52 4.758 -12.674 5.595 307 H LEU 53 HN LEU 53 4.994 -9.958 3.380 308 HA LEU 53 HA LEU 53 6.482 -11.688 1.518 309 HB2 LEU 53 HB2 LEU 53 4.402 -9.659 0.714 310 HB3 LEU 53 HB1 LEU 53 5.188 -10.839 -0.314 311 HG LEU 53 HG LEU 53 3.307 -11.556 1.933 312 HD11 LEU 53 HD11 LEU 53 1.678 -12.030 0.153 313 HD12 LEU 53 HD12 LEU 53 2.787 -11.324 -1.024 314 HD13 LEU 53 HD13 LEU 53 2.098 -10.320 0.250 315 HD21 LEU 53 HD21 LEU 53 4.885 -13.314 1.373 316 HD22 LEU 53 HD22 LEU 53 4.456 -13.177 -0.332 317 HD23 LEU 53 HD23 LEU 53 3.262 -13.744 0.836 318 H SER 54 HN SER 54 6.927 -9.943 -0.492 319 HA SER 54 HA SER 54 8.533 -7.823 0.769 320 HB2 SER 54 HB2 SER 54 10.060 -9.264 -0.304 321 HB3 SER 54 HB1 SER 54 8.980 -9.537 -1.671 322 HG SER 54 HG SER 54 10.908 -7.708 -1.403 323 H MET 55 HN MET 55 8.422 -5.730 -0.100 324 HA MET 55 HA MET 55 5.955 -5.018 -1.302 325 HB2 MET 55 HB2 MET 55 7.754 -3.628 0.130 326 HB3 MET 55 HB1 MET 55 8.230 -3.117 -1.484 327 HG2 MET 55 HG2 MET 55 5.849 -2.483 -1.896 328 HG3 MET 55 HG1 MET 55 5.535 -2.804 -0.191 329 HE1 MET 55 HE1 MET 55 6.832 -0.359 -2.827 330 HE2 MET 55 HE2 MET 55 8.390 -0.985 -2.287 331 HE3 MET 55 HE3 MET 55 7.947 0.688 -1.947 332 H ARG 56 HN ARG 56 8.791 -6.253 -2.589 333 HA ARG 56 HA ARG 56 8.563 -4.999 -5.188 334 HB2 ARG 56 HB2 ARG 56 10.759 -5.666 -4.166 335 HB3 ARG 56 HB1 ARG 56 10.279 -7.347 -4.351 336 HG2 ARG 56 HG2 ARG 56 10.092 -6.974 -6.793 337 HG3 ARG 56 HG1 ARG 56 10.725 -5.346 -6.549 338 HD2 ARG 56 HD2 ARG 56 12.791 -6.227 -5.677 339 HD3 ARG 56 HD1 ARG 56 12.158 -7.871 -5.746 340 HE ARG 56 HE ARG 56 12.296 -7.801 -8.108 341 HH11 ARG 56 HH11 ARG 56 14.555 -4.439 -7.973 342 HH12 ARG 56 HH12 ARG 56 13.644 -4.965 -6.513 343 HH21 ARG 56 HH21 ARG 56 14.448 -5.687 -9.911 344 HH22 ARG 56 HH22 ARG 56 13.442 -7.184 -9.964 345 H GLN 57 HN GLN 57 7.029 -7.488 -3.564 346 HA GLN 57 HA GLN 57 6.521 -9.077 -5.968 347 HB2 GLN 57 HB2 GLN 57 7.135 -10.350 -4.005 348 HB3 GLN 57 HB1 GLN 57 5.874 -9.571 -3.058 349 HG2 GLN 57 HG2 GLN 57 4.206 -10.597 -4.627 350 HG3 GLN 57 HG1 GLN 57 5.536 -11.527 -5.314 351 HE21 GLN 57 HE21 GLN 57 3.108 -12.356 -3.850 352 HE22 GLN 57 HE22 GLN 57 3.680 -13.309 -2.522 353 H ILE 58 HN ILE 58 4.843 -7.019 -3.634 354 HA ILE 58 HA ILE 58 2.329 -7.505 -5.062 355 HB ILE 58 HB ILE 58 1.254 -6.275 -3.179 356 HG12 ILE 58 HG12 ILE 58 4.015 -6.457 -1.950 357 HG13 ILE 58 HG11 ILE 58 3.214 -4.973 -2.452 358 HG21 ILE 58 HG21 ILE 58 1.303 -8.696 -3.232 359 HG22 ILE 58 HG22 ILE 58 1.483 -8.123 -1.574 360 HG23 ILE 58 HG23 ILE 58 2.890 -8.704 -2.463 361 HD11 ILE 58 HD11 ILE 58 2.348 -6.826 -0.251 362 HD12 ILE 58 HD12 ILE 58 1.439 -5.419 -0.799 363 HD13 ILE 58 HD13 ILE 58 3.035 -5.211 -0.076 364 H ARG 59 HN ARG 59 0.927 -5.725 -5.568 365 HA ARG 59 HA ARG 59 2.349 -3.191 -6.089 366 HB2 ARG 59 HB2 ARG 59 0.359 -4.508 -7.953 367 HB3 ARG 59 HB1 ARG 59 1.234 -3.013 -8.246 368 HG2 ARG 59 HG2 ARG 59 2.561 -5.692 -7.911 369 HG3 ARG 59 HG1 ARG 59 2.095 -5.005 -9.470 370 HD2 ARG 59 HD2 ARG 59 3.563 -3.122 -9.123 371 HD3 ARG 59 HD1 ARG 59 3.949 -3.679 -7.495 372 HE ARG 59 HE ARG 59 4.789 -4.979 -10.002 373 HH11 ARG 59 HH11 ARG 59 6.613 -5.466 -6.426 374 HH12 ARG 59 HH12 ARG 59 5.080 -4.527 -6.516 375 HH21 ARG 59 HH21 ARG 59 6.689 -6.218 -9.902 376 HH22 ARG 59 HH22 ARG 59 7.497 -6.440 -8.299 377 H PHE 60 HN PHE 60 1.264 -1.408 -5.459 378 HA PHE 60 HA PHE 60 -1.482 -1.766 -4.491 379 HB2 PHE 60 HB2 PHE 60 0.696 0.189 -3.788 380 HB3 PHE 60 HB1 PHE 60 -0.983 0.509 -3.373 381 HD1 PHE 60 HD1 PHE 60 1.734 -1.979 -2.945 382 HD2 PHE 60 HD2 PHE 60 -1.909 -0.384 -1.433 383 HE1 PHE 60 HE1 PHE 60 2.000 -3.321 -0.905 384 HE2 PHE 60 HE2 PHE 60 -1.653 -1.726 0.613 385 HZ PHE 60 HZ PHE 60 0.307 -3.197 0.879 386 H ARG 61 HN ARG 61 -3.146 -0.720 -5.418 387 HA ARG 61 HA ARG 61 -2.513 1.405 -7.353 388 HB2 ARG 61 HB2 ARG 61 -3.257 -1.050 -8.181 389 HB3 ARG 61 HB1 ARG 61 -4.844 -0.328 -7.951 390 HG2 ARG 61 HG2 ARG 61 -4.413 1.367 -9.534 391 HG3 ARG 61 HG1 ARG 61 -2.689 0.991 -9.573 392 HD2 ARG 61 HD2 ARG 61 -3.373 -1.300 -10.446 393 HD3 ARG 61 HD1 ARG 61 -4.976 -0.605 -10.695 394 HE ARG 61 HE ARG 61 -3.826 1.071 -12.152 395 HH11 ARG 61 HH11 ARG 61 -1.490 -2.096 -13.120 396 HH12 ARG 61 HH12 ARG 61 -2.534 -2.168 -11.655 397 HH21 ARG 61 HH21 ARG 61 -2.602 1.149 -14.082 398 HH22 ARG 61 HH22 ARG 61 -1.547 -0.254 -14.491 399 H PHE 62 HN PHE 62 -3.771 3.155 -7.307 400 HA PHE 62 HA PHE 62 -6.234 3.090 -5.714 401 HB2 PHE 62 HB2 PHE 62 -4.475 3.959 -4.247 402 HB3 PHE 62 HB1 PHE 62 -4.025 5.146 -5.465 403 HD1 PHE 62 HD1 PHE 62 -6.923 4.068 -3.396 404 HD2 PHE 62 HD2 PHE 62 -4.934 7.267 -5.375 405 HE1 PHE 62 HE1 PHE 62 -8.523 5.662 -2.422 406 HE2 PHE 62 HE2 PHE 62 -6.531 8.866 -4.405 407 HZ PHE 62 HZ PHE 62 -8.328 8.066 -2.926 408 H ASP 63 HN ASP 63 -7.850 3.819 -6.905 409 HA ASP 63 HA ASP 63 -9.077 4.920 -8.466 410 HB2 ASP 63 HB2 ASP 63 -8.089 6.878 -7.147 411 HB3 ASP 63 HB1 ASP 63 -6.953 7.062 -8.477 412 H GLY 64 HN GLY 64 -6.993 3.048 -9.316 413 HA2 GLY 64 HA2 GLY 64 -6.664 2.216 -11.494 414 HA3 GLY 64 HA1 GLY 64 -6.968 3.823 -12.131 415 H GLN 65 HN GLN 65 -4.984 4.856 -10.031 416 HA GLN 65 HA GLN 65 -2.612 4.312 -11.676 417 HB2 GLN 65 HB2 GLN 65 -3.492 6.655 -10.028 418 HB3 GLN 65 HB1 GLN 65 -1.785 6.426 -10.378 419 HG2 GLN 65 HG2 GLN 65 -3.950 6.617 -12.460 420 HG3 GLN 65 HG1 GLN 65 -2.928 7.954 -11.945 421 HE21 GLN 65 HE21 GLN 65 -0.758 7.962 -12.499 422 HE22 GLN 65 HE22 GLN 65 -0.119 6.955 -13.753 423 HA PRO 66 HA PRO 66 -0.760 2.187 -8.271 424 HB2 PRO 66 HB2 PRO 66 1.844 2.332 -8.970 425 HB3 PRO 66 HB1 PRO 66 0.689 1.311 -9.841 426 HG2 PRO 66 HG2 PRO 66 1.736 4.007 -10.574 427 HG3 PRO 66 HG1 PRO 66 1.467 2.586 -11.603 428 HD2 PRO 66 HD2 PRO 66 -0.272 4.675 -11.485 429 HD3 PRO 66 HD1 PRO 66 -0.772 3.011 -11.841 430 H ILE 67 HN ILE 67 0.459 2.533 -6.383 431 HA ILE 67 HA ILE 67 0.786 5.348 -5.699 432 HB ILE 67 HB ILE 67 0.945 2.896 -3.933 433 HG12 ILE 67 HG12 ILE 67 -1.267 4.923 -4.343 434 HG13 ILE 67 HG11 ILE 67 -1.300 3.232 -4.836 435 HG21 ILE 67 HG21 ILE 67 0.830 5.817 -3.178 436 HG22 ILE 67 HG22 ILE 67 2.253 4.781 -3.066 437 HG23 ILE 67 HG23 ILE 67 0.843 4.452 -2.061 438 HD11 ILE 67 HD11 ILE 67 -1.190 4.256 -2.008 439 HD12 ILE 67 HD12 ILE 67 -1.196 2.559 -2.487 440 HD13 ILE 67 HD13 ILE 67 -2.598 3.574 -2.824 441 H ASN 68 HN ASN 68 2.697 6.317 -5.423 442 HA ASN 68 HA ASN 68 5.107 4.758 -5.976 443 HB2 ASN 68 HB2 ASN 68 4.714 7.754 -5.752 444 HB3 ASN 68 HB1 ASN 68 6.199 6.953 -6.256 445 HD21 ASN 68 HD21 ASN 68 2.934 7.775 -7.126 446 HD22 ASN 68 HD22 ASN 68 3.085 7.427 -8.822 447 H GLU 69 HN GLU 69 7.085 5.336 -4.724 448 HA GLU 69 HA GLU 69 6.616 4.929 -1.948 449 HB2 GLU 69 HB2 GLU 69 9.154 5.576 -3.461 450 HB3 GLU 69 HB1 GLU 69 9.101 5.137 -1.759 451 HG2 GLU 69 HG2 GLU 69 8.507 2.945 -2.211 452 HG3 GLU 69 HG1 GLU 69 7.920 3.332 -3.829 453 H THR 70 HN THR 70 7.035 7.712 -3.925 454 HA THR 70 HA THR 70 7.590 9.445 -1.641 455 HB THR 70 HB THR 70 7.427 11.151 -3.722 456 HG1 THR 70 HG1 THR 70 7.768 10.182 -5.607 457 HG21 THR 70 HG21 THR 70 9.359 10.847 -2.232 458 HG22 THR 70 HG22 THR 70 9.854 10.964 -3.921 459 HG23 THR 70 HG23 THR 70 9.810 9.392 -3.122 460 H ASP 71 HN ASP 71 4.912 8.059 -2.668 461 HA ASP 71 HA ASP 71 3.201 10.362 -3.001 462 HB2 ASP 71 HB2 ASP 71 2.912 7.449 -3.268 463 HB3 ASP 71 HB1 ASP 71 1.482 8.276 -2.664 464 H THR 72 HN THR 72 1.411 10.846 -1.652 465 HA THR 72 HA THR 72 1.506 9.861 1.099 466 HB THR 72 HB THR 72 1.032 12.605 1.383 467 HG1 THR 72 HG1 THR 72 3.076 12.063 -0.507 468 HG21 THR 72 HG21 THR 72 3.642 11.164 1.846 469 HG22 THR 72 HG22 THR 72 2.254 11.089 2.930 470 HG23 THR 72 HG23 THR 72 3.078 12.625 2.656 471 HA PRO 73 HA PRO 73 -2.911 9.920 0.863 472 HB2 PRO 73 HB2 PRO 73 -2.987 11.500 3.381 473 HB3 PRO 73 HB1 PRO 73 -3.751 9.949 3.001 474 HG2 PRO 73 HG2 PRO 73 -1.623 10.037 4.579 475 HG3 PRO 73 HG1 PRO 73 -1.826 8.735 3.390 476 HD2 PRO 73 HD2 PRO 73 -0.056 11.136 3.272 477 HD3 PRO 73 HD1 PRO 73 0.251 9.476 2.724 478 H ALA 74 HN ALA 74 -1.617 13.006 2.097 479 HA ALA 74 HA ALA 74 -3.760 14.582 1.107 480 HB1 ALA 74 HB1 ALA 74 -2.339 16.501 1.638 481 HB2 ALA 74 HB2 ALA 74 -0.963 15.422 1.869 482 HB3 ALA 74 HB3 ALA 74 -2.348 15.331 2.956 483 H GLN 75 HN GLN 75 -0.786 13.424 -0.266 484 HA GLN 75 HA GLN 75 -0.573 15.245 -2.420 485 HB2 GLN 75 HB2 GLN 75 1.269 13.775 -1.612 486 HB3 GLN 75 HB1 GLN 75 0.410 12.391 -2.267 487 HG2 GLN 75 HG2 GLN 75 2.209 13.126 -3.737 488 HG3 GLN 75 HG1 GLN 75 0.629 13.271 -4.510 489 HE21 GLN 75 HE21 GLN 75 -0.180 15.285 -4.979 490 HE22 GLN 75 HE22 GLN 75 0.778 16.723 -4.901 491 H LEU 76 HN LEU 76 -2.124 12.084 -2.075 492 HA LEU 76 HA LEU 76 -3.106 12.181 -4.814 493 HB2 LEU 76 HB2 LEU 76 -3.509 10.120 -2.642 494 HB3 LEU 76 HB1 LEU 76 -4.041 9.956 -4.302 495 HG LEU 76 HG LEU 76 -1.170 10.140 -3.387 496 HD11 LEU 76 HD11 LEU 76 -2.784 7.826 -4.449 497 HD12 LEU 76 HD12 LEU 76 -2.171 8.013 -2.806 498 HD13 LEU 76 HD13 LEU 76 -1.047 7.804 -4.148 499 HD21 LEU 76 HD21 LEU 76 -1.430 11.160 -5.560 500 HD22 LEU 76 HD22 LEU 76 -2.350 9.771 -6.136 501 HD23 LEU 76 HD23 LEU 76 -0.643 9.593 -5.733 502 H GLU 77 HN GLU 77 -4.005 13.757 -2.211 503 HA GLU 77 HA GLU 77 -5.904 14.663 -1.367 504 HB2 GLU 77 HB2 GLU 77 -6.957 14.041 -4.135 505 HB3 GLU 77 HB1 GLU 77 -7.706 15.139 -2.983 506 HG2 GLU 77 HG2 GLU 77 -5.590 16.479 -3.026 507 HG3 GLU 77 HG1 GLU 77 -5.053 15.456 -4.360 508 H MET 78 HN MET 78 -5.558 12.156 -0.527 509 HA MET 78 HA MET 78 -7.817 10.467 -1.000 510 HB2 MET 78 HB2 MET 78 -5.465 10.438 0.836 511 HB3 MET 78 HB1 MET 78 -6.829 9.393 1.200 512 HG2 MET 78 HG2 MET 78 -6.579 8.196 -0.812 513 HG3 MET 78 HG1 MET 78 -5.473 9.399 -1.474 514 HE1 MET 78 HE1 MET 78 -3.366 6.073 -0.949 515 HE2 MET 78 HE2 MET 78 -4.214 7.078 -2.125 516 HE3 MET 78 HE3 MET 78 -5.124 6.007 -1.058 517 H GLU 79 HN GLU 79 -9.546 10.054 0.315 518 HA GLU 79 HA GLU 79 -10.044 12.032 2.449 519 HB2 GLU 79 HB2 GLU 79 -11.968 10.800 0.463 520 HB3 GLU 79 HB1 GLU 79 -12.481 11.711 1.876 521 HG2 GLU 79 HG2 GLU 79 -10.589 12.932 -0.086 522 HG3 GLU 79 HG1 GLU 79 -12.318 12.883 -0.427 523 H ASP 80 HN ASP 80 -12.089 11.054 3.771 524 HA ASP 80 HA ASP 80 -11.020 8.725 5.043 525 HB2 ASP 80 HB2 ASP 80 -13.455 10.420 5.477 526 HB3 ASP 80 HB1 ASP 80 -13.310 8.869 6.293 527 H GLU 81 HN GLU 81 -11.723 6.668 4.999 528 HA GLU 81 HA GLU 81 -12.821 4.787 4.387 529 HB2 GLU 81 HB2 GLU 81 -14.865 6.797 3.535 530 HB3 GLU 81 HB1 GLU 81 -15.042 5.118 3.051 531 HG2 GLU 81 HG2 GLU 81 -14.747 6.041 5.897 532 HG3 GLU 81 HG1 GLU 81 -16.287 5.717 5.103 533 H ASP 82 HN ASP 82 -11.000 6.510 2.614 534 HA ASP 82 HA ASP 82 -11.666 5.801 -0.074 535 HB2 ASP 82 HB2 ASP 82 -9.617 7.329 1.235 536 HB3 ASP 82 HB1 ASP 82 -8.853 6.171 0.150 537 H THR 83 HN THR 83 -10.811 4.096 -1.337 538 HA THR 83 HA THR 83 -9.707 1.917 0.308 539 HB THR 83 HB THR 83 -11.229 1.452 -2.234 540 HG1 THR 83 HG1 THR 83 -12.219 2.631 -0.093 541 HG21 THR 83 HG21 THR 83 -10.798 -0.205 0.262 542 HG22 THR 83 HG22 THR 83 -9.975 -0.429 -1.282 543 HG23 THR 83 HG23 THR 83 -11.713 -0.707 -1.161 544 H ILE 84 HN ILE 84 -7.922 0.916 -0.253 545 HA ILE 84 HA ILE 84 -6.647 1.587 -2.828 546 HB ILE 84 HB ILE 84 -5.300 0.699 -0.266 547 HG12 ILE 84 HG12 ILE 84 -5.220 3.464 -1.473 548 HG13 ILE 84 HG11 ILE 84 -6.388 3.011 -0.237 549 HG21 ILE 84 HG21 ILE 84 -3.235 1.389 -1.401 550 HG22 ILE 84 HG22 ILE 84 -4.164 1.729 -2.858 551 HG23 ILE 84 HG23 ILE 84 -4.057 0.079 -2.249 552 HD11 ILE 84 HD11 ILE 84 -3.395 2.921 0.068 553 HD12 ILE 84 HD12 ILE 84 -4.583 2.531 1.314 554 HD13 ILE 84 HD13 ILE 84 -4.460 4.179 0.696 555 H ASP 85 HN ASP 85 -5.988 -0.113 -4.129 556 HA ASP 85 HA ASP 85 -6.831 -2.783 -3.234 557 HB2 ASP 85 HB2 ASP 85 -7.316 -1.391 -5.599 558 HB3 ASP 85 HB1 ASP 85 -6.111 -2.599 -6.038 559 H VAL 86 HN VAL 86 -5.533 -4.597 -3.588 560 HA VAL 86 HA VAL 86 -2.668 -4.039 -4.005 561 HB VAL 86 HB VAL 86 -3.729 -6.121 -2.094 562 HG11 VAL 86 HG11 VAL 86 -1.427 -6.154 -1.258 563 HG12 VAL 86 HG12 VAL 86 -0.971 -4.962 -2.474 564 HG13 VAL 86 HG13 VAL 86 -1.503 -6.567 -2.971 565 HG21 VAL 86 HG21 VAL 86 -4.354 -3.892 -1.299 566 HG22 VAL 86 HG22 VAL 86 -2.672 -3.380 -1.423 567 HG23 VAL 86 HG23 VAL 86 -3.130 -4.631 -0.268 568 H PHE 87 HN PHE 87 -1.976 -5.032 -5.758 569 HA PHE 87 HA PHE 87 -3.197 -7.605 -6.519 570 HB2 PHE 87 HB2 PHE 87 -1.793 -5.576 -8.276 571 HB3 PHE 87 HB1 PHE 87 -2.475 -7.104 -8.824 572 HD1 PHE 87 HD1 PHE 87 -4.925 -7.433 -8.814 573 HD2 PHE 87 HD2 PHE 87 -3.159 -3.666 -7.919 574 HE1 PHE 87 HE1 PHE 87 -7.090 -6.330 -9.199 575 HE2 PHE 87 HE2 PHE 87 -5.321 -2.558 -8.302 576 HZ PHE 87 HZ PHE 87 -7.290 -3.890 -8.942 577 H GLN 88 HN GLN 88 -1.665 -9.070 -7.732 578 HA GLN 88 HA GLN 88 0.928 -9.071 -6.343 579 HB2 GLN 88 HB2 GLN 88 -0.628 -11.305 -7.654 580 HB3 GLN 88 HB1 GLN 88 0.994 -11.494 -7.010 581 HG2 GLN 88 HG2 GLN 88 -1.335 -10.589 -5.348 582 HG3 GLN 88 HG1 GLN 88 -0.879 -12.281 -5.540 583 HE21 GLN 88 HE21 GLN 88 -0.955 -10.735 -3.123 584 HE22 GLN 88 HE22 GLN 88 0.651 -10.723 -2.484 585 H GLN 89 HN GLN 89 2.841 -9.489 -7.486 586 HA GLN 89 HA GLN 89 2.911 -8.444 -10.149 587 HB2 GLN 89 HB2 GLN 89 4.829 -7.933 -8.904 588 HB3 GLN 89 HB1 GLN 89 4.950 -9.556 -8.240 589 HG2 GLN 89 HG2 GLN 89 6.739 -9.353 -9.729 590 HG3 GLN 89 HG1 GLN 89 5.537 -10.322 -10.577 591 HE21 GLN 89 HE21 GLN 89 6.136 -9.845 -12.623 592 HE22 GLN 89 HE22 GLN 89 6.035 -8.263 -13.316 593 H GLN 90 HN GLN 90 3.184 -9.533 -12.071 594 HA GLN 90 HA GLN 90 2.273 -12.211 -12.207 595 HB2 GLN 90 HB2 GLN 90 3.685 -10.579 -14.325 596 HB3 GLN 90 HB1 GLN 90 2.785 -12.064 -14.600 597 HG2 GLN 90 HG2 GLN 90 1.139 -10.636 -15.135 598 HG3 GLN 90 HG1 GLN 90 0.886 -10.618 -13.392 599 HE21 GLN 90 HE21 GLN 90 0.207 -8.582 -15.272 600 HE22 GLN 90 HE22 GLN 90 1.085 -7.160 -14.818 601 H THR 91 HN THR 91 3.357 -13.971 -11.796 602 HA THR 91 HA THR 91 6.223 -13.932 -11.481 603 HB THR 91 HB THR 91 5.380 -16.560 -11.192 604 HG1 THR 91 HG1 THR 91 3.253 -16.353 -11.076 605 HG21 THR 91 HG21 THR 91 5.389 -14.430 -9.049 606 HG22 THR 91 HG22 THR 91 6.839 -15.202 -9.687 607 HG23 THR 91 HG23 THR 91 5.635 -16.162 -8.826 608 H GLY 92 HN GLY 92 4.124 -14.445 -14.021 609 HA2 GLY 92 HA2 GLY 92 5.961 -14.942 -15.969 610 HA3 GLY 92 HA1 GLY 92 5.520 -16.543 -15.382 611 H ASN 357 HT1 ASN 357 -16.664 -9.133 6.903 612 HA ASN 357 HA ASN 357 -14.171 -10.105 5.646 613 HB2 ASN 357 HB2 ASN 357 -13.785 -7.955 4.799 614 HB3 ASN 357 HB1 ASN 357 -15.501 -8.191 4.487 615 HD21 ASN 357 HD21 ASN 357 -13.168 -6.220 5.927 616 HD22 ASN 357 HD22 ASN 357 -14.237 -5.140 6.752 617 H ASN 358 HN ASN 358 -12.296 -8.826 6.625 618 HA ASN 358 HA ASN 358 -12.830 -8.408 9.478 619 HB2 ASN 358 HB2 ASN 358 -10.607 -9.245 9.996 620 HB3 ASN 358 HB1 ASN 358 -11.500 -10.450 9.079 621 HD21 ASN 358 HD21 ASN 358 -8.679 -8.614 9.286 622 HD22 ASN 358 HD22 ASN 358 -7.997 -9.049 7.758 623 H ARG 359 HN ARG 359 -12.349 -6.487 10.312 624 HA ARG 359 HA ARG 359 -10.542 -4.784 8.737 625 HB2 ARG 359 HB2 ARG 359 -11.873 -2.824 9.462 626 HB3 ARG 359 HB1 ARG 359 -12.762 -3.928 8.427 627 HG2 ARG 359 HG2 ARG 359 -13.880 -4.858 10.412 628 HG3 ARG 359 HG1 ARG 359 -13.018 -3.695 11.421 629 HD2 ARG 359 HD2 ARG 359 -14.961 -3.052 9.204 630 HD3 ARG 359 HD1 ARG 359 -15.272 -2.911 10.931 631 HE ARG 359 HE ARG 359 -13.203 -1.300 9.577 632 HH11 ARG 359 HH11 ARG 359 -15.978 -1.600 11.721 633 HH12 ARG 359 HH12 ARG 359 -15.985 0.156 12.135 634 HH21 ARG 359 HH21 ARG 359 -13.183 0.928 10.080 635 HH22 ARG 359 HH22 ARG 359 -14.430 1.558 11.226 636 H ASP 360 HN ASP 360 -8.864 -4.097 9.744 637 HA ASP 360 HA ASP 360 -8.825 -3.921 12.673 638 HB2 ASP 360 HB2 ASP 360 -7.218 -5.475 12.777 639 HB3 ASP 360 HB1 ASP 360 -7.288 -5.672 11.031 640 HA PRO 361 HA PRO 361 -7.158 0.041 11.421 641 HB2 PRO 361 HB2 PRO 361 -7.555 1.332 13.736 642 HB3 PRO 361 HB1 PRO 361 -8.917 0.731 12.782 643 HG2 PRO 361 HG2 PRO 361 -7.890 -0.259 15.346 644 HG3 PRO 361 HG1 PRO 361 -9.472 -0.506 14.590 645 HD2 PRO 361 HD2 PRO 361 -7.165 -2.275 14.577 646 HD3 PRO 361 HD1 PRO 361 -8.821 -2.586 14.013 647 H ILE 362 HN ILE 362 -5.181 0.687 11.182 648 HA ILE 362 HA ILE 362 -3.179 0.225 13.294 649 HB ILE 362 HB ILE 362 -2.530 0.505 10.370 650 HG12 ILE 362 HG12 ILE 362 -2.199 -2.158 10.814 651 HG13 ILE 362 HG11 ILE 362 -3.656 -1.838 11.755 652 HG21 ILE 362 HG21 ILE 362 -0.618 -1.075 11.363 653 HG22 ILE 362 HG22 ILE 362 -1.031 -0.170 12.818 654 HG23 ILE 362 HG23 ILE 362 -0.516 0.684 11.363 655 HD11 ILE 362 HD11 ILE 362 -4.174 -2.532 9.471 656 HD12 ILE 362 HD12 ILE 362 -3.260 -1.156 8.854 657 HD13 ILE 362 HD13 ILE 362 -4.729 -0.888 9.793 658 H VAL 363 HN VAL 363 -2.115 1.978 14.034 659 HA VAL 363 HA VAL 363 -2.344 4.448 12.433 660 HB VAL 363 HB VAL 363 -1.882 4.302 15.415 661 HG11 VAL 363 HG11 VAL 363 -2.494 6.674 15.368 662 HG12 VAL 363 HG12 VAL 363 -2.648 6.588 13.613 663 HG13 VAL 363 HG13 VAL 363 -1.080 6.318 14.376 664 HG21 VAL 363 HG21 VAL 363 -4.155 4.739 15.862 665 HG22 VAL 363 HG22 VAL 363 -4.134 3.385 14.732 666 HG23 VAL 363 HG23 VAL 363 -4.521 5.005 14.155 667 H ILE 364 HN ILE 364 -0.483 5.137 11.661 668 HA ILE 364 HA ILE 364 1.979 4.473 13.105 669 HB ILE 364 HB ILE 364 1.638 3.201 10.879 670 HG12 ILE 364 HG12 ILE 364 4.210 4.759 11.175 671 HG13 ILE 364 HG11 ILE 364 3.743 3.465 12.277 672 HG21 ILE 364 HG21 ILE 364 2.532 4.415 8.913 673 HG22 ILE 364 HG22 ILE 364 2.431 5.910 9.843 674 HG23 ILE 364 HG23 ILE 364 0.967 5.007 9.460 675 HD11 ILE 364 HD11 ILE 364 3.693 1.900 10.397 676 HD12 ILE 364 HD12 ILE 364 5.275 2.651 10.601 677 HD13 ILE 364 HD13 ILE 364 4.198 3.198 9.315 678 H SER 365 HN SER 365 3.301 6.088 13.529 679 HA SER 365 HA SER 365 2.660 8.697 12.330 680 HB2 SER 365 HB2 SER 365 3.597 8.046 15.138 681 HB3 SER 365 HB1 SER 365 3.502 9.679 14.477 682 HG SER 365 HG SER 365 1.264 7.995 14.353 683 H ASP 366 HN ASP 366 4.285 9.786 11.396 684 HA ASP 366 HA ASP 366 6.997 8.636 11.608 685 HB2 ASP 366 HB2 ASP 366 5.724 8.522 9.354 686 HB3 ASP 366 HB1 ASP 366 5.981 10.264 9.276 687 H SER 367 HN SER 367 8.566 9.975 12.259 688 HA SER 367 HA SER 367 7.796 12.668 13.064 689 HB2 SER 367 HB2 SER 367 10.414 11.369 13.743 690 HB3 SER 367 HB1 SER 367 9.449 12.500 14.689 691 HG SER 367 HG SER 367 9.326 9.760 14.569 692 HA PRO 368 HA PRO 368 10.381 13.979 9.548 693 HB2 PRO 368 HB2 PRO 368 8.964 16.457 9.505 694 HB3 PRO 368 HB1 PRO 368 8.792 15.110 8.375 695 HG2 PRO 368 HG2 PRO 368 6.852 15.961 10.168 696 HG3 PRO 368 HG1 PRO 368 6.882 14.391 9.346 697 HD2 PRO 368 HD2 PRO 368 7.640 15.081 12.130 698 HD3 PRO 368 HD1 PRO 368 6.954 13.581 11.477 Start of MODEL 14 1 H ASP 16 HT1 ASP 16 -4.727 15.884 11.882 2 HA ASP 16 HA ASP 16 -6.557 14.337 13.608 3 HB2 ASP 16 HB2 ASP 16 -7.017 16.027 11.194 4 HB3 ASP 16 HB1 ASP 16 -7.942 14.534 11.353 5 H HIS 17 HN HIS 17 -7.442 12.464 12.270 6 HA HIS 17 HA HIS 17 -5.216 11.274 10.755 7 HB2 HIS 17 HB2 HIS 17 -7.030 10.091 12.835 8 HB3 HIS 17 HB1 HIS 17 -6.276 9.062 11.622 9 HD2 HIS 17 HD2 HIS 17 -3.593 8.580 11.952 10 HE1 HIS 17 HE1 HIS 17 -3.224 10.733 15.572 11 HE2 HIS 17 HE2 HIS 17 -2.188 8.955 14.095 12 H ILE 18 HN ILE 18 -5.811 9.718 9.129 13 HA ILE 18 HA ILE 18 -8.502 10.207 8.032 14 HB ILE 18 HB ILE 18 -6.796 11.334 6.699 15 HG12 ILE 18 HG12 ILE 18 -7.789 8.892 5.218 16 HG13 ILE 18 HG11 ILE 18 -8.788 10.292 5.601 17 HG21 ILE 18 HG21 ILE 18 -5.086 10.048 5.479 18 HG22 ILE 18 HG22 ILE 18 -5.557 8.607 6.380 19 HG23 ILE 18 HG23 ILE 18 -4.868 9.990 7.230 20 HD11 ILE 18 HD11 ILE 18 -6.318 10.309 3.880 21 HD12 ILE 18 HD12 ILE 18 -7.325 11.707 4.259 22 HD13 ILE 18 HD13 ILE 18 -7.986 10.374 3.310 23 H ASN 19 HN ASN 19 -9.650 8.460 7.269 24 HA ASN 19 HA ASN 19 -8.632 5.839 8.048 25 HB2 ASN 19 HB2 ASN 19 -11.356 6.828 7.204 26 HB3 ASN 19 HB1 ASN 19 -11.003 5.120 7.428 27 HD21 ASN 19 HD21 ASN 19 -11.508 8.167 8.960 28 HD22 ASN 19 HD22 ASN 19 -11.584 7.569 10.588 29 H LEU 20 HN LEU 20 -7.347 4.937 6.547 30 HA LEU 20 HA LEU 20 -8.267 4.985 3.751 31 HB2 LEU 20 HB2 LEU 20 -5.517 4.457 4.885 32 HB3 LEU 20 HB1 LEU 20 -5.926 4.358 3.185 33 HG LEU 20 HG LEU 20 -6.060 6.859 4.869 34 HD11 LEU 20 HD11 LEU 20 -4.096 6.047 2.735 35 HD12 LEU 20 HD12 LEU 20 -3.772 6.116 4.467 36 HD13 LEU 20 HD13 LEU 20 -4.137 7.595 3.580 37 HD21 LEU 20 HD21 LEU 20 -6.384 7.993 2.702 38 HD22 LEU 20 HD22 LEU 20 -7.717 6.917 3.121 39 HD23 LEU 20 HD23 LEU 20 -6.523 6.417 1.924 40 H LYS 21 HN LYS 21 -9.380 3.207 3.247 41 HA LYS 21 HA LYS 21 -8.944 0.732 4.698 42 HB2 LYS 21 HB2 LYS 21 -10.822 1.230 2.387 43 HB3 LYS 21 HB1 LYS 21 -10.865 -0.117 3.518 44 HG2 LYS 21 HG2 LYS 21 -11.330 1.520 5.335 45 HG3 LYS 21 HG1 LYS 21 -11.463 2.774 4.099 46 HD2 LYS 21 HD2 LYS 21 -13.282 1.551 3.037 47 HD3 LYS 21 HD1 LYS 21 -13.133 0.262 4.233 48 HE2 LYS 21 HE2 LYS 21 -13.662 1.914 6.004 49 HE3 LYS 21 HE1 LYS 21 -13.924 3.125 4.748 50 HZ1 LYS 21 HZ1 LYS 21 -16.018 2.212 5.368 51 HZ2 LYS 21 HZ2 LYS 21 -15.466 0.628 5.166 52 HZ3 LYS 21 HZ3 LYS 21 -15.651 1.635 3.825 53 H VAL 22 HN VAL 22 -7.838 -0.967 4.012 54 HA VAL 22 HA VAL 22 -6.888 -0.976 1.217 55 HB VAL 22 HB VAL 22 -5.475 -2.045 3.672 56 HG11 VAL 22 HG11 VAL 22 -5.061 -3.451 1.731 57 HG12 VAL 22 HG12 VAL 22 -3.614 -2.545 2.173 58 HG13 VAL 22 HG13 VAL 22 -4.585 -2.033 0.794 59 HG21 VAL 22 HG21 VAL 22 -3.817 -0.311 3.235 60 HG22 VAL 22 HG22 VAL 22 -5.410 0.396 3.507 61 HG23 VAL 22 HG23 VAL 22 -4.772 0.267 1.869 62 H ALA 23 HN ALA 23 -7.966 -2.474 0.123 63 HA ALA 23 HA ALA 23 -8.719 -4.952 1.527 64 HB1 ALA 23 HB1 ALA 23 -10.613 -5.131 0.001 65 HB2 ALA 23 HB2 ALA 23 -10.129 -3.627 -0.786 66 HB3 ALA 23 HB3 ALA 23 -10.658 -3.613 0.897 67 H GLY 24 HN GLY 24 -8.238 -6.872 0.650 68 HA2 GLY 24 HA2 GLY 24 -6.440 -6.838 -1.664 69 HA3 GLY 24 HA1 GLY 24 -6.607 -8.149 -0.502 70 H GLN 25 HN GLN 25 -6.789 -9.604 -2.282 71 HA GLN 25 HA GLN 25 -9.202 -9.361 -3.910 72 HB2 GLN 25 HB2 GLN 25 -7.085 -11.498 -4.101 73 HB3 GLN 25 HB1 GLN 25 -8.288 -11.070 -5.309 74 HG2 GLN 25 HG2 GLN 25 -5.952 -9.393 -4.424 75 HG3 GLN 25 HG1 GLN 25 -6.123 -10.238 -5.962 76 HE21 GLN 25 HE21 GLN 25 -5.767 -7.368 -5.252 77 HE22 GLN 25 HE22 GLN 25 -7.062 -6.545 -6.051 78 H ASP 26 HN ASP 26 -8.299 -10.681 -1.010 79 HA ASP 26 HA ASP 26 -10.062 -12.998 -1.217 80 HB2 ASP 26 HB2 ASP 26 -9.237 -13.455 1.146 81 HB3 ASP 26 HB1 ASP 26 -8.015 -13.524 -0.117 82 H GLY 27 HN GLY 27 -9.795 -11.525 1.876 83 HA2 GLY 27 HA2 GLY 27 -12.248 -9.990 1.630 84 HA3 GLY 27 HA1 GLY 27 -12.364 -11.443 2.618 85 H SER 28 HN SER 28 -9.672 -9.193 2.252 86 HA SER 28 HA SER 28 -9.733 -8.758 5.156 87 HB2 SER 28 HB2 SER 28 -7.303 -7.849 4.462 88 HB3 SER 28 HB1 SER 28 -7.610 -9.554 4.794 89 HG SER 28 HG SER 28 -7.590 -10.002 2.659 90 H VAL 29 HN VAL 29 -10.454 -6.820 5.831 91 HA VAL 29 HA VAL 29 -10.058 -4.528 4.010 92 HB VAL 29 HB VAL 29 -12.440 -4.817 5.847 93 HG11 VAL 29 HG11 VAL 29 -13.343 -2.957 4.563 94 HG12 VAL 29 HG12 VAL 29 -11.895 -2.925 3.556 95 HG13 VAL 29 HG13 VAL 29 -11.788 -2.525 5.272 96 HG21 VAL 29 HG21 VAL 29 -13.792 -5.342 3.894 97 HG22 VAL 29 HG22 VAL 29 -12.527 -6.554 4.113 98 HG23 VAL 29 HG23 VAL 29 -12.355 -5.313 2.871 99 H VAL 30 HN VAL 30 -8.118 -4.182 5.206 100 HA VAL 30 HA VAL 30 -8.325 -3.593 8.030 101 HB VAL 30 HB VAL 30 -5.921 -3.163 7.943 102 HG11 VAL 30 HG11 VAL 30 -6.742 -5.663 6.472 103 HG12 VAL 30 HG12 VAL 30 -6.674 -5.450 8.221 104 HG13 VAL 30 HG13 VAL 30 -5.191 -5.407 7.269 105 HG21 VAL 30 HG21 VAL 30 -6.183 -3.639 4.974 106 HG22 VAL 30 HG22 VAL 30 -4.663 -3.490 5.855 107 HG23 VAL 30 HG23 VAL 30 -5.762 -2.114 5.755 108 H GLN 31 HN GLN 31 -7.985 -1.572 8.978 109 HA GLN 31 HA GLN 31 -8.491 0.690 7.153 110 HB2 GLN 31 HB2 GLN 31 -10.240 0.020 8.907 111 HB3 GLN 31 HB1 GLN 31 -9.108 0.639 10.101 112 HG2 GLN 31 HG2 GLN 31 -10.075 2.617 9.813 113 HG3 GLN 31 HG1 GLN 31 -9.272 2.677 8.244 114 HE21 GLN 31 HE21 GLN 31 -11.789 3.859 9.032 115 HE22 GLN 31 HE22 GLN 31 -12.991 3.201 7.974 116 H PHE 32 HN PHE 32 -6.606 1.694 6.784 117 HA PHE 32 HA PHE 32 -4.610 1.867 8.887 118 HB2 PHE 32 HB2 PHE 32 -4.672 2.440 5.962 119 HB3 PHE 32 HB1 PHE 32 -3.494 3.304 6.943 120 HD1 PHE 32 HD1 PHE 32 -4.506 0.055 5.624 121 HD2 PHE 32 HD2 PHE 32 -1.668 2.136 8.012 122 HE1 PHE 32 HE1 PHE 32 -3.006 -1.891 5.527 123 HE2 PHE 32 HE2 PHE 32 -0.162 0.194 7.920 124 HZ PHE 32 HZ PHE 32 -0.828 -1.821 6.674 125 H LYS 33 HN LYS 33 -5.147 3.298 10.421 126 HA LYS 33 HA LYS 33 -6.260 5.881 9.617 127 HB2 LYS 33 HB2 LYS 33 -7.338 4.560 11.467 128 HB3 LYS 33 HB1 LYS 33 -5.877 4.802 12.414 129 HG2 LYS 33 HG2 LYS 33 -6.220 7.142 12.521 130 HG3 LYS 33 HG1 LYS 33 -7.504 7.076 11.312 131 HD2 LYS 33 HD2 LYS 33 -8.859 5.732 12.886 132 HD3 LYS 33 HD1 LYS 33 -7.587 5.917 14.096 133 HE2 LYS 33 HE2 LYS 33 -7.874 8.322 14.072 134 HE3 LYS 33 HE1 LYS 33 -9.080 8.192 12.793 135 HZ1 LYS 33 HZ1 LYS 33 -10.111 8.472 14.956 136 HZ2 LYS 33 HZ2 LYS 33 -9.341 7.084 15.535 137 HZ3 LYS 33 HZ3 LYS 33 -10.498 6.959 14.308 138 H ILE 34 HN ILE 34 -4.292 6.566 8.674 139 HA ILE 34 HA ILE 34 -2.157 7.221 10.590 140 HB ILE 34 HB ILE 34 -0.698 7.518 8.618 141 HG12 ILE 34 HG12 ILE 34 -3.010 6.385 7.024 142 HG13 ILE 34 HG11 ILE 34 -2.563 8.089 7.034 143 HG21 ILE 34 HG21 ILE 34 -0.513 5.138 8.029 144 HG22 ILE 34 HG22 ILE 34 -2.087 4.844 8.773 145 HG23 ILE 34 HG23 ILE 34 -0.729 5.381 9.764 146 HD11 ILE 34 HD11 ILE 34 -1.716 6.873 5.074 147 HD12 ILE 34 HD12 ILE 34 -0.764 5.845 6.147 148 HD13 ILE 34 HD13 ILE 34 -0.427 7.574 6.053 149 H LYS 35 HN LYS 35 -0.893 9.256 9.477 150 HA LYS 35 HA LYS 35 -2.895 11.377 9.548 151 HB2 LYS 35 HB2 LYS 35 0.120 11.480 9.780 152 HB3 LYS 35 HB1 LYS 35 -0.942 12.880 9.870 153 HG2 LYS 35 HG2 LYS 35 -1.958 12.068 11.881 154 HG3 LYS 35 HG1 LYS 35 -1.104 10.531 11.748 155 HD2 LYS 35 HD2 LYS 35 1.039 11.767 11.981 156 HD3 LYS 35 HD1 LYS 35 0.111 13.245 12.259 157 HE2 LYS 35 HE2 LYS 35 -0.908 12.264 14.227 158 HE3 LYS 35 HE1 LYS 35 -0.069 10.745 13.933 159 HZ1 LYS 35 HZ1 LYS 35 2.039 11.912 14.250 160 HZ2 LYS 35 HZ2 LYS 35 1.056 12.025 15.620 161 HZ3 LYS 35 HZ3 LYS 35 1.207 13.344 14.579 162 H ARG 36 HN ARG 36 -2.725 13.150 7.997 163 HA ARG 36 HA ARG 36 -2.664 12.138 5.363 164 HB2 ARG 36 HB2 ARG 36 -3.254 14.738 6.627 165 HB3 ARG 36 HB1 ARG 36 -2.769 14.791 4.936 166 HG2 ARG 36 HG2 ARG 36 -4.538 13.140 4.416 167 HG3 ARG 36 HG1 ARG 36 -5.059 13.219 6.098 168 HD2 ARG 36 HD2 ARG 36 -5.995 15.273 5.853 169 HD3 ARG 36 HD1 ARG 36 -4.820 15.784 4.645 170 HE ARG 36 HE ARG 36 -6.056 14.443 3.019 171 HH11 ARG 36 HH11 ARG 36 -7.691 15.324 6.016 172 HH12 ARG 36 HH12 ARG 36 -9.334 15.061 5.323 173 HH21 ARG 36 HH21 ARG 36 -8.109 14.092 2.120 174 HH22 ARG 36 HH22 ARG 36 -9.578 14.406 3.131 175 H HIS 37 HN HIS 37 -0.120 13.407 7.274 176 HA HIS 37 HA HIS 37 1.427 13.991 4.850 177 HB2 HIS 37 HB2 HIS 37 2.949 15.272 6.195 178 HB3 HIS 37 HB1 HIS 37 1.313 15.788 6.568 179 HD2 HIS 37 HD2 HIS 37 4.014 16.017 8.581 180 HE1 HIS 37 HE1 HIS 37 1.645 13.451 10.959 181 HE2 HIS 37 HE2 HIS 37 3.439 15.235 10.984 182 H THR 38 HN THR 38 0.793 11.380 6.532 183 HA THR 38 HA THR 38 3.463 10.404 7.058 184 HB THR 38 HB THR 38 0.885 8.823 7.030 185 HG1 THR 38 HG1 THR 38 1.754 10.769 8.721 186 HG21 THR 38 HG21 THR 38 3.512 8.364 8.451 187 HG22 THR 38 HG22 THR 38 2.936 7.475 7.041 188 HG23 THR 38 HG23 THR 38 2.079 7.345 8.579 189 HA PRO 39 HA PRO 39 4.226 9.202 2.820 190 HB2 PRO 39 HB2 PRO 39 6.037 7.246 4.136 191 HB3 PRO 39 HB1 PRO 39 6.386 8.429 2.868 192 HG2 PRO 39 HG2 PRO 39 7.210 8.844 5.354 193 HG3 PRO 39 HG1 PRO 39 6.612 10.178 4.350 194 HD2 PRO 39 HD2 PRO 39 5.268 8.758 6.591 195 HD3 PRO 39 HD1 PRO 39 5.200 10.471 6.125 196 H LEU 40 HN LEU 40 3.107 7.839 1.585 197 HA LEU 40 HA LEU 40 1.615 5.691 2.695 198 HB2 LEU 40 HB2 LEU 40 2.122 6.613 -0.122 199 HB3 LEU 40 HB1 LEU 40 1.161 5.186 0.221 200 HG LEU 40 HG LEU 40 0.528 7.961 1.233 201 HD11 LEU 40 HD11 LEU 40 -1.269 7.954 -0.407 202 HD12 LEU 40 HD12 LEU 40 -0.720 6.394 -1.016 203 HD13 LEU 40 HD13 LEU 40 0.304 7.819 -1.190 204 HD21 LEU 40 HD21 LEU 40 -0.971 5.351 1.379 205 HD22 LEU 40 HD22 LEU 40 -1.683 6.923 1.735 206 HD23 LEU 40 HD23 LEU 40 -0.360 6.311 2.726 207 H SER 41 HN SER 41 4.799 5.935 1.569 208 HA SER 41 HA SER 41 5.255 3.359 0.549 209 HB2 SER 41 HB2 SER 41 7.606 4.178 1.833 210 HB3 SER 41 HB1 SER 41 7.177 4.459 0.144 211 HG SER 41 HG SER 41 7.224 6.486 0.684 212 H LYS 42 HN LYS 42 5.351 4.690 3.812 213 HA LYS 42 HA LYS 42 6.284 2.306 5.061 214 HB2 LYS 42 HB2 LYS 42 5.327 4.961 5.923 215 HB3 LYS 42 HB1 LYS 42 5.027 3.661 7.067 216 HG2 LYS 42 HG2 LYS 42 7.212 3.404 7.564 217 HG3 LYS 42 HG1 LYS 42 7.743 3.775 5.924 218 HD2 LYS 42 HD2 LYS 42 7.496 6.120 6.294 219 HD3 LYS 42 HD1 LYS 42 6.681 5.848 7.836 220 HE2 LYS 42 HE2 LYS 42 8.646 5.193 8.902 221 HE3 LYS 42 HE1 LYS 42 9.458 4.829 7.382 222 HZ1 LYS 42 HZ1 LYS 42 9.857 7.063 6.965 223 HZ2 LYS 42 HZ2 LYS 42 10.111 6.948 8.631 224 HZ3 LYS 42 HZ3 LYS 42 8.662 7.600 8.045 225 H LEU 43 HN LEU 43 3.171 3.601 4.193 226 HA LEU 43 HA LEU 43 1.545 1.882 5.736 227 HB2 LEU 43 HB2 LEU 43 0.661 3.902 4.691 228 HB3 LEU 43 HB1 LEU 43 1.005 3.263 3.099 229 HG LEU 43 HG LEU 43 -0.808 1.627 4.773 230 HD11 LEU 43 HD11 LEU 43 -2.738 3.053 4.258 231 HD12 LEU 43 HD12 LEU 43 -1.646 4.288 3.631 232 HD13 LEU 43 HD13 LEU 43 -1.595 3.849 5.338 233 HD21 LEU 43 HD21 LEU 43 -0.901 2.559 1.901 234 HD22 LEU 43 HD22 LEU 43 -1.967 1.363 2.641 235 HD23 LEU 43 HD23 LEU 43 -0.246 1.022 2.466 236 H MET 44 HN MET 44 2.894 1.667 2.488 237 HA MET 44 HA MET 44 1.707 -0.745 1.691 238 HB2 MET 44 HB2 MET 44 4.417 0.370 0.942 239 HB3 MET 44 HB1 MET 44 3.586 -0.924 0.095 240 HG2 MET 44 HG2 MET 44 1.807 0.612 -0.532 241 HG3 MET 44 HG1 MET 44 2.610 1.912 0.348 242 HE1 MET 44 HE1 MET 44 1.823 2.476 -2.555 243 HE2 MET 44 HE2 MET 44 3.313 3.118 -3.247 244 HE3 MET 44 HE3 MET 44 2.830 3.579 -1.615 245 H LYS 45 HN LYS 45 4.832 -0.093 3.206 246 HA LYS 45 HA LYS 45 5.693 -2.760 3.346 247 HB2 LYS 45 HB2 LYS 45 6.461 -0.392 5.055 248 HB3 LYS 45 HB1 LYS 45 7.324 -1.924 5.016 249 HG2 LYS 45 HG2 LYS 45 7.488 -1.468 2.468 250 HG3 LYS 45 HG1 LYS 45 7.141 0.199 2.927 251 HD2 LYS 45 HD2 LYS 45 9.068 0.228 4.395 252 HD3 LYS 45 HD1 LYS 45 9.389 -1.472 4.044 253 HE2 LYS 45 HE2 LYS 45 9.607 -0.798 1.619 254 HE3 LYS 45 HE1 LYS 45 9.581 0.876 2.169 255 HZ1 LYS 45 HZ1 LYS 45 11.833 0.167 1.914 256 HZ2 LYS 45 HZ2 LYS 45 11.581 -1.196 2.882 257 HZ3 LYS 45 HZ3 LYS 45 11.526 0.348 3.568 258 H ALA 46 HN ALA 46 3.839 -0.775 5.623 259 HA ALA 46 HA ALA 46 3.882 -2.484 7.819 260 HB1 ALA 46 HB1 ALA 46 2.981 -0.224 7.931 261 HB2 ALA 46 HB2 ALA 46 1.800 -1.395 8.517 262 HB3 ALA 46 HB3 ALA 46 1.625 -0.699 6.905 263 H TYR 47 HN TYR 47 1.591 -2.391 5.102 264 HA TYR 47 HA TYR 47 0.066 -4.620 5.986 265 HB2 TYR 47 HB2 TYR 47 -0.739 -2.874 4.376 266 HB3 TYR 47 HB1 TYR 47 0.343 -3.551 3.166 267 HD1 TYR 47 HD1 TYR 47 -0.519 -5.102 1.678 268 HD2 TYR 47 HD2 TYR 47 -2.406 -4.629 5.461 269 HE1 TYR 47 HE1 TYR 47 -2.276 -6.679 0.992 270 HE2 TYR 47 HE2 TYR 47 -4.168 -6.207 4.787 271 HH TYR 47 HH TYR 47 -5.181 -7.031 2.631 272 H CYS 48 HN CYS 48 2.750 -4.219 3.737 273 HA CYS 48 HA CYS 48 2.865 -6.805 2.692 274 HB2 CYS 48 HB2 CYS 48 4.153 -4.623 2.060 275 HB3 CYS 48 HB1 CYS 48 5.347 -5.209 3.213 276 HG CYS 48 HG CYS 48 6.040 -7.456 1.858 277 H GLU 49 HN GLU 49 4.542 -5.430 5.507 278 HA GLU 49 HA GLU 49 6.026 -7.697 6.212 279 HB2 GLU 49 HB2 GLU 49 4.983 -5.369 7.812 280 HB3 GLU 49 HB1 GLU 49 5.966 -6.633 8.541 281 HG2 GLU 49 HG2 GLU 49 6.844 -5.030 6.156 282 HG3 GLU 49 HG1 GLU 49 7.188 -4.563 7.820 283 H ARG 50 HN ARG 50 2.782 -6.679 7.168 284 HA ARG 50 HA ARG 50 2.343 -8.720 9.066 285 HB2 ARG 50 HB2 ARG 50 0.476 -7.014 7.439 286 HB3 ARG 50 HB1 ARG 50 -0.101 -8.187 8.614 287 HG2 ARG 50 HG2 ARG 50 0.863 -7.015 10.412 288 HG3 ARG 50 HG1 ARG 50 1.837 -6.016 9.333 289 HD2 ARG 50 HD2 ARG 50 -0.294 -5.015 10.388 290 HD3 ARG 50 HD1 ARG 50 0.038 -4.728 8.681 291 HE ARG 50 HE ARG 50 -1.515 -6.789 8.395 292 HH11 ARG 50 HH11 ARG 50 -1.819 -4.310 10.863 293 HH12 ARG 50 HH12 ARG 50 -3.625 -4.421 10.918 294 HH21 ARG 50 HH21 ARG 50 -4.729 -5.901 9.571 295 HH22 ARG 50 HH22 ARG 50 -3.794 -6.984 8.452 296 H GLN 51 HN GLN 51 1.872 -8.576 5.586 297 HA GLN 51 HA GLN 51 0.492 -11.097 5.475 298 HB2 GLN 51 HB2 GLN 51 1.731 -9.420 3.283 299 HB3 GLN 51 HB1 GLN 51 0.736 -10.846 3.018 300 HG2 GLN 51 HG2 GLN 51 -0.164 -8.322 4.387 301 HG3 GLN 51 HG1 GLN 51 -0.510 -8.764 2.715 302 HE21 GLN 51 HE21 GLN 51 -2.076 -10.274 2.283 303 HE22 GLN 51 HE22 GLN 51 -3.147 -10.891 3.489 304 H GLY 52 HN GLY 52 3.763 -10.017 5.438 305 HA2 GLY 52 HA2 GLY 52 5.686 -11.290 5.691 306 HA3 GLY 52 HA1 GLY 52 4.713 -12.743 5.502 307 H LEU 53 HN LEU 53 4.574 -10.145 3.204 308 HA LEU 53 HA LEU 53 5.898 -11.889 1.233 309 HB2 LEU 53 HB2 LEU 53 3.778 -9.770 0.830 310 HB3 LEU 53 HB1 LEU 53 4.560 -10.659 -0.465 311 HG LEU 53 HG LEU 53 2.968 -12.019 1.705 312 HD11 LEU 53 HD11 LEU 53 1.124 -12.126 0.089 313 HD12 LEU 53 HD12 LEU 53 2.031 -11.075 -1.002 314 HD13 LEU 53 HD13 LEU 53 1.496 -10.469 0.567 315 HD21 LEU 53 HD21 LEU 53 4.542 -13.432 0.489 316 HD22 LEU 53 HD22 LEU 53 3.851 -12.902 -1.044 317 HD23 LEU 53 HD23 LEU 53 2.878 -13.848 0.082 318 H SER 54 HN SER 54 6.814 -10.588 -0.645 319 HA SER 54 HA SER 54 8.578 -8.557 0.451 320 HB2 SER 54 HB2 SER 54 9.561 -10.348 -0.911 321 HB3 SER 54 HB1 SER 54 8.526 -9.901 -2.265 322 HG SER 54 HG SER 54 10.892 -9.006 -1.854 323 H MET 55 HN MET 55 8.591 -6.434 -0.171 324 HA MET 55 HA MET 55 6.198 -5.301 -1.132 325 HB2 MET 55 HB2 MET 55 7.798 -4.122 0.340 326 HB3 MET 55 HB1 MET 55 8.942 -4.042 -0.991 327 HG2 MET 55 HG2 MET 55 7.323 -2.696 -2.270 328 HG3 MET 55 HG1 MET 55 6.235 -2.726 -0.883 329 HE1 MET 55 HE1 MET 55 6.103 -0.131 -1.056 330 HE2 MET 55 HE2 MET 55 7.318 0.019 -2.326 331 HE3 MET 55 HE3 MET 55 7.466 0.964 -0.846 332 H ARG 56 HN ARG 56 8.954 -6.556 -2.753 333 HA ARG 56 HA ARG 56 8.530 -5.090 -5.198 334 HB2 ARG 56 HB2 ARG 56 10.745 -6.049 -4.292 335 HB3 ARG 56 HB1 ARG 56 10.177 -7.592 -4.913 336 HG2 ARG 56 HG2 ARG 56 10.095 -6.713 -7.154 337 HG3 ARG 56 HG1 ARG 56 10.509 -5.101 -6.567 338 HD2 ARG 56 HD2 ARG 56 12.676 -5.892 -5.829 339 HD3 ARG 56 HD1 ARG 56 12.266 -7.537 -6.309 340 HE ARG 56 HE ARG 56 12.585 -6.960 -8.532 341 HH11 ARG 56 HH11 ARG 56 13.632 -3.127 -7.727 342 HH12 ARG 56 HH12 ARG 56 12.863 -4.139 -6.447 343 HH21 ARG 56 HH21 ARG 56 14.036 -4.006 -9.805 344 HH22 ARG 56 HH22 ARG 56 13.566 -5.707 -10.182 345 H GLN 57 HN GLN 57 6.971 -7.653 -3.730 346 HA GLN 57 HA GLN 57 6.306 -8.986 -6.247 347 HB2 GLN 57 HB2 GLN 57 6.937 -10.403 -4.352 348 HB3 GLN 57 HB1 GLN 57 5.613 -9.744 -3.409 349 HG2 GLN 57 HG2 GLN 57 3.991 -10.750 -4.850 350 HG3 GLN 57 HG1 GLN 57 5.243 -11.252 -5.984 351 HE21 GLN 57 HE21 GLN 57 3.239 -12.822 -4.513 352 HE22 GLN 57 HE22 GLN 57 4.141 -14.006 -3.631 353 H ILE 58 HN ILE 58 4.724 -7.217 -3.606 354 HA ILE 58 HA ILE 58 2.179 -7.414 -5.020 355 HB ILE 58 HB ILE 58 1.217 -6.257 -3.037 356 HG12 ILE 58 HG12 ILE 58 3.968 -6.655 -1.838 357 HG13 ILE 58 HG11 ILE 58 3.314 -5.101 -2.343 358 HG21 ILE 58 HG21 ILE 58 1.063 -8.622 -3.129 359 HG22 ILE 58 HG22 ILE 58 1.539 -8.199 -1.485 360 HG23 ILE 58 HG23 ILE 58 2.740 -8.817 -2.620 361 HD11 ILE 58 HD11 ILE 58 2.215 -6.870 -0.171 362 HD12 ILE 58 HD12 ILE 58 1.509 -5.343 -0.704 363 HD13 ILE 58 HD13 ILE 58 3.107 -5.362 0.044 364 H ARG 59 HN ARG 59 0.848 -5.483 -5.303 365 HA ARG 59 HA ARG 59 2.396 -3.010 -5.686 366 HB2 ARG 59 HB2 ARG 59 0.521 -4.264 -7.702 367 HB3 ARG 59 HB1 ARG 59 1.165 -2.634 -7.824 368 HG2 ARG 59 HG2 ARG 59 2.801 -5.160 -7.810 369 HG3 ARG 59 HG1 ARG 59 2.369 -4.217 -9.238 370 HD2 ARG 59 HD2 ARG 59 3.566 -2.282 -8.294 371 HD3 ARG 59 HD1 ARG 59 4.035 -3.267 -6.908 372 HE ARG 59 HE ARG 59 5.114 -3.386 -9.596 373 HH11 ARG 59 HH11 ARG 59 6.310 -5.930 -6.684 374 HH12 ARG 59 HH12 ARG 59 4.886 -4.853 -6.403 375 HH21 ARG 59 HH21 ARG 59 6.954 -4.703 -9.955 376 HH22 ARG 59 HH22 ARG 59 7.480 -5.820 -8.640 377 H PHE 60 HN PHE 60 1.239 -1.111 -5.390 378 HA PHE 60 HA PHE 60 -1.483 -1.466 -4.318 379 HB2 PHE 60 HB2 PHE 60 0.699 0.466 -3.523 380 HB3 PHE 60 HB1 PHE 60 -0.979 0.677 -3.035 381 HD1 PHE 60 HD1 PHE 60 1.914 -1.630 -2.808 382 HD2 PHE 60 HD2 PHE 60 -1.850 -0.474 -1.192 383 HE1 PHE 60 HE1 PHE 60 2.295 -3.104 -0.877 384 HE2 PHE 60 HE2 PHE 60 -1.476 -1.947 0.743 385 HZ PHE 60 HZ PHE 60 0.598 -3.265 0.900 386 H ARG 61 HN ARG 61 -3.092 -0.355 -5.249 387 HA ARG 61 HA ARG 61 -2.372 1.816 -7.110 388 HB2 ARG 61 HB2 ARG 61 -4.368 -0.409 -7.508 389 HB3 ARG 61 HB1 ARG 61 -4.373 1.059 -8.474 390 HG2 ARG 61 HG2 ARG 61 -2.060 0.546 -9.184 391 HG3 ARG 61 HG1 ARG 61 -2.162 -0.977 -8.297 392 HD2 ARG 61 HD2 ARG 61 -4.175 -1.534 -9.685 393 HD3 ARG 61 HD1 ARG 61 -3.825 -0.106 -10.654 394 HE ARG 61 HE ARG 61 -1.537 -1.297 -10.929 395 HH11 ARG 61 HH11 ARG 61 -4.210 -4.212 -11.827 396 HH12 ARG 61 HH12 ARG 61 -4.735 -2.778 -10.868 397 HH21 ARG 61 HH21 ARG 61 -0.857 -3.068 -12.187 398 HH22 ARG 61 HH22 ARG 61 -2.045 -4.365 -12.587 399 H PHE 62 HN PHE 62 -3.760 3.536 -7.256 400 HA PHE 62 HA PHE 62 -6.001 3.618 -5.344 401 HB2 PHE 62 HB2 PHE 62 -4.203 4.954 -4.409 402 HB3 PHE 62 HB1 PHE 62 -3.967 5.779 -5.946 403 HD1 PHE 62 HD1 PHE 62 -6.700 5.137 -3.494 404 HD2 PHE 62 HD2 PHE 62 -4.837 7.888 -6.150 405 HE1 PHE 62 HE1 PHE 62 -8.291 6.877 -2.799 406 HE2 PHE 62 HE2 PHE 62 -6.424 9.637 -5.459 407 HZ PHE 62 HZ PHE 62 -8.155 9.133 -3.785 408 H ASP 63 HN ASP 63 -7.763 3.606 -6.563 409 HA ASP 63 HA ASP 63 -9.310 4.131 -8.136 410 HB2 ASP 63 HB2 ASP 63 -8.699 6.475 -7.274 411 HB3 ASP 63 HB1 ASP 63 -7.741 6.635 -8.741 412 H GLY 64 HN GLY 64 -6.854 2.671 -8.805 413 HA2 GLY 64 HA2 GLY 64 -6.480 1.496 -10.829 414 HA3 GLY 64 HA1 GLY 64 -7.080 2.885 -11.719 415 H GLN 65 HN GLN 65 -5.400 4.714 -10.065 416 HA GLN 65 HA GLN 65 -3.035 4.534 -11.723 417 HB2 GLN 65 HB2 GLN 65 -3.609 6.538 -9.539 418 HB3 GLN 65 HB1 GLN 65 -2.469 6.705 -10.865 419 HG2 GLN 65 HG2 GLN 65 -5.466 6.617 -11.105 420 HG3 GLN 65 HG1 GLN 65 -4.452 8.054 -11.223 421 HE21 GLN 65 HE21 GLN 65 -2.994 8.207 -13.015 422 HE22 GLN 65 HE22 GLN 65 -3.350 7.384 -14.496 423 HA PRO 66 HA PRO 66 -0.653 2.371 -8.656 424 HB2 PRO 66 HB2 PRO 66 1.830 2.851 -9.652 425 HB3 PRO 66 HB1 PRO 66 0.714 1.685 -10.376 426 HG2 PRO 66 HG2 PRO 66 1.316 4.479 -11.224 427 HG3 PRO 66 HG1 PRO 66 1.082 3.027 -12.217 428 HD2 PRO 66 HD2 PRO 66 -0.855 4.890 -11.880 429 HD3 PRO 66 HD1 PRO 66 -1.208 3.170 -12.129 430 H ILE 67 HN ILE 67 0.281 2.869 -6.745 431 HA ILE 67 HA ILE 67 0.723 5.696 -6.181 432 HB ILE 67 HB ILE 67 0.817 3.399 -4.223 433 HG12 ILE 67 HG12 ILE 67 -1.536 5.167 -4.930 434 HG13 ILE 67 HG11 ILE 67 -1.365 3.477 -5.390 435 HG21 ILE 67 HG21 ILE 67 0.494 6.377 -3.883 436 HG22 ILE 67 HG22 ILE 67 1.854 5.383 -3.365 437 HG23 ILE 67 HG23 ILE 67 0.282 5.200 -2.588 438 HD11 ILE 67 HD11 ILE 67 -1.697 4.598 -2.623 439 HD12 ILE 67 HD12 ILE 67 -1.286 2.916 -2.957 440 HD13 ILE 67 HD13 ILE 67 -2.819 3.577 -3.522 441 H ASN 68 HN ASN 68 2.662 6.574 -5.675 442 HA ASN 68 HA ASN 68 5.013 4.913 -6.173 443 HB2 ASN 68 HB2 ASN 68 4.812 7.907 -5.753 444 HB3 ASN 68 HB1 ASN 68 6.241 7.029 -6.285 445 HD21 ASN 68 HD21 ASN 68 3.202 8.362 -7.180 446 HD22 ASN 68 HD22 ASN 68 3.344 8.077 -8.886 447 H GLU 69 HN GLU 69 6.953 5.363 -4.758 448 HA GLU 69 HA GLU 69 6.188 4.925 -2.013 449 HB2 GLU 69 HB2 GLU 69 8.904 5.113 -3.329 450 HB3 GLU 69 HB1 GLU 69 8.640 4.673 -1.648 451 HG2 GLU 69 HG2 GLU 69 7.780 2.617 -2.169 452 HG3 GLU 69 HG1 GLU 69 7.246 3.122 -3.772 453 H THR 70 HN THR 70 6.564 7.617 -3.837 454 HA THR 70 HA THR 70 7.544 9.262 -1.608 455 HB THR 70 HB THR 70 7.501 10.991 -3.661 456 HG1 THR 70 HG1 THR 70 7.157 9.937 -5.469 457 HG21 THR 70 HG21 THR 70 9.470 10.476 -2.315 458 HG22 THR 70 HG22 THR 70 9.883 10.451 -4.030 459 HG23 THR 70 HG23 THR 70 9.660 8.936 -3.156 460 H ASP 71 HN ASP 71 4.727 8.150 -2.667 461 HA ASP 71 HA ASP 71 3.252 10.638 -2.836 462 HB2 ASP 71 HB2 ASP 71 2.592 7.753 -3.217 463 HB3 ASP 71 HB1 ASP 71 1.285 8.864 -2.826 464 H THR 72 HN THR 72 1.495 11.165 -1.485 465 HA THR 72 HA THR 72 1.443 9.907 1.160 466 HB THR 72 HB THR 72 1.029 12.439 1.921 467 HG1 THR 72 HG1 THR 72 3.129 13.003 0.193 468 HG21 THR 72 HG21 THR 72 3.768 11.232 1.513 469 HG22 THR 72 HG22 THR 72 2.707 10.959 2.896 470 HG23 THR 72 HG23 THR 72 3.385 12.562 2.604 471 HA PRO 73 HA PRO 73 -2.974 9.996 0.863 472 HB2 PRO 73 HB2 PRO 73 -3.071 11.542 3.405 473 HB3 PRO 73 HB1 PRO 73 -3.870 10.022 2.979 474 HG2 PRO 73 HG2 PRO 73 -1.770 10.015 4.598 475 HG3 PRO 73 HG1 PRO 73 -1.984 8.747 3.377 476 HD2 PRO 73 HD2 PRO 73 -0.133 11.081 3.358 477 HD3 PRO 73 HD1 PRO 73 0.119 9.433 2.751 478 H ALA 74 HN ALA 74 -1.654 13.066 2.102 479 HA ALA 74 HA ALA 74 -3.799 14.652 1.116 480 HB1 ALA 74 HB1 ALA 74 -2.365 16.562 1.678 481 HB2 ALA 74 HB2 ALA 74 -1.013 15.462 1.947 482 HB3 ALA 74 HB3 ALA 74 -2.433 15.388 2.989 483 H GLN 75 HN GLN 75 -0.764 13.558 -0.215 484 HA GLN 75 HA GLN 75 -0.631 15.417 -2.363 485 HB2 GLN 75 HB2 GLN 75 1.347 14.217 -1.556 486 HB3 GLN 75 HB1 GLN 75 0.639 12.692 -2.063 487 HG2 GLN 75 HG2 GLN 75 2.313 13.436 -3.645 488 HG3 GLN 75 HG1 GLN 75 0.714 13.428 -4.387 489 HE21 GLN 75 HE21 GLN 75 1.363 14.898 -5.969 490 HE22 GLN 75 HE22 GLN 75 1.607 16.572 -5.616 491 H LEU 76 HN LEU 76 -1.885 12.117 -2.063 492 HA LEU 76 HA LEU 76 -2.648 12.060 -4.848 493 HB2 LEU 76 HB2 LEU 76 -2.696 10.144 -2.581 494 HB3 LEU 76 HB1 LEU 76 -3.843 9.880 -3.881 495 HG LEU 76 HG LEU 76 -0.849 10.071 -4.234 496 HD11 LEU 76 HD11 LEU 76 -2.681 7.681 -4.226 497 HD12 LEU 76 HD12 LEU 76 -1.443 8.059 -3.029 498 HD13 LEU 76 HD13 LEU 76 -0.980 7.659 -4.684 499 HD21 LEU 76 HD21 LEU 76 -1.939 10.797 -6.230 500 HD22 LEU 76 HD22 LEU 76 -3.089 9.462 -6.152 501 HD23 LEU 76 HD23 LEU 76 -1.388 9.142 -6.493 502 H GLU 77 HN GLU 77 -3.890 13.778 -2.501 503 HA GLU 77 HA GLU 77 -5.897 14.711 -2.013 504 HB2 GLU 77 HB2 GLU 77 -6.518 13.692 -4.788 505 HB3 GLU 77 HB1 GLU 77 -7.576 14.761 -3.878 506 HG2 GLU 77 HG2 GLU 77 -4.745 15.397 -4.679 507 HG3 GLU 77 HG1 GLU 77 -6.191 15.953 -5.519 508 H MET 78 HN MET 78 -5.466 12.092 -1.046 509 HA MET 78 HA MET 78 -7.776 10.462 -1.430 510 HB2 MET 78 HB2 MET 78 -5.532 10.472 0.574 511 HB3 MET 78 HB1 MET 78 -6.886 9.364 0.732 512 HG2 MET 78 HG2 MET 78 -6.366 8.331 -1.359 513 HG3 MET 78 HG1 MET 78 -5.134 9.544 -1.703 514 HE1 MET 78 HE1 MET 78 -3.750 7.226 -2.277 515 HE2 MET 78 HE2 MET 78 -4.958 6.160 -1.559 516 HE3 MET 78 HE3 MET 78 -3.275 6.064 -1.039 517 H GLU 79 HN GLU 79 -9.431 10.032 0.105 518 HA GLU 79 HA GLU 79 -9.853 12.205 2.048 519 HB2 GLU 79 HB2 GLU 79 -11.432 11.614 -0.223 520 HB3 GLU 79 HB1 GLU 79 -12.350 11.080 1.180 521 HG2 GLU 79 HG2 GLU 79 -11.286 13.838 0.630 522 HG3 GLU 79 HG1 GLU 79 -12.973 13.326 0.725 523 H ASP 80 HN ASP 80 -11.886 11.406 3.492 524 HA ASP 80 HA ASP 80 -10.815 9.190 4.953 525 HB2 ASP 80 HB2 ASP 80 -12.029 11.249 5.895 526 HB3 ASP 80 HB1 ASP 80 -13.516 10.436 5.417 527 H GLU 81 HN GLU 81 -11.572 7.163 5.170 528 HA GLU 81 HA GLU 81 -12.654 5.224 4.740 529 HB2 GLU 81 HB2 GLU 81 -14.857 6.995 3.663 530 HB3 GLU 81 HB1 GLU 81 -15.001 5.272 3.981 531 HG2 GLU 81 HG2 GLU 81 -14.073 6.917 6.234 532 HG3 GLU 81 HG1 GLU 81 -15.732 7.194 5.708 533 H ASP 82 HN ASP 82 -10.858 6.517 2.829 534 HA ASP 82 HA ASP 82 -11.860 5.923 0.194 535 HB2 ASP 82 HB2 ASP 82 -9.878 7.553 1.079 536 HB3 ASP 82 HB1 ASP 82 -8.934 6.152 0.575 537 H THR 83 HN THR 83 -10.080 4.494 -1.183 538 HA THR 83 HA THR 83 -9.480 2.088 0.373 539 HB THR 83 HB THR 83 -11.044 1.839 -2.186 540 HG1 THR 83 HG1 THR 83 -11.895 2.412 0.396 541 HG21 THR 83 HG21 THR 83 -11.478 -0.428 -1.344 542 HG22 THR 83 HG22 THR 83 -10.510 -0.081 0.090 543 HG23 THR 83 HG23 THR 83 -9.748 -0.124 -1.501 544 H ILE 84 HN ILE 84 -7.658 1.163 -0.169 545 HA ILE 84 HA ILE 84 -6.380 1.889 -2.723 546 HB ILE 84 HB ILE 84 -5.101 0.885 -0.166 547 HG12 ILE 84 HG12 ILE 84 -4.901 3.623 -1.436 548 HG13 ILE 84 HG11 ILE 84 -5.990 3.241 -0.106 549 HG21 ILE 84 HG21 ILE 84 -2.970 1.378 -1.261 550 HG22 ILE 84 HG22 ILE 84 -3.831 1.806 -2.741 551 HG23 ILE 84 HG23 ILE 84 -3.882 0.149 -2.137 552 HD11 ILE 84 HD11 ILE 84 -2.986 3.061 -0.037 553 HD12 ILE 84 HD12 ILE 84 -4.075 2.678 1.298 554 HD13 ILE 84 HD13 ILE 84 -3.974 4.330 0.687 555 H ASP 85 HN ASP 85 -5.872 0.294 -4.140 556 HA ASP 85 HA ASP 85 -6.808 -2.394 -3.479 557 HB2 ASP 85 HB2 ASP 85 -6.216 -0.973 -6.057 558 HB3 ASP 85 HB1 ASP 85 -6.352 -2.727 -6.012 559 H VAL 86 HN VAL 86 -5.543 -4.204 -3.534 560 HA VAL 86 HA VAL 86 -2.645 -3.774 -3.884 561 HB VAL 86 HB VAL 86 -3.778 -5.871 -2.050 562 HG11 VAL 86 HG11 VAL 86 -1.573 -5.760 -1.029 563 HG12 VAL 86 HG12 VAL 86 -1.111 -4.465 -2.137 564 HG13 VAL 86 HG13 VAL 86 -1.445 -6.083 -2.759 565 HG21 VAL 86 HG21 VAL 86 -3.360 -4.330 -0.166 566 HG22 VAL 86 HG22 VAL 86 -4.673 -3.795 -1.215 567 HG23 VAL 86 HG23 VAL 86 -3.089 -3.029 -1.324 568 H PHE 87 HN PHE 87 -1.845 -4.872 -5.519 569 HA PHE 87 HA PHE 87 -3.115 -7.425 -6.276 570 HB2 PHE 87 HB2 PHE 87 -1.813 -5.393 -8.110 571 HB3 PHE 87 HB1 PHE 87 -2.448 -6.957 -8.611 572 HD1 PHE 87 HD1 PHE 87 -4.879 -7.375 -8.569 573 HD2 PHE 87 HD2 PHE 87 -3.242 -3.537 -7.742 574 HE1 PHE 87 HE1 PHE 87 -7.088 -6.357 -8.927 575 HE2 PHE 87 HE2 PHE 87 -5.450 -2.517 -8.099 576 HZ PHE 87 HZ PHE 87 -7.374 -3.927 -8.690 577 H GLN 88 HN GLN 88 -1.407 -8.596 -7.851 578 HA GLN 88 HA GLN 88 1.211 -8.486 -6.516 579 HB2 GLN 88 HB2 GLN 88 -0.331 -10.957 -7.325 580 HB3 GLN 88 HB1 GLN 88 1.356 -10.965 -6.831 581 HG2 GLN 88 HG2 GLN 88 0.524 -9.843 -4.684 582 HG3 GLN 88 HG1 GLN 88 -1.074 -10.379 -5.191 583 HE21 GLN 88 HE21 GLN 88 -1.369 -11.816 -3.550 584 HE22 GLN 88 HE22 GLN 88 -0.451 -13.270 -3.378 585 H GLN 89 HN GLN 89 3.008 -8.918 -7.797 586 HA GLN 89 HA GLN 89 2.647 -8.278 -10.579 587 HB2 GLN 89 HB2 GLN 89 4.554 -7.535 -8.981 588 HB3 GLN 89 HB1 GLN 89 5.256 -9.107 -9.340 589 HG2 GLN 89 HG2 GLN 89 6.194 -7.377 -10.763 590 HG3 GLN 89 HG1 GLN 89 5.293 -8.561 -11.710 591 HE21 GLN 89 HE21 GLN 89 4.908 -7.205 -13.413 592 HE22 GLN 89 HE22 GLN 89 3.845 -5.846 -13.325 593 H GLN 90 HN GLN 90 3.401 -9.563 -12.336 594 HA GLN 90 HA GLN 90 2.637 -12.285 -12.145 595 HB2 GLN 90 HB2 GLN 90 4.176 -11.006 -14.407 596 HB3 GLN 90 HB1 GLN 90 3.161 -12.438 -14.482 597 HG2 GLN 90 HG2 GLN 90 1.752 -10.905 -15.390 598 HG3 GLN 90 HG1 GLN 90 1.299 -10.757 -13.693 599 HE21 GLN 90 HE21 GLN 90 0.562 -8.655 -13.962 600 HE22 GLN 90 HE22 GLN 90 1.639 -7.322 -14.202 601 H THR 91 HN THR 91 3.830 -14.112 -11.992 602 HA THR 91 HA THR 91 6.574 -13.847 -11.124 603 HB THR 91 HB THR 91 5.720 -16.586 -11.427 604 HG1 THR 91 HG1 THR 91 4.018 -15.107 -9.711 605 HG21 THR 91 HG21 THR 91 6.215 -14.849 -9.002 606 HG22 THR 91 HG22 THR 91 7.411 -15.843 -9.837 607 HG23 THR 91 HG23 THR 91 6.068 -16.607 -8.986 608 H GLY 92 HN GLY 92 5.390 -13.742 -14.062 609 HA2 GLY 92 HA2 GLY 92 7.757 -14.530 -15.362 610 HA3 GLY 92 HA1 GLY 92 6.538 -15.783 -15.569 611 H ASN 357 HT1 ASN 357 -16.056 -9.873 7.037 612 HA ASN 357 HA ASN 357 -13.491 -10.661 5.800 613 HB2 ASN 357 HB2 ASN 357 -13.267 -8.229 5.323 614 HB3 ASN 357 HB1 ASN 357 -14.585 -8.985 4.445 615 HD21 ASN 357 HD21 ASN 357 -15.846 -7.257 4.121 616 HD22 ASN 357 HD22 ASN 357 -16.577 -6.324 5.379 617 H ASN 358 HN ASN 358 -11.722 -9.159 6.736 618 HA ASN 358 HA ASN 358 -12.220 -8.887 9.623 619 HB2 ASN 358 HB2 ASN 358 -9.834 -9.390 9.998 620 HB3 ASN 358 HB1 ASN 358 -10.669 -10.724 9.210 621 HD21 ASN 358 HD21 ASN 358 -8.175 -8.386 8.974 622 HD22 ASN 358 HD22 ASN 358 -7.543 -8.887 7.444 623 H ARG 359 HN ARG 359 -11.969 -6.941 10.482 624 HA ARG 359 HA ARG 359 -10.421 -4.949 8.943 625 HB2 ARG 359 HB2 ARG 359 -12.142 -3.381 10.305 626 HB3 ARG 359 HB1 ARG 359 -12.460 -3.967 8.678 627 HG2 ARG 359 HG2 ARG 359 -13.755 -5.820 9.589 628 HG3 ARG 359 HG1 ARG 359 -13.420 -5.256 11.226 629 HD2 ARG 359 HD2 ARG 359 -15.651 -4.589 10.428 630 HD3 ARG 359 HD1 ARG 359 -14.627 -3.205 10.807 631 HE ARG 359 HE ARG 359 -14.518 -3.939 8.040 632 HH11 ARG 359 HH11 ARG 359 -16.361 -2.219 10.477 633 HH12 ARG 359 HH12 ARG 359 -17.043 -1.032 9.299 634 HH21 ARG 359 HH21 ARG 359 -15.417 -2.473 6.486 635 HH22 ARG 359 HH22 ARG 359 -16.558 -1.208 7.078 636 H ASP 360 HN ASP 360 -8.752 -4.236 9.988 637 HA ASP 360 HA ASP 360 -8.886 -3.768 12.865 638 HB2 ASP 360 HB2 ASP 360 -6.754 -4.639 13.334 639 HB3 ASP 360 HB1 ASP 360 -7.555 -5.867 12.371 640 HA PRO 361 HA PRO 361 -7.169 0.036 11.357 641 HB2 PRO 361 HB2 PRO 361 -7.556 1.491 13.606 642 HB3 PRO 361 HB1 PRO 361 -8.896 0.964 12.582 643 HG2 PRO 361 HG2 PRO 361 -8.203 0.081 15.260 644 HG3 PRO 361 HG1 PRO 361 -9.674 -0.231 14.327 645 HD2 PRO 361 HD2 PRO 361 -7.344 -1.952 14.709 646 HD3 PRO 361 HD1 PRO 361 -8.952 -2.353 14.079 647 H ILE 362 HN ILE 362 -5.189 0.733 11.155 648 HA ILE 362 HA ILE 362 -3.221 0.305 13.307 649 HB ILE 362 HB ILE 362 -2.601 0.450 10.358 650 HG12 ILE 362 HG12 ILE 362 -2.214 -2.178 10.987 651 HG13 ILE 362 HG11 ILE 362 -3.653 -1.809 11.936 652 HG21 ILE 362 HG21 ILE 362 -0.586 -0.916 11.238 653 HG22 ILE 362 HG22 ILE 362 -1.035 -0.238 12.801 654 HG23 ILE 362 HG23 ILE 362 -0.622 0.832 11.462 655 HD11 ILE 362 HD11 ILE 362 -3.346 -1.340 8.980 656 HD12 ILE 362 HD12 ILE 362 -4.797 -1.055 9.940 657 HD13 ILE 362 HD13 ILE 362 -4.192 -2.698 9.722 658 H VAL 363 HN VAL 363 -2.043 2.021 13.962 659 HA VAL 363 HA VAL 363 -2.390 4.541 12.464 660 HB VAL 363 HB VAL 363 -1.873 4.230 15.434 661 HG11 VAL 363 HG11 VAL 363 -0.959 6.289 14.470 662 HG12 VAL 363 HG12 VAL 363 -2.314 6.624 15.550 663 HG13 VAL 363 HG13 VAL 363 -2.544 6.679 13.801 664 HG21 VAL 363 HG21 VAL 363 -4.172 4.945 15.768 665 HG22 VAL 363 HG22 VAL 363 -4.117 3.465 14.813 666 HG23 VAL 363 HG23 VAL 363 -4.417 5.010 14.021 667 H ILE 364 HN ILE 364 -0.605 5.428 11.700 668 HA ILE 364 HA ILE 364 1.986 4.555 12.787 669 HB ILE 364 HB ILE 364 1.439 5.327 9.916 670 HG12 ILE 364 HG12 ILE 364 2.008 2.570 11.030 671 HG13 ILE 364 HG11 ILE 364 0.408 3.147 10.569 672 HG21 ILE 364 HG21 ILE 364 3.816 3.902 10.055 673 HG22 ILE 364 HG22 ILE 364 3.867 4.986 11.446 674 HG23 ILE 364 HG23 ILE 364 3.637 5.640 9.825 675 HD11 ILE 364 HD11 ILE 364 1.177 3.420 8.263 676 HD12 ILE 364 HD12 ILE 364 1.372 1.761 8.826 677 HD13 ILE 364 HD13 ILE 364 2.773 2.829 8.730 678 H SER 365 HN SER 365 3.307 6.096 13.443 679 HA SER 365 HA SER 365 2.714 8.894 12.734 680 HB2 SER 365 HB2 SER 365 3.730 7.714 15.333 681 HB3 SER 365 HB1 SER 365 3.763 9.440 14.975 682 HG SER 365 HG SER 365 1.856 8.446 16.150 683 H ASP 366 HN ASP 366 4.377 10.051 11.887 684 HA ASP 366 HA ASP 366 7.012 8.727 11.828 685 HB2 ASP 366 HB2 ASP 366 5.438 9.213 9.643 686 HB3 ASP 366 HB1 ASP 366 6.445 10.658 9.678 687 H SER 367 HN SER 367 8.702 9.853 12.530 688 HA SER 367 HA SER 367 8.205 12.593 13.433 689 HB2 SER 367 HB2 SER 367 10.537 10.771 14.103 690 HB3 SER 367 HB1 SER 367 10.138 12.308 14.875 691 HG SER 367 HG SER 367 8.216 10.260 14.833 692 HA PRO 368 HA PRO 368 10.832 13.789 9.969 693 HB2 PRO 368 HB2 PRO 368 10.154 16.397 9.939 694 HB3 PRO 368 HB1 PRO 368 9.094 15.141 9.282 695 HG2 PRO 368 HG2 PRO 368 8.884 16.622 11.839 696 HG3 PRO 368 HG1 PRO 368 7.604 16.005 10.782 697 HD2 PRO 368 HD2 PRO 368 8.484 14.792 13.129 698 HD3 PRO 368 HD1 PRO 368 7.537 14.008 11.852 Start of MODEL 15 1 H ASP 16 HT1 ASP 16 -4.936 15.967 11.368 2 HA ASP 16 HA ASP 16 -6.082 14.686 13.064 3 HB2 ASP 16 HB2 ASP 16 -8.462 14.956 11.210 4 HB3 ASP 16 HB1 ASP 16 -8.394 13.976 12.671 5 H HIS 17 HN HIS 17 -6.736 12.356 12.644 6 HA HIS 17 HA HIS 17 -4.996 11.296 10.656 7 HB2 HIS 17 HB2 HIS 17 -6.958 9.992 12.542 8 HB3 HIS 17 HB1 HIS 17 -5.926 9.086 11.444 9 HD2 HIS 17 HD2 HIS 17 -3.369 8.696 12.265 10 HE1 HIS 17 HE1 HIS 17 -3.666 10.991 15.802 11 HE2 HIS 17 HE2 HIS 17 -2.338 9.217 14.586 12 H ILE 18 HN ILE 18 -5.644 9.629 9.107 13 HA ILE 18 HA ILE 18 -8.314 10.096 7.955 14 HB ILE 18 HB ILE 18 -6.762 11.292 6.552 15 HG12 ILE 18 HG12 ILE 18 -7.413 8.643 5.245 16 HG13 ILE 18 HG11 ILE 18 -8.540 9.984 5.424 17 HG21 ILE 18 HG21 ILE 18 -4.840 10.206 5.479 18 HG22 ILE 18 HG22 ILE 18 -5.152 8.745 6.419 19 HG23 ILE 18 HG23 ILE 18 -4.694 10.239 7.236 20 HD11 ILE 18 HD11 ILE 18 -5.973 10.059 3.854 21 HD12 ILE 18 HD12 ILE 18 -7.141 11.370 4.008 22 HD13 ILE 18 HD13 ILE 18 -7.595 9.881 3.181 23 H ASN 19 HN ASN 19 -9.427 8.270 7.471 24 HA ASN 19 HA ASN 19 -8.116 5.740 8.109 25 HB2 ASN 19 HB2 ASN 19 -11.025 6.402 7.621 26 HB3 ASN 19 HB1 ASN 19 -10.416 4.808 8.057 27 HD21 ASN 19 HD21 ASN 19 -11.174 7.979 9.144 28 HD22 ASN 19 HD22 ASN 19 -10.937 7.685 10.839 29 H LEU 20 HN LEU 20 -7.098 4.806 6.487 30 HA LEU 20 HA LEU 20 -8.326 4.869 3.814 31 HB2 LEU 20 HB2 LEU 20 -5.489 4.239 4.649 32 HB3 LEU 20 HB1 LEU 20 -6.086 4.188 3.001 33 HG LEU 20 HG LEU 20 -5.989 6.670 4.720 34 HD11 LEU 20 HD11 LEU 20 -4.198 5.780 2.466 35 HD12 LEU 20 HD12 LEU 20 -3.750 5.925 4.166 36 HD13 LEU 20 HD13 LEU 20 -4.162 7.365 3.236 37 HD21 LEU 20 HD21 LEU 20 -6.399 7.794 2.520 38 HD22 LEU 20 HD22 LEU 20 -7.759 6.856 3.135 39 HD23 LEU 20 HD23 LEU 20 -6.750 6.203 1.845 40 H LYS 21 HN LYS 21 -9.272 3.084 3.095 41 HA LYS 21 HA LYS 21 -8.995 0.626 4.638 42 HB2 LYS 21 HB2 LYS 21 -10.864 1.333 2.370 43 HB3 LYS 21 HB1 LYS 21 -10.897 -0.173 3.273 44 HG2 LYS 21 HG2 LYS 21 -11.438 1.059 5.313 45 HG3 LYS 21 HG1 LYS 21 -11.411 2.572 4.399 46 HD2 LYS 21 HD2 LYS 21 -13.203 1.621 2.933 47 HD3 LYS 21 HD1 LYS 21 -13.297 0.245 4.033 48 HE2 LYS 21 HE2 LYS 21 -13.974 1.663 5.844 49 HE3 LYS 21 HE1 LYS 21 -13.696 3.111 4.875 50 HZ1 LYS 21 HZ1 LYS 21 -15.993 2.755 4.822 51 HZ2 LYS 21 HZ2 LYS 21 -15.832 1.086 4.567 52 HZ3 LYS 21 HZ3 LYS 21 -15.446 2.170 3.327 53 H VAL 22 HN VAL 22 -7.472 -0.758 4.073 54 HA VAL 22 HA VAL 22 -6.644 -0.906 1.254 55 HB VAL 22 HB VAL 22 -5.304 -2.003 3.739 56 HG11 VAL 22 HG11 VAL 22 -4.889 -3.408 1.768 57 HG12 VAL 22 HG12 VAL 22 -3.429 -2.577 2.306 58 HG13 VAL 22 HG13 VAL 22 -4.308 -1.992 0.893 59 HG21 VAL 22 HG21 VAL 22 -3.628 -0.295 3.373 60 HG22 VAL 22 HG22 VAL 22 -5.220 0.450 3.523 61 HG23 VAL 22 HG23 VAL 22 -4.480 0.264 1.932 62 H ALA 23 HN ALA 23 -7.884 -2.304 0.180 63 HA ALA 23 HA ALA 23 -8.710 -4.776 1.539 64 HB1 ALA 23 HB1 ALA 23 -10.518 -4.903 -0.073 65 HB2 ALA 23 HB2 ALA 23 -9.898 -3.475 -0.907 66 HB3 ALA 23 HB3 ALA 23 -10.524 -3.334 0.736 67 H GLY 24 HN GLY 24 -8.132 -6.703 0.817 68 HA2 GLY 24 HA2 GLY 24 -6.296 -6.800 -1.464 69 HA3 GLY 24 HA1 GLY 24 -6.500 -8.051 -0.241 70 H GLN 25 HN GLN 25 -6.480 -8.760 -2.886 71 HA GLN 25 HA GLN 25 -9.177 -8.892 -3.907 72 HB2 GLN 25 HB2 GLN 25 -6.809 -10.466 -4.907 73 HB3 GLN 25 HB1 GLN 25 -8.255 -10.003 -5.792 74 HG2 GLN 25 HG2 GLN 25 -6.032 -8.199 -4.872 75 HG3 GLN 25 HG1 GLN 25 -6.413 -8.662 -6.529 76 HE21 GLN 25 HE21 GLN 25 -6.237 -6.034 -5.230 77 HE22 GLN 25 HE22 GLN 25 -7.760 -5.252 -5.533 78 H ASP 26 HN ASP 26 -9.078 -9.977 -1.379 79 HA ASP 26 HA ASP 26 -9.772 -12.765 -1.916 80 HB2 ASP 26 HB2 ASP 26 -8.658 -13.423 0.264 81 HB3 ASP 26 HB1 ASP 26 -7.570 -13.041 -1.062 82 H GLY 27 HN GLY 27 -9.727 -10.232 0.613 83 HA2 GLY 27 HA2 GLY 27 -12.387 -9.872 0.967 84 HA3 GLY 27 HA1 GLY 27 -12.081 -11.354 1.858 85 H SER 28 HN SER 28 -9.302 -10.278 2.503 86 HA SER 28 HA SER 28 -9.986 -9.147 5.012 87 HB2 SER 28 HB2 SER 28 -7.471 -8.710 5.136 88 HB3 SER 28 HB1 SER 28 -7.965 -10.387 4.913 89 HG SER 28 HG SER 28 -7.443 -10.231 2.735 90 H VAL 29 HN VAL 29 -10.292 -7.065 5.627 91 HA VAL 29 HA VAL 29 -9.378 -4.961 3.758 92 HB VAL 29 HB VAL 29 -12.002 -4.796 5.248 93 HG11 VAL 29 HG11 VAL 29 -12.433 -2.937 3.686 94 HG12 VAL 29 HG12 VAL 29 -10.813 -3.145 3.021 95 HG13 VAL 29 HG13 VAL 29 -11.020 -2.650 4.701 96 HG21 VAL 29 HG21 VAL 29 -13.113 -5.197 3.089 97 HG22 VAL 29 HG22 VAL 29 -12.182 -6.597 3.624 98 HG23 VAL 29 HG23 VAL 29 -11.545 -5.544 2.360 99 H VAL 30 HN VAL 30 -7.635 -4.407 5.023 100 HA VAL 30 HA VAL 30 -8.009 -3.865 7.846 101 HB VAL 30 HB VAL 30 -5.614 -3.327 7.881 102 HG11 VAL 30 HG11 VAL 30 -6.239 -5.879 6.406 103 HG12 VAL 30 HG12 VAL 30 -6.342 -5.640 8.151 104 HG13 VAL 30 HG13 VAL 30 -4.777 -5.559 7.337 105 HG21 VAL 30 HG21 VAL 30 -5.738 -3.846 4.911 106 HG22 VAL 30 HG22 VAL 30 -4.253 -3.668 5.849 107 HG23 VAL 30 HG23 VAL 30 -5.369 -2.310 5.699 108 H GLN 31 HN GLN 31 -7.821 -1.858 8.838 109 HA GLN 31 HA GLN 31 -8.259 0.421 7.017 110 HB2 GLN 31 HB2 GLN 31 -10.172 -0.135 8.461 111 HB3 GLN 31 HB1 GLN 31 -9.158 0.058 9.882 112 HG2 GLN 31 HG2 GLN 31 -9.045 2.361 9.646 113 HG3 GLN 31 HG1 GLN 31 -9.514 2.308 7.946 114 HE21 GLN 31 HE21 GLN 31 -10.629 3.743 10.330 115 HE22 GLN 31 HE22 GLN 31 -12.310 3.338 10.329 116 H PHE 32 HN PHE 32 -6.541 1.667 6.820 117 HA PHE 32 HA PHE 32 -4.617 1.814 9.017 118 HB2 PHE 32 HB2 PHE 32 -4.506 2.369 6.084 119 HB3 PHE 32 HB1 PHE 32 -3.369 3.193 7.144 120 HD1 PHE 32 HD1 PHE 32 -4.281 0.064 5.580 121 HD2 PHE 32 HD2 PHE 32 -1.750 1.892 8.469 122 HE1 PHE 32 HE1 PHE 32 -2.840 -1.928 5.569 123 HE2 PHE 32 HE2 PHE 32 -0.301 -0.097 8.465 124 HZ PHE 32 HZ PHE 32 -0.845 -2.010 7.014 125 H LYS 33 HN LYS 33 -4.973 3.345 10.452 126 HA LYS 33 HA LYS 33 -6.223 5.857 9.584 127 HB2 LYS 33 HB2 LYS 33 -7.123 4.438 11.546 128 HB3 LYS 33 HB1 LYS 33 -5.733 5.039 12.439 129 HG2 LYS 33 HG2 LYS 33 -6.482 7.317 12.135 130 HG3 LYS 33 HG1 LYS 33 -7.837 6.760 11.152 131 HD2 LYS 33 HD2 LYS 33 -8.697 5.507 13.081 132 HD3 LYS 33 HD1 LYS 33 -7.359 6.112 14.059 133 HE2 LYS 33 HE2 LYS 33 -8.154 8.422 13.606 134 HE3 LYS 33 HE1 LYS 33 -9.546 7.736 12.769 135 HZ1 LYS 33 HZ1 LYS 33 -10.023 8.338 15.086 136 HZ2 LYS 33 HZ2 LYS 33 -8.867 7.223 15.612 137 HZ3 LYS 33 HZ3 LYS 33 -10.246 6.687 14.796 138 H ILE 34 HN ILE 34 -4.224 6.501 8.587 139 HA ILE 34 HA ILE 34 -2.047 7.172 10.433 140 HB ILE 34 HB ILE 34 -0.691 7.585 8.426 141 HG12 ILE 34 HG12 ILE 34 -3.047 6.558 6.832 142 HG13 ILE 34 HG11 ILE 34 -2.660 8.268 6.990 143 HG21 ILE 34 HG21 ILE 34 -0.472 5.283 7.711 144 HG22 ILE 34 HG22 ILE 34 -2.088 4.914 8.313 145 HG23 ILE 34 HG23 ILE 34 -0.801 5.336 9.443 146 HD11 ILE 34 HD11 ILE 34 -1.852 7.224 4.894 147 HD12 ILE 34 HD12 ILE 34 -0.783 6.212 5.860 148 HD13 ILE 34 HD13 ILE 34 -0.578 7.961 5.861 149 H LYS 35 HN LYS 35 -0.874 9.307 9.382 150 HA LYS 35 HA LYS 35 -2.934 11.367 9.673 151 HB2 LYS 35 HB2 LYS 35 0.083 11.584 9.814 152 HB3 LYS 35 HB1 LYS 35 -1.047 12.904 10.095 153 HG2 LYS 35 HG2 LYS 35 -1.990 11.657 12.000 154 HG3 LYS 35 HG1 LYS 35 -0.789 10.390 11.738 155 HD2 LYS 35 HD2 LYS 35 0.998 12.041 12.116 156 HD3 LYS 35 HD1 LYS 35 -0.227 13.274 12.429 157 HE2 LYS 35 HE2 LYS 35 -1.087 11.836 14.280 158 HE3 LYS 35 HE1 LYS 35 0.291 10.769 14.025 159 HZ1 LYS 35 HZ1 LYS 35 1.749 12.684 14.478 160 HZ2 LYS 35 HZ2 LYS 35 0.770 12.283 15.796 161 HZ3 LYS 35 HZ3 LYS 35 0.386 13.617 14.838 162 H ARG 36 HN ARG 36 -2.743 13.308 8.285 163 HA ARG 36 HA ARG 36 -2.807 12.578 5.566 164 HB2 ARG 36 HB2 ARG 36 -3.616 14.769 7.082 165 HB3 ARG 36 HB1 ARG 36 -2.418 15.425 5.976 166 HG2 ARG 36 HG2 ARG 36 -4.331 15.671 4.744 167 HG3 ARG 36 HG1 ARG 36 -3.773 14.093 4.182 168 HD2 ARG 36 HD2 ARG 36 -5.266 13.047 5.893 169 HD3 ARG 36 HD1 ARG 36 -5.916 14.653 6.226 170 HE ARG 36 HE ARG 36 -6.004 13.724 3.466 171 HH11 ARG 36 HH11 ARG 36 -7.724 14.310 6.487 172 HH12 ARG 36 HH12 ARG 36 -9.345 14.199 5.706 173 HH21 ARG 36 HH21 ARG 36 -8.018 13.580 2.449 174 HH22 ARG 36 HH22 ARG 36 -9.519 13.828 3.440 175 H HIS 37 HN HIS 37 -0.214 13.550 7.584 176 HA HIS 37 HA HIS 37 1.465 14.153 5.259 177 HB2 HIS 37 HB2 HIS 37 3.089 14.915 7.184 178 HB3 HIS 37 HB1 HIS 37 1.782 15.960 6.650 179 HD2 HIS 37 HD2 HIS 37 -0.410 16.134 8.442 180 HE1 HIS 37 HE1 HIS 37 1.799 14.562 11.687 181 HE2 HIS 37 HE2 HIS 37 -0.202 15.965 11.022 182 H THR 38 HN THR 38 0.660 11.444 6.447 183 HA THR 38 HA THR 38 3.317 10.412 7.109 184 HB THR 38 HB THR 38 0.709 8.887 7.076 185 HG1 THR 38 HG1 THR 38 1.922 10.507 9.051 186 HG21 THR 38 HG21 THR 38 2.729 7.495 7.021 187 HG22 THR 38 HG22 THR 38 1.899 7.348 8.573 188 HG23 THR 38 HG23 THR 38 3.351 8.342 8.439 189 HA PRO 39 HA PRO 39 3.933 9.359 2.782 190 HB2 PRO 39 HB2 PRO 39 5.919 7.516 4.014 191 HB3 PRO 39 HB1 PRO 39 6.134 8.698 2.715 192 HG2 PRO 39 HG2 PRO 39 7.065 9.203 5.149 193 HG3 PRO 39 HG1 PRO 39 6.325 10.485 4.170 194 HD2 PRO 39 HD2 PRO 39 5.196 8.999 6.490 195 HD3 PRO 39 HD1 PRO 39 4.993 10.700 6.028 196 H LEU 40 HN LEU 40 2.871 7.923 1.589 197 HA LEU 40 HA LEU 40 1.455 5.763 2.735 198 HB2 LEU 40 HB2 LEU 40 2.029 6.485 -0.131 199 HB3 LEU 40 HB1 LEU 40 0.983 5.157 0.337 200 HG LEU 40 HG LEU 40 0.492 8.014 1.175 201 HD11 LEU 40 HD11 LEU 40 -1.201 8.076 -0.595 202 HD12 LEU 40 HD12 LEU 40 -0.669 6.493 -1.155 203 HD13 LEU 40 HD13 LEU 40 0.421 7.873 -1.252 204 HD21 LEU 40 HD21 LEU 40 -1.230 5.537 1.188 205 HD22 LEU 40 HD22 LEU 40 -1.789 7.162 1.586 206 HD23 LEU 40 HD23 LEU 40 -0.576 6.374 2.597 207 H SER 41 HN SER 41 4.665 6.007 1.650 208 HA SER 41 HA SER 41 5.180 3.428 0.695 209 HB2 SER 41 HB2 SER 41 7.453 4.334 2.118 210 HB3 SER 41 HB1 SER 41 7.147 4.461 0.385 211 HG SER 41 HG SER 41 7.025 6.528 0.701 212 H LYS 42 HN LYS 42 5.265 4.766 3.975 213 HA LYS 42 HA LYS 42 6.155 2.359 5.208 214 HB2 LYS 42 HB2 LYS 42 4.701 4.685 6.483 215 HB3 LYS 42 HB1 LYS 42 5.671 3.472 7.310 216 HG2 LYS 42 HG2 LYS 42 7.623 4.272 5.921 217 HG3 LYS 42 HG1 LYS 42 6.607 5.631 5.442 218 HD2 LYS 42 HD2 LYS 42 6.369 6.275 7.795 219 HD3 LYS 42 HD1 LYS 42 7.383 4.910 8.271 220 HE2 LYS 42 HE2 LYS 42 9.167 5.891 6.767 221 HE3 LYS 42 HE1 LYS 42 8.165 7.336 6.670 222 HZ1 LYS 42 HZ1 LYS 42 10.002 7.245 8.419 223 HZ2 LYS 42 HZ2 LYS 42 8.972 6.221 9.282 224 HZ3 LYS 42 HZ3 LYS 42 8.481 7.800 8.912 225 H LEU 43 HN LEU 43 3.078 3.665 4.301 226 HA LEU 43 HA LEU 43 1.429 1.996 5.892 227 HB2 LEU 43 HB2 LEU 43 0.602 4.058 4.859 228 HB3 LEU 43 HB1 LEU 43 0.882 3.389 3.266 229 HG LEU 43 HG LEU 43 -0.936 1.820 4.988 230 HD11 LEU 43 HD11 LEU 43 -2.829 3.323 4.561 231 HD12 LEU 43 HD12 LEU 43 -1.715 4.526 3.909 232 HD13 LEU 43 HD13 LEU 43 -1.619 4.065 5.609 233 HD21 LEU 43 HD21 LEU 43 -1.084 2.794 2.134 234 HD22 LEU 43 HD22 LEU 43 -2.182 1.643 2.893 235 HD23 LEU 43 HD23 LEU 43 -0.487 1.220 2.658 236 H MET 44 HN MET 44 2.663 1.805 2.587 237 HA MET 44 HA MET 44 1.415 -0.629 1.899 238 HB2 MET 44 HB2 MET 44 3.937 0.655 0.833 239 HB3 MET 44 HB1 MET 44 3.168 -0.752 0.110 240 HG2 MET 44 HG2 MET 44 1.111 0.631 -0.188 241 HG3 MET 44 HG1 MET 44 2.044 2.025 0.351 242 HE1 MET 44 HE1 MET 44 3.916 3.201 -1.044 243 HE2 MET 44 HE2 MET 44 4.656 2.493 -2.483 244 HE3 MET 44 HE3 MET 44 4.856 1.712 -0.913 245 H LYS 45 HN LYS 45 4.601 0.113 3.247 246 HA LYS 45 HA LYS 45 5.629 -2.499 3.243 247 HB2 LYS 45 HB2 LYS 45 6.225 -0.103 4.974 248 HB3 LYS 45 HB1 LYS 45 7.106 -1.617 5.122 249 HG2 LYS 45 HG2 LYS 45 7.828 -1.422 2.793 250 HG3 LYS 45 HG1 LYS 45 6.940 0.096 2.651 251 HD2 LYS 45 HD2 LYS 45 8.336 1.085 4.396 252 HD3 LYS 45 HD1 LYS 45 9.216 -0.437 4.559 253 HE2 LYS 45 HE2 LYS 45 9.867 -0.229 2.160 254 HE3 LYS 45 HE1 LYS 45 9.131 1.373 2.152 255 HZ1 LYS 45 HZ1 LYS 45 11.322 0.559 3.977 256 HZ2 LYS 45 HZ2 LYS 45 10.690 2.114 3.780 257 HZ3 LYS 45 HZ3 LYS 45 11.554 1.388 2.522 258 H ALA 46 HN ALA 46 3.730 -0.747 5.674 259 HA ALA 46 HA ALA 46 3.911 -2.562 7.773 260 HB1 ALA 46 HB1 ALA 46 2.947 -0.329 8.001 261 HB2 ALA 46 HB2 ALA 46 1.856 -1.566 8.620 262 HB3 ALA 46 HB3 ALA 46 1.552 -0.830 7.049 263 H TYR 47 HN TYR 47 1.487 -2.431 5.162 264 HA TYR 47 HA TYR 47 0.110 -4.758 6.072 265 HB2 TYR 47 HB2 TYR 47 -0.940 -2.995 4.660 266 HB3 TYR 47 HB1 TYR 47 0.071 -3.508 3.316 267 HD1 TYR 47 HD1 TYR 47 -0.919 -4.881 1.758 268 HD2 TYR 47 HD2 TYR 47 -2.269 -5.065 5.787 269 HE1 TYR 47 HE1 TYR 47 -2.611 -6.540 1.108 270 HE2 TYR 47 HE2 TYR 47 -3.965 -6.728 5.150 271 HH TYR 47 HH TYR 47 -5.187 -7.439 3.138 272 H CYS 48 HN CYS 48 2.628 -4.148 3.699 273 HA CYS 48 HA CYS 48 2.660 -6.672 2.479 274 HB2 CYS 48 HB2 CYS 48 3.817 -4.456 1.806 275 HB3 CYS 48 HB1 CYS 48 5.127 -5.004 2.842 276 HG CYS 48 HG CYS 48 5.791 -7.207 1.387 277 H GLU 49 HN GLU 49 4.634 -5.386 5.156 278 HA GLU 49 HA GLU 49 6.072 -7.782 5.587 279 HB2 GLU 49 HB2 GLU 49 5.555 -5.372 7.320 280 HB3 GLU 49 HB1 GLU 49 6.539 -6.724 7.862 281 HG2 GLU 49 HG2 GLU 49 7.074 -4.906 5.524 282 HG3 GLU 49 HG1 GLU 49 7.983 -5.015 7.033 283 H ARG 50 HN ARG 50 2.982 -6.629 6.697 284 HA ARG 50 HA ARG 50 2.645 -8.424 8.856 285 HB2 ARG 50 HB2 ARG 50 1.282 -6.339 8.350 286 HB3 ARG 50 HB1 ARG 50 0.433 -7.299 7.145 287 HG2 ARG 50 HG2 ARG 50 -0.147 -8.908 8.986 288 HG3 ARG 50 HG1 ARG 50 0.496 -7.717 10.121 289 HD2 ARG 50 HD2 ARG 50 -1.304 -6.452 8.277 290 HD3 ARG 50 HD1 ARG 50 -2.089 -7.840 9.031 291 HE ARG 50 HE ARG 50 -0.732 -6.228 10.948 292 HH11 ARG 50 HH11 ARG 50 -3.652 -6.482 9.015 293 HH12 ARG 50 HH12 ARG 50 -4.646 -5.487 10.154 294 HH21 ARG 50 HH21 ARG 50 -3.684 -4.627 12.052 295 HH22 ARG 50 HH22 ARG 50 -1.942 -4.972 12.429 296 H GLN 51 HN GLN 51 1.915 -8.628 5.408 297 HA GLN 51 HA GLN 51 0.672 -11.218 5.650 298 HB2 GLN 51 HB2 GLN 51 1.672 -9.853 3.143 299 HB3 GLN 51 HB1 GLN 51 0.529 -11.184 3.233 300 HG2 GLN 51 HG2 GLN 51 0.080 -8.368 4.188 301 HG3 GLN 51 HG1 GLN 51 -0.626 -9.126 2.763 302 HE21 GLN 51 HE21 GLN 51 -2.269 -10.652 3.027 303 HE22 GLN 51 HE22 GLN 51 -3.142 -10.809 4.510 304 H GLY 52 HN GLY 52 3.843 -10.000 5.378 305 HA2 GLY 52 HA2 GLY 52 5.837 -11.157 5.590 306 HA3 GLY 52 HA1 GLY 52 4.944 -12.666 5.465 307 H LEU 53 HN LEU 53 4.967 -9.949 3.213 308 HA LEU 53 HA LEU 53 6.300 -11.669 1.231 309 HB2 LEU 53 HB2 LEU 53 3.889 -9.900 0.808 310 HB3 LEU 53 HB1 LEU 53 4.809 -10.630 -0.494 311 HG LEU 53 HG LEU 53 3.397 -12.220 1.650 312 HD11 LEU 53 HD11 LEU 53 1.699 -12.681 -0.068 313 HD12 LEU 53 HD12 LEU 53 2.480 -11.509 -1.133 314 HD13 LEU 53 HD13 LEU 53 1.754 -10.977 0.384 315 HD21 LEU 53 HD21 LEU 53 5.248 -13.390 0.577 316 HD22 LEU 53 HD22 LEU 53 4.576 -13.020 -1.012 317 HD23 LEU 53 HD23 LEU 53 3.698 -14.082 0.091 318 H SER 54 HN SER 54 7.434 -10.510 -0.439 319 HA SER 54 HA SER 54 8.758 -8.186 0.562 320 HB2 SER 54 HB2 SER 54 9.856 -9.961 -0.838 321 HB3 SER 54 HB1 SER 54 8.922 -9.378 -2.216 322 HG SER 54 HG SER 54 11.034 -8.154 -0.833 323 H MET 55 HN MET 55 8.547 -6.075 -0.076 324 HA MET 55 HA MET 55 6.061 -5.212 -1.085 325 HB2 MET 55 HB2 MET 55 7.836 -3.963 0.374 326 HB3 MET 55 HB1 MET 55 8.496 -3.465 -1.179 327 HG2 MET 55 HG2 MET 55 6.065 -2.729 -1.690 328 HG3 MET 55 HG1 MET 55 5.864 -2.797 0.059 329 HE1 MET 55 HE1 MET 55 7.204 -0.847 -2.966 330 HE2 MET 55 HE2 MET 55 8.701 -1.615 -2.437 331 HE3 MET 55 HE3 MET 55 8.509 0.132 -2.297 332 H ARG 56 HN ARG 56 8.881 -6.275 -2.661 333 HA ARG 56 HA ARG 56 8.376 -4.848 -5.126 334 HB2 ARG 56 HB2 ARG 56 10.683 -5.517 -4.304 335 HB3 ARG 56 HB1 ARG 56 10.268 -7.172 -4.730 336 HG2 ARG 56 HG2 ARG 56 9.932 -6.495 -7.051 337 HG3 ARG 56 HG1 ARG 56 10.339 -4.833 -6.626 338 HD2 ARG 56 HD2 ARG 56 12.568 -5.584 -5.912 339 HD3 ARG 56 HD1 ARG 56 12.155 -7.228 -6.396 340 HE ARG 56 HE ARG 56 12.368 -6.621 -8.619 341 HH11 ARG 56 HH11 ARG 56 13.289 -2.752 -7.831 342 HH12 ARG 56 HH12 ARG 56 12.720 -3.827 -6.499 343 HH21 ARG 56 HH21 ARG 56 13.524 -3.562 -9.958 344 HH22 ARG 56 HH22 ARG 56 13.131 -5.285 -10.326 345 H GLN 57 HN GLN 57 7.000 -7.481 -3.643 346 HA GLN 57 HA GLN 57 6.505 -8.961 -6.111 347 HB2 GLN 57 HB2 GLN 57 7.081 -10.285 -4.169 348 HB3 GLN 57 HB1 GLN 57 5.782 -9.553 -3.239 349 HG2 GLN 57 HG2 GLN 57 4.122 -10.631 -4.559 350 HG3 GLN 57 HG1 GLN 57 5.326 -11.192 -5.718 351 HE21 GLN 57 HE21 GLN 57 3.357 -12.620 -4.008 352 HE22 GLN 57 HE22 GLN 57 4.297 -13.791 -3.140 353 H ILE 58 HN ILE 58 4.722 -7.114 -3.652 354 HA ILE 58 HA ILE 58 2.307 -7.385 -5.298 355 HB ILE 58 HB ILE 58 1.057 -6.516 -3.367 356 HG12 ILE 58 HG12 ILE 58 3.683 -6.695 -1.878 357 HG13 ILE 58 HG11 ILE 58 2.922 -5.189 -2.381 358 HG21 ILE 58 HG21 ILE 58 2.818 -8.879 -2.721 359 HG22 ILE 58 HG22 ILE 58 1.339 -8.919 -3.678 360 HG23 ILE 58 HG23 ILE 58 1.268 -8.503 -1.968 361 HD11 ILE 58 HD11 ILE 58 2.521 -5.713 -0.021 362 HD12 ILE 58 HD12 ILE 58 1.702 -7.199 -0.506 363 HD13 ILE 58 HD13 ILE 58 1.029 -5.633 -0.957 364 H ARG 59 HN ARG 59 0.931 -5.484 -5.564 365 HA ARG 59 HA ARG 59 2.436 -2.953 -5.612 366 HB2 ARG 59 HB2 ARG 59 0.680 -4.055 -7.816 367 HB3 ARG 59 HB1 ARG 59 1.312 -2.417 -7.772 368 HG2 ARG 59 HG2 ARG 59 2.982 -4.921 -7.878 369 HG3 ARG 59 HG1 ARG 59 2.596 -3.882 -9.250 370 HD2 ARG 59 HD2 ARG 59 3.742 -2.018 -8.179 371 HD3 ARG 59 HD1 ARG 59 4.107 -3.031 -6.783 372 HE ARG 59 HE ARG 59 5.390 -3.089 -9.382 373 HH11 ARG 59 HH11 ARG 59 6.336 -5.716 -6.456 374 HH12 ARG 59 HH12 ARG 59 4.900 -4.642 -6.263 375 HH21 ARG 59 HH21 ARG 59 7.251 -4.413 -9.635 376 HH22 ARG 59 HH22 ARG 59 7.663 -5.567 -8.309 377 H PHE 60 HN PHE 60 1.216 -1.105 -5.253 378 HA PHE 60 HA PHE 60 -1.533 -1.583 -4.317 379 HB2 PHE 60 HB2 PHE 60 0.573 0.368 -3.363 380 HB3 PHE 60 HB1 PHE 60 -1.126 0.527 -2.933 381 HD1 PHE 60 HD1 PHE 60 1.741 -1.826 -2.755 382 HD2 PHE 60 HD2 PHE 60 -1.982 -0.601 -1.097 383 HE1 PHE 60 HE1 PHE 60 2.081 -3.362 -0.864 384 HE2 PHE 60 HE2 PHE 60 -1.652 -2.137 0.793 385 HZ PHE 60 HZ PHE 60 0.385 -3.522 0.910 386 H ARG 61 HN ARG 61 -3.136 -0.487 -5.275 387 HA ARG 61 HA ARG 61 -2.395 1.741 -7.061 388 HB2 ARG 61 HB2 ARG 61 -4.414 -0.449 -7.542 389 HB3 ARG 61 HB1 ARG 61 -4.318 1.015 -8.508 390 HG2 ARG 61 HG2 ARG 61 -1.989 0.418 -9.098 391 HG3 ARG 61 HG1 ARG 61 -2.203 -1.109 -8.241 392 HD2 ARG 61 HD2 ARG 61 -4.167 -1.565 -9.730 393 HD3 ARG 61 HD1 ARG 61 -3.717 -0.139 -10.660 394 HE ARG 61 HE ARG 61 -1.443 -1.639 -10.609 395 HH11 ARG 61 HH11 ARG 61 -4.320 -3.433 -12.830 396 HH12 ARG 61 HH12 ARG 61 -4.782 -2.213 -11.582 397 HH21 ARG 61 HH21 ARG 61 -0.830 -3.163 -12.198 398 HH22 ARG 61 HH22 ARG 61 -2.119 -3.940 -13.195 399 H PHE 62 HN PHE 62 -3.637 3.514 -7.050 400 HA PHE 62 HA PHE 62 -5.982 3.531 -5.268 401 HB2 PHE 62 HB2 PHE 62 -4.093 4.744 -4.247 402 HB3 PHE 62 HB1 PHE 62 -3.957 5.750 -5.684 403 HD1 PHE 62 HD1 PHE 62 -6.584 4.709 -3.247 404 HD2 PHE 62 HD2 PHE 62 -4.878 7.846 -5.560 405 HE1 PHE 62 HE1 PHE 62 -8.197 6.298 -2.281 406 HE2 PHE 62 HE2 PHE 62 -6.485 9.435 -4.598 407 HZ PHE 62 HZ PHE 62 -8.146 8.662 -2.953 408 H ASP 63 HN ASP 63 -7.686 3.636 -6.542 409 HA ASP 63 HA ASP 63 -9.157 4.265 -8.140 410 HB2 ASP 63 HB2 ASP 63 -8.622 6.535 -7.107 411 HB3 ASP 63 HB1 ASP 63 -7.552 6.799 -8.479 412 H GLY 64 HN GLY 64 -6.940 2.685 -8.888 413 HA2 GLY 64 HA2 GLY 64 -6.469 1.700 -10.960 414 HA3 GLY 64 HA1 GLY 64 -7.034 3.160 -11.757 415 H GLN 65 HN GLN 65 -5.235 4.709 -9.816 416 HA GLN 65 HA GLN 65 -2.880 4.558 -11.530 417 HB2 GLN 65 HB2 GLN 65 -3.707 6.596 -9.457 418 HB3 GLN 65 HB1 GLN 65 -2.252 6.705 -10.437 419 HG2 GLN 65 HG2 GLN 65 -5.062 6.654 -11.510 420 HG3 GLN 65 HG1 GLN 65 -4.084 8.102 -11.284 421 HE21 GLN 65 HE21 GLN 65 -2.322 8.460 -12.638 422 HE22 GLN 65 HE22 GLN 65 -2.151 7.642 -14.151 423 HA PRO 66 HA PRO 66 -0.547 2.377 -8.443 424 HB2 PRO 66 HB2 PRO 66 1.870 3.471 -9.687 425 HB3 PRO 66 HB1 PRO 66 1.313 1.796 -9.612 426 HG2 PRO 66 HG2 PRO 66 1.320 3.190 -11.910 427 HG3 PRO 66 HG1 PRO 66 0.101 1.953 -11.545 428 HD2 PRO 66 HD2 PRO 66 -0.132 4.928 -11.398 429 HD3 PRO 66 HD1 PRO 66 -1.305 3.725 -11.973 430 H ILE 67 HN ILE 67 0.249 2.857 -6.467 431 HA ILE 67 HA ILE 67 0.577 5.644 -5.751 432 HB ILE 67 HB ILE 67 0.745 3.132 -4.071 433 HG12 ILE 67 HG12 ILE 67 -1.413 5.248 -4.249 434 HG13 ILE 67 HG11 ILE 67 -1.496 3.657 -4.999 435 HG21 ILE 67 HG21 ILE 67 0.740 6.019 -3.191 436 HG22 ILE 67 HG22 ILE 67 2.106 4.907 -3.099 437 HG23 ILE 67 HG23 ILE 67 0.665 4.614 -2.124 438 HD11 ILE 67 HD11 ILE 67 -1.246 4.136 -2.043 439 HD12 ILE 67 HD12 ILE 67 -1.505 2.592 -2.854 440 HD13 ILE 67 HD13 ILE 67 -2.761 3.828 -2.893 441 H ASN 68 HN ASN 68 2.468 6.677 -5.414 442 HA ASN 68 HA ASN 68 4.914 5.235 -6.039 443 HB2 ASN 68 HB2 ASN 68 4.415 8.172 -5.514 444 HB3 ASN 68 HB1 ASN 68 5.970 7.487 -5.967 445 HD21 ASN 68 HD21 ASN 68 2.841 8.431 -7.023 446 HD22 ASN 68 HD22 ASN 68 3.113 8.195 -8.721 447 H GLU 69 HN GLU 69 6.816 5.372 -4.718 448 HA GLU 69 HA GLU 69 6.266 4.863 -1.964 449 HB2 GLU 69 HB2 GLU 69 8.886 5.188 -3.431 450 HB3 GLU 69 HB1 GLU 69 8.727 4.614 -1.777 451 HG2 GLU 69 HG2 GLU 69 7.306 2.748 -2.673 452 HG3 GLU 69 HG1 GLU 69 7.776 3.276 -4.289 453 H THR 70 HN THR 70 6.560 7.711 -3.613 454 HA THR 70 HA THR 70 7.470 9.129 -1.198 455 HB THR 70 HB THR 70 7.618 10.665 -3.688 456 HG1 THR 70 HG1 THR 70 9.716 9.367 -4.103 457 HG21 THR 70 HG21 THR 70 8.611 11.453 -1.623 458 HG22 THR 70 HG22 THR 70 9.888 11.144 -2.803 459 HG23 THR 70 HG23 THR 70 9.591 9.992 -1.500 460 H ASP 71 HN ASP 71 4.748 8.243 -2.248 461 HA ASP 71 HA ASP 71 3.463 10.845 -2.604 462 HB2 ASP 71 HB2 ASP 71 2.692 8.038 -3.196 463 HB3 ASP 71 HB1 ASP 71 1.399 9.163 -2.794 464 H THR 72 HN THR 72 1.624 11.427 -1.373 465 HA THR 72 HA THR 72 1.391 10.126 1.253 466 HB THR 72 HB THR 72 0.951 12.569 2.078 467 HG1 THR 72 HG1 THR 72 2.792 13.688 0.561 468 HG21 THR 72 HG21 THR 72 3.721 11.549 1.441 469 HG22 THR 72 HG22 THR 72 2.793 11.248 2.910 470 HG23 THR 72 HG23 THR 72 3.371 12.876 2.551 471 HA PRO 73 HA PRO 73 -3.009 10.255 0.712 472 HB2 PRO 73 HB2 PRO 73 -3.267 11.765 3.265 473 HB3 PRO 73 HB1 PRO 73 -4.006 10.230 2.786 474 HG2 PRO 73 HG2 PRO 73 -2.002 10.273 4.522 475 HG3 PRO 73 HG1 PRO 73 -2.132 8.992 3.301 476 HD2 PRO 73 HD2 PRO 73 -0.317 11.357 3.363 477 HD3 PRO 73 HD1 PRO 73 -0.007 9.706 2.788 478 H ALA 74 HN ALA 74 -1.607 13.261 1.946 479 HA ALA 74 HA ALA 74 -3.701 14.942 0.990 480 HB1 ALA 74 HB1 ALA 74 -2.235 16.784 1.594 481 HB2 ALA 74 HB2 ALA 74 -0.880 15.668 1.772 482 HB3 ALA 74 HB3 ALA 74 -2.255 15.568 2.873 483 H GLN 75 HN GLN 75 -0.778 13.661 -0.392 484 HA GLN 75 HA GLN 75 -0.608 15.539 -2.545 485 HB2 GLN 75 HB2 GLN 75 1.379 14.360 -1.748 486 HB3 GLN 75 HB1 GLN 75 0.660 12.818 -2.190 487 HG2 GLN 75 HG2 GLN 75 2.237 13.381 -3.869 488 HG3 GLN 75 HG1 GLN 75 0.629 13.594 -4.561 489 HE21 GLN 75 HE21 GLN 75 1.325 15.010 -6.123 490 HE22 GLN 75 HE22 GLN 75 1.822 16.625 -5.768 491 H LEU 76 HN LEU 76 -1.824 12.221 -2.200 492 HA LEU 76 HA LEU 76 -2.661 12.152 -4.970 493 HB2 LEU 76 HB2 LEU 76 -2.533 10.222 -2.728 494 HB3 LEU 76 HB1 LEU 76 -3.752 9.927 -3.953 495 HG LEU 76 HG LEU 76 -0.808 10.251 -4.551 496 HD11 LEU 76 HD11 LEU 76 -2.475 7.758 -4.262 497 HD12 LEU 76 HD12 LEU 76 -1.145 8.262 -3.220 498 HD13 LEU 76 HD13 LEU 76 -0.830 7.815 -4.896 499 HD21 LEU 76 HD21 LEU 76 -2.203 10.816 -6.439 500 HD22 LEU 76 HD22 LEU 76 -3.141 9.339 -6.227 501 HD23 LEU 76 HD23 LEU 76 -1.451 9.246 -6.715 502 H GLU 77 HN GLU 77 -3.928 13.805 -2.578 503 HA GLU 77 HA GLU 77 -5.978 14.620 -2.028 504 HB2 GLU 77 HB2 GLU 77 -6.499 13.680 -4.843 505 HB3 GLU 77 HB1 GLU 77 -7.712 14.533 -3.896 506 HG2 GLU 77 HG2 GLU 77 -4.976 15.656 -4.403 507 HG3 GLU 77 HG1 GLU 77 -6.329 15.918 -5.502 508 H MET 78 HN MET 78 -5.488 12.198 -0.921 509 HA MET 78 HA MET 78 -7.733 10.421 -1.369 510 HB2 MET 78 HB2 MET 78 -5.639 10.289 0.806 511 HB3 MET 78 HB1 MET 78 -6.701 8.990 0.280 512 HG2 MET 78 HG2 MET 78 -5.595 8.914 -1.869 513 HG3 MET 78 HG1 MET 78 -4.575 10.277 -1.419 514 HE1 MET 78 HE1 MET 78 -5.053 6.505 -1.439 515 HE2 MET 78 HE2 MET 78 -5.712 6.824 0.163 516 HE3 MET 78 HE3 MET 78 -4.200 5.931 -0.009 517 H GLU 79 HN GLU 79 -9.406 10.030 0.074 518 HA GLU 79 HA GLU 79 -9.732 12.073 2.178 519 HB2 GLU 79 HB2 GLU 79 -11.361 11.543 -0.073 520 HB3 GLU 79 HB1 GLU 79 -12.244 10.967 1.334 521 HG2 GLU 79 HG2 GLU 79 -11.145 13.737 0.918 522 HG3 GLU 79 HG1 GLU 79 -12.840 13.252 0.853 523 H ASP 80 HN ASP 80 -11.632 11.273 3.696 524 HA ASP 80 HA ASP 80 -10.611 8.976 5.040 525 HB2 ASP 80 HB2 ASP 80 -11.709 10.994 6.110 526 HB3 ASP 80 HB1 ASP 80 -13.247 10.361 5.543 527 H GLU 81 HN GLU 81 -11.280 6.937 5.030 528 HA GLU 81 HA GLU 81 -12.459 5.045 4.621 529 HB2 GLU 81 HB2 GLU 81 -14.606 6.984 3.794 530 HB3 GLU 81 HB1 GLU 81 -14.794 5.250 3.575 531 HG2 GLU 81 HG2 GLU 81 -14.143 5.204 6.125 532 HG3 GLU 81 HG1 GLU 81 -14.750 6.859 6.067 533 H ASP 82 HN ASP 82 -10.762 6.600 2.643 534 HA ASP 82 HA ASP 82 -11.754 5.852 0.059 535 HB2 ASP 82 HB2 ASP 82 -9.526 7.366 1.070 536 HB3 ASP 82 HB1 ASP 82 -8.943 6.176 -0.091 537 H THR 83 HN THR 83 -10.985 4.165 -1.288 538 HA THR 83 HA THR 83 -9.937 1.894 0.252 539 HB THR 83 HB THR 83 -11.230 1.552 -2.423 540 HG1 THR 83 HG1 THR 83 -12.881 2.621 -1.571 541 HG21 THR 83 HG21 THR 83 -11.958 -0.552 -1.446 542 HG22 THR 83 HG22 THR 83 -11.278 -0.087 0.113 543 HG23 THR 83 HG23 THR 83 -10.213 -0.369 -1.264 544 H ILE 84 HN ILE 84 -8.112 0.910 -0.265 545 HA ILE 84 HA ILE 84 -6.688 1.746 -2.714 546 HB ILE 84 HB ILE 84 -5.503 0.617 -0.163 547 HG12 ILE 84 HG12 ILE 84 -5.405 3.464 -1.187 548 HG13 ILE 84 HG11 ILE 84 -6.466 2.910 0.103 549 HG21 ILE 84 HG21 ILE 84 -3.352 1.285 -1.131 550 HG22 ILE 84 HG22 ILE 84 -4.179 1.801 -2.601 551 HG23 ILE 84 HG23 ILE 84 -4.182 0.099 -2.138 552 HD11 ILE 84 HD11 ILE 84 -3.457 2.895 0.153 553 HD12 ILE 84 HD12 ILE 84 -4.509 2.316 1.444 554 HD13 ILE 84 HD13 ILE 84 -4.514 4.024 1.004 555 H ASP 85 HN ASP 85 -6.044 0.175 -4.135 556 HA ASP 85 HA ASP 85 -7.024 -2.533 -3.588 557 HB2 ASP 85 HB2 ASP 85 -6.743 -0.881 -5.992 558 HB3 ASP 85 HB1 ASP 85 -6.172 -2.531 -6.211 559 H VAL 86 HN VAL 86 -5.738 -4.260 -3.440 560 HA VAL 86 HA VAL 86 -2.839 -3.841 -3.769 561 HB VAL 86 HB VAL 86 -4.167 -6.010 -2.141 562 HG11 VAL 86 HG11 VAL 86 -1.981 -6.295 -1.144 563 HG12 VAL 86 HG12 VAL 86 -1.342 -4.952 -2.091 564 HG13 VAL 86 HG13 VAL 86 -1.855 -6.436 -2.898 565 HG21 VAL 86 HG21 VAL 86 -3.619 -4.684 -0.151 566 HG22 VAL 86 HG22 VAL 86 -4.775 -3.852 -1.193 567 HG23 VAL 86 HG23 VAL 86 -3.080 -3.362 -1.188 568 H PHE 87 HN PHE 87 -1.834 -4.961 -5.329 569 HA PHE 87 HA PHE 87 -3.170 -7.358 -6.410 570 HB2 PHE 87 HB2 PHE 87 -1.851 -5.103 -7.929 571 HB3 PHE 87 HB1 PHE 87 -2.206 -6.666 -8.656 572 HD1 PHE 87 HD1 PHE 87 -4.639 -7.438 -8.667 573 HD2 PHE 87 HD2 PHE 87 -3.461 -3.433 -7.837 574 HE1 PHE 87 HE1 PHE 87 -6.913 -6.663 -9.201 575 HE2 PHE 87 HE2 PHE 87 -5.732 -2.650 -8.369 576 HZ PHE 87 HZ PHE 87 -7.460 -4.266 -9.055 577 H GLN 88 HN GLN 88 -1.734 -8.900 -7.424 578 HA GLN 88 HA GLN 88 0.982 -8.794 -6.288 579 HB2 GLN 88 HB2 GLN 88 -0.744 -11.167 -7.026 580 HB3 GLN 88 HB1 GLN 88 0.945 -11.294 -6.563 581 HG2 GLN 88 HG2 GLN 88 -0.318 -9.796 -4.550 582 HG3 GLN 88 HG1 GLN 88 -1.381 -11.153 -4.912 583 HE21 GLN 88 HE21 GLN 88 -0.992 -12.168 -2.971 584 HE22 GLN 88 HE22 GLN 88 0.512 -12.930 -2.600 585 H GLN 89 HN GLN 89 2.749 -9.338 -7.617 586 HA GLN 89 HA GLN 89 2.329 -8.768 -10.402 587 HB2 GLN 89 HB2 GLN 89 4.396 -8.256 -8.818 588 HB3 GLN 89 HB1 GLN 89 4.936 -9.819 -9.413 589 HG2 GLN 89 HG2 GLN 89 5.887 -8.118 -10.787 590 HG3 GLN 89 HG1 GLN 89 4.672 -8.978 -11.728 591 HE21 GLN 89 HE21 GLN 89 2.803 -7.919 -12.346 592 HE22 GLN 89 HE22 GLN 89 2.609 -6.208 -12.204 593 H GLN 90 HN GLN 90 3.030 -10.158 -12.141 594 HA GLN 90 HA GLN 90 2.007 -12.797 -11.873 595 HB2 GLN 90 HB2 GLN 90 3.334 -11.289 -14.108 596 HB3 GLN 90 HB1 GLN 90 2.962 -12.998 -14.269 597 HG2 GLN 90 HG2 GLN 90 1.209 -11.751 -15.283 598 HG3 GLN 90 HG1 GLN 90 0.580 -12.467 -13.801 599 HE21 GLN 90 HE21 GLN 90 -1.078 -10.962 -13.676 600 HE22 GLN 90 HE22 GLN 90 -0.798 -9.318 -13.217 601 H THR 91 HN THR 91 3.060 -14.751 -11.928 602 HA THR 91 HA THR 91 5.565 -14.919 -10.671 603 HB THR 91 HB THR 91 4.757 -17.265 -12.254 604 HG1 THR 91 HG1 THR 91 2.958 -17.454 -10.531 605 HG21 THR 91 HG21 THR 91 5.187 -16.782 -9.303 606 HG22 THR 91 HG22 THR 91 6.393 -17.371 -10.443 607 HG23 THR 91 HG23 THR 91 4.982 -18.356 -10.071 608 H GLY 92 HN GLY 92 4.636 -14.976 -14.056 609 HA2 GLY 92 HA2 GLY 92 6.774 -14.042 -15.286 610 HA3 GLY 92 HA1 GLY 92 7.350 -15.654 -14.881 611 H ASN 357 HT1 ASN 357 -16.069 -10.348 6.468 612 HA ASN 357 HA ASN 357 -13.316 -10.307 5.399 613 HB2 ASN 357 HB2 ASN 357 -13.812 -7.816 5.198 614 HB3 ASN 357 HB1 ASN 357 -14.601 -8.859 4.027 615 HD21 ASN 357 HD21 ASN 357 -16.066 -7.125 3.688 616 HD22 ASN 357 HD22 ASN 357 -17.383 -6.863 4.776 617 H ASN 358 HN ASN 358 -11.838 -9.090 6.615 618 HA ASN 358 HA ASN 358 -12.661 -8.607 9.385 619 HB2 ASN 358 HB2 ASN 358 -10.345 -9.227 10.063 620 HB3 ASN 358 HB1 ASN 358 -11.239 -10.562 9.340 621 HD21 ASN 358 HD21 ASN 358 -8.435 -8.668 9.206 622 HD22 ASN 358 HD22 ASN 358 -7.780 -9.325 7.748 623 H ARG 359 HN ARG 359 -12.334 -6.634 10.167 624 HA ARG 359 HA ARG 359 -10.448 -4.904 8.717 625 HB2 ARG 359 HB2 ARG 359 -12.069 -3.018 9.495 626 HB3 ARG 359 HB1 ARG 359 -12.464 -3.965 8.067 627 HG2 ARG 359 HG2 ARG 359 -13.805 -5.446 9.693 628 HG3 ARG 359 HG1 ARG 359 -13.670 -4.080 10.800 629 HD2 ARG 359 HD2 ARG 359 -14.891 -2.665 9.397 630 HD3 ARG 359 HD1 ARG 359 -14.650 -3.703 7.994 631 HE ARG 359 HE ARG 359 -16.087 -5.300 9.579 632 HH11 ARG 359 HH11 ARG 359 -16.507 -1.905 8.753 633 HH12 ARG 359 HH12 ARG 359 -18.303 -1.983 8.845 634 HH21 ARG 359 HH21 ARG 359 -18.385 -5.424 9.727 635 HH22 ARG 359 HH22 ARG 359 -19.350 -3.944 9.368 636 H ASP 360 HN ASP 360 -8.877 -4.195 9.904 637 HA ASP 360 HA ASP 360 -9.269 -3.681 12.752 638 HB2 ASP 360 HB2 ASP 360 -7.316 -4.741 13.422 639 HB3 ASP 360 HB1 ASP 360 -7.935 -5.837 12.196 640 HA PRO 361 HA PRO 361 -7.305 0.062 11.381 641 HB2 PRO 361 HB2 PRO 361 -7.813 1.553 13.568 642 HB3 PRO 361 HB1 PRO 361 -9.109 0.986 12.504 643 HG2 PRO 361 HG2 PRO 361 -8.464 0.135 15.227 644 HG3 PRO 361 HG1 PRO 361 -9.945 -0.126 14.291 645 HD2 PRO 361 HD2 PRO 361 -7.707 -1.949 14.709 646 HD3 PRO 361 HD1 PRO 361 -9.303 -2.269 14.001 647 H ILE 362 HN ILE 362 -5.316 0.670 11.261 648 HA ILE 362 HA ILE 362 -3.467 0.298 13.523 649 HB ILE 362 HB ILE 362 -2.738 0.274 10.589 650 HG12 ILE 362 HG12 ILE 362 -2.272 -2.269 11.467 651 HG13 ILE 362 HG11 ILE 362 -3.753 -1.869 12.332 652 HG21 ILE 362 HG21 ILE 362 -1.163 -0.559 13.021 653 HG22 ILE 362 HG22 ILE 362 -0.922 0.920 12.090 654 HG23 ILE 362 HG23 ILE 362 -0.620 -0.648 11.345 655 HD11 ILE 362 HD11 ILE 362 -3.369 -1.664 9.356 656 HD12 ILE 362 HD12 ILE 362 -4.861 -1.356 10.247 657 HD13 ILE 362 HD13 ILE 362 -4.183 -2.983 10.198 658 H VAL 363 HN VAL 363 -2.268 2.008 14.158 659 HA VAL 363 HA VAL 363 -2.576 4.501 12.612 660 HB VAL 363 HB VAL 363 -1.998 4.260 15.569 661 HG11 VAL 363 HG11 VAL 363 -1.219 6.340 14.589 662 HG12 VAL 363 HG12 VAL 363 -2.606 6.628 15.641 663 HG13 VAL 363 HG13 VAL 363 -2.813 6.625 13.889 664 HG21 VAL 363 HG21 VAL 363 -4.313 4.891 15.964 665 HG22 VAL 363 HG22 VAL 363 -4.218 3.369 15.077 666 HG23 VAL 363 HG23 VAL 363 -4.629 4.862 14.229 667 H ILE 364 HN ILE 364 -0.799 5.426 11.863 668 HA ILE 364 HA ILE 364 1.812 4.497 12.858 669 HB ILE 364 HB ILE 364 1.142 5.381 10.044 670 HG12 ILE 364 HG12 ILE 364 1.897 2.628 11.045 671 HG13 ILE 364 HG11 ILE 364 0.252 3.129 10.670 672 HG21 ILE 364 HG21 ILE 364 3.722 4.313 11.179 673 HG22 ILE 364 HG22 ILE 364 3.410 5.984 10.708 674 HG23 ILE 364 HG23 ILE 364 3.418 4.710 9.488 675 HD11 ILE 364 HD11 ILE 364 1.218 1.842 8.853 676 HD12 ILE 364 HD12 ILE 364 2.547 2.996 8.726 677 HD13 ILE 364 HD13 ILE 364 0.902 3.502 8.346 678 H SER 365 HN SER 365 3.188 6.020 13.536 679 HA SER 365 HA SER 365 2.465 8.831 13.043 680 HB2 SER 365 HB2 SER 365 3.932 7.773 15.466 681 HB3 SER 365 HB1 SER 365 3.243 9.381 15.241 682 HG SER 365 HG SER 365 1.212 7.908 14.894 683 H ASP 366 HN ASP 366 3.980 10.066 12.104 684 HA ASP 366 HA ASP 366 6.721 8.994 11.975 685 HB2 ASP 366 HB2 ASP 366 5.239 9.089 9.810 686 HB3 ASP 366 HB1 ASP 366 5.645 10.804 9.844 687 H SER 367 HN SER 367 8.304 10.277 12.642 688 HA SER 367 HA SER 367 7.633 13.074 13.260 689 HB2 SER 367 HB2 SER 367 9.895 12.436 14.739 690 HB3 SER 367 HB1 SER 367 8.242 12.497 15.348 691 HG SER 367 HG SER 367 9.855 10.323 14.818 692 HA PRO 368 HA PRO 368 10.651 14.003 10.107 693 HB2 PRO 368 HB2 PRO 368 10.704 16.702 10.535 694 HB3 PRO 368 HB1 PRO 368 9.435 15.886 9.614 695 HG2 PRO 368 HG2 PRO 368 9.390 16.840 12.435 696 HG3 PRO 368 HG1 PRO 368 8.107 16.879 11.208 697 HD2 PRO 368 HD2 PRO 368 8.181 15.036 13.194 698 HD3 PRO 368 HD1 PRO 368 7.479 14.708 11.597 Start of MODEL 16 1 H ASP 16 HT1 ASP 16 -6.721 15.752 11.420 2 HA ASP 16 HA ASP 16 -6.563 14.120 13.881 3 HB2 ASP 16 HB2 ASP 16 -8.866 15.086 12.939 4 HB3 ASP 16 HB1 ASP 16 -8.688 13.743 11.814 5 H HIS 17 HN HIS 17 -7.510 11.817 12.580 6 HA HIS 17 HA HIS 17 -5.214 11.258 10.825 7 HB2 HIS 17 HB2 HIS 17 -6.866 9.470 12.613 8 HB3 HIS 17 HB1 HIS 17 -5.738 8.841 11.418 9 HD2 HIS 17 HD2 HIS 17 -3.069 9.009 12.069 10 HE1 HIS 17 HE1 HIS 17 -3.687 10.680 15.904 11 HE2 HIS 17 HE2 HIS 17 -2.034 9.484 14.401 12 H ILE 18 HN ILE 18 -5.620 9.607 9.119 13 HA ILE 18 HA ILE 18 -8.308 9.966 7.962 14 HB ILE 18 HB ILE 18 -6.576 11.173 6.693 15 HG12 ILE 18 HG12 ILE 18 -7.513 8.755 5.145 16 HG13 ILE 18 HG11 ILE 18 -8.548 10.119 5.556 17 HG21 ILE 18 HG21 ILE 18 -4.830 9.953 5.476 18 HG22 ILE 18 HG22 ILE 18 -5.305 8.468 6.298 19 HG23 ILE 18 HG23 ILE 18 -4.639 9.812 7.224 20 HD11 ILE 18 HD11 ILE 18 -6.048 10.269 3.893 21 HD12 ILE 18 HD12 ILE 18 -7.141 11.603 4.259 22 HD13 ILE 18 HD13 ILE 18 -7.696 10.253 3.271 23 H ASN 19 HN ASN 19 -9.390 8.153 7.336 24 HA ASN 19 HA ASN 19 -8.099 5.603 7.985 25 HB2 ASN 19 HB2 ASN 19 -11.020 6.191 7.465 26 HB3 ASN 19 HB1 ASN 19 -10.354 4.668 8.044 27 HD21 ASN 19 HD21 ASN 19 -11.122 7.951 8.837 28 HD22 ASN 19 HD22 ASN 19 -10.957 7.785 10.556 29 H LEU 20 HN LEU 20 -7.045 4.791 6.321 30 HA LEU 20 HA LEU 20 -8.322 4.836 3.672 31 HB2 LEU 20 HB2 LEU 20 -5.454 4.237 4.414 32 HB3 LEU 20 HB1 LEU 20 -6.094 4.326 2.784 33 HG LEU 20 HG LEU 20 -5.961 6.635 4.724 34 HD11 LEU 20 HD11 LEU 20 -4.275 6.006 2.306 35 HD12 LEU 20 HD12 LEU 20 -3.747 5.958 3.988 36 HD13 LEU 20 HD13 LEU 20 -4.207 7.493 3.253 37 HD21 LEU 20 HD21 LEU 20 -6.485 7.963 2.660 38 HD22 LEU 20 HD22 LEU 20 -7.808 6.955 3.252 39 HD23 LEU 20 HD23 LEU 20 -6.862 6.438 1.855 40 H LYS 21 HN LYS 21 -9.412 3.053 3.180 41 HA LYS 21 HA LYS 21 -8.958 0.583 4.604 42 HB2 LYS 21 HB2 LYS 21 -10.808 1.157 2.282 43 HB3 LYS 21 HB1 LYS 21 -10.842 -0.271 3.306 44 HG2 LYS 21 HG2 LYS 21 -11.626 0.945 5.157 45 HG3 LYS 21 HG1 LYS 21 -11.238 2.495 4.403 46 HD2 LYS 21 HD2 LYS 21 -12.938 2.028 2.666 47 HD3 LYS 21 HD1 LYS 21 -13.366 0.545 3.523 48 HE2 LYS 21 HE2 LYS 21 -14.057 1.806 5.453 49 HE3 LYS 21 HE1 LYS 21 -13.492 3.307 4.719 50 HZ1 LYS 21 HZ1 LYS 21 -15.781 3.298 4.380 51 HZ2 LYS 21 HZ2 LYS 21 -15.823 1.654 3.963 52 HZ3 LYS 21 HZ3 LYS 21 -15.155 2.778 2.889 53 H VAL 22 HN VAL 22 -7.540 -0.900 4.022 54 HA VAL 22 HA VAL 22 -6.735 -1.036 1.191 55 HB VAL 22 HB VAL 22 -5.155 -1.862 3.637 56 HG11 VAL 22 HG11 VAL 22 -4.720 -3.345 1.749 57 HG12 VAL 22 HG12 VAL 22 -3.322 -2.324 2.086 58 HG13 VAL 22 HG13 VAL 22 -4.379 -1.953 0.723 59 HG21 VAL 22 HG21 VAL 22 -3.659 -0.039 3.067 60 HG22 VAL 22 HG22 VAL 22 -5.297 0.573 3.302 61 HG23 VAL 22 HG23 VAL 22 -4.654 0.372 1.672 62 H ALA 23 HN ALA 23 -7.928 -2.577 0.293 63 HA ALA 23 HA ALA 23 -8.391 -5.062 1.795 64 HB1 ALA 23 HB1 ALA 23 -10.273 -5.450 0.304 65 HB2 ALA 23 HB2 ALA 23 -9.877 -3.987 -0.599 66 HB3 ALA 23 HB3 ALA 23 -10.409 -3.870 1.077 67 H GLY 24 HN GLY 24 -7.928 -7.037 0.898 68 HA2 GLY 24 HA2 GLY 24 -5.989 -6.980 -1.289 69 HA3 GLY 24 HA1 GLY 24 -6.302 -8.334 -0.209 70 H GLN 25 HN GLN 25 -6.356 -9.623 -2.201 71 HA GLN 25 HA GLN 25 -8.789 -9.238 -3.794 72 HB2 GLN 25 HB2 GLN 25 -6.450 -11.090 -4.308 73 HB3 GLN 25 HB1 GLN 25 -7.798 -10.793 -5.396 74 HG2 GLN 25 HG2 GLN 25 -5.668 -8.842 -4.571 75 HG3 GLN 25 HG1 GLN 25 -5.912 -9.553 -6.165 76 HE21 GLN 25 HE21 GLN 25 -5.868 -6.749 -5.187 77 HE22 GLN 25 HE22 GLN 25 -7.353 -6.046 -5.740 78 H ASP 26 HN ASP 26 -8.728 -10.274 -1.053 79 HA ASP 26 HA ASP 26 -9.993 -12.872 -1.576 80 HB2 ASP 26 HB2 ASP 26 -9.243 -13.396 0.871 81 HB3 ASP 26 HB1 ASP 26 -8.106 -13.605 -0.450 82 H GLY 27 HN GLY 27 -9.674 -10.728 1.249 83 HA2 GLY 27 HA2 GLY 27 -12.300 -9.719 1.182 84 HA3 GLY 27 HA1 GLY 27 -12.291 -11.169 2.174 85 H SER 28 HN SER 28 -9.288 -10.126 2.629 86 HA SER 28 HA SER 28 -9.840 -9.019 5.195 87 HB2 SER 28 HB2 SER 28 -7.307 -8.621 5.179 88 HB3 SER 28 HB1 SER 28 -7.841 -10.291 5.002 89 HG SER 28 HG SER 28 -7.464 -10.141 2.778 90 H VAL 29 HN VAL 29 -10.260 -6.934 5.719 91 HA VAL 29 HA VAL 29 -9.311 -4.866 3.828 92 HB VAL 29 HB VAL 29 -11.918 -4.660 5.347 93 HG11 VAL 29 HG11 VAL 29 -12.338 -2.830 3.720 94 HG12 VAL 29 HG12 VAL 29 -10.696 -3.043 3.109 95 HG13 VAL 29 HG13 VAL 29 -10.958 -2.524 4.776 96 HG21 VAL 29 HG21 VAL 29 -13.018 -5.042 3.153 97 HG22 VAL 29 HG22 VAL 29 -12.179 -6.464 3.772 98 HG23 VAL 29 HG23 VAL 29 -11.450 -5.500 2.487 99 H VAL 30 HN VAL 30 -7.550 -4.256 5.059 100 HA VAL 30 HA VAL 30 -7.886 -3.726 7.876 101 HB VAL 30 HB VAL 30 -5.536 -3.074 7.892 102 HG11 VAL 30 HG11 VAL 30 -6.043 -5.596 6.317 103 HG12 VAL 30 HG12 VAL 30 -6.071 -5.436 8.074 104 HG13 VAL 30 HG13 VAL 30 -4.560 -5.215 7.190 105 HG21 VAL 30 HG21 VAL 30 -5.596 -3.518 4.908 106 HG22 VAL 30 HG22 VAL 30 -4.169 -3.150 5.878 107 HG23 VAL 30 HG23 VAL 30 -5.457 -1.955 5.710 108 H GLN 31 HN GLN 31 -7.774 -1.747 8.887 109 HA GLN 31 HA GLN 31 -8.508 0.533 7.180 110 HB2 GLN 31 HB2 GLN 31 -10.157 -0.239 8.876 111 HB3 GLN 31 HB1 GLN 31 -8.983 0.098 10.137 112 HG2 GLN 31 HG2 GLN 31 -9.059 2.456 9.631 113 HG3 GLN 31 HG1 GLN 31 -10.136 2.158 8.264 114 HE21 GLN 31 HE21 GLN 31 -10.611 3.824 10.597 115 HE22 GLN 31 HE22 GLN 31 -12.021 3.183 11.370 116 H PHE 32 HN PHE 32 -6.558 1.463 6.685 117 HA PHE 32 HA PHE 32 -4.512 1.794 8.686 118 HB2 PHE 32 HB2 PHE 32 -4.777 2.318 5.791 119 HB3 PHE 32 HB1 PHE 32 -3.699 3.405 6.663 120 HD1 PHE 32 HD1 PHE 32 -4.151 0.106 5.292 121 HD2 PHE 32 HD2 PHE 32 -1.782 2.451 7.935 122 HE1 PHE 32 HE1 PHE 32 -2.384 -1.596 5.204 123 HE2 PHE 32 HE2 PHE 32 -0.003 0.749 7.852 124 HZ PHE 32 HZ PHE 32 -0.305 -1.278 6.484 125 H LYS 33 HN LYS 33 -4.958 3.161 10.290 126 HA LYS 33 HA LYS 33 -6.231 5.727 9.653 127 HB2 LYS 33 HB2 LYS 33 -7.170 4.209 11.458 128 HB3 LYS 33 HB1 LYS 33 -5.718 4.552 12.386 129 HG2 LYS 33 HG2 LYS 33 -6.309 6.986 12.226 130 HG3 LYS 33 HG1 LYS 33 -7.860 6.489 11.547 131 HD2 LYS 33 HD2 LYS 33 -8.292 5.159 13.575 132 HD3 LYS 33 HD1 LYS 33 -6.763 5.721 14.254 133 HE2 LYS 33 HE2 LYS 33 -7.702 8.084 13.865 134 HE3 LYS 33 HE1 LYS 33 -9.264 7.284 13.690 135 HZ1 LYS 33 HZ1 LYS 33 -8.933 8.017 15.950 136 HZ2 LYS 33 HZ2 LYS 33 -7.488 7.147 16.066 137 HZ3 LYS 33 HZ3 LYS 33 -8.956 6.323 15.904 138 H ILE 34 HN ILE 34 -4.205 6.402 8.680 139 HA ILE 34 HA ILE 34 -2.123 7.098 10.639 140 HB ILE 34 HB ILE 34 -0.669 7.488 8.639 141 HG12 ILE 34 HG12 ILE 34 -2.823 6.017 7.107 142 HG13 ILE 34 HG11 ILE 34 -2.623 7.763 7.041 143 HG21 ILE 34 HG21 ILE 34 -1.804 4.706 8.875 144 HG22 ILE 34 HG22 ILE 34 -0.611 5.414 9.962 145 HG23 ILE 34 HG23 ILE 34 -0.208 5.138 8.267 146 HD11 ILE 34 HD11 ILE 34 -0.427 7.511 6.089 147 HD12 ILE 34 HD12 ILE 34 -1.597 6.595 5.140 148 HD13 ILE 34 HD13 ILE 34 -0.520 5.759 6.262 149 H LYS 35 HN LYS 35 -0.877 9.172 9.521 150 HA LYS 35 HA LYS 35 -2.913 11.247 9.665 151 HB2 LYS 35 HB2 LYS 35 0.092 11.554 9.560 152 HB3 LYS 35 HB1 LYS 35 -1.079 12.802 9.973 153 HG2 LYS 35 HG2 LYS 35 -1.747 11.063 11.843 154 HG3 LYS 35 HG1 LYS 35 -0.094 10.508 11.582 155 HD2 LYS 35 HD2 LYS 35 0.729 12.773 12.009 156 HD3 LYS 35 HD1 LYS 35 -0.925 13.327 12.270 157 HE2 LYS 35 HE2 LYS 35 -1.116 11.679 14.128 158 HE3 LYS 35 HE1 LYS 35 0.593 11.304 13.910 159 HZ1 LYS 35 HZ1 LYS 35 1.136 13.596 14.424 160 HZ2 LYS 35 HZ2 LYS 35 0.252 12.901 15.685 161 HZ3 LYS 35 HZ3 LYS 35 -0.503 13.973 14.615 162 H ARG 36 HN ARG 36 -2.950 12.996 8.107 163 HA ARG 36 HA ARG 36 -2.910 12.003 5.449 164 HB2 ARG 36 HB2 ARG 36 -3.358 14.783 6.530 165 HB3 ARG 36 HB1 ARG 36 -3.561 14.344 4.841 166 HG2 ARG 36 HG2 ARG 36 -5.318 12.786 5.418 167 HG3 ARG 36 HG1 ARG 36 -5.075 13.111 7.135 168 HD2 ARG 36 HD2 ARG 36 -6.966 14.376 6.473 169 HD3 ARG 36 HD1 ARG 36 -5.635 15.517 6.638 170 HE ARG 36 HE ARG 36 -5.477 15.579 4.231 171 HH11 ARG 36 HH11 ARG 36 -8.368 14.047 5.549 172 HH12 ARG 36 HH12 ARG 36 -9.337 14.324 4.047 173 HH21 ARG 36 HH21 ARG 36 -6.674 15.953 2.331 174 HH22 ARG 36 HH22 ARG 36 -8.397 15.399 2.260 175 H HIS 37 HN HIS 37 -0.409 13.164 7.324 176 HA HIS 37 HA HIS 37 1.069 14.124 4.973 177 HB2 HIS 37 HB2 HIS 37 2.623 15.193 6.541 178 HB3 HIS 37 HB1 HIS 37 0.976 15.751 6.794 179 HD2 HIS 37 HD2 HIS 37 0.363 15.893 9.367 180 HE1 HIS 37 HE1 HIS 37 3.060 12.958 10.779 181 HE2 HIS 37 HE2 HIS 37 1.511 14.849 11.446 182 H THR 38 HN THR 38 0.627 11.363 6.650 183 HA THR 38 HA THR 38 3.360 10.505 6.935 184 HB THR 38 HB THR 38 0.871 8.801 7.031 185 HG1 THR 38 HG1 THR 38 1.941 10.647 8.828 186 HG21 THR 38 HG21 THR 38 2.982 7.558 6.885 187 HG22 THR 38 HG22 THR 38 2.235 7.358 8.472 188 HG23 THR 38 HG23 THR 38 3.605 8.451 8.271 189 HA PRO 39 HA PRO 39 3.951 9.411 2.641 190 HB2 PRO 39 HB2 PRO 39 5.997 7.624 3.860 191 HB3 PRO 39 HB1 PRO 39 6.168 8.811 2.559 192 HG2 PRO 39 HG2 PRO 39 7.107 9.344 4.982 193 HG3 PRO 39 HG1 PRO 39 6.322 10.602 4.007 194 HD2 PRO 39 HD2 PRO 39 5.251 9.090 6.344 195 HD3 PRO 39 HD1 PRO 39 5.002 10.785 5.878 196 H LEU 40 HN LEU 40 2.996 7.899 1.427 197 HA LEU 40 HA LEU 40 1.627 5.718 2.625 198 HB2 LEU 40 HB2 LEU 40 2.109 6.447 -0.258 199 HB3 LEU 40 HB1 LEU 40 1.101 5.100 0.242 200 HG LEU 40 HG LEU 40 0.594 7.983 1.004 201 HD11 LEU 40 HD11 LEU 40 -1.208 7.927 -0.622 202 HD12 LEU 40 HD12 LEU 40 -0.747 6.291 -1.094 203 HD13 LEU 40 HD13 LEU 40 0.348 7.638 -1.402 204 HD21 LEU 40 HD21 LEU 40 -1.059 5.479 1.321 205 HD22 LEU 40 HD22 LEU 40 -1.622 7.116 1.650 206 HD23 LEU 40 HD23 LEU 40 -0.319 6.426 2.614 207 H SER 41 HN SER 41 4.821 6.048 1.643 208 HA SER 41 HA SER 41 5.414 3.499 0.630 209 HB2 SER 41 HB2 SER 41 7.647 4.387 2.099 210 HB3 SER 41 HB1 SER 41 7.356 4.600 0.370 211 HG SER 41 HG SER 41 7.022 6.640 0.721 212 H LYS 42 HN LYS 42 5.274 4.782 3.915 213 HA LYS 42 HA LYS 42 6.174 2.369 5.150 214 HB2 LYS 42 HB2 LYS 42 4.706 4.753 6.297 215 HB3 LYS 42 HB1 LYS 42 5.397 3.446 7.253 216 HG2 LYS 42 HG2 LYS 42 7.627 4.008 6.306 217 HG3 LYS 42 HG1 LYS 42 6.887 5.399 5.510 218 HD2 LYS 42 HD2 LYS 42 6.394 6.437 7.578 219 HD3 LYS 42 HD1 LYS 42 6.736 4.959 8.485 220 HE2 LYS 42 HE2 LYS 42 9.091 5.113 7.833 221 HE3 LYS 42 HE1 LYS 42 8.746 6.587 6.932 222 HZ1 LYS 42 HZ1 LYS 42 9.694 6.979 9.156 223 HZ2 LYS 42 HZ2 LYS 42 8.323 6.283 9.851 224 HZ3 LYS 42 HZ3 LYS 42 8.182 7.709 8.946 225 H LEU 43 HN LEU 43 3.110 3.683 4.166 226 HA LEU 43 HA LEU 43 1.407 1.956 5.611 227 HB2 LEU 43 HB2 LEU 43 0.567 3.975 4.556 228 HB3 LEU 43 HB1 LEU 43 1.031 3.388 2.973 229 HG LEU 43 HG LEU 43 -0.896 1.701 4.461 230 HD11 LEU 43 HD11 LEU 43 -2.786 3.140 3.846 231 HD12 LEU 43 HD12 LEU 43 -1.656 4.391 3.330 232 HD13 LEU 43 HD13 LEU 43 -1.726 3.911 5.026 233 HD21 LEU 43 HD21 LEU 43 -0.776 2.720 1.621 234 HD22 LEU 43 HD22 LEU 43 -1.895 1.506 2.242 235 HD23 LEU 43 HD23 LEU 43 -0.166 1.165 2.183 236 H MET 44 HN MET 44 2.840 1.784 2.388 237 HA MET 44 HA MET 44 1.701 -0.662 1.599 238 HB2 MET 44 HB2 MET 44 4.290 0.659 0.766 239 HB3 MET 44 HB1 MET 44 3.610 -0.757 -0.025 240 HG2 MET 44 HG2 MET 44 1.550 0.619 -0.465 241 HG3 MET 44 HG1 MET 44 2.469 2.018 0.088 242 HE1 MET 44 HE1 MET 44 4.441 3.127 -1.235 243 HE2 MET 44 HE2 MET 44 5.265 2.349 -2.587 244 HE3 MET 44 HE3 MET 44 5.339 1.630 -0.977 245 H LYS 45 HN LYS 45 4.781 0.094 3.178 246 HA LYS 45 HA LYS 45 5.753 -2.550 3.257 247 HB2 LYS 45 HB2 LYS 45 6.379 -0.095 4.879 248 HB3 LYS 45 HB1 LYS 45 7.168 -1.634 5.195 249 HG2 LYS 45 HG2 LYS 45 7.842 -1.628 2.751 250 HG3 LYS 45 HG1 LYS 45 7.316 0.054 2.721 251 HD2 LYS 45 HD2 LYS 45 9.348 -1.021 4.667 252 HD3 LYS 45 HD1 LYS 45 9.772 -0.292 3.118 253 HE2 LYS 45 HE2 LYS 45 8.617 1.773 3.811 254 HE3 LYS 45 HE1 LYS 45 8.280 1.038 5.378 255 HZ1 LYS 45 HZ1 LYS 45 10.742 0.774 5.615 256 HZ2 LYS 45 HZ2 LYS 45 10.191 2.370 5.633 257 HZ3 LYS 45 HZ3 LYS 45 10.925 1.747 4.243 258 H ALA 46 HN ALA 46 3.905 -0.653 5.636 259 HA ALA 46 HA ALA 46 3.928 -2.491 7.725 260 HB1 ALA 46 HB1 ALA 46 3.134 -0.226 8.010 261 HB2 ALA 46 HB2 ALA 46 1.894 -1.372 8.522 262 HB3 ALA 46 HB3 ALA 46 1.748 -0.554 6.965 263 H TYR 47 HN TYR 47 1.650 -2.221 5.007 264 HA TYR 47 HA TYR 47 0.009 -4.381 5.860 265 HB2 TYR 47 HB2 TYR 47 -0.728 -2.598 4.278 266 HB3 TYR 47 HB1 TYR 47 0.340 -3.288 3.060 267 HD1 TYR 47 HD1 TYR 47 -0.613 -4.722 1.512 268 HD2 TYR 47 HD2 TYR 47 -2.380 -4.402 5.372 269 HE1 TYR 47 HE1 TYR 47 -2.401 -6.260 0.818 270 HE2 TYR 47 HE2 TYR 47 -4.174 -5.938 4.683 271 HH TYR 47 HH TYR 47 -5.227 -6.784 2.735 272 H CYS 48 HN CYS 48 2.726 -4.096 3.626 273 HA CYS 48 HA CYS 48 2.672 -6.705 2.597 274 HB2 CYS 48 HB2 CYS 48 4.029 -4.620 1.854 275 HB3 CYS 48 HB1 CYS 48 5.223 -5.177 3.020 276 HG CYS 48 HG CYS 48 5.937 -7.431 1.749 277 H GLU 49 HN GLU 49 4.304 -5.335 5.422 278 HA GLU 49 HA GLU 49 5.797 -7.582 6.169 279 HB2 GLU 49 HB2 GLU 49 4.636 -5.314 7.778 280 HB3 GLU 49 HB1 GLU 49 5.641 -6.561 8.501 281 HG2 GLU 49 HG2 GLU 49 6.509 -4.803 6.220 282 HG3 GLU 49 HG1 GLU 49 6.840 -4.468 7.917 283 H ARG 50 HN ARG 50 2.481 -6.656 6.922 284 HA ARG 50 HA ARG 50 1.991 -8.703 8.809 285 HB2 ARG 50 HB2 ARG 50 0.195 -6.959 7.147 286 HB3 ARG 50 HB1 ARG 50 -0.447 -8.175 8.242 287 HG2 ARG 50 HG2 ARG 50 0.356 -7.075 10.130 288 HG3 ARG 50 HG1 ARG 50 1.492 -6.104 9.191 289 HD2 ARG 50 HD2 ARG 50 -0.088 -4.611 8.550 290 HD3 ARG 50 HD1 ARG 50 -1.372 -5.819 8.539 291 HE ARG 50 HE ARG 50 -0.292 -4.717 11.055 292 HH11 ARG 50 HH11 ARG 50 -2.963 -5.621 8.955 293 HH12 ARG 50 HH12 ARG 50 -4.223 -5.073 10.129 294 HH21 ARG 50 HH21 ARG 50 -3.624 -4.256 12.165 295 HH22 ARG 50 HH22 ARG 50 -1.873 -4.097 12.608 296 H GLN 51 HN GLN 51 1.835 -8.619 5.324 297 HA GLN 51 HA GLN 51 0.439 -11.165 5.225 298 HB2 GLN 51 HB2 GLN 51 1.631 -9.591 2.935 299 HB3 GLN 51 HB1 GLN 51 0.487 -10.924 2.817 300 HG2 GLN 51 HG2 GLN 51 -0.005 -8.155 3.887 301 HG3 GLN 51 HG1 GLN 51 -0.720 -8.914 2.466 302 HE21 GLN 51 HE21 GLN 51 -2.416 -10.350 2.722 303 HE22 GLN 51 HE22 GLN 51 -3.260 -10.538 4.218 304 H GLY 52 HN GLY 52 3.562 -10.124 5.670 305 HA2 GLY 52 HA2 GLY 52 5.571 -11.224 5.772 306 HA3 GLY 52 HA1 GLY 52 4.668 -12.722 5.615 307 H LEU 53 HN LEU 53 4.878 -10.032 3.330 308 HA LEU 53 HA LEU 53 6.256 -11.839 1.461 309 HB2 LEU 53 HB2 LEU 53 3.998 -9.940 0.804 310 HB3 LEU 53 HB1 LEU 53 4.920 -10.857 -0.375 311 HG LEU 53 HG LEU 53 3.184 -12.063 1.781 312 HD11 LEU 53 HD11 LEU 53 1.678 -12.644 -0.075 313 HD12 LEU 53 HD12 LEU 53 2.689 -11.710 -1.174 314 HD13 LEU 53 HD13 LEU 53 1.835 -10.902 0.141 315 HD21 LEU 53 HD21 LEU 53 4.983 -13.551 1.202 316 HD22 LEU 53 HD22 LEU 53 4.699 -13.295 -0.518 317 HD23 LEU 53 HD23 LEU 53 3.498 -14.141 0.456 318 H SER 54 HN SER 54 7.112 -10.518 -0.471 319 HA SER 54 HA SER 54 8.762 -8.411 0.633 320 HB2 SER 54 HB2 SER 54 9.720 -10.166 -0.840 321 HB3 SER 54 HB1 SER 54 8.709 -9.584 -2.161 322 HG SER 54 HG SER 54 11.096 -8.709 -1.416 323 H MET 55 HN MET 55 8.788 -6.272 -0.046 324 HA MET 55 HA MET 55 6.309 -5.141 -0.779 325 HB2 MET 55 HB2 MET 55 8.194 -4.044 0.534 326 HB3 MET 55 HB1 MET 55 8.987 -3.773 -1.012 327 HG2 MET 55 HG2 MET 55 6.912 -2.551 -1.739 328 HG3 MET 55 HG1 MET 55 6.372 -2.643 -0.064 329 HE1 MET 55 HE1 MET 55 8.749 -1.050 -2.640 330 HE2 MET 55 HE2 MET 55 9.945 -1.961 -1.718 331 HE3 MET 55 HE3 MET 55 9.941 -0.198 -1.656 332 H ARG 56 HN ARG 56 8.976 -6.301 -2.635 333 HA ARG 56 HA ARG 56 8.178 -4.902 -5.047 334 HB2 ARG 56 HB2 ARG 56 10.579 -5.466 -4.361 335 HB3 ARG 56 HB1 ARG 56 10.215 -7.112 -4.854 336 HG2 ARG 56 HG2 ARG 56 9.742 -6.348 -7.115 337 HG3 ARG 56 HG1 ARG 56 10.055 -4.681 -6.625 338 HD2 ARG 56 HD2 ARG 56 12.350 -5.273 -6.060 339 HD3 ARG 56 HD1 ARG 56 12.039 -6.945 -6.522 340 HE ARG 56 HE ARG 56 11.431 -5.633 -8.773 341 HH11 ARG 56 HH11 ARG 56 15.325 -4.966 -7.887 342 HH12 ARG 56 HH12 ARG 56 14.161 -5.390 -6.580 343 HH21 ARG 56 HH21 ARG 56 14.599 -4.772 -10.066 344 HH22 ARG 56 HH22 ARG 56 12.866 -5.062 -10.469 345 H GLN 57 HN GLN 57 6.918 -7.452 -3.450 346 HA GLN 57 HA GLN 57 6.449 -9.113 -5.804 347 HB2 GLN 57 HB2 GLN 57 7.005 -10.170 -3.625 348 HB3 GLN 57 HB1 GLN 57 5.509 -9.526 -2.961 349 HG2 GLN 57 HG2 GLN 57 4.272 -10.802 -4.708 350 HG3 GLN 57 HG1 GLN 57 5.802 -11.545 -5.169 351 HE21 GLN 57 HE21 GLN 57 3.353 -12.731 -4.118 352 HE22 GLN 57 HE22 GLN 57 3.820 -13.601 -2.694 353 H ILE 58 HN ILE 58 4.665 -7.081 -3.521 354 HA ILE 58 HA ILE 58 2.256 -7.435 -5.163 355 HB ILE 58 HB ILE 58 1.063 -6.315 -3.260 356 HG12 ILE 58 HG12 ILE 58 3.662 -6.806 -1.786 357 HG13 ILE 58 HG11 ILE 58 3.084 -5.221 -2.285 358 HG21 ILE 58 HG21 ILE 58 1.003 -8.716 -3.546 359 HG22 ILE 58 HG22 ILE 58 1.085 -8.316 -1.832 360 HG23 ILE 58 HG23 ILE 58 2.526 -8.884 -2.672 361 HD11 ILE 58 HD11 ILE 58 1.694 -7.066 -0.356 362 HD12 ILE 58 HD12 ILE 58 1.136 -5.467 -0.845 363 HD13 ILE 58 HD13 ILE 58 2.634 -5.636 0.067 364 H ARG 59 HN ARG 59 0.893 -5.510 -5.504 365 HA ARG 59 HA ARG 59 2.442 -3.011 -5.706 366 HB2 ARG 59 HB2 ARG 59 0.654 -4.182 -7.856 367 HB3 ARG 59 HB1 ARG 59 1.360 -2.574 -7.904 368 HG2 ARG 59 HG2 ARG 59 2.923 -5.144 -7.850 369 HG3 ARG 59 HG1 ARG 59 2.571 -4.194 -9.295 370 HD2 ARG 59 HD2 ARG 59 3.787 -2.298 -8.334 371 HD3 ARG 59 HD1 ARG 59 4.138 -3.254 -6.894 372 HE ARG 59 HE ARG 59 5.392 -3.474 -9.496 373 HH11 ARG 59 HH11 ARG 59 6.212 -6.086 -6.517 374 HH12 ARG 59 HH12 ARG 59 4.863 -4.901 -6.319 375 HH21 ARG 59 HH21 ARG 59 7.138 -4.930 -9.745 376 HH22 ARG 59 HH22 ARG 59 7.500 -6.075 -8.398 377 H PHE 60 HN PHE 60 1.288 -1.155 -5.315 378 HA PHE 60 HA PHE 60 -1.449 -1.561 -4.335 379 HB2 PHE 60 HB2 PHE 60 0.673 0.460 -3.632 380 HB3 PHE 60 HB1 PHE 60 -1.017 0.697 -3.196 381 HD1 PHE 60 HD1 PHE 60 1.639 -1.915 -2.949 382 HD2 PHE 60 HD2 PHE 60 -1.707 -0.021 -1.128 383 HE1 PHE 60 HE1 PHE 60 1.978 -3.272 -0.927 384 HE2 PHE 60 HE2 PHE 60 -1.375 -1.376 0.901 385 HZ PHE 60 HZ PHE 60 0.473 -3.005 1.001 386 H ARG 61 HN ARG 61 -3.120 -0.570 -5.256 387 HA ARG 61 HA ARG 61 -2.557 1.436 -7.350 388 HB2 ARG 61 HB2 ARG 61 -3.459 -0.993 -7.915 389 HB3 ARG 61 HB1 ARG 61 -4.999 -0.280 -7.453 390 HG2 ARG 61 HG2 ARG 61 -4.717 1.443 -9.155 391 HG3 ARG 61 HG1 ARG 61 -3.161 0.740 -9.608 392 HD2 ARG 61 HD2 ARG 61 -4.498 -1.434 -9.955 393 HD3 ARG 61 HD1 ARG 61 -5.917 -0.390 -9.963 394 HE ARG 61 HE ARG 61 -4.495 0.831 -11.798 395 HH11 ARG 61 HH11 ARG 61 -4.655 -3.045 -12.999 396 HH12 ARG 61 HH12 ARG 61 -4.938 -2.621 -11.271 397 HH21 ARG 61 HH21 ARG 61 -4.152 0.334 -14.015 398 HH22 ARG 61 HH22 ARG 61 -4.224 -1.395 -14.529 399 H PHE 62 HN PHE 62 -3.550 3.350 -7.111 400 HA PHE 62 HA PHE 62 -5.798 3.498 -5.208 401 HB2 PHE 62 HB2 PHE 62 -3.967 4.666 -4.215 402 HB3 PHE 62 HB1 PHE 62 -3.567 5.469 -5.729 403 HD1 PHE 62 HD1 PHE 62 -6.418 5.150 -3.340 404 HD2 PHE 62 HD2 PHE 62 -4.239 7.652 -6.005 405 HE1 PHE 62 HE1 PHE 62 -7.838 7.059 -2.704 406 HE2 PHE 62 HE2 PHE 62 -5.651 9.563 -5.374 407 HZ PHE 62 HZ PHE 62 -7.451 9.267 -3.724 408 H ASP 63 HN ASP 63 -7.646 4.007 -6.102 409 HA ASP 63 HA ASP 63 -9.249 4.875 -7.431 410 HB2 ASP 63 HB2 ASP 63 -8.123 7.043 -7.043 411 HB3 ASP 63 HB1 ASP 63 -7.120 6.755 -8.463 412 H GLY 64 HN GLY 64 -6.238 4.809 -9.319 413 HA2 GLY 64 HA2 GLY 64 -7.244 2.753 -11.042 414 HA3 GLY 64 HA1 GLY 64 -7.247 4.330 -11.822 415 H GLN 65 HN GLN 65 -4.867 5.190 -10.284 416 HA GLN 65 HA GLN 65 -2.880 3.815 -11.947 417 HB2 GLN 65 HB2 GLN 65 -2.860 6.532 -10.626 418 HB3 GLN 65 HB1 GLN 65 -1.488 5.853 -11.489 419 HG2 GLN 65 HG2 GLN 65 -4.165 6.164 -12.796 420 HG3 GLN 65 HG1 GLN 65 -3.002 7.488 -12.732 421 HE21 GLN 65 HE21 GLN 65 -1.120 7.356 -13.908 422 HE22 GLN 65 HE22 GLN 65 -0.890 6.198 -15.172 423 HA PRO 66 HA PRO 66 -0.843 2.101 -8.401 424 HB2 PRO 66 HB2 PRO 66 1.773 2.576 -9.626 425 HB3 PRO 66 HB1 PRO 66 0.942 1.043 -9.333 426 HG2 PRO 66 HG2 PRO 66 1.285 2.004 -11.822 427 HG3 PRO 66 HG1 PRO 66 -0.147 1.066 -11.352 428 HD2 PRO 66 HD2 PRO 66 0.141 4.030 -11.661 429 HD3 PRO 66 HD1 PRO 66 -1.182 2.962 -12.178 430 H ILE 67 HN ILE 67 0.245 2.693 -6.543 431 HA ILE 67 HA ILE 67 0.680 5.541 -6.185 432 HB ILE 67 HB ILE 67 1.044 3.351 -4.135 433 HG12 ILE 67 HG12 ILE 67 -1.456 4.930 -4.780 434 HG13 ILE 67 HG11 ILE 67 -1.211 3.223 -5.129 435 HG21 ILE 67 HG21 ILE 67 0.463 6.298 -3.849 436 HG22 ILE 67 HG22 ILE 67 2.008 5.508 -3.535 437 HG23 ILE 67 HG23 ILE 67 0.611 5.141 -2.525 438 HD11 ILE 67 HD11 ILE 67 -1.365 4.500 -2.409 439 HD12 ILE 67 HD12 ILE 67 -0.988 2.803 -2.707 440 HD13 ILE 67 HD13 ILE 67 -2.564 3.448 -3.162 441 H ASN 68 HN ASN 68 2.617 6.512 -5.559 442 HA ASN 68 HA ASN 68 5.020 4.953 -6.207 443 HB2 ASN 68 HB2 ASN 68 4.788 7.955 -5.870 444 HB3 ASN 68 HB1 ASN 68 6.140 7.065 -6.562 445 HD21 ASN 68 HD21 ASN 68 2.966 8.322 -7.065 446 HD22 ASN 68 HD22 ASN 68 2.902 8.046 -8.782 447 H GLU 69 HN GLU 69 7.004 5.626 -4.865 448 HA GLU 69 HA GLU 69 6.383 5.057 -2.137 449 HB2 GLU 69 HB2 GLU 69 8.952 5.626 -3.591 450 HB3 GLU 69 HB1 GLU 69 8.906 5.404 -1.848 451 HG2 GLU 69 HG2 GLU 69 7.728 3.190 -2.350 452 HG3 GLU 69 HG1 GLU 69 8.285 3.426 -4.005 453 H THR 70 HN THR 70 7.143 7.970 -3.912 454 HA THR 70 HA THR 70 7.396 9.473 -1.416 455 HB THR 70 HB THR 70 7.556 10.803 -4.083 456 HG1 THR 70 HG1 THR 70 9.586 9.133 -2.963 457 HG21 THR 70 HG21 THR 70 7.812 12.089 -1.995 458 HG22 THR 70 HG22 THR 70 9.293 12.101 -2.957 459 HG23 THR 70 HG23 THR 70 9.169 11.059 -1.539 460 H ASP 71 HN ASP 71 4.854 8.365 -2.043 461 HA ASP 71 HA ASP 71 3.293 10.767 -2.717 462 HB2 ASP 71 HB2 ASP 71 2.843 7.866 -3.154 463 HB3 ASP 71 HB1 ASP 71 1.429 8.828 -2.737 464 H THR 72 HN THR 72 1.613 11.416 -1.392 465 HA THR 72 HA THR 72 1.394 10.109 1.233 466 HB THR 72 HB THR 72 0.980 12.558 2.067 467 HG1 THR 72 HG1 THR 72 2.759 13.763 0.654 468 HG21 THR 72 HG21 THR 72 3.744 11.535 1.414 469 HG22 THR 72 HG22 THR 72 2.814 11.202 2.876 470 HG23 THR 72 HG23 THR 72 3.389 12.836 2.550 471 HA PRO 73 HA PRO 73 -2.999 10.187 0.727 472 HB2 PRO 73 HB2 PRO 73 -3.196 11.704 3.287 473 HB3 PRO 73 HB1 PRO 73 -3.991 10.195 2.809 474 HG2 PRO 73 HG2 PRO 73 -1.962 10.147 4.512 475 HG3 PRO 73 HG1 PRO 73 -2.127 8.897 3.262 476 HD2 PRO 73 HD2 PRO 73 -0.270 11.230 3.361 477 HD3 PRO 73 HD1 PRO 73 0.006 9.592 2.735 478 H ALA 74 HN ALA 74 -1.726 13.225 2.073 479 HA ALA 74 HA ALA 74 -3.808 14.847 1.027 480 HB1 ALA 74 HB1 ALA 74 -2.365 16.728 1.656 481 HB2 ALA 74 HB2 ALA 74 -1.037 15.604 1.950 482 HB3 ALA 74 HB3 ALA 74 -2.489 15.537 2.950 483 H GLN 75 HN GLN 75 -0.745 13.738 -0.238 484 HA GLN 75 HA GLN 75 -0.480 15.627 -2.331 485 HB2 GLN 75 HB2 GLN 75 1.322 14.112 -1.418 486 HB3 GLN 75 HB1 GLN 75 0.573 12.802 -2.319 487 HG2 GLN 75 HG2 GLN 75 2.460 13.705 -3.528 488 HG3 GLN 75 HG1 GLN 75 0.961 14.014 -4.402 489 HE21 GLN 75 HE21 GLN 75 1.941 15.692 -5.541 490 HE22 GLN 75 HE22 GLN 75 2.251 17.228 -4.812 491 H LEU 76 HN LEU 76 -1.948 12.419 -2.162 492 HA LEU 76 HA LEU 76 -2.733 12.576 -4.959 493 HB2 LEU 76 HB2 LEU 76 -3.104 10.432 -2.876 494 HB3 LEU 76 HB1 LEU 76 -3.667 10.300 -4.529 495 HG LEU 76 HG LEU 76 -0.768 10.665 -3.765 496 HD11 LEU 76 HD11 LEU 76 -2.233 8.148 -4.544 497 HD12 LEU 76 HD12 LEU 76 -1.657 8.539 -2.925 498 HD13 LEU 76 HD13 LEU 76 -0.504 8.300 -4.239 499 HD21 LEU 76 HD21 LEU 76 -2.096 9.896 -6.362 500 HD22 LEU 76 HD22 LEU 76 -0.359 9.970 -6.077 501 HD23 LEU 76 HD23 LEU 76 -1.324 11.442 -6.011 502 H GLU 77 HN GLU 77 -3.929 14.113 -2.484 503 HA GLU 77 HA GLU 77 -5.949 14.943 -1.853 504 HB2 GLU 77 HB2 GLU 77 -6.488 14.165 -4.711 505 HB3 GLU 77 HB1 GLU 77 -7.745 14.882 -3.714 506 HG2 GLU 77 HG2 GLU 77 -5.097 16.236 -3.941 507 HG3 GLU 77 HG1 GLU 77 -6.270 16.375 -5.247 508 H MET 78 HN MET 78 -5.411 12.337 -1.005 509 HA MET 78 HA MET 78 -7.763 10.709 -1.408 510 HB2 MET 78 HB2 MET 78 -5.603 10.335 0.676 511 HB3 MET 78 HB1 MET 78 -6.726 9.123 0.072 512 HG2 MET 78 HG2 MET 78 -5.653 9.139 -2.080 513 HG3 MET 78 HG1 MET 78 -4.604 10.464 -1.580 514 HE1 MET 78 HE1 MET 78 -5.749 7.138 0.228 515 HE2 MET 78 HE2 MET 78 -4.349 6.116 -0.088 516 HE3 MET 78 HE3 MET 78 -5.355 6.668 -1.426 517 H GLU 79 HN GLU 79 -9.501 10.573 -0.088 518 HA GLU 79 HA GLU 79 -9.478 12.349 2.252 519 HB2 GLU 79 HB2 GLU 79 -11.598 11.673 0.264 520 HB3 GLU 79 HB1 GLU 79 -12.077 12.086 1.906 521 HG2 GLU 79 HG2 GLU 79 -10.567 13.789 -0.055 522 HG3 GLU 79 HG1 GLU 79 -12.170 14.074 0.622 523 H ASP 80 HN ASP 80 -11.338 11.644 3.814 524 HA ASP 80 HA ASP 80 -10.477 9.243 5.019 525 HB2 ASP 80 HB2 ASP 80 -11.799 11.442 5.884 526 HB3 ASP 80 HB1 ASP 80 -13.137 10.305 5.766 527 H GLU 81 HN GLU 81 -11.449 7.255 5.217 528 HA GLU 81 HA GLU 81 -12.734 5.447 4.746 529 HB2 GLU 81 HB2 GLU 81 -14.668 7.502 3.679 530 HB3 GLU 81 HB1 GLU 81 -15.022 5.784 3.770 531 HG2 GLU 81 HG2 GLU 81 -14.129 7.163 6.242 532 HG3 GLU 81 HG1 GLU 81 -15.764 7.459 5.658 533 H ASP 82 HN ASP 82 -10.824 6.719 2.752 534 HA ASP 82 HA ASP 82 -11.882 6.009 0.174 535 HB2 ASP 82 HB2 ASP 82 -9.903 7.669 0.869 536 HB3 ASP 82 HB1 ASP 82 -8.938 6.226 0.573 537 H THR 83 HN THR 83 -10.454 4.454 -1.230 538 HA THR 83 HA THR 83 -9.792 2.060 0.358 539 HB THR 83 HB THR 83 -11.300 1.759 -2.219 540 HG1 THR 83 HG1 THR 83 -12.305 3.090 -0.271 541 HG21 THR 83 HG21 THR 83 -11.975 -0.361 -1.225 542 HG22 THR 83 HG22 THR 83 -11.165 0.065 0.285 543 HG23 THR 83 HG23 THR 83 -10.217 -0.211 -1.177 544 H ILE 84 HN ILE 84 -8.015 1.017 -0.268 545 HA ILE 84 HA ILE 84 -6.769 1.767 -2.837 546 HB ILE 84 HB ILE 84 -5.343 0.748 -0.369 547 HG12 ILE 84 HG12 ILE 84 -5.455 3.604 -1.363 548 HG13 ILE 84 HG11 ILE 84 -6.421 2.990 -0.025 549 HG21 ILE 84 HG21 ILE 84 -3.327 1.572 -1.523 550 HG22 ILE 84 HG22 ILE 84 -4.324 1.984 -2.922 551 HG23 ILE 84 HG23 ILE 84 -4.155 0.301 -2.422 552 HD11 ILE 84 HD11 ILE 84 -3.415 3.104 -0.137 553 HD12 ILE 84 HD12 ILE 84 -4.369 2.463 1.200 554 HD13 ILE 84 HD13 ILE 84 -4.471 4.174 0.785 555 H ASP 85 HN ASP 85 -5.935 0.089 -4.123 556 HA ASP 85 HA ASP 85 -6.854 -2.599 -3.340 557 HB2 ASP 85 HB2 ASP 85 -7.665 -1.361 -5.512 558 HB3 ASP 85 HB1 ASP 85 -6.117 -1.898 -6.157 559 H VAL 86 HN VAL 86 -5.515 -4.390 -3.630 560 HA VAL 86 HA VAL 86 -2.666 -3.783 -4.093 561 HB VAL 86 HB VAL 86 -3.713 -5.808 -2.106 562 HG11 VAL 86 HG11 VAL 86 -1.387 -5.928 -1.358 563 HG12 VAL 86 HG12 VAL 86 -0.920 -4.790 -2.622 564 HG13 VAL 86 HG13 VAL 86 -1.543 -6.384 -3.054 565 HG21 VAL 86 HG21 VAL 86 -2.939 -4.275 -0.364 566 HG22 VAL 86 HG22 VAL 86 -4.210 -3.544 -1.344 567 HG23 VAL 86 HG23 VAL 86 -2.527 -3.080 -1.593 568 H PHE 87 HN PHE 87 -1.833 -4.887 -5.726 569 HA PHE 87 HA PHE 87 -3.131 -7.410 -6.535 570 HB2 PHE 87 HB2 PHE 87 -1.810 -5.241 -8.152 571 HB3 PHE 87 HB1 PHE 87 -2.004 -6.867 -8.795 572 HD1 PHE 87 HD1 PHE 87 -4.477 -7.825 -8.490 573 HD2 PHE 87 HD2 PHE 87 -3.424 -3.707 -8.668 574 HE1 PHE 87 HE1 PHE 87 -6.767 -7.274 -9.198 575 HE2 PHE 87 HE2 PHE 87 -5.713 -3.150 -9.375 576 HZ PHE 87 HZ PHE 87 -7.388 -4.935 -9.644 577 H GLN 88 HN GLN 88 -1.597 -8.892 -7.745 578 HA GLN 88 HA GLN 88 1.004 -8.962 -6.354 579 HB2 GLN 88 HB2 GLN 88 -0.832 -11.161 -7.292 580 HB3 GLN 88 HB1 GLN 88 0.862 -11.465 -6.934 581 HG2 GLN 88 HG2 GLN 88 -0.587 -10.043 -4.825 582 HG3 GLN 88 HG1 GLN 88 -1.176 -11.672 -5.155 583 HE21 GLN 88 HE21 GLN 88 -0.448 -12.471 -3.187 584 HE22 GLN 88 HE22 GLN 88 1.229 -12.718 -2.857 585 H GLN 89 HN GLN 89 2.848 -9.233 -7.562 586 HA GLN 89 HA GLN 89 2.722 -8.528 -10.318 587 HB2 GLN 89 HB2 GLN 89 4.622 -8.064 -8.643 588 HB3 GLN 89 HB1 GLN 89 5.127 -9.721 -8.940 589 HG2 GLN 89 HG2 GLN 89 6.398 -8.162 -10.293 590 HG3 GLN 89 HG1 GLN 89 5.420 -9.217 -11.309 591 HE21 GLN 89 HE21 GLN 89 5.405 -7.813 -13.032 592 HE22 GLN 89 HE22 GLN 89 4.528 -6.323 -13.022 593 H GLN 90 HN GLN 90 3.316 -9.786 -12.134 594 HA GLN 90 HA GLN 90 2.299 -12.430 -12.117 595 HB2 GLN 90 HB2 GLN 90 3.921 -10.958 -14.198 596 HB3 GLN 90 HB1 GLN 90 3.183 -12.531 -14.457 597 HG2 GLN 90 HG2 GLN 90 1.649 -11.111 -15.409 598 HG3 GLN 90 HG1 GLN 90 0.989 -11.336 -13.790 599 HE21 GLN 90 HE21 GLN 90 -0.131 -9.402 -13.848 600 HE22 GLN 90 HE22 GLN 90 0.658 -7.868 -13.750 601 H THR 91 HN THR 91 3.279 -14.344 -11.855 602 HA THR 91 HA THR 91 5.892 -14.480 -10.781 603 HB THR 91 HB THR 91 4.958 -17.015 -11.824 604 HG1 THR 91 HG1 THR 91 3.121 -16.103 -9.956 605 HG21 THR 91 HG21 THR 91 5.137 -15.969 -8.995 606 HG22 THR 91 HG22 THR 91 6.481 -16.676 -9.895 607 HG23 THR 91 HG23 THR 91 5.073 -17.660 -9.491 608 H GLY 92 HN GLY 92 4.543 -15.273 -13.956 609 HA2 GLY 92 HA2 GLY 92 6.404 -14.563 -15.661 610 HA3 GLY 92 HA1 GLY 92 7.197 -15.964 -14.953 611 H ASN 357 HT1 ASN 357 -15.768 -10.692 7.071 612 HA ASN 357 HA ASN 357 -13.223 -10.449 5.605 613 HB2 ASN 357 HB2 ASN 357 -13.868 -8.492 4.632 614 HB3 ASN 357 HB1 ASN 357 -15.478 -9.174 4.791 615 HD21 ASN 357 HD21 ASN 357 -16.861 -8.385 6.422 616 HD22 ASN 357 HD22 ASN 357 -16.564 -6.864 7.193 617 H ASN 358 HN ASN 358 -11.688 -9.217 6.758 618 HA ASN 358 HA ASN 358 -12.508 -8.617 9.508 619 HB2 ASN 358 HB2 ASN 358 -10.533 -9.479 10.415 620 HB3 ASN 358 HB1 ASN 358 -10.939 -10.640 9.159 621 HD21 ASN 358 HD21 ASN 358 -9.671 -10.753 7.309 622 HD22 ASN 358 HD22 ASN 358 -8.092 -10.050 7.241 623 H ARG 359 HN ARG 359 -12.226 -6.627 10.198 624 HA ARG 359 HA ARG 359 -10.329 -4.939 8.707 625 HB2 ARG 359 HB2 ARG 359 -12.041 -3.102 9.705 626 HB3 ARG 359 HB1 ARG 359 -12.197 -3.807 8.102 627 HG2 ARG 359 HG2 ARG 359 -13.794 -5.423 8.946 628 HG3 ARG 359 HG1 ARG 359 -13.615 -4.772 10.575 629 HD2 ARG 359 HD2 ARG 359 -14.465 -3.050 8.268 630 HD3 ARG 359 HD1 ARG 359 -15.624 -4.011 9.187 631 HE ARG 359 HE ARG 359 -13.871 -2.127 10.598 632 HH11 ARG 359 HH11 ARG 359 -17.083 -3.131 9.549 633 HH12 ARG 359 HH12 ARG 359 -17.922 -2.010 10.689 634 HH21 ARG 359 HH21 ARG 359 -14.910 -0.706 12.065 635 HH22 ARG 359 HH22 ARG 359 -16.714 -0.684 12.108 636 H ASP 360 HN ASP 360 -8.747 -4.252 9.870 637 HA ASP 360 HA ASP 360 -9.093 -3.735 12.728 638 HB2 ASP 360 HB2 ASP 360 -7.341 -5.011 13.368 639 HB3 ASP 360 HB1 ASP 360 -7.651 -5.861 11.862 640 HA PRO 361 HA PRO 361 -7.169 0.009 11.282 641 HB2 PRO 361 HB2 PRO 361 -7.674 1.535 13.430 642 HB3 PRO 361 HB1 PRO 361 -8.981 0.930 12.402 643 HG2 PRO 361 HG2 PRO 361 -8.250 0.124 15.130 644 HG3 PRO 361 HG1 PRO 361 -9.776 -0.103 14.263 645 HD2 PRO 361 HD2 PRO 361 -7.622 -1.995 14.643 646 HD3 PRO 361 HD1 PRO 361 -9.217 -2.257 13.908 647 H ILE 362 HN ILE 362 -5.178 0.692 11.182 648 HA ILE 362 HA ILE 362 -3.328 0.253 13.435 649 HB ILE 362 HB ILE 362 -2.260 0.500 10.676 650 HG12 ILE 362 HG12 ILE 362 -3.100 -2.242 11.472 651 HG13 ILE 362 HG11 ILE 362 -4.356 -1.165 10.872 652 HG21 ILE 362 HG21 ILE 362 -1.553 -1.286 12.999 653 HG22 ILE 362 HG22 ILE 362 -0.773 0.244 12.594 654 HG23 ILE 362 HG23 ILE 362 -0.645 -1.130 11.494 655 HD11 ILE 362 HD11 ILE 362 -1.826 -1.906 9.427 656 HD12 ILE 362 HD12 ILE 362 -3.072 -0.814 8.823 657 HD13 ILE 362 HD13 ILE 362 -3.441 -2.521 9.080 658 H VAL 363 HN VAL 363 -2.143 1.967 14.131 659 HA VAL 363 HA VAL 363 -2.402 4.461 12.573 660 HB VAL 363 HB VAL 363 -2.074 4.151 15.558 661 HG11 VAL 363 HG11 VAL 363 -2.435 6.568 15.656 662 HG12 VAL 363 HG12 VAL 363 -2.455 6.635 13.894 663 HG13 VAL 363 HG13 VAL 363 -0.984 6.159 14.744 664 HG21 VAL 363 HG21 VAL 363 -4.347 4.923 15.764 665 HG22 VAL 363 HG22 VAL 363 -4.303 3.500 14.720 666 HG23 VAL 363 HG23 VAL 363 -4.476 5.107 14.015 667 H ILE 364 HN ILE 364 -0.624 5.333 11.881 668 HA ILE 364 HA ILE 364 1.959 4.579 13.078 669 HB ILE 364 HB ILE 364 1.365 5.192 10.170 670 HG12 ILE 364 HG12 ILE 364 2.422 2.666 11.453 671 HG13 ILE 364 HG11 ILE 364 0.766 2.893 10.906 672 HG21 ILE 364 HG21 ILE 364 4.034 4.403 11.293 673 HG22 ILE 364 HG22 ILE 364 3.551 6.088 11.092 674 HG23 ILE 364 HG23 ILE 364 3.658 5.028 9.686 675 HD11 ILE 364 HD11 ILE 364 1.561 3.149 8.610 676 HD12 ILE 364 HD12 ILE 364 2.065 1.608 9.300 677 HD13 ILE 364 HD13 ILE 364 3.221 2.931 9.161 678 H SER 365 HN SER 365 3.268 6.230 13.671 679 HA SER 365 HA SER 365 2.396 8.969 12.996 680 HB2 SER 365 HB2 SER 365 4.033 8.378 15.440 681 HB3 SER 365 HB1 SER 365 2.861 9.667 15.165 682 HG SER 365 HG SER 365 2.154 6.919 15.369 683 H ASP 366 HN ASP 366 3.876 10.207 11.981 684 HA ASP 366 HA ASP 366 6.634 9.164 11.872 685 HB2 ASP 366 HB2 ASP 366 5.001 9.155 9.764 686 HB3 ASP 366 HB1 ASP 366 5.581 10.812 9.628 687 H SER 367 HN SER 367 8.198 10.484 12.451 688 HA SER 367 HA SER 367 7.559 13.279 13.041 689 HB2 SER 367 HB2 SER 367 10.073 12.890 14.048 690 HB3 SER 367 HB1 SER 367 8.595 12.615 14.954 691 HG SER 367 HG SER 367 8.933 10.539 14.887 692 HA PRO 368 HA PRO 368 9.610 14.353 9.163 693 HB2 PRO 368 HB2 PRO 368 9.558 17.049 10.412 694 HB3 PRO 368 HB1 PRO 368 8.957 16.527 8.832 695 HG2 PRO 368 HG2 PRO 368 7.269 17.073 10.814 696 HG3 PRO 368 HG1 PRO 368 6.961 15.748 9.676 697 HD2 PRO 368 HD2 PRO 368 7.928 15.629 12.492 698 HD3 PRO 368 HD1 PRO 368 6.844 14.528 11.614 Start of MODEL 17 1 H ASP 16 HT1 ASP 16 -4.164 15.328 12.196 2 HA ASP 16 HA ASP 16 -6.994 14.653 12.714 3 HB2 ASP 16 HB2 ASP 16 -6.349 16.774 11.306 4 HB3 ASP 16 HB1 ASP 16 -5.928 15.591 10.071 5 H HIS 17 HN HIS 17 -7.175 12.524 12.593 6 HA HIS 17 HA HIS 17 -5.259 10.967 11.054 7 HB2 HIS 17 HB2 HIS 17 -7.388 10.304 13.059 8 HB3 HIS 17 HB1 HIS 17 -6.719 9.042 12.033 9 HD2 HIS 17 HD2 HIS 17 -3.717 9.061 12.263 10 HE1 HIS 17 HE1 HIS 17 -4.115 10.014 16.367 11 HE2 HIS 17 HE2 HIS 17 -2.601 8.999 14.608 12 H ILE 18 HN ILE 18 -5.781 9.606 9.352 13 HA ILE 18 HA ILE 18 -8.442 10.035 8.161 14 HB ILE 18 HB ILE 18 -6.663 11.143 6.859 15 HG12 ILE 18 HG12 ILE 18 -7.695 8.728 5.368 16 HG13 ILE 18 HG11 ILE 18 -8.700 10.112 5.788 17 HG21 ILE 18 HG21 ILE 18 -5.024 9.733 5.619 18 HG22 ILE 18 HG22 ILE 18 -5.510 8.371 6.633 19 HG23 ILE 18 HG23 ILE 18 -4.762 9.792 7.363 20 HD11 ILE 18 HD11 ILE 18 -6.252 10.168 4.042 21 HD12 ILE 18 HD12 ILE 18 -7.245 11.562 4.469 22 HD13 ILE 18 HD13 ILE 18 -7.928 10.257 3.498 23 H ASN 19 HN ASN 19 -9.567 8.242 7.503 24 HA ASN 19 HA ASN 19 -8.405 5.669 8.295 25 HB2 ASN 19 HB2 ASN 19 -11.265 6.390 7.621 26 HB3 ASN 19 HB1 ASN 19 -10.716 4.820 8.193 27 HD21 ASN 19 HD21 ASN 19 -11.242 8.159 9.027 28 HD22 ASN 19 HD22 ASN 19 -11.212 7.936 10.749 29 H LEU 20 HN LEU 20 -7.145 5.047 6.613 30 HA LEU 20 HA LEU 20 -8.314 4.978 3.933 31 HB2 LEU 20 HB2 LEU 20 -5.521 4.320 4.888 32 HB3 LEU 20 HB1 LEU 20 -6.039 4.313 3.213 33 HG LEU 20 HG LEU 20 -6.008 6.751 4.994 34 HD11 LEU 20 HD11 LEU 20 -4.119 5.913 2.800 35 HD12 LEU 20 HD12 LEU 20 -3.753 5.975 4.524 36 HD13 LEU 20 HD13 LEU 20 -4.101 7.462 3.643 37 HD21 LEU 20 HD21 LEU 20 -6.312 7.941 2.826 38 HD22 LEU 20 HD22 LEU 20 -7.696 6.965 3.313 39 HD23 LEU 20 HD23 LEU 20 -6.600 6.377 2.065 40 H LYS 21 HN LYS 21 -9.151 3.150 3.097 41 HA LYS 21 HA LYS 21 -8.865 0.708 4.693 42 HB2 LYS 21 HB2 LYS 21 -10.926 1.642 2.715 43 HB3 LYS 21 HB1 LYS 21 -10.824 -0.045 3.201 44 HG2 LYS 21 HG2 LYS 21 -11.188 0.588 5.524 45 HG3 LYS 21 HG1 LYS 21 -11.253 2.289 5.058 46 HD2 LYS 21 HD2 LYS 21 -13.249 1.947 3.801 47 HD3 LYS 21 HD1 LYS 21 -13.115 0.194 3.960 48 HE2 LYS 21 HE2 LYS 21 -13.529 0.330 6.330 49 HE3 LYS 21 HE1 LYS 21 -13.507 2.092 6.270 50 HZ1 LYS 21 HZ1 LYS 21 -15.543 2.180 5.247 51 HZ2 LYS 21 HZ2 LYS 21 -15.753 0.830 6.251 52 HZ3 LYS 21 HZ3 LYS 21 -15.426 0.616 4.608 53 H VAL 22 HN VAL 22 -7.669 -0.906 4.019 54 HA VAL 22 HA VAL 22 -6.879 -1.000 1.178 55 HB VAL 22 HB VAL 22 -5.408 -2.057 3.607 56 HG11 VAL 22 HG11 VAL 22 -5.101 -3.520 1.677 57 HG12 VAL 22 HG12 VAL 22 -3.615 -2.654 2.063 58 HG13 VAL 22 HG13 VAL 22 -4.606 -2.138 0.699 59 HG21 VAL 22 HG21 VAL 22 -3.757 -0.367 3.151 60 HG22 VAL 22 HG22 VAL 22 -5.335 0.405 3.294 61 HG23 VAL 22 HG23 VAL 22 -4.621 0.146 1.705 62 H ALA 23 HN ALA 23 -7.992 -2.517 0.126 63 HA ALA 23 HA ALA 23 -8.822 -4.919 1.613 64 HB1 ALA 23 HB1 ALA 23 -10.636 -5.147 0.038 65 HB2 ALA 23 HB2 ALA 23 -10.031 -3.787 -0.905 66 HB3 ALA 23 HB3 ALA 23 -10.653 -3.525 0.723 67 H GLY 24 HN GLY 24 -8.345 -6.912 0.876 68 HA2 GLY 24 HA2 GLY 24 -6.321 -7.079 -1.219 69 HA3 GLY 24 HA1 GLY 24 -6.785 -8.364 -0.108 70 H GLN 25 HN GLN 25 -6.689 -9.576 -2.242 71 HA GLN 25 HA GLN 25 -9.044 -9.152 -3.917 72 HB2 GLN 25 HB2 GLN 25 -6.795 -11.150 -4.241 73 HB3 GLN 25 HB1 GLN 25 -8.057 -10.816 -5.418 74 HG2 GLN 25 HG2 GLN 25 -5.890 -8.935 -4.507 75 HG3 GLN 25 HG1 GLN 25 -6.027 -9.719 -6.081 76 HE21 GLN 25 HE21 GLN 25 -5.930 -6.876 -5.285 77 HE22 GLN 25 HE22 GLN 25 -7.340 -6.157 -5.991 78 H ASP 26 HN ASP 26 -8.520 -10.577 -1.100 79 HA ASP 26 HA ASP 26 -10.164 -12.940 -1.664 80 HB2 ASP 26 HB2 ASP 26 -9.450 -13.556 0.750 81 HB3 ASP 26 HB1 ASP 26 -8.259 -13.695 -0.536 82 H GLY 27 HN GLY 27 -9.859 -11.159 1.394 83 HA2 GLY 27 HA2 GLY 27 -12.402 -9.878 1.196 84 HA3 GLY 27 HA1 GLY 27 -12.519 -11.367 2.122 85 H SER 28 HN SER 28 -9.527 -9.689 2.244 86 HA SER 28 HA SER 28 -10.059 -8.966 5.022 87 HB2 SER 28 HB2 SER 28 -7.489 -8.533 4.917 88 HB3 SER 28 HB1 SER 28 -8.065 -10.200 4.893 89 HG SER 28 HG SER 28 -7.593 -10.366 2.776 90 H VAL 29 HN VAL 29 -10.346 -6.860 5.625 91 HA VAL 29 HA VAL 29 -9.425 -4.792 3.724 92 HB VAL 29 HB VAL 29 -12.035 -4.528 5.216 93 HG11 VAL 29 HG11 VAL 29 -12.437 -2.747 3.553 94 HG12 VAL 29 HG12 VAL 29 -10.823 -3.024 2.900 95 HG13 VAL 29 HG13 VAL 29 -11.017 -2.440 4.553 96 HG21 VAL 29 HG21 VAL 29 -13.178 -5.004 3.079 97 HG22 VAL 29 HG22 VAL 29 -12.306 -6.404 3.707 98 HG23 VAL 29 HG23 VAL 29 -11.626 -5.466 2.378 99 H VAL 30 HN VAL 30 -7.638 -4.435 5.090 100 HA VAL 30 HA VAL 30 -8.034 -3.822 7.870 101 HB VAL 30 HB VAL 30 -5.634 -3.213 7.881 102 HG11 VAL 30 HG11 VAL 30 -6.309 -5.854 6.585 103 HG12 VAL 30 HG12 VAL 30 -6.300 -5.503 8.313 104 HG13 VAL 30 HG13 VAL 30 -4.791 -5.481 7.401 105 HG21 VAL 30 HG21 VAL 30 -5.769 -3.907 4.947 106 HG22 VAL 30 HG22 VAL 30 -4.283 -3.655 5.865 107 HG23 VAL 30 HG23 VAL 30 -5.417 -2.324 5.638 108 H GLN 31 HN GLN 31 -7.554 -1.793 8.867 109 HA GLN 31 HA GLN 31 -8.199 0.478 7.109 110 HB2 GLN 31 HB2 GLN 31 -9.922 -0.266 8.831 111 HB3 GLN 31 HB1 GLN 31 -8.795 0.292 10.057 112 HG2 GLN 31 HG2 GLN 31 -9.136 2.496 9.567 113 HG3 GLN 31 HG1 GLN 31 -9.579 2.169 7.891 114 HE21 GLN 31 HE21 GLN 31 -10.916 3.709 10.079 115 HE22 GLN 31 HE22 GLN 31 -12.516 3.054 10.160 116 H PHE 32 HN PHE 32 -6.489 1.719 6.798 117 HA PHE 32 HA PHE 32 -4.393 1.830 8.819 118 HB2 PHE 32 HB2 PHE 32 -4.587 2.532 5.926 119 HB3 PHE 32 HB1 PHE 32 -3.388 3.368 6.907 120 HD1 PHE 32 HD1 PHE 32 -4.380 0.191 5.429 121 HD2 PHE 32 HD2 PHE 32 -1.535 2.166 7.898 122 HE1 PHE 32 HE1 PHE 32 -2.854 -1.726 5.201 123 HE2 PHE 32 HE2 PHE 32 -0.005 0.258 7.675 124 HZ PHE 32 HZ PHE 32 -0.664 -1.694 6.324 125 H LYS 33 HN LYS 33 -4.996 3.130 10.429 126 HA LYS 33 HA LYS 33 -6.246 5.698 9.828 127 HB2 LYS 33 HB2 LYS 33 -7.174 4.248 11.621 128 HB3 LYS 33 HB1 LYS 33 -5.656 4.392 12.493 129 HG2 LYS 33 HG2 LYS 33 -6.046 6.870 12.565 130 HG3 LYS 33 HG1 LYS 33 -7.661 6.558 11.918 131 HD2 LYS 33 HD2 LYS 33 -8.184 5.156 13.826 132 HD3 LYS 33 HD1 LYS 33 -6.550 5.369 14.458 133 HE2 LYS 33 HE2 LYS 33 -6.972 7.788 14.650 134 HE3 LYS 33 HE1 LYS 33 -8.623 7.525 14.090 135 HZ1 LYS 33 HZ1 LYS 33 -8.478 7.680 16.505 136 HZ2 LYS 33 HZ2 LYS 33 -7.442 6.345 16.547 137 HZ3 LYS 33 HZ3 LYS 33 -9.038 6.158 16.023 138 H ILE 34 HN ILE 34 -4.249 6.404 8.783 139 HA ILE 34 HA ILE 34 -2.110 7.105 10.676 140 HB ILE 34 HB ILE 34 -0.701 7.489 8.678 141 HG12 ILE 34 HG12 ILE 34 -2.910 6.202 7.065 142 HG13 ILE 34 HG11 ILE 34 -2.716 7.950 7.169 143 HG21 ILE 34 HG21 ILE 34 -0.454 5.115 8.042 144 HG22 ILE 34 HG22 ILE 34 -1.982 4.764 8.855 145 HG23 ILE 34 HG23 ILE 34 -0.599 5.344 9.786 146 HD11 ILE 34 HD11 ILE 34 -1.719 6.904 5.145 147 HD12 ILE 34 HD12 ILE 34 -0.568 6.083 6.201 148 HD13 ILE 34 HD13 ILE 34 -0.586 7.843 6.112 149 H LYS 35 HN LYS 35 -0.899 9.170 9.460 150 HA LYS 35 HA LYS 35 -2.927 11.281 9.612 151 HB2 LYS 35 HB2 LYS 35 0.085 11.361 9.909 152 HB3 LYS 35 HB1 LYS 35 -0.939 12.792 9.908 153 HG2 LYS 35 HG2 LYS 35 -2.067 12.044 11.904 154 HG3 LYS 35 HG1 LYS 35 -1.175 10.523 11.878 155 HD2 LYS 35 HD2 LYS 35 0.906 11.691 12.273 156 HD3 LYS 35 HD1 LYS 35 0.086 13.248 12.160 157 HE2 LYS 35 HE2 LYS 35 -1.271 12.653 14.126 158 HE3 LYS 35 HE1 LYS 35 -0.395 11.130 14.252 159 HZ1 LYS 35 HZ1 LYS 35 1.661 12.458 14.531 160 HZ2 LYS 35 HZ2 LYS 35 0.544 12.679 15.778 161 HZ3 LYS 35 HZ3 LYS 35 0.717 13.861 14.582 162 H ARG 36 HN ARG 36 -2.743 13.088 8.081 163 HA ARG 36 HA ARG 36 -2.641 12.148 5.424 164 HB2 ARG 36 HB2 ARG 36 -2.703 14.989 6.441 165 HB3 ARG 36 HB1 ARG 36 -3.013 14.493 4.784 166 HG2 ARG 36 HG2 ARG 36 -4.901 13.088 5.684 167 HG3 ARG 36 HG1 ARG 36 -4.665 13.919 7.224 168 HD2 ARG 36 HD2 ARG 36 -6.048 15.487 6.451 169 HD3 ARG 36 HD1 ARG 36 -4.742 15.968 5.370 170 HE ARG 36 HE ARG 36 -5.773 14.750 3.624 171 HH11 ARG 36 HH11 ARG 36 -7.652 14.863 6.592 172 HH12 ARG 36 HH12 ARG 36 -9.162 14.301 5.791 173 HH21 ARG 36 HH21 ARG 36 -7.685 14.058 2.558 174 HH22 ARG 36 HH22 ARG 36 -9.208 13.916 3.531 175 H HIS 37 HN HIS 37 -0.202 13.441 7.473 176 HA HIS 37 HA HIS 37 1.525 14.094 5.210 177 HB2 HIS 37 HB2 HIS 37 2.942 14.414 7.648 178 HB3 HIS 37 HB1 HIS 37 2.347 15.666 6.567 179 HD2 HIS 37 HD2 HIS 37 0.439 17.249 7.587 180 HE1 HIS 37 HE1 HIS 37 -0.405 14.908 11.006 181 HE2 HIS 37 HE2 HIS 37 -0.767 17.146 9.877 182 H THR 38 HN THR 38 0.726 11.323 6.631 183 HA THR 38 HA THR 38 3.406 10.284 7.078 184 HB THR 38 HB THR 38 0.818 8.728 7.113 185 HG1 THR 38 HG1 THR 38 1.674 10.679 8.773 186 HG21 THR 38 HG21 THR 38 3.503 8.263 8.421 187 HG22 THR 38 HG22 THR 38 2.843 7.365 7.056 188 HG23 THR 38 HG23 THR 38 2.075 7.253 8.639 189 HA PRO 39 HA PRO 39 3.869 9.375 2.700 190 HB2 PRO 39 HB2 PRO 39 5.991 7.626 3.855 191 HB3 PRO 39 HB1 PRO 39 6.094 8.806 2.537 192 HG2 PRO 39 HG2 PRO 39 7.091 9.399 4.912 193 HG3 PRO 39 HG1 PRO 39 6.214 10.619 3.970 194 HD2 PRO 39 HD2 PRO 39 5.302 9.060 6.345 195 HD3 PRO 39 HD1 PRO 39 4.971 10.747 5.900 196 H LEU 40 HN LEU 40 2.898 7.898 1.492 197 HA LEU 40 HA LEU 40 1.610 5.650 2.638 198 HB2 LEU 40 HB2 LEU 40 2.048 6.457 -0.236 199 HB3 LEU 40 HB1 LEU 40 1.072 5.082 0.244 200 HG LEU 40 HG LEU 40 0.522 7.940 1.041 201 HD11 LEU 40 HD11 LEU 40 -1.449 7.620 -0.510 202 HD12 LEU 40 HD12 LEU 40 -0.596 6.211 -1.146 203 HD13 LEU 40 HD13 LEU 40 0.127 7.815 -1.275 204 HD21 LEU 40 HD21 LEU 40 -1.051 5.395 1.416 205 HD22 LEU 40 HD22 LEU 40 -1.678 7.016 1.711 206 HD23 LEU 40 HD23 LEU 40 -0.339 6.400 2.676 207 H SER 41 HN SER 41 4.770 6.105 1.549 208 HA SER 41 HA SER 41 5.432 3.605 0.479 209 HB2 SER 41 HB2 SER 41 7.708 4.436 1.807 210 HB3 SER 41 HB1 SER 41 7.244 4.929 0.176 211 HG SER 41 HG SER 41 7.226 6.860 1.012 212 H LYS 42 HN LYS 42 5.471 4.807 3.817 213 HA LYS 42 HA LYS 42 6.388 2.324 4.905 214 HB2 LYS 42 HB2 LYS 42 5.314 4.864 6.102 215 HB3 LYS 42 HB1 LYS 42 5.601 3.444 7.102 216 HG2 LYS 42 HG2 LYS 42 7.922 3.447 6.579 217 HG3 LYS 42 HG1 LYS 42 7.703 4.692 5.349 218 HD2 LYS 42 HD2 LYS 42 7.072 6.297 7.074 219 HD3 LYS 42 HD1 LYS 42 7.239 5.047 8.312 220 HE2 LYS 42 HE2 LYS 42 9.599 4.835 7.838 221 HE3 LYS 42 HE1 LYS 42 9.467 5.972 6.501 222 HZ1 LYS 42 HZ1 LYS 42 10.373 7.047 8.439 223 HZ2 LYS 42 HZ2 LYS 42 9.044 6.588 9.372 224 HZ3 LYS 42 HZ3 LYS 42 8.846 7.695 8.107 225 H LEU 43 HN LEU 43 3.314 3.786 4.220 226 HA LEU 43 HA LEU 43 1.654 2.108 5.761 227 HB2 LEU 43 HB2 LEU 43 0.791 4.152 4.802 228 HB3 LEU 43 HB1 LEU 43 1.160 3.601 3.181 229 HG LEU 43 HG LEU 43 -0.715 1.889 4.693 230 HD11 LEU 43 HD11 LEU 43 -2.608 3.386 4.283 231 HD12 LEU 43 HD12 LEU 43 -1.495 4.651 3.765 232 HD13 LEU 43 HD13 LEU 43 -1.464 4.077 5.432 233 HD21 LEU 43 HD21 LEU 43 -0.757 3.069 1.915 234 HD22 LEU 43 HD22 LEU 43 -1.842 1.825 2.535 235 HD23 LEU 43 HD23 LEU 43 -0.124 1.481 2.348 236 H MET 44 HN MET 44 2.845 1.903 2.444 237 HA MET 44 HA MET 44 1.547 -0.502 1.756 238 HB2 MET 44 HB2 MET 44 4.044 0.816 0.679 239 HB3 MET 44 HB1 MET 44 3.355 -0.645 -0.016 240 HG2 MET 44 HG2 MET 44 1.243 0.600 -0.391 241 HG3 MET 44 HG1 MET 44 2.058 2.062 0.162 242 HE1 MET 44 HE1 MET 44 3.398 3.554 -1.210 243 HE2 MET 44 HE2 MET 44 4.283 3.128 -2.675 244 HE3 MET 44 HE3 MET 44 4.766 2.443 -1.123 245 H LYS 45 HN LYS 45 4.695 0.186 3.201 246 HA LYS 45 HA LYS 45 5.663 -2.465 3.140 247 HB2 LYS 45 HB2 LYS 45 6.389 -0.092 4.852 248 HB3 LYS 45 HB1 LYS 45 7.204 -1.644 4.990 249 HG2 LYS 45 HG2 LYS 45 7.681 -1.448 2.505 250 HG3 LYS 45 HG1 LYS 45 7.166 0.233 2.649 251 HD2 LYS 45 HD2 LYS 45 9.362 -1.039 4.281 252 HD3 LYS 45 HD1 LYS 45 9.624 -0.077 2.826 253 HE2 LYS 45 HE2 LYS 45 8.537 1.839 3.922 254 HE3 LYS 45 HE1 LYS 45 8.330 0.872 5.381 255 HZ1 LYS 45 HZ1 LYS 45 10.758 0.651 5.495 256 HZ2 LYS 45 HZ2 LYS 45 10.264 2.261 5.585 257 HZ3 LYS 45 HZ3 LYS 45 10.914 1.660 4.149 258 H ALA 46 HN ALA 46 3.798 -0.660 5.543 259 HA ALA 46 HA ALA 46 3.905 -2.490 7.643 260 HB1 ALA 46 HB1 ALA 46 3.000 -0.274 7.944 261 HB2 ALA 46 HB2 ALA 46 1.787 -1.472 8.403 262 HB3 ALA 46 HB3 ALA 46 1.664 -0.637 6.852 263 H TYR 47 HN TYR 47 1.583 -2.264 4.961 264 HA TYR 47 HA TYR 47 0.056 -4.529 5.719 265 HB2 TYR 47 HB2 TYR 47 -0.723 -2.749 4.146 266 HB3 TYR 47 HB1 TYR 47 0.405 -3.369 2.947 267 HD1 TYR 47 HD1 TYR 47 -0.326 -4.958 1.421 268 HD2 TYR 47 HD2 TYR 47 -2.447 -4.494 5.081 269 HE1 TYR 47 HE1 TYR 47 -2.024 -6.551 0.635 270 HE2 TYR 47 HE2 TYR 47 -4.153 -6.086 4.300 271 HH TYR 47 HH TYR 47 -5.014 -7.008 2.255 272 H CYS 48 HN CYS 48 2.888 -4.048 3.734 273 HA CYS 48 HA CYS 48 3.063 -6.567 2.529 274 HB2 CYS 48 HB2 CYS 48 4.387 -4.630 1.813 275 HB3 CYS 48 HB1 CYS 48 5.266 -4.657 3.336 276 HG CYS 48 HG CYS 48 6.306 -7.291 2.765 277 H GLU 49 HN GLU 49 4.432 -5.350 5.579 278 HA GLU 49 HA GLU 49 5.785 -7.734 6.278 279 HB2 GLU 49 HB2 GLU 49 4.690 -5.635 8.157 280 HB3 GLU 49 HB1 GLU 49 5.982 -6.777 8.497 281 HG2 GLU 49 HG2 GLU 49 6.138 -4.683 6.349 282 HG3 GLU 49 HG1 GLU 49 6.700 -4.430 7.998 283 H ARG 50 HN ARG 50 2.527 -6.564 6.829 284 HA ARG 50 HA ARG 50 1.705 -8.516 8.699 285 HB2 ARG 50 HB2 ARG 50 0.208 -6.771 6.754 286 HB3 ARG 50 HB1 ARG 50 -0.629 -7.932 7.772 287 HG2 ARG 50 HG2 ARG 50 1.201 -5.857 8.929 288 HG3 ARG 50 HG1 ARG 50 -0.495 -5.516 8.575 289 HD2 ARG 50 HD2 ARG 50 -1.020 -7.591 9.965 290 HD3 ARG 50 HD1 ARG 50 0.651 -7.501 10.521 291 HE ARG 50 HE ARG 50 0.139 -5.576 11.716 292 HH11 ARG 50 HH11 ARG 50 -2.578 -6.637 9.763 293 HH12 ARG 50 HH12 ARG 50 -3.772 -5.570 10.608 294 HH21 ARG 50 HH21 ARG 50 -3.092 -4.233 12.331 295 HH22 ARG 50 HH22 ARG 50 -1.350 -4.205 12.833 296 H GLN 51 HN GLN 51 1.692 -8.407 5.184 297 HA GLN 51 HA GLN 51 0.301 -10.912 4.926 298 HB2 GLN 51 HB2 GLN 51 1.624 -9.046 2.979 299 HB3 GLN 51 HB1 GLN 51 1.042 -10.629 2.478 300 HG2 GLN 51 HG2 GLN 51 -0.674 -8.551 3.812 301 HG3 GLN 51 HG1 GLN 51 -0.548 -8.766 2.066 302 HE21 GLN 51 HE21 GLN 51 -1.526 -10.506 1.101 303 HE22 GLN 51 HE22 GLN 51 -2.639 -11.539 1.925 304 H GLY 52 HN GLY 52 3.521 -9.961 5.442 305 HA2 GLY 52 HA2 GLY 52 5.412 -11.220 5.770 306 HA3 GLY 52 HA1 GLY 52 4.419 -12.657 5.585 307 H LEU 53 HN LEU 53 5.636 -9.999 3.554 308 HA LEU 53 HA LEU 53 6.984 -11.832 1.826 309 HB2 LEU 53 HB2 LEU 53 5.663 -10.845 -0.211 310 HB3 LEU 53 HB1 LEU 53 5.074 -12.254 0.648 311 HG LEU 53 HG LEU 53 3.682 -10.518 2.013 312 HD11 LEU 53 HD11 LEU 53 3.035 -8.560 0.731 313 HD12 LEU 53 HD12 LEU 53 4.193 -8.985 -0.529 314 HD13 LEU 53 HD13 LEU 53 4.764 -8.532 1.076 315 HD21 LEU 53 HD21 LEU 53 2.701 -12.214 0.610 316 HD22 LEU 53 HD22 LEU 53 3.067 -11.275 -0.838 317 HD23 LEU 53 HD23 LEU 53 1.886 -10.677 0.326 318 H SER 54 HN SER 54 7.292 -10.244 -0.410 319 HA SER 54 HA SER 54 8.779 -7.994 0.733 320 HB2 SER 54 HB2 SER 54 10.156 -9.554 -0.514 321 HB3 SER 54 HB1 SER 54 9.080 -9.446 -1.906 322 HG SER 54 HG SER 54 10.747 -7.412 -0.834 323 H MET 55 HN MET 55 8.594 -5.921 -0.092 324 HA MET 55 HA MET 55 6.053 -5.137 -1.045 325 HB2 MET 55 HB2 MET 55 7.471 -3.656 0.298 326 HB3 MET 55 HB1 MET 55 8.661 -3.600 -0.991 327 HG2 MET 55 HG2 MET 55 6.962 -2.532 -2.445 328 HG3 MET 55 HG1 MET 55 5.864 -2.497 -1.064 329 HE1 MET 55 HE1 MET 55 5.587 0.085 -1.539 330 HE2 MET 55 HE2 MET 55 6.807 0.125 -2.809 331 HE3 MET 55 HE3 MET 55 6.897 1.262 -1.466 332 H ARG 56 HN ARG 56 8.953 -6.098 -2.599 333 HA ARG 56 HA ARG 56 8.444 -4.910 -5.148 334 HB2 ARG 56 HB2 ARG 56 10.697 -5.593 -4.259 335 HB3 ARG 56 HB1 ARG 56 10.222 -7.267 -4.494 336 HG2 ARG 56 HG2 ARG 56 10.270 -7.092 -6.808 337 HG3 ARG 56 HG1 ARG 56 10.149 -5.332 -6.771 338 HD2 ARG 56 HD2 ARG 56 12.390 -5.172 -5.867 339 HD3 ARG 56 HD1 ARG 56 12.516 -6.925 -5.803 340 HE ARG 56 HE ARG 56 12.015 -6.469 -8.414 341 HH11 ARG 56 HH11 ARG 56 15.574 -4.802 -7.409 342 HH12 ARG 56 HH12 ARG 56 14.307 -5.053 -6.150 343 HH21 ARG 56 HH21 ARG 56 15.153 -5.380 -9.593 344 HH22 ARG 56 HH22 ARG 56 13.579 -6.134 -10.048 345 H GLN 57 HN GLN 57 7.139 -7.551 -3.498 346 HA GLN 57 HA GLN 57 6.501 -9.091 -5.881 347 HB2 GLN 57 HB2 GLN 57 7.177 -10.242 -3.816 348 HB3 GLN 57 HB1 GLN 57 5.799 -9.551 -2.977 349 HG2 GLN 57 HG2 GLN 57 4.324 -10.745 -4.615 350 HG3 GLN 57 HG1 GLN 57 5.768 -11.574 -5.196 351 HE21 GLN 57 HE21 GLN 57 3.357 -12.623 -3.892 352 HE22 GLN 57 HE22 GLN 57 3.924 -13.481 -2.498 353 H ILE 58 HN ILE 58 4.944 -6.843 -3.692 354 HA ILE 58 HA ILE 58 2.363 -7.394 -4.988 355 HB ILE 58 HB ILE 58 1.382 -6.020 -3.127 356 HG12 ILE 58 HG12 ILE 58 4.152 -6.354 -1.946 357 HG13 ILE 58 HG11 ILE 58 3.436 -4.832 -2.460 358 HG21 ILE 58 HG21 ILE 58 1.250 -8.431 -3.122 359 HG22 ILE 58 HG22 ILE 58 1.527 -7.847 -1.482 360 HG23 ILE 58 HG23 ILE 58 2.857 -8.547 -2.406 361 HD11 ILE 58 HD11 ILE 58 2.713 -6.548 -0.120 362 HD12 ILE 58 HD12 ILE 58 1.602 -5.337 -0.756 363 HD13 ILE 58 HD13 ILE 58 3.185 -4.850 -0.149 364 H ARG 59 HN ARG 59 0.943 -5.500 -5.352 365 HA ARG 59 HA ARG 59 2.412 -3.042 -6.002 366 HB2 ARG 59 HB2 ARG 59 0.616 -4.595 -7.875 367 HB3 ARG 59 HB1 ARG 59 1.062 -2.917 -8.147 368 HG2 ARG 59 HG2 ARG 59 2.955 -5.257 -8.010 369 HG3 ARG 59 HG1 ARG 59 2.443 -4.402 -9.467 370 HD2 ARG 59 HD2 ARG 59 3.439 -2.334 -8.565 371 HD3 ARG 59 HD1 ARG 59 4.016 -3.246 -7.171 372 HE ARG 59 HE ARG 59 5.032 -3.371 -9.900 373 HH11 ARG 59 HH11 ARG 59 6.727 -5.397 -6.827 374 HH12 ARG 59 HH12 ARG 59 5.130 -4.586 -6.585 375 HH21 ARG 59 HH21 ARG 59 7.052 -4.359 -10.214 376 HH22 ARG 59 HH22 ARG 59 7.827 -5.220 -8.834 377 H PHE 60 HN PHE 60 1.360 -1.247 -5.395 378 HA PHE 60 HA PHE 60 -1.384 -1.552 -4.404 379 HB2 PHE 60 HB2 PHE 60 0.901 0.230 -3.694 380 HB3 PHE 60 HB1 PHE 60 -0.736 0.820 -3.432 381 HD1 PHE 60 HD1 PHE 60 1.386 -2.166 -2.726 382 HD2 PHE 60 HD2 PHE 60 -1.757 0.386 -1.426 383 HE1 PHE 60 HE1 PHE 60 1.298 -3.366 -0.577 384 HE2 PHE 60 HE2 PHE 60 -1.852 -0.809 0.719 385 HZ PHE 60 HZ PHE 60 -0.322 -2.689 1.147 386 H ARG 61 HN ARG 61 -3.043 -0.301 -5.133 387 HA ARG 61 HA ARG 61 -2.423 1.676 -7.224 388 HB2 ARG 61 HB2 ARG 61 -4.453 -0.538 -7.302 389 HB3 ARG 61 HB1 ARG 61 -4.643 0.908 -8.282 390 HG2 ARG 61 HG2 ARG 61 -2.369 0.432 -9.235 391 HG3 ARG 61 HG1 ARG 61 -2.435 -1.126 -8.406 392 HD2 ARG 61 HD2 ARG 61 -4.543 -1.624 -9.607 393 HD3 ARG 61 HD1 ARG 61 -4.361 -0.111 -10.494 394 HE ARG 61 HE ARG 61 -2.799 -2.544 -10.828 395 HH11 ARG 61 HH11 ARG 61 -2.273 0.742 -13.132 396 HH12 ARG 61 HH12 ARG 61 -3.365 0.822 -11.696 397 HH21 ARG 61 HH21 ARG 61 -1.459 -2.690 -12.666 398 HH22 ARG 61 HH22 ARG 61 -1.228 -1.223 -13.688 399 H PHE 62 HN PHE 62 -3.711 3.445 -7.347 400 HA PHE 62 HA PHE 62 -5.803 3.778 -5.308 401 HB2 PHE 62 HB2 PHE 62 -4.003 4.974 -4.346 402 HB3 PHE 62 HB1 PHE 62 -3.466 5.590 -5.904 403 HD1 PHE 62 HD1 PHE 62 -6.185 5.838 -3.400 404 HD2 PHE 62 HD2 PHE 62 -4.192 7.665 -6.679 405 HE1 PHE 62 HE1 PHE 62 -7.455 7.909 -3.015 406 HE2 PHE 62 HE2 PHE 62 -5.454 9.733 -6.297 407 HZ PHE 62 HZ PHE 62 -7.088 9.860 -4.466 408 H ASP 63 HN ASP 63 -7.649 4.143 -6.335 409 HA ASP 63 HA ASP 63 -9.187 4.788 -7.884 410 HB2 ASP 63 HB2 ASP 63 -8.244 7.018 -7.015 411 HB3 ASP 63 HB1 ASP 63 -7.373 7.103 -8.544 412 H GLY 64 HN GLY 64 -6.917 3.082 -8.741 413 HA2 GLY 64 HA2 GLY 64 -6.974 1.962 -10.884 414 HA3 GLY 64 HA1 GLY 64 -7.212 3.528 -11.640 415 H GLN 65 HN GLN 65 -5.235 5.000 -10.375 416 HA GLN 65 HA GLN 65 -2.952 4.190 -11.903 417 HB2 GLN 65 HB2 GLN 65 -3.354 6.461 -9.950 418 HB3 GLN 65 HB1 GLN 65 -1.917 6.245 -10.941 419 HG2 GLN 65 HG2 GLN 65 -4.717 6.768 -11.909 420 HG3 GLN 65 HG1 GLN 65 -3.353 7.882 -11.949 421 HE21 GLN 65 HE21 GLN 65 -1.615 7.433 -13.379 422 HE22 GLN 65 HE22 GLN 65 -1.868 6.462 -14.788 423 HA PRO 66 HA PRO 66 -0.731 2.135 -8.644 424 HB2 PRO 66 HB2 PRO 66 1.837 2.772 -9.761 425 HB3 PRO 66 HB1 PRO 66 0.924 1.270 -9.929 426 HG2 PRO 66 HG2 PRO 66 1.437 2.993 -12.004 427 HG3 PRO 66 HG1 PRO 66 0.093 1.837 -11.959 428 HD2 PRO 66 HD2 PRO 66 0.075 4.771 -11.399 429 HD3 PRO 66 HD1 PRO 66 -1.128 3.774 -12.243 430 H ILE 67 HN ILE 67 0.205 2.607 -6.703 431 HA ILE 67 HA ILE 67 0.682 5.404 -6.109 432 HB ILE 67 HB ILE 67 0.851 3.016 -4.261 433 HG12 ILE 67 HG12 ILE 67 -1.436 4.920 -4.813 434 HG13 ILE 67 HG11 ILE 67 -1.387 3.207 -5.217 435 HG21 ILE 67 HG21 ILE 67 0.587 5.960 -3.654 436 HG22 ILE 67 HG22 ILE 67 2.047 4.994 -3.448 437 HG23 ILE 67 HG23 ILE 67 0.620 4.655 -2.469 438 HD11 ILE 67 HD11 ILE 67 -1.440 4.408 -2.458 439 HD12 ILE 67 HD12 ILE 67 -1.273 2.687 -2.804 440 HD13 ILE 67 HD13 ILE 67 -2.743 3.541 -3.267 441 H ASN 68 HN ASN 68 2.621 6.330 -5.577 442 HA ASN 68 HA ASN 68 5.005 4.702 -6.126 443 HB2 ASN 68 HB2 ASN 68 4.370 7.046 -7.231 444 HB3 ASN 68 HB1 ASN 68 5.154 7.664 -5.780 445 HD21 ASN 68 HD21 ASN 68 5.629 6.754 -8.908 446 HD22 ASN 68 HD22 ASN 68 7.338 6.488 -8.868 447 H GLU 69 HN GLU 69 6.983 5.497 -4.825 448 HA GLU 69 HA GLU 69 6.415 5.018 -2.059 449 HB2 GLU 69 HB2 GLU 69 9.019 5.772 -3.398 450 HB3 GLU 69 HB1 GLU 69 8.845 5.125 -1.773 451 HG2 GLU 69 HG2 GLU 69 8.166 3.017 -2.578 452 HG3 GLU 69 HG1 GLU 69 7.923 3.636 -4.209 453 H THR 70 HN THR 70 7.046 7.796 -4.039 454 HA THR 70 HA THR 70 7.372 9.532 -1.714 455 HB THR 70 HB THR 70 7.526 11.262 -3.719 456 HG1 THR 70 HG1 THR 70 7.237 10.123 -5.514 457 HG21 THR 70 HG21 THR 70 9.336 10.791 -2.165 458 HG22 THR 70 HG22 THR 70 9.954 10.839 -3.817 459 HG23 THR 70 HG23 THR 70 9.702 9.289 -3.016 460 H ASP 71 HN ASP 71 4.861 8.362 -1.901 461 HA ASP 71 HA ASP 71 3.175 10.621 -2.751 462 HB2 ASP 71 HB2 ASP 71 2.793 7.681 -3.015 463 HB3 ASP 71 HB1 ASP 71 1.368 8.652 -2.658 464 H THR 72 HN THR 72 1.466 11.218 -1.429 465 HA THR 72 HA THR 72 1.348 10.025 1.242 466 HB THR 72 HB THR 72 0.948 12.601 1.902 467 HG1 THR 72 HG1 THR 72 2.988 13.514 0.676 468 HG21 THR 72 HG21 THR 72 3.672 11.319 1.683 469 HG22 THR 72 HG22 THR 72 2.512 11.048 2.986 470 HG23 THR 72 HG23 THR 72 3.228 12.644 2.760 471 HA PRO 73 HA PRO 73 -3.048 10.173 0.794 472 HB2 PRO 73 HB2 PRO 73 -3.176 11.541 3.434 473 HB3 PRO 73 HB1 PRO 73 -3.972 10.055 2.895 474 HG2 PRO 73 HG2 PRO 73 -1.897 9.938 4.552 475 HG3 PRO 73 HG1 PRO 73 -2.112 8.742 3.259 476 HD2 PRO 73 HD2 PRO 73 -0.221 11.041 3.400 477 HD3 PRO 73 HD1 PRO 73 0.006 9.428 2.693 478 H ALA 74 HN ALA 74 -1.530 13.088 2.111 479 HA ALA 74 HA ALA 74 -3.650 14.829 1.350 480 HB1 ALA 74 HB1 ALA 74 -2.158 16.631 1.971 481 HB2 ALA 74 HB2 ALA 74 -0.794 15.516 2.011 482 HB3 ALA 74 HB3 ALA 74 -2.100 15.350 3.181 483 H GLN 75 HN GLN 75 -0.706 13.729 -0.193 484 HA GLN 75 HA GLN 75 -0.654 15.693 -2.251 485 HB2 GLN 75 HB2 GLN 75 1.367 14.507 -1.693 486 HB3 GLN 75 HB1 GLN 75 0.617 12.958 -2.052 487 HG2 GLN 75 HG2 GLN 75 2.106 13.599 -3.837 488 HG3 GLN 75 HG1 GLN 75 0.439 13.600 -4.409 489 HE21 GLN 75 HE21 GLN 75 0.720 15.020 -6.063 490 HE22 GLN 75 HE22 GLN 75 1.110 16.690 -5.835 491 H LEU 76 HN LEU 76 -1.855 12.354 -2.118 492 HA LEU 76 HA LEU 76 -2.834 12.484 -4.828 493 HB2 LEU 76 HB2 LEU 76 -3.022 10.417 -2.654 494 HB3 LEU 76 HB1 LEU 76 -3.859 10.235 -4.182 495 HG LEU 76 HG LEU 76 -0.869 10.547 -3.913 496 HD11 LEU 76 HD11 LEU 76 -2.508 8.057 -4.371 497 HD12 LEU 76 HD12 LEU 76 -1.640 8.463 -2.891 498 HD13 LEU 76 HD13 LEU 76 -0.747 8.161 -4.381 499 HD21 LEU 76 HD21 LEU 76 -1.677 11.293 -6.062 500 HD22 LEU 76 HD22 LEU 76 -2.643 9.829 -6.245 501 HD23 LEU 76 HD23 LEU 76 -0.882 9.729 -6.252 502 H GLU 77 HN GLU 77 -3.926 14.003 -2.240 503 HA GLU 77 HA GLU 77 -5.908 14.841 -1.510 504 HB2 GLU 77 HB2 GLU 77 -6.643 14.192 -4.363 505 HB3 GLU 77 HB1 GLU 77 -7.712 15.054 -3.266 506 HG2 GLU 77 HG2 GLU 77 -5.847 16.732 -2.976 507 HG3 GLU 77 HG1 GLU 77 -5.054 15.937 -4.338 508 H MET 78 HN MET 78 -5.449 12.214 -0.790 509 HA MET 78 HA MET 78 -7.753 10.584 -1.301 510 HB2 MET 78 HB2 MET 78 -5.673 10.287 0.875 511 HB3 MET 78 HB1 MET 78 -6.793 9.049 0.323 512 HG2 MET 78 HG2 MET 78 -5.711 8.991 -1.840 513 HG3 MET 78 HG1 MET 78 -4.631 10.298 -1.359 514 HE1 MET 78 HE1 MET 78 -5.285 6.523 -1.420 515 HE2 MET 78 HE2 MET 78 -5.916 6.894 0.185 516 HE3 MET 78 HE3 MET 78 -4.453 5.920 0.016 517 H GLU 79 HN GLU 79 -9.370 10.020 0.208 518 HA GLU 79 HA GLU 79 -9.693 11.944 2.413 519 HB2 GLU 79 HB2 GLU 79 -11.297 11.760 0.091 520 HB3 GLU 79 HB1 GLU 79 -12.250 11.091 1.409 521 HG2 GLU 79 HG2 GLU 79 -11.047 13.841 1.217 522 HG3 GLU 79 HG1 GLU 79 -12.755 13.402 1.262 523 H ASP 80 HN ASP 80 -11.724 11.106 3.769 524 HA ASP 80 HA ASP 80 -10.865 8.707 4.992 525 HB2 ASP 80 HB2 ASP 80 -12.401 10.785 5.789 526 HB3 ASP 80 HB1 ASP 80 -13.656 9.607 5.429 527 H GLU 81 HN GLU 81 -11.595 6.655 4.845 528 HA GLU 81 HA GLU 81 -12.734 4.814 4.160 529 HB2 GLU 81 HB2 GLU 81 -14.644 6.782 2.899 530 HB3 GLU 81 HB1 GLU 81 -14.863 5.036 2.872 531 HG2 GLU 81 HG2 GLU 81 -14.652 6.684 5.378 532 HG3 GLU 81 HG1 GLU 81 -16.170 6.202 4.621 533 H ASP 82 HN ASP 82 -10.787 6.571 2.451 534 HA ASP 82 HA ASP 82 -11.328 5.899 -0.252 535 HB2 ASP 82 HB2 ASP 82 -9.480 7.494 0.978 536 HB3 ASP 82 HB1 ASP 82 -8.485 6.122 0.499 537 H THR 83 HN THR 83 -11.107 4.016 -1.297 538 HA THR 83 HA THR 83 -9.988 1.759 0.182 539 HB THR 83 HB THR 83 -11.463 1.635 -2.444 540 HG1 THR 83 HG1 THR 83 -12.465 2.535 -0.209 541 HG21 THR 83 HG21 THR 83 -11.960 -0.647 -1.748 542 HG22 THR 83 HG22 THR 83 -11.095 -0.392 -0.236 543 HG23 THR 83 HG23 THR 83 -10.218 -0.379 -1.764 544 H ILE 84 HN ILE 84 -7.973 1.213 -0.147 545 HA ILE 84 HA ILE 84 -6.638 1.892 -2.658 546 HB ILE 84 HB ILE 84 -5.438 0.671 -0.165 547 HG12 ILE 84 HG12 ILE 84 -5.469 3.590 -0.964 548 HG13 ILE 84 HG11 ILE 84 -6.530 2.891 0.254 549 HG21 ILE 84 HG21 ILE 84 -3.331 1.623 -1.092 550 HG22 ILE 84 HG22 ILE 84 -4.217 2.031 -2.561 551 HG23 ILE 84 HG23 ILE 84 -4.038 0.344 -2.079 552 HD11 ILE 84 HD11 ILE 84 -3.522 2.976 0.383 553 HD12 ILE 84 HD12 ILE 84 -4.596 2.305 1.611 554 HD13 ILE 84 HD13 ILE 84 -4.630 4.033 1.262 555 H ASP 85 HN ASP 85 -6.046 0.384 -4.141 556 HA ASP 85 HA ASP 85 -6.978 -2.354 -3.699 557 HB2 ASP 85 HB2 ASP 85 -6.016 -0.970 -6.209 558 HB3 ASP 85 HB1 ASP 85 -6.616 -2.621 -6.139 559 H VAL 86 HN VAL 86 -5.657 -4.123 -3.741 560 HA VAL 86 HA VAL 86 -2.771 -3.627 -4.058 561 HB VAL 86 HB VAL 86 -3.962 -5.547 -2.048 562 HG11 VAL 86 HG11 VAL 86 -1.662 -5.639 -1.176 563 HG12 VAL 86 HG12 VAL 86 -1.135 -4.595 -2.495 564 HG13 VAL 86 HG13 VAL 86 -1.764 -6.205 -2.844 565 HG21 VAL 86 HG21 VAL 86 -3.227 -3.950 -0.330 566 HG22 VAL 86 HG22 VAL 86 -4.469 -3.269 -1.382 567 HG23 VAL 86 HG23 VAL 86 -2.781 -2.810 -1.602 568 H PHE 87 HN PHE 87 -1.905 -4.830 -5.600 569 HA PHE 87 HA PHE 87 -3.160 -7.416 -6.269 570 HB2 PHE 87 HB2 PHE 87 -1.928 -5.372 -8.131 571 HB3 PHE 87 HB1 PHE 87 -2.350 -7.010 -8.617 572 HD1 PHE 87 HD1 PHE 87 -4.661 -7.686 -8.848 573 HD2 PHE 87 HD2 PHE 87 -3.632 -3.709 -7.729 574 HE1 PHE 87 HE1 PHE 87 -6.951 -6.952 -9.374 575 HE2 PHE 87 HE2 PHE 87 -5.919 -2.968 -8.252 576 HZ PHE 87 HZ PHE 87 -7.582 -4.591 -9.076 577 H GLN 88 HN GLN 88 -1.445 -8.717 -7.693 578 HA GLN 88 HA GLN 88 1.124 -8.542 -6.262 579 HB2 GLN 88 HB2 GLN 88 -0.399 -10.993 -7.152 580 HB3 GLN 88 HB1 GLN 88 1.278 -11.033 -6.625 581 HG2 GLN 88 HG2 GLN 88 0.090 -9.706 -4.568 582 HG3 GLN 88 HG1 GLN 88 -1.185 -10.818 -5.064 583 HE21 GLN 88 HE21 GLN 88 -1.031 -12.036 -3.208 584 HE22 GLN 88 HE22 GLN 88 0.303 -13.087 -2.887 585 H GLN 89 HN GLN 89 3.002 -9.194 -7.421 586 HA GLN 89 HA GLN 89 2.982 -8.313 -10.144 587 HB2 GLN 89 HB2 GLN 89 4.840 -7.895 -8.526 588 HB3 GLN 89 HB1 GLN 89 5.221 -9.611 -8.578 589 HG2 GLN 89 HG2 GLN 89 6.714 -8.307 -9.996 590 HG3 GLN 89 HG1 GLN 89 5.754 -9.447 -10.938 591 HE21 GLN 89 HE21 GLN 89 6.032 -8.270 -12.826 592 HE22 GLN 89 HE22 GLN 89 5.222 -6.769 -13.105 593 H GLN 90 HN GLN 90 3.554 -9.505 -11.994 594 HA GLN 90 HA GLN 90 2.418 -12.051 -12.235 595 HB2 GLN 90 HB2 GLN 90 4.227 -10.412 -13.974 596 HB3 GLN 90 HB1 GLN 90 3.837 -12.065 -14.427 597 HG2 GLN 90 HG2 GLN 90 2.343 -10.604 -15.568 598 HG3 GLN 90 HG1 GLN 90 1.431 -11.467 -14.333 599 HE21 GLN 90 HE21 GLN 90 -0.182 -9.954 -14.210 600 HE22 GLN 90 HE22 GLN 90 0.049 -8.385 -13.525 601 H THR 91 HN THR 91 3.175 -14.050 -11.920 602 HA THR 91 HA THR 91 5.720 -14.413 -10.667 603 HB THR 91 HB THR 91 4.655 -16.934 -11.321 604 HG1 THR 91 HG1 THR 91 2.461 -16.482 -10.378 605 HG21 THR 91 HG21 THR 91 4.310 -15.298 -8.806 606 HG22 THR 91 HG22 THR 91 5.730 -16.264 -9.205 607 HG23 THR 91 HG23 THR 91 4.175 -17.052 -8.939 608 H GLY 92 HN GLY 92 4.373 -15.138 -13.853 609 HA2 GLY 92 HA2 GLY 92 6.861 -15.126 -15.134 610 HA3 GLY 92 HA1 GLY 92 6.455 -16.796 -14.759 611 H ASN 357 HT1 ASN 357 -15.961 -9.920 7.530 612 HA ASN 357 HA ASN 357 -13.492 -10.264 5.961 613 HB2 ASN 357 HB2 ASN 357 -13.644 -7.768 5.605 614 HB3 ASN 357 HB1 ASN 357 -14.797 -8.724 4.683 615 HD21 ASN 357 HD21 ASN 357 -16.091 -6.892 4.433 616 HD22 ASN 357 HD22 ASN 357 -17.085 -6.301 5.720 617 H ASN 358 HN ASN 358 -11.725 -8.994 6.879 618 HA ASN 358 HA ASN 358 -12.216 -8.408 9.705 619 HB2 ASN 358 HB2 ASN 358 -9.911 -9.181 10.207 620 HB3 ASN 358 HB1 ASN 358 -10.936 -10.461 9.556 621 HD21 ASN 358 HD21 ASN 358 -8.096 -8.602 9.128 622 HD22 ASN 358 HD22 ASN 358 -7.571 -9.356 7.663 623 H ARG 359 HN ARG 359 -11.794 -6.438 10.365 624 HA ARG 359 HA ARG 359 -9.837 -4.891 8.829 625 HB2 ARG 359 HB2 ARG 359 -11.156 -2.866 9.075 626 HB3 ARG 359 HB1 ARG 359 -12.083 -4.098 8.242 627 HG2 ARG 359 HG2 ARG 359 -13.343 -4.539 10.268 628 HG3 ARG 359 HG1 ARG 359 -12.387 -3.330 11.134 629 HD2 ARG 359 HD2 ARG 359 -13.116 -1.675 9.374 630 HD3 ARG 359 HD1 ARG 359 -14.253 -2.894 8.810 631 HE ARG 359 HE ARG 359 -14.363 -1.446 11.352 632 HH11 ARG 359 HH11 ARG 359 -15.781 -3.757 9.094 633 HH12 ARG 359 HH12 ARG 359 -17.421 -3.649 9.835 634 HH21 ARG 359 HH21 ARG 359 -16.454 -1.249 12.282 635 HH22 ARG 359 HH22 ARG 359 -17.786 -2.267 11.620 636 H ASP 360 HN ASP 360 -8.248 -4.177 9.992 637 HA ASP 360 HA ASP 360 -8.643 -3.628 12.832 638 HB2 ASP 360 HB2 ASP 360 -6.844 -4.827 13.543 639 HB3 ASP 360 HB1 ASP 360 -7.204 -5.779 12.116 640 HA PRO 361 HA PRO 361 -6.738 0.058 11.321 641 HB2 PRO 361 HB2 PRO 361 -7.207 1.615 13.484 642 HB3 PRO 361 HB1 PRO 361 -8.499 1.084 12.400 643 HG2 PRO 361 HG2 PRO 361 -7.981 0.281 15.148 644 HG3 PRO 361 HG1 PRO 361 -9.417 -0.006 14.151 645 HD2 PRO 361 HD2 PRO 361 -7.200 -1.811 14.728 646 HD3 PRO 361 HD1 PRO 361 -8.772 -2.160 13.983 647 H ILE 362 HN ILE 362 -4.776 0.644 11.160 648 HA ILE 362 HA ILE 362 -2.884 0.345 13.399 649 HB ILE 362 HB ILE 362 -2.052 0.386 10.511 650 HG12 ILE 362 HG12 ILE 362 -2.478 -2.234 11.900 651 HG13 ILE 362 HG11 ILE 362 -3.839 -1.444 11.108 652 HG21 ILE 362 HG21 ILE 362 -0.841 -0.817 12.995 653 HG22 ILE 362 HG22 ILE 362 -0.315 0.653 12.172 654 HG23 ILE 362 HG23 ILE 362 -0.152 -0.912 11.372 655 HD11 ILE 362 HD11 ILE 362 -2.602 -1.414 9.004 656 HD12 ILE 362 HD12 ILE 362 -2.786 -3.054 9.636 657 HD13 ILE 362 HD13 ILE 362 -1.245 -2.211 9.800 658 H VAL 363 HN VAL 363 -1.741 2.099 13.968 659 HA VAL 363 HA VAL 363 -2.037 4.507 12.283 660 HB VAL 363 HB VAL 363 -1.511 4.496 15.255 661 HG11 VAL 363 HG11 VAL 363 -0.871 6.522 14.053 662 HG12 VAL 363 HG12 VAL 363 -2.238 6.819 15.132 663 HG13 VAL 363 HG13 VAL 363 -2.504 6.654 13.395 664 HG21 VAL 363 HG21 VAL 363 -3.863 4.964 15.621 665 HG22 VAL 363 HG22 VAL 363 -3.671 3.411 14.802 666 HG23 VAL 363 HG23 VAL 363 -4.178 4.833 13.889 667 H ILE 364 HN ILE 364 -0.257 5.366 11.538 668 HA ILE 364 HA ILE 364 2.337 4.561 12.676 669 HB ILE 364 HB ILE 364 1.771 5.165 9.759 670 HG12 ILE 364 HG12 ILE 364 2.433 2.476 10.963 671 HG13 ILE 364 HG11 ILE 364 0.776 3.006 10.688 672 HG21 ILE 364 HG21 ILE 364 4.029 4.354 9.364 673 HG22 ILE 364 HG22 ILE 364 4.249 4.061 11.090 674 HG23 ILE 364 HG23 ILE 364 4.056 5.710 10.493 675 HD11 ILE 364 HD11 ILE 364 1.152 3.123 8.322 676 HD12 ILE 364 HD12 ILE 364 1.676 1.544 8.911 677 HD13 ILE 364 HD13 ILE 364 2.870 2.788 8.539 678 H SER 365 HN SER 365 3.690 6.207 13.213 679 HA SER 365 HA SER 365 2.887 8.910 12.353 680 HB2 SER 365 HB2 SER 365 4.304 8.165 14.927 681 HB3 SER 365 HB1 SER 365 3.717 9.765 14.474 682 HG SER 365 HG SER 365 2.228 7.453 15.141 683 H ASP 366 HN ASP 366 4.342 10.025 11.238 684 HA ASP 366 HA ASP 366 7.148 9.144 11.329 685 HB2 ASP 366 HB2 ASP 366 5.790 8.709 9.158 686 HB3 ASP 366 HB1 ASP 366 5.916 10.449 8.912 687 H SER 367 HN SER 367 8.582 10.682 11.850 688 HA SER 367 HA SER 367 7.725 13.493 11.697 689 HB2 SER 367 HB2 SER 367 9.411 12.336 13.921 690 HB3 SER 367 HB1 SER 367 8.678 13.942 13.842 691 HG SER 367 HG SER 367 6.615 12.745 13.732 692 HA PRO 368 HA PRO 368 11.436 13.546 9.146 693 HB2 PRO 368 HB2 PRO 368 10.854 16.456 9.309 694 HB3 PRO 368 HB1 PRO 368 11.130 15.442 7.886 695 HG2 PRO 368 HG2 PRO 368 8.684 16.282 8.473 696 HG3 PRO 368 HG1 PRO 368 8.964 14.645 7.844 697 HD2 PRO 368 HD2 PRO 368 8.377 15.515 10.634 698 HD3 PRO 368 HD1 PRO 368 7.828 14.072 9.759 Start of MODEL 18 1 H ASP 16 HT1 ASP 16 -6.639 15.956 11.783 2 HA ASP 16 HA ASP 16 -5.932 14.333 14.146 3 HB2 ASP 16 HB2 ASP 16 -8.491 14.728 12.630 4 HB3 ASP 16 HB1 ASP 16 -8.154 13.175 13.390 5 H HIS 17 HN HIS 17 -6.879 11.961 13.178 6 HA HIS 17 HA HIS 17 -4.893 11.382 11.122 7 HB2 HIS 17 HB2 HIS 17 -6.484 9.646 13.011 8 HB3 HIS 17 HB1 HIS 17 -5.541 8.969 11.690 9 HD2 HIS 17 HD2 HIS 17 -2.882 8.698 12.147 10 HE1 HIS 17 HE1 HIS 17 -2.850 10.614 15.916 11 HE2 HIS 17 HE2 HIS 17 -1.558 9.109 14.340 12 H ILE 18 HN ILE 18 -5.538 9.703 9.474 13 HA ILE 18 HA ILE 18 -8.284 10.193 8.521 14 HB ILE 18 HB ILE 18 -6.638 11.394 7.140 15 HG12 ILE 18 HG12 ILE 18 -7.752 9.026 5.630 16 HG13 ILE 18 HG11 ILE 18 -8.718 10.405 6.153 17 HG21 ILE 18 HG21 ILE 18 -5.053 10.112 5.731 18 HG22 ILE 18 HG22 ILE 18 -5.449 8.666 6.659 19 HG23 ILE 18 HG23 ILE 18 -4.679 10.040 7.453 20 HD11 ILE 18 HD11 ILE 18 -6.355 10.545 4.292 21 HD12 ILE 18 HD12 ILE 18 -7.398 11.885 4.772 22 HD13 ILE 18 HD13 ILE 18 -8.052 10.562 3.807 23 H ASN 19 HN ASN 19 -9.440 8.404 7.894 24 HA ASN 19 HA ASN 19 -8.154 5.840 8.467 25 HB2 ASN 19 HB2 ASN 19 -11.079 6.501 8.079 26 HB3 ASN 19 HB1 ASN 19 -10.438 4.928 8.541 27 HD21 ASN 19 HD21 ASN 19 -11.141 8.161 9.556 28 HD22 ASN 19 HD22 ASN 19 -10.873 7.901 11.253 29 H LEU 20 HN LEU 20 -7.058 5.235 6.680 30 HA LEU 20 HA LEU 20 -8.442 5.229 4.094 31 HB2 LEU 20 HB2 LEU 20 -5.582 4.519 4.763 32 HB3 LEU 20 HB1 LEU 20 -6.257 4.645 3.150 33 HG LEU 20 HG LEU 20 -5.998 6.939 5.095 34 HD11 LEU 20 HD11 LEU 20 -4.364 6.257 2.659 35 HD12 LEU 20 HD12 LEU 20 -3.825 6.152 4.336 36 HD13 LEU 20 HD13 LEU 20 -4.216 7.721 3.633 37 HD21 LEU 20 HD21 LEU 20 -6.464 8.290 3.041 38 HD22 LEU 20 HD22 LEU 20 -7.832 7.346 3.633 39 HD23 LEU 20 HD23 LEU 20 -6.915 6.789 2.233 40 H LYS 21 HN LYS 21 -9.088 3.328 3.107 41 HA LYS 21 HA LYS 21 -8.679 0.902 4.727 42 HB2 LYS 21 HB2 LYS 21 -10.952 1.665 2.893 43 HB3 LYS 21 HB1 LYS 21 -10.776 0.078 3.630 44 HG2 LYS 21 HG2 LYS 21 -11.353 0.811 5.701 45 HG3 LYS 21 HG1 LYS 21 -10.691 2.426 5.433 46 HD2 LYS 21 HD2 LYS 21 -13.054 2.654 5.551 47 HD3 LYS 21 HD1 LYS 21 -12.602 2.836 3.855 48 HE2 LYS 21 HE2 LYS 21 -13.237 0.518 3.430 49 HE3 LYS 21 HE1 LYS 21 -13.664 0.317 5.128 50 HZ1 LYS 21 HZ1 LYS 21 -15.238 2.276 4.708 51 HZ2 LYS 21 HZ2 LYS 21 -15.673 0.755 4.101 52 HZ3 LYS 21 HZ3 LYS 21 -15.030 1.922 3.064 53 H VAL 22 HN VAL 22 -7.347 -0.507 3.941 54 HA VAL 22 HA VAL 22 -6.935 -0.681 1.033 55 HB VAL 22 HB VAL 22 -5.202 -1.891 3.197 56 HG11 VAL 22 HG11 VAL 22 -4.989 -2.908 0.988 57 HG12 VAL 22 HG12 VAL 22 -3.523 -2.039 1.442 58 HG13 VAL 22 HG13 VAL 22 -4.651 -1.323 0.291 59 HG21 VAL 22 HG21 VAL 22 -3.699 -0.029 2.980 60 HG22 VAL 22 HG22 VAL 22 -5.302 0.580 3.391 61 HG23 VAL 22 HG23 VAL 22 -4.715 0.692 1.734 62 H ALA 23 HN ALA 23 -7.700 -2.457 -0.010 63 HA ALA 23 HA ALA 23 -8.439 -4.767 1.662 64 HB1 ALA 23 HB1 ALA 23 -10.454 -5.080 0.324 65 HB2 ALA 23 HB2 ALA 23 -10.067 -3.633 -0.606 66 HB3 ALA 23 HB3 ALA 23 -10.448 -3.500 1.111 67 H GLY 24 HN GLY 24 -7.978 -6.736 0.896 68 HA2 GLY 24 HA2 GLY 24 -6.408 -6.851 -1.574 69 HA3 GLY 24 HA1 GLY 24 -6.461 -8.085 -0.322 70 H GLN 25 HN GLN 25 -6.684 -9.052 -2.771 71 HA GLN 25 HA GLN 25 -9.449 -9.123 -3.629 72 HB2 GLN 25 HB2 GLN 25 -7.237 -10.893 -4.662 73 HB3 GLN 25 HB1 GLN 25 -8.705 -10.395 -5.489 74 HG2 GLN 25 HG2 GLN 25 -6.332 -8.668 -4.823 75 HG3 GLN 25 HG1 GLN 25 -6.813 -9.237 -6.420 76 HE21 GLN 25 HE21 GLN 25 -6.419 -6.532 -5.346 77 HE22 GLN 25 HE22 GLN 25 -7.907 -5.689 -5.636 78 H ASP 26 HN ASP 26 -9.798 -9.898 -1.276 79 HA ASP 26 HA ASP 26 -10.502 -12.673 -1.400 80 HB2 ASP 26 HB2 ASP 26 -9.282 -13.398 0.605 81 HB3 ASP 26 HB1 ASP 26 -8.174 -12.914 -0.673 82 H GLY 27 HN GLY 27 -10.370 -9.631 0.336 83 HA2 GLY 27 HA2 GLY 27 -12.704 -8.962 1.033 84 HA3 GLY 27 HA1 GLY 27 -12.726 -10.491 1.890 85 H SER 28 HN SER 28 -9.646 -9.550 2.244 86 HA SER 28 HA SER 28 -9.992 -8.740 4.940 87 HB2 SER 28 HB2 SER 28 -7.449 -8.176 4.627 88 HB3 SER 28 HB1 SER 28 -7.982 -9.855 4.565 89 HG SER 28 HG SER 28 -7.655 -9.914 2.436 90 H VAL 29 HN VAL 29 -10.362 -6.750 5.767 91 HA VAL 29 HA VAL 29 -9.720 -4.445 4.025 92 HB VAL 29 HB VAL 29 -12.061 -4.616 5.935 93 HG11 VAL 29 HG11 VAL 29 -12.722 -2.467 4.944 94 HG12 VAL 29 HG12 VAL 29 -11.228 -2.453 4.003 95 HG13 VAL 29 HG13 VAL 29 -11.163 -2.366 5.761 96 HG21 VAL 29 HG21 VAL 29 -13.450 -4.562 3.902 97 HG22 VAL 29 HG22 VAL 29 -12.448 -6.011 3.984 98 HG23 VAL 29 HG23 VAL 29 -11.992 -4.682 2.917 99 H VAL 30 HN VAL 30 -7.904 -3.654 4.901 100 HA VAL 30 HA VAL 30 -7.715 -3.477 7.812 101 HB VAL 30 HB VAL 30 -5.370 -2.827 7.471 102 HG11 VAL 30 HG11 VAL 30 -6.189 -5.282 5.925 103 HG12 VAL 30 HG12 VAL 30 -5.926 -5.182 7.665 104 HG13 VAL 30 HG13 VAL 30 -4.573 -4.958 6.556 105 HG21 VAL 30 HG21 VAL 30 -5.988 -3.144 4.534 106 HG22 VAL 30 HG22 VAL 30 -4.376 -2.953 5.220 107 HG23 VAL 30 HG23 VAL 30 -5.553 -1.647 5.358 108 H GLN 31 HN GLN 31 -7.954 -1.657 8.916 109 HA GLN 31 HA GLN 31 -8.545 0.777 7.387 110 HB2 GLN 31 HB2 GLN 31 -10.245 -0.029 8.986 111 HB3 GLN 31 HB1 GLN 31 -9.088 0.135 10.293 112 HG2 GLN 31 HG2 GLN 31 -9.036 2.516 10.025 113 HG3 GLN 31 HG1 GLN 31 -10.036 2.419 8.577 114 HE21 GLN 31 HE21 GLN 31 -10.505 3.860 11.085 115 HE22 GLN 31 HE22 GLN 31 -12.009 3.261 11.699 116 H PHE 32 HN PHE 32 -6.658 1.734 6.969 117 HA PHE 32 HA PHE 32 -4.578 1.921 8.966 118 HB2 PHE 32 HB2 PHE 32 -4.859 2.592 6.085 119 HB3 PHE 32 HB1 PHE 32 -3.670 3.503 7.010 120 HD1 PHE 32 HD1 PHE 32 -4.513 0.308 5.523 121 HD2 PHE 32 HD2 PHE 32 -1.776 2.346 8.057 122 HE1 PHE 32 HE1 PHE 32 -2.912 -1.542 5.271 123 HE2 PHE 32 HE2 PHE 32 -0.167 0.498 7.811 124 HZ PHE 32 HZ PHE 32 -0.736 -1.448 6.418 125 H LYS 33 HN LYS 33 -5.054 3.260 10.590 126 HA LYS 33 HA LYS 33 -6.271 5.858 9.993 127 HB2 LYS 33 HB2 LYS 33 -7.039 4.279 11.885 128 HB3 LYS 33 HB1 LYS 33 -5.589 4.800 12.726 129 HG2 LYS 33 HG2 LYS 33 -6.346 7.016 12.888 130 HG3 LYS 33 HG1 LYS 33 -7.615 6.748 11.690 131 HD2 LYS 33 HD2 LYS 33 -8.684 5.149 13.267 132 HD3 LYS 33 HD1 LYS 33 -7.471 5.586 14.470 133 HE2 LYS 33 HE2 LYS 33 -8.245 7.863 14.491 134 HE3 LYS 33 HE1 LYS 33 -9.356 7.539 13.161 135 HZ1 LYS 33 HZ1 LYS 33 -10.481 7.565 15.306 136 HZ2 LYS 33 HZ2 LYS 33 -9.498 6.304 15.856 137 HZ3 LYS 33 HZ3 LYS 33 -10.582 6.038 14.584 138 H ILE 34 HN ILE 34 -4.269 6.412 8.866 139 HA ILE 34 HA ILE 34 -2.037 7.098 10.653 140 HB ILE 34 HB ILE 34 -0.656 7.303 8.674 141 HG12 ILE 34 HG12 ILE 34 -3.090 6.526 7.046 142 HG13 ILE 34 HG11 ILE 34 -2.484 8.172 7.181 143 HG21 ILE 34 HG21 ILE 34 -0.639 4.992 7.947 144 HG22 ILE 34 HG22 ILE 34 -2.285 4.768 8.536 145 HG23 ILE 34 HG23 ILE 34 -0.976 5.076 9.677 146 HD11 ILE 34 HD11 ILE 34 -0.377 7.478 6.161 147 HD12 ILE 34 HD12 ILE 34 -1.754 7.134 5.114 148 HD13 ILE 34 HD13 ILE 34 -0.989 5.831 6.025 149 H LYS 35 HN LYS 35 -0.824 9.144 9.500 150 HA LYS 35 HA LYS 35 -2.821 11.271 9.665 151 HB2 LYS 35 HB2 LYS 35 0.206 11.398 9.721 152 HB3 LYS 35 HB1 LYS 35 -0.865 12.786 9.873 153 HG2 LYS 35 HG2 LYS 35 -1.828 11.769 11.909 154 HG3 LYS 35 HG1 LYS 35 -0.643 10.469 11.779 155 HD2 LYS 35 HD2 LYS 35 1.168 12.122 11.963 156 HD3 LYS 35 HD1 LYS 35 -0.036 13.404 12.131 157 HE2 LYS 35 HE2 LYS 35 -0.906 12.251 14.149 158 HE3 LYS 35 HE1 LYS 35 0.399 11.077 14.001 159 HZ1 LYS 35 HZ1 LYS 35 1.977 12.939 14.223 160 HZ2 LYS 35 HZ2 LYS 35 1.006 12.733 15.587 161 HZ3 LYS 35 HZ3 LYS 35 0.680 13.988 14.501 162 H ARG 36 HN ARG 36 -2.896 12.941 8.075 163 HA ARG 36 HA ARG 36 -2.751 11.962 5.421 164 HB2 ARG 36 HB2 ARG 36 -3.153 14.783 6.438 165 HB3 ARG 36 HB1 ARG 36 -3.412 14.264 4.777 166 HG2 ARG 36 HG2 ARG 36 -5.238 12.883 5.400 167 HG3 ARG 36 HG1 ARG 36 -4.870 13.062 7.115 168 HD2 ARG 36 HD2 ARG 36 -6.679 14.494 6.778 169 HD3 ARG 36 HD1 ARG 36 -5.281 15.564 6.743 170 HE ARG 36 HE ARG 36 -5.536 15.788 4.407 171 HH11 ARG 36 HH11 ARG 36 -8.102 13.897 5.930 172 HH12 ARG 36 HH12 ARG 36 -9.234 14.085 4.530 173 HH21 ARG 36 HH21 ARG 36 -6.972 16.071 2.628 174 HH22 ARG 36 HH22 ARG 36 -8.620 15.331 2.721 175 H HIS 37 HN HIS 37 -0.416 13.248 7.438 176 HA HIS 37 HA HIS 37 1.268 14.214 5.241 177 HB2 HIS 37 HB2 HIS 37 2.046 14.393 8.131 178 HB3 HIS 37 HB1 HIS 37 2.464 15.464 6.801 179 HD2 HIS 37 HD2 HIS 37 0.612 17.454 6.225 180 HE1 HIS 37 HE1 HIS 37 -1.846 16.645 9.572 181 HE2 HIS 37 HE2 HIS 37 -1.484 18.164 7.570 182 H THR 38 HN THR 38 0.636 11.336 6.415 183 HA THR 38 HA THR 38 3.391 10.470 6.889 184 HB THR 38 HB THR 38 0.862 8.823 7.053 185 HG1 THR 38 HG1 THR 38 1.645 10.800 8.618 186 HG21 THR 38 HG21 THR 38 2.920 7.509 6.826 187 HG22 THR 38 HG22 THR 38 2.229 7.332 8.441 188 HG23 THR 38 HG23 THR 38 3.627 8.377 8.189 189 HA PRO 39 HA PRO 39 3.879 9.357 2.587 190 HB2 PRO 39 HB2 PRO 39 5.882 7.500 3.757 191 HB3 PRO 39 HB1 PRO 39 6.072 8.692 2.463 192 HG2 PRO 39 HG2 PRO 39 7.063 9.170 4.875 193 HG3 PRO 39 HG1 PRO 39 6.310 10.462 3.919 194 HD2 PRO 39 HD2 PRO 39 5.225 8.976 6.263 195 HD3 PRO 39 HD1 PRO 39 5.027 10.681 5.807 196 H LEU 40 HN LEU 40 2.931 7.853 1.339 197 HA LEU 40 HA LEU 40 1.473 5.723 2.534 198 HB2 LEU 40 HB2 LEU 40 2.046 6.420 -0.341 199 HB3 LEU 40 HB1 LEU 40 1.028 5.072 0.130 200 HG LEU 40 HG LEU 40 0.494 7.964 0.806 201 HD11 LEU 40 HD11 LEU 40 -1.321 7.796 -0.810 202 HD12 LEU 40 HD12 LEU 40 -0.818 6.154 -1.214 203 HD13 LEU 40 HD13 LEU 40 0.243 7.516 -1.574 204 HD21 LEU 40 HD21 LEU 40 -1.123 5.460 1.264 205 HD22 LEU 40 HD22 LEU 40 -1.733 7.102 1.464 206 HD23 LEU 40 HD23 LEU 40 -0.426 6.517 2.492 207 H SER 41 HN SER 41 4.690 5.985 1.574 208 HA SER 41 HA SER 41 5.277 3.421 0.625 209 HB2 SER 41 HB2 SER 41 7.470 4.326 2.167 210 HB3 SER 41 HB1 SER 41 7.246 4.486 0.422 211 HG SER 41 HG SER 41 6.968 6.539 0.718 212 H LYS 42 HN LYS 42 5.287 4.748 3.918 213 HA LYS 42 HA LYS 42 6.067 2.337 5.188 214 HB2 LYS 42 HB2 LYS 42 4.689 4.813 6.238 215 HB3 LYS 42 HB1 LYS 42 5.188 3.478 7.268 216 HG2 LYS 42 HG2 LYS 42 7.520 3.815 6.371 217 HG3 LYS 42 HG1 LYS 42 6.931 5.317 5.660 218 HD2 LYS 42 HD2 LYS 42 6.501 6.276 7.759 219 HD3 LYS 42 HD1 LYS 42 6.572 4.713 8.579 220 HE2 LYS 42 HE2 LYS 42 9.001 4.607 7.903 221 HE3 LYS 42 HE1 LYS 42 8.848 6.289 7.394 222 HZ1 LYS 42 HZ1 LYS 42 9.725 5.814 9.726 223 HZ2 LYS 42 HZ2 LYS 42 8.126 5.449 10.130 224 HZ3 LYS 42 HZ3 LYS 42 8.525 6.996 9.573 225 H LEU 43 HN LEU 43 3.017 3.666 4.188 226 HA LEU 43 HA LEU 43 1.299 1.996 5.684 227 HB2 LEU 43 HB2 LEU 43 0.494 4.029 4.632 228 HB3 LEU 43 HB1 LEU 43 0.903 3.416 3.045 229 HG LEU 43 HG LEU 43 -0.998 1.746 4.550 230 HD11 LEU 43 HD11 LEU 43 -2.887 3.254 4.066 231 HD12 LEU 43 HD12 LEU 43 -1.740 4.517 3.618 232 HD13 LEU 43 HD13 LEU 43 -1.786 3.910 5.275 233 HD21 LEU 43 HD21 LEU 43 -1.006 2.904 1.763 234 HD22 LEU 43 HD22 LEU 43 -2.099 1.664 2.379 235 HD23 LEU 43 HD23 LEU 43 -0.376 1.320 2.216 236 H MET 44 HN MET 44 2.583 1.767 2.380 237 HA MET 44 HA MET 44 1.366 -0.695 1.741 238 HB2 MET 44 HB2 MET 44 3.869 0.601 0.649 239 HB3 MET 44 HB1 MET 44 3.114 -0.823 -0.049 240 HG2 MET 44 HG2 MET 44 1.059 0.494 -0.420 241 HG3 MET 44 HG1 MET 44 1.902 1.920 0.182 242 HE1 MET 44 HE1 MET 44 3.822 3.143 -1.035 243 HE2 MET 44 HE2 MET 44 4.581 2.597 -2.530 244 HE3 MET 44 HE3 MET 44 4.819 1.688 -1.038 245 H LYS 45 HN LYS 45 4.512 0.109 3.121 246 HA LYS 45 HA LYS 45 5.567 -2.500 3.134 247 HB2 LYS 45 HB2 LYS 45 6.192 -0.061 4.791 248 HB3 LYS 45 HB1 LYS 45 7.089 -1.567 4.941 249 HG2 LYS 45 HG2 LYS 45 6.888 -0.750 2.182 250 HG3 LYS 45 HG1 LYS 45 7.593 0.521 3.181 251 HD2 LYS 45 HD2 LYS 45 8.533 -2.317 3.380 252 HD3 LYS 45 HD1 LYS 45 9.161 -1.233 2.138 253 HE2 LYS 45 HE2 LYS 45 9.863 0.342 3.885 254 HE3 LYS 45 HE1 LYS 45 9.247 -0.757 5.116 255 HZ1 LYS 45 HZ1 LYS 45 10.864 -2.381 4.502 256 HZ2 LYS 45 HZ2 LYS 45 11.670 -0.915 4.755 257 HZ3 LYS 45 HZ3 LYS 45 11.382 -1.461 3.181 258 H ALA 46 HN ALA 46 3.522 -0.776 5.421 259 HA ALA 46 HA ALA 46 3.803 -2.541 7.598 260 HB1 ALA 46 HB1 ALA 46 2.812 -0.324 7.834 261 HB2 ALA 46 HB2 ALA 46 1.715 -1.572 8.429 262 HB3 ALA 46 HB3 ALA 46 1.434 -0.826 6.856 263 H TYR 47 HN TYR 47 1.434 -2.449 4.952 264 HA TYR 47 HA TYR 47 -0.003 -4.738 5.803 265 HB2 TYR 47 HB2 TYR 47 -0.866 -3.021 4.188 266 HB3 TYR 47 HB1 TYR 47 0.244 -3.659 2.982 267 HD1 TYR 47 HD1 TYR 47 -0.461 -5.372 1.567 268 HD2 TYR 47 HD2 TYR 47 -2.554 -4.709 5.209 269 HE1 TYR 47 HE1 TYR 47 -2.147 -7.025 0.889 270 HE2 TYR 47 HE2 TYR 47 -4.249 -6.364 4.543 271 HH TYR 47 HH TYR 47 -5.081 -7.529 2.718 272 H CYS 48 HN CYS 48 2.746 -4.224 3.692 273 HA CYS 48 HA CYS 48 2.953 -6.813 2.618 274 HB2 CYS 48 HB2 CYS 48 4.124 -4.675 1.856 275 HB3 CYS 48 HB1 CYS 48 5.269 -4.957 3.165 276 HG CYS 48 HG CYS 48 6.435 -7.151 2.157 277 H GLU 49 HN GLU 49 4.508 -5.317 5.439 278 HA GLU 49 HA GLU 49 6.072 -7.498 6.223 279 HB2 GLU 49 HB2 GLU 49 4.927 -5.137 7.675 280 HB3 GLU 49 HB1 GLU 49 5.757 -6.397 8.575 281 HG2 GLU 49 HG2 GLU 49 6.915 -4.755 6.334 282 HG3 GLU 49 HG1 GLU 49 7.257 -4.570 8.054 283 H ARG 50 HN ARG 50 2.730 -6.665 6.993 284 HA ARG 50 HA ARG 50 2.294 -8.644 8.937 285 HB2 ARG 50 HB2 ARG 50 0.690 -6.932 8.820 286 HB3 ARG 50 HB1 ARG 50 0.462 -7.146 7.090 287 HG2 ARG 50 HG2 ARG 50 -0.630 -9.279 7.476 288 HG3 ARG 50 HG1 ARG 50 -0.373 -9.108 9.212 289 HD2 ARG 50 HD2 ARG 50 -1.922 -7.140 7.549 290 HD3 ARG 50 HD1 ARG 50 -2.663 -8.492 8.403 291 HE ARG 50 HE ARG 50 -1.140 -7.090 10.256 292 HH11 ARG 50 HH11 ARG 50 -3.933 -6.606 8.205 293 HH12 ARG 50 HH12 ARG 50 -4.719 -5.426 9.331 294 HH21 ARG 50 HH21 ARG 50 -3.672 -4.839 11.278 295 HH22 ARG 50 HH22 ARG 50 -2.083 -5.593 11.721 296 H GLN 51 HN GLN 51 1.728 -8.664 5.431 297 HA GLN 51 HA GLN 51 0.721 -11.317 5.372 298 HB2 GLN 51 HB2 GLN 51 1.954 -9.690 3.139 299 HB3 GLN 51 HB1 GLN 51 1.031 -11.172 2.929 300 HG2 GLN 51 HG2 GLN 51 0.081 -8.459 3.757 301 HG3 GLN 51 HG1 GLN 51 -0.478 -9.474 2.430 302 HE21 GLN 51 HE21 GLN 51 -1.782 -11.310 2.940 303 HE22 GLN 51 HE22 GLN 51 -2.701 -11.350 4.402 304 H GLY 52 HN GLY 52 3.899 -9.960 5.371 305 HA2 GLY 52 HA2 GLY 52 5.893 -11.066 5.796 306 HA3 GLY 52 HA1 GLY 52 5.056 -12.602 5.617 307 H LEU 53 HN LEU 53 4.789 -10.125 3.217 308 HA LEU 53 HA LEU 53 6.311 -11.825 1.364 309 HB2 LEU 53 HB2 LEU 53 4.225 -9.723 0.763 310 HB3 LEU 53 HB1 LEU 53 5.042 -10.723 -0.423 311 HG LEU 53 HG LEU 53 3.219 -11.775 1.742 312 HD11 LEU 53 HD11 LEU 53 1.606 -12.140 -0.059 313 HD12 LEU 53 HD12 LEU 53 2.691 -11.341 -1.197 314 HD13 LEU 53 HD13 LEU 53 1.981 -10.429 0.136 315 HD21 LEU 53 HD21 LEU 53 4.890 -13.392 1.034 316 HD22 LEU 53 HD22 LEU 53 4.463 -13.122 -0.655 317 HD23 LEU 53 HD23 LEU 53 3.294 -13.853 0.445 318 H SER 54 HN SER 54 6.877 -10.151 -0.639 319 HA SER 54 HA SER 54 8.630 -8.144 0.602 320 HB2 SER 54 HB2 SER 54 9.784 -9.944 -0.658 321 HB3 SER 54 HB1 SER 54 8.877 -9.505 -2.103 322 HG SER 54 HG SER 54 11.142 -8.439 -1.143 323 H MET 55 HN MET 55 8.600 -6.023 -0.173 324 HA MET 55 HA MET 55 6.157 -5.107 -1.261 325 HB2 MET 55 HB2 MET 55 8.266 -3.920 0.054 326 HB3 MET 55 HB1 MET 55 8.408 -3.256 -1.567 327 HG2 MET 55 HG2 MET 55 5.836 -2.844 -1.286 328 HG3 MET 55 HG1 MET 55 6.230 -2.928 0.429 329 HE1 MET 55 HE1 MET 55 7.446 0.329 -2.559 330 HE2 MET 55 HE2 MET 55 6.166 -0.868 -2.755 331 HE3 MET 55 HE3 MET 55 7.857 -1.360 -2.861 332 H ARG 56 HN ARG 56 8.921 -6.389 -2.701 333 HA ARG 56 HA ARG 56 8.564 -5.064 -5.247 334 HB2 ARG 56 HB2 ARG 56 10.793 -5.819 -4.241 335 HB3 ARG 56 HB1 ARG 56 10.313 -7.452 -4.682 336 HG2 ARG 56 HG2 ARG 56 10.223 -6.833 -7.013 337 HG3 ARG 56 HG1 ARG 56 10.585 -5.152 -6.607 338 HD2 ARG 56 HD2 ARG 56 12.728 -5.992 -5.577 339 HD3 ARG 56 HD1 ARG 56 12.373 -7.556 -6.306 340 HE ARG 56 HE ARG 56 12.389 -6.359 -8.485 341 HH11 ARG 56 HH11 ARG 56 15.282 -4.140 -6.711 342 HH12 ARG 56 HH12 ARG 56 14.105 -5.063 -5.701 343 HH21 ARG 56 HH21 ARG 56 15.148 -4.228 -9.004 344 HH22 ARG 56 HH22 ARG 56 13.852 -5.195 -9.804 345 H GLN 57 HN GLN 57 7.113 -7.613 -3.638 346 HA GLN 57 HA GLN 57 6.560 -9.148 -6.067 347 HB2 GLN 57 HB2 GLN 57 7.210 -10.387 -4.056 348 HB3 GLN 57 HB1 GLN 57 5.851 -9.691 -3.181 349 HG2 GLN 57 HG2 GLN 57 4.328 -10.797 -4.811 350 HG3 GLN 57 HG1 GLN 57 5.737 -11.605 -5.499 351 HE21 GLN 57 HE21 GLN 57 3.373 -12.706 -4.181 352 HE22 GLN 57 HE22 GLN 57 3.970 -13.654 -2.862 353 H ILE 58 HN ILE 58 4.899 -7.206 -3.624 354 HA ILE 58 HA ILE 58 2.380 -7.615 -5.047 355 HB ILE 58 HB ILE 58 1.424 -6.246 -3.106 356 HG12 ILE 58 HG12 ILE 58 4.115 -6.971 -1.921 357 HG13 ILE 58 HG11 ILE 58 3.559 -5.339 -2.287 358 HG21 ILE 58 HG21 ILE 58 0.978 -8.571 -3.273 359 HG22 ILE 58 HG22 ILE 58 1.462 -8.256 -1.606 360 HG23 ILE 58 HG23 ILE 58 2.602 -8.990 -2.732 361 HD11 ILE 58 HD11 ILE 58 2.323 -7.208 -0.272 362 HD12 ILE 58 HD12 ILE 58 1.791 -5.563 -0.626 363 HD13 ILE 58 HD13 ILE 58 3.378 -5.844 0.089 364 H ARG 59 HN ARG 59 0.999 -5.796 -5.524 365 HA ARG 59 HA ARG 59 2.467 -3.286 -6.020 366 HB2 ARG 59 HB2 ARG 59 0.542 -4.672 -7.906 367 HB3 ARG 59 HB1 ARG 59 1.215 -3.070 -8.157 368 HG2 ARG 59 HG2 ARG 59 2.838 -5.601 -7.973 369 HG3 ARG 59 HG1 ARG 59 2.336 -4.824 -9.477 370 HD2 ARG 59 HD2 ARG 59 3.580 -2.818 -8.873 371 HD3 ARG 59 HD1 ARG 59 4.049 -3.554 -7.341 372 HE ARG 59 HE ARG 59 5.106 -4.173 -9.986 373 HH11 ARG 59 HH11 ARG 59 6.443 -5.959 -6.614 374 HH12 ARG 59 HH12 ARG 59 4.949 -4.947 -6.554 375 HH21 ARG 59 HH21 ARG 59 7.019 -5.413 -10.079 376 HH22 ARG 59 HH22 ARG 59 7.600 -6.212 -8.567 377 H PHE 60 HN PHE 60 1.294 -1.416 -5.699 378 HA PHE 60 HA PHE 60 -1.437 -1.772 -4.656 379 HB2 PHE 60 HB2 PHE 60 0.747 0.101 -3.737 380 HB3 PHE 60 HB1 PHE 60 -0.940 0.296 -3.276 381 HD1 PHE 60 HD1 PHE 60 2.015 -1.889 -2.982 382 HD2 PHE 60 HD2 PHE 60 -1.935 -1.068 -1.610 383 HE1 PHE 60 HE1 PHE 60 2.349 -3.433 -1.098 384 HE2 PHE 60 HE2 PHE 60 -1.602 -2.610 0.276 385 HZ PHE 60 HZ PHE 60 0.541 -3.791 0.535 386 H ARG 61 HN ARG 61 -3.005 -0.452 -5.415 387 HA ARG 61 HA ARG 61 -2.201 1.730 -7.216 388 HB2 ARG 61 HB2 ARG 61 -4.121 -0.508 -7.768 389 HB3 ARG 61 HB1 ARG 61 -4.344 1.055 -8.538 390 HG2 ARG 61 HG2 ARG 61 -1.983 0.850 -9.381 391 HG3 ARG 61 HG1 ARG 61 -2.010 -0.816 -8.807 392 HD2 ARG 61 HD2 ARG 61 -3.816 -1.358 -10.281 393 HD3 ARG 61 HD1 ARG 61 -4.020 0.335 -10.731 394 HE ARG 61 HE ARG 61 -1.404 -0.708 -11.314 395 HH11 ARG 61 HH11 ARG 61 -4.238 -0.524 -14.202 396 HH12 ARG 61 HH12 ARG 61 -4.712 -0.427 -12.469 397 HH21 ARG 61 HH21 ARG 61 -0.760 -0.843 -13.512 398 HH22 ARG 61 HH22 ARG 61 -2.033 -0.760 -14.790 399 H PHE 62 HN PHE 62 -3.705 3.423 -7.427 400 HA PHE 62 HA PHE 62 -5.806 3.488 -5.376 401 HB2 PHE 62 HB2 PHE 62 -3.910 4.812 -4.559 402 HB3 PHE 62 HB1 PHE 62 -3.879 5.724 -6.065 403 HD1 PHE 62 HD1 PHE 62 -6.177 4.883 -3.253 404 HD2 PHE 62 HD2 PHE 62 -4.981 7.744 -6.168 405 HE1 PHE 62 HE1 PHE 62 -7.758 6.509 -2.303 406 HE2 PHE 62 HE2 PHE 62 -6.561 9.376 -5.222 407 HZ PHE 62 HZ PHE 62 -7.953 8.757 -3.287 408 H ASP 63 HN ASP 63 -7.322 2.997 -6.948 409 HA ASP 63 HA ASP 63 -8.875 3.388 -8.538 410 HB2 ASP 63 HB2 ASP 63 -9.409 5.328 -7.161 411 HB3 ASP 63 HB1 ASP 63 -8.183 6.283 -7.988 412 H GLY 64 HN GLY 64 -7.327 2.353 -10.010 413 HA2 GLY 64 HA2 GLY 64 -6.753 2.263 -12.260 414 HA3 GLY 64 HA1 GLY 64 -7.004 3.995 -12.370 415 H GLN 65 HN GLN 65 -5.245 5.082 -10.676 416 HA GLN 65 HA GLN 65 -2.741 4.504 -12.013 417 HB2 GLN 65 HB2 GLN 65 -3.626 6.711 -10.164 418 HB3 GLN 65 HB1 GLN 65 -1.973 6.564 -10.748 419 HG2 GLN 65 HG2 GLN 65 -4.418 6.878 -12.474 420 HG3 GLN 65 HG1 GLN 65 -3.267 8.150 -12.070 421 HE21 GLN 65 HE21 GLN 65 -1.230 8.122 -12.984 422 HE22 GLN 65 HE22 GLN 65 -0.850 7.148 -14.364 423 HA PRO 66 HA PRO 66 -0.977 2.271 -8.604 424 HB2 PRO 66 HB2 PRO 66 1.685 2.925 -9.569 425 HB3 PRO 66 HB1 PRO 66 0.836 1.376 -9.634 426 HG2 PRO 66 HG2 PRO 66 1.387 2.834 -11.846 427 HG3 PRO 66 HG1 PRO 66 -0.022 1.764 -11.714 428 HD2 PRO 66 HD2 PRO 66 0.118 4.740 -11.418 429 HD3 PRO 66 HD1 PRO 66 -1.099 3.740 -12.239 430 H ILE 67 HN ILE 67 0.268 2.560 -6.699 431 HA ILE 67 HA ILE 67 0.511 5.363 -5.920 432 HB ILE 67 HB ILE 67 0.674 2.841 -4.260 433 HG12 ILE 67 HG12 ILE 67 -1.500 4.938 -4.456 434 HG13 ILE 67 HG11 ILE 67 -1.570 3.336 -5.185 435 HG21 ILE 67 HG21 ILE 67 0.641 5.727 -3.382 436 HG22 ILE 67 HG22 ILE 67 2.013 4.622 -3.278 437 HG23 ILE 67 HG23 ILE 67 0.566 4.325 -2.314 438 HD11 ILE 67 HD11 ILE 67 -1.558 2.306 -3.007 439 HD12 ILE 67 HD12 ILE 67 -2.847 3.506 -3.092 440 HD13 ILE 67 HD13 ILE 67 -1.352 3.876 -2.233 441 H ASN 68 HN ASN 68 2.402 6.360 -5.527 442 HA ASN 68 HA ASN 68 4.856 4.845 -6.047 443 HB2 ASN 68 HB2 ASN 68 4.475 7.842 -5.817 444 HB3 ASN 68 HB1 ASN 68 5.927 7.017 -6.366 445 HD21 ASN 68 HD21 ASN 68 2.626 7.841 -7.136 446 HD22 ASN 68 HD22 ASN 68 2.750 7.558 -8.847 447 H GLU 69 HN GLU 69 6.718 5.162 -4.659 448 HA GLU 69 HA GLU 69 6.072 4.948 -1.903 449 HB2 GLU 69 HB2 GLU 69 8.680 5.177 -3.388 450 HB3 GLU 69 HB1 GLU 69 8.616 5.086 -1.634 451 HG2 GLU 69 HG2 GLU 69 7.149 2.958 -2.140 452 HG3 GLU 69 HG1 GLU 69 8.029 3.008 -3.669 453 H THR 70 HN THR 70 6.729 7.625 -3.918 454 HA THR 70 HA THR 70 7.455 9.334 -1.663 455 HB THR 70 HB THR 70 7.505 11.040 -3.704 456 HG1 THR 70 HG1 THR 70 7.353 10.075 -5.578 457 HG21 THR 70 HG21 THR 70 9.425 10.477 -2.326 458 HG22 THR 70 HG22 THR 70 9.881 10.442 -4.031 459 HG23 THR 70 HG23 THR 70 9.601 8.935 -3.159 460 H ASP 71 HN ASP 71 4.669 8.175 -2.584 461 HA ASP 71 HA ASP 71 3.208 10.682 -2.856 462 HB2 ASP 71 HB2 ASP 71 2.500 7.802 -3.236 463 HB3 ASP 71 HB1 ASP 71 1.215 8.961 -2.913 464 H THR 72 HN THR 72 1.354 11.114 -1.568 465 HA THR 72 HA THR 72 1.306 9.939 1.111 466 HB THR 72 HB THR 72 0.859 12.555 1.709 467 HG1 THR 72 HG1 THR 72 3.047 12.664 -0.093 468 HG21 THR 72 HG21 THR 72 3.584 11.254 1.630 469 HG22 THR 72 HG22 THR 72 2.377 11.018 2.893 470 HG23 THR 72 HG23 THR 72 3.105 12.608 2.654 471 HA PRO 73 HA PRO 73 -3.108 10.099 0.711 472 HB2 PRO 73 HB2 PRO 73 -3.243 11.629 3.261 473 HB3 PRO 73 HB1 PRO 73 -4.031 10.107 2.817 474 HG2 PRO 73 HG2 PRO 73 -1.964 10.107 4.477 475 HG3 PRO 73 HG1 PRO 73 -2.158 8.833 3.257 476 HD2 PRO 73 HD2 PRO 73 -0.313 11.176 3.262 477 HD3 PRO 73 HD1 PRO 73 -0.039 9.523 2.680 478 H ALA 74 HN ALA 74 -1.692 13.111 1.955 479 HA ALA 74 HA ALA 74 -3.783 14.776 0.969 480 HB1 ALA 74 HB1 ALA 74 -2.364 16.628 1.620 481 HB2 ALA 74 HB2 ALA 74 -0.985 15.543 1.784 482 HB3 ALA 74 HB3 ALA 74 -2.357 15.393 2.880 483 H GLN 75 HN GLN 75 -0.917 13.442 -0.414 484 HA GLN 75 HA GLN 75 -0.647 15.365 -2.530 485 HB2 GLN 75 HB2 GLN 75 1.202 13.907 -1.573 486 HB3 GLN 75 HB1 GLN 75 0.489 12.575 -2.471 487 HG2 GLN 75 HG2 GLN 75 2.273 13.420 -3.768 488 HG3 GLN 75 HG1 GLN 75 0.779 13.930 -4.549 489 HE21 GLN 75 HE21 GLN 75 1.857 15.613 -5.606 490 HE22 GLN 75 HE22 GLN 75 2.347 17.047 -4.776 491 H LEU 76 HN LEU 76 -2.012 12.113 -2.218 492 HA LEU 76 HA LEU 76 -2.865 12.141 -4.997 493 HB2 LEU 76 HB2 LEU 76 -3.165 10.101 -2.797 494 HB3 LEU 76 HB1 LEU 76 -3.848 9.895 -4.397 495 HG LEU 76 HG LEU 76 -0.910 10.124 -3.735 496 HD11 LEU 76 HD11 LEU 76 -2.581 7.798 -4.681 497 HD12 LEU 76 HD12 LEU 76 -1.876 7.992 -3.077 498 HD13 LEU 76 HD13 LEU 76 -0.829 7.792 -4.482 499 HD21 LEU 76 HD21 LEU 76 -1.270 11.123 -5.871 500 HD22 LEU 76 HD22 LEU 76 -2.349 9.818 -6.361 501 HD23 LEU 76 HD23 LEU 76 -0.628 9.503 -6.140 502 H GLU 77 HN GLU 77 -3.952 13.746 -2.518 503 HA GLU 77 HA GLU 77 -5.917 14.622 -1.815 504 HB2 GLU 77 HB2 GLU 77 -6.641 13.894 -4.652 505 HB3 GLU 77 HB1 GLU 77 -7.692 14.838 -3.605 506 HG2 GLU 77 HG2 GLU 77 -4.865 15.651 -4.186 507 HG3 GLU 77 HG1 GLU 77 -6.210 16.110 -5.226 508 H MET 78 HN MET 78 -5.548 12.200 -0.818 509 HA MET 78 HA MET 78 -7.900 10.552 -1.269 510 HB2 MET 78 HB2 MET 78 -5.676 10.160 0.742 511 HB3 MET 78 HB1 MET 78 -6.842 8.960 0.205 512 HG2 MET 78 HG2 MET 78 -5.865 8.860 -1.960 513 HG3 MET 78 HG1 MET 78 -4.849 10.260 -1.625 514 HE1 MET 78 HE1 MET 78 -5.534 6.514 -0.983 515 HE2 MET 78 HE2 MET 78 -5.617 7.106 0.676 516 HE3 MET 78 HE3 MET 78 -4.286 6.065 0.179 517 H GLU 79 HN GLU 79 -9.378 10.032 0.385 518 HA GLU 79 HA GLU 79 -9.381 11.896 2.661 519 HB2 GLU 79 HB2 GLU 79 -11.543 11.371 0.672 520 HB3 GLU 79 HB1 GLU 79 -11.995 11.691 2.341 521 HG2 GLU 79 HG2 GLU 79 -10.379 13.494 0.556 522 HG3 GLU 79 HG1 GLU 79 -12.059 13.721 1.036 523 H ASP 80 HN ASP 80 -11.403 11.124 4.112 524 HA ASP 80 HA ASP 80 -10.564 8.661 5.225 525 HB2 ASP 80 HB2 ASP 80 -11.811 10.706 6.305 526 HB3 ASP 80 HB1 ASP 80 -13.258 9.837 5.810 527 H GLU 81 HN GLU 81 -11.609 6.650 5.274 528 HA GLU 81 HA GLU 81 -12.851 4.895 4.537 529 HB2 GLU 81 HB2 GLU 81 -14.639 7.140 3.647 530 HB3 GLU 81 HB1 GLU 81 -15.016 5.473 3.250 531 HG2 GLU 81 HG2 GLU 81 -14.403 5.988 6.078 532 HG3 GLU 81 HG1 GLU 81 -15.872 6.747 5.464 533 H ASP 82 HN ASP 82 -10.845 6.490 2.807 534 HA ASP 82 HA ASP 82 -11.593 5.985 0.107 535 HB2 ASP 82 HB2 ASP 82 -9.556 7.398 1.342 536 HB3 ASP 82 HB1 ASP 82 -8.712 6.050 0.583 537 H THR 83 HN THR 83 -10.445 4.476 -1.345 538 HA THR 83 HA THR 83 -9.822 1.957 0.055 539 HB THR 83 HB THR 83 -11.216 2.226 -2.615 540 HG1 THR 83 HG1 THR 83 -12.234 2.625 -0.278 541 HG21 THR 83 HG21 THR 83 -11.600 -0.170 -2.418 542 HG22 THR 83 HG22 THR 83 -10.729 -0.205 -0.885 543 HG23 THR 83 HG23 THR 83 -9.871 0.175 -2.378 544 H ILE 84 HN ILE 84 -8.031 0.905 -0.492 545 HA ILE 84 HA ILE 84 -6.460 1.899 -2.778 546 HB ILE 84 HB ILE 84 -5.510 0.756 -0.138 547 HG12 ILE 84 HG12 ILE 84 -4.977 3.437 -1.430 548 HG13 ILE 84 HG11 ILE 84 -6.201 3.156 -0.197 549 HG21 ILE 84 HG21 ILE 84 -3.225 1.093 -1.006 550 HG22 ILE 84 HG22 ILE 84 -3.908 1.473 -2.587 551 HG23 ILE 84 HG23 ILE 84 -4.118 -0.138 -1.902 552 HD11 ILE 84 HD11 ILE 84 -3.258 2.668 0.200 553 HD12 ILE 84 HD12 ILE 84 -4.529 2.619 1.423 554 HD13 ILE 84 HD13 ILE 84 -4.101 4.145 0.659 555 H ASP 85 HN ASP 85 -5.786 0.437 -4.261 556 HA ASP 85 HA ASP 85 -6.918 -2.238 -4.105 557 HB2 ASP 85 HB2 ASP 85 -5.481 -0.798 -6.340 558 HB3 ASP 85 HB1 ASP 85 -6.190 -2.402 -6.477 559 H VAL 86 HN VAL 86 -5.802 -4.108 -4.006 560 HA VAL 86 HA VAL 86 -2.858 -3.956 -3.857 561 HB VAL 86 HB VAL 86 -4.598 -5.929 -2.363 562 HG11 VAL 86 HG11 VAL 86 -2.547 -6.458 -1.157 563 HG12 VAL 86 HG12 VAL 86 -1.663 -5.281 -2.128 564 HG13 VAL 86 HG13 VAL 86 -2.344 -6.719 -2.890 565 HG21 VAL 86 HG21 VAL 86 -4.039 -4.670 -0.341 566 HG22 VAL 86 HG22 VAL 86 -4.969 -3.695 -1.478 567 HG23 VAL 86 HG23 VAL 86 -3.228 -3.453 -1.327 568 H PHE 87 HN PHE 87 -1.828 -5.158 -5.319 569 HA PHE 87 HA PHE 87 -3.162 -7.540 -6.412 570 HB2 PHE 87 HB2 PHE 87 -1.841 -5.330 -7.998 571 HB3 PHE 87 HB1 PHE 87 -2.185 -6.920 -8.668 572 HD1 PHE 87 HD1 PHE 87 -4.634 -7.709 -8.582 573 HD2 PHE 87 HD2 PHE 87 -3.437 -3.656 -8.085 574 HE1 PHE 87 HE1 PHE 87 -6.905 -6.969 -9.175 575 HE2 PHE 87 HE2 PHE 87 -5.705 -2.909 -8.676 576 HZ PHE 87 HZ PHE 87 -7.444 -4.567 -9.222 577 H GLN 88 HN GLN 88 -1.522 -8.878 -7.695 578 HA GLN 88 HA GLN 88 1.091 -8.776 -6.340 579 HB2 GLN 88 HB2 GLN 88 -0.618 -11.138 -7.095 580 HB3 GLN 88 HB1 GLN 88 1.108 -11.303 -6.811 581 HG2 GLN 88 HG2 GLN 88 0.461 -10.055 -4.561 582 HG3 GLN 88 HG1 GLN 88 -1.096 -10.806 -4.902 583 HE21 GLN 88 HE21 GLN 88 -0.984 -12.212 -3.188 584 HE22 GLN 88 HE22 GLN 88 0.108 -13.553 -3.146 585 H GLN 89 HN GLN 89 2.917 -9.185 -7.559 586 HA GLN 89 HA GLN 89 2.691 -8.612 -10.361 587 HB2 GLN 89 HB2 GLN 89 4.564 -7.838 -8.836 588 HB3 GLN 89 HB1 GLN 89 5.162 -9.493 -8.860 589 HG2 GLN 89 HG2 GLN 89 6.371 -8.122 -10.445 590 HG3 GLN 89 HG1 GLN 89 5.438 -9.363 -11.278 591 HE21 GLN 89 HE21 GLN 89 5.435 -8.214 -13.202 592 HE22 GLN 89 HE22 GLN 89 4.466 -6.795 -13.430 593 H GLN 90 HN GLN 90 3.264 -9.967 -12.085 594 HA GLN 90 HA GLN 90 2.464 -12.662 -11.840 595 HB2 GLN 90 HB2 GLN 90 3.838 -11.135 -14.048 596 HB3 GLN 90 HB1 GLN 90 3.407 -12.832 -14.207 597 HG2 GLN 90 HG2 GLN 90 1.696 -11.577 -15.247 598 HG3 GLN 90 HG1 GLN 90 1.037 -12.184 -13.730 599 HE21 GLN 90 HE21 GLN 90 -0.539 -10.585 -13.695 600 HE22 GLN 90 HE22 GLN 90 -0.177 -8.939 -13.318 601 H THR 91 HN THR 91 3.645 -14.565 -11.986 602 HA THR 91 HA THR 91 6.102 -14.597 -10.593 603 HB THR 91 HB THR 91 5.689 -17.047 -12.011 604 HG1 THR 91 HG1 THR 91 3.523 -17.443 -11.439 605 HG21 THR 91 HG21 THR 91 5.336 -17.934 -9.777 606 HG22 THR 91 HG22 THR 91 5.088 -16.307 -9.144 607 HG23 THR 91 HG23 THR 91 6.671 -16.785 -9.763 608 H GLY 92 HN GLY 92 5.268 -14.879 -14.019 609 HA2 GLY 92 HA2 GLY 92 7.644 -13.883 -15.014 610 HA3 GLY 92 HA1 GLY 92 7.866 -15.624 -14.895 611 H ASN 357 HT1 ASN 357 -15.845 -11.035 6.161 612 HA ASN 357 HA ASN 357 -13.329 -10.015 5.015 613 HB2 ASN 357 HB2 ASN 357 -14.456 -7.848 4.976 614 HB3 ASN 357 HB1 ASN 357 -15.350 -9.021 4.024 615 HD21 ASN 357 HD21 ASN 357 -16.219 -6.513 5.249 616 HD22 ASN 357 HD22 ASN 357 -17.551 -6.922 6.275 617 H ASN 358 HN ASN 358 -11.970 -9.018 6.384 618 HA ASN 358 HA ASN 358 -12.813 -8.809 9.185 619 HB2 ASN 358 HB2 ASN 358 -10.329 -9.248 9.710 620 HB3 ASN 358 HB1 ASN 358 -11.325 -10.613 9.228 621 HD21 ASN 358 HD21 ASN 358 -9.674 -11.834 8.492 622 HD22 ASN 358 HD22 ASN 358 -8.757 -11.452 7.076 623 H ARG 359 HN ARG 359 -12.491 -6.899 10.209 624 HA ARG 359 HA ARG 359 -10.867 -4.947 8.720 625 HB2 ARG 359 HB2 ARG 359 -12.351 -3.177 9.712 626 HB3 ARG 359 HB1 ARG 359 -13.154 -4.236 8.562 627 HG2 ARG 359 HG2 ARG 359 -13.987 -5.538 10.589 628 HG3 ARG 359 HG1 ARG 359 -13.413 -4.181 11.557 629 HD2 ARG 359 HD2 ARG 359 -14.861 -2.670 10.228 630 HD3 ARG 359 HD1 ARG 359 -15.484 -4.072 9.357 631 HE ARG 359 HE ARG 359 -15.828 -4.549 12.078 632 HH11 ARG 359 HH11 ARG 359 -17.005 -2.342 9.605 633 HH12 ARG 359 HH12 ARG 359 -18.584 -2.067 10.441 634 HH21 ARG 359 HH21 ARG 359 -17.840 -4.275 13.134 635 HH22 ARG 359 HH22 ARG 359 -19.071 -3.192 12.379 636 H ASP 360 HN ASP 360 -9.168 -4.254 9.715 637 HA ASP 360 HA ASP 360 -9.062 -4.183 12.630 638 HB2 ASP 360 HB2 ASP 360 -7.099 -5.342 12.799 639 HB3 ASP 360 HB1 ASP 360 -7.773 -6.128 11.380 640 HA PRO 361 HA PRO 361 -7.415 -0.166 11.575 641 HB2 PRO 361 HB2 PRO 361 -7.724 0.953 14.007 642 HB3 PRO 361 HB1 PRO 361 -9.117 0.492 13.019 643 HG2 PRO 361 HG2 PRO 361 -8.141 -0.718 15.495 644 HG3 PRO 361 HG1 PRO 361 -9.709 -0.909 14.692 645 HD2 PRO 361 HD2 PRO 361 -7.378 -2.660 14.586 646 HD3 PRO 361 HD1 PRO 361 -9.036 -2.956 14.028 647 H ILE 362 HN ILE 362 -5.437 0.483 11.334 648 HA ILE 362 HA ILE 362 -3.389 -0.038 13.391 649 HB ILE 362 HB ILE 362 -2.837 0.253 10.445 650 HG12 ILE 362 HG12 ILE 362 -2.935 -2.423 11.814 651 HG13 ILE 362 HG11 ILE 362 -4.388 -1.730 11.101 652 HG21 ILE 362 HG21 ILE 362 -1.221 -1.029 12.639 653 HG22 ILE 362 HG22 ILE 362 -0.977 0.606 12.019 654 HG23 ILE 362 HG23 ILE 362 -0.727 -0.790 10.966 655 HD11 ILE 362 HD11 ILE 362 -1.818 -2.325 9.662 656 HD12 ILE 362 HD12 ILE 362 -3.255 -1.605 8.938 657 HD13 ILE 362 HD13 ILE 362 -3.310 -3.258 9.557 658 H VAL 363 HN VAL 363 -2.215 1.714 14.092 659 HA VAL 363 HA VAL 363 -2.693 4.224 12.602 660 HB VAL 363 HB VAL 363 -1.982 3.977 15.536 661 HG11 VAL 363 HG11 VAL 363 -1.303 6.082 14.503 662 HG12 VAL 363 HG12 VAL 363 -2.605 6.327 15.666 663 HG13 VAL 363 HG13 VAL 363 -2.953 6.341 13.938 664 HG21 VAL 363 HG21 VAL 363 -4.255 4.416 16.101 665 HG22 VAL 363 HG22 VAL 363 -4.233 3.038 15.000 666 HG23 VAL 363 HG23 VAL 363 -4.691 4.633 14.406 667 H ILE 364 HN ILE 364 -0.983 5.017 11.640 668 HA ILE 364 HA ILE 364 1.693 4.494 12.760 669 HB ILE 364 HB ILE 364 1.014 4.724 9.817 670 HG12 ILE 364 HG12 ILE 364 2.000 2.301 11.330 671 HG13 ILE 364 HG11 ILE 364 0.314 2.568 10.895 672 HG21 ILE 364 HG21 ILE 364 3.650 4.138 11.165 673 HG22 ILE 364 HG22 ILE 364 3.211 5.641 10.353 674 HG23 ILE 364 HG23 ILE 364 3.355 4.147 9.427 675 HD11 ILE 364 HD11 ILE 364 1.455 1.043 9.358 676 HD12 ILE 364 HD12 ILE 364 2.598 2.321 8.945 677 HD13 ILE 364 HD13 ILE 364 0.889 2.501 8.542 678 H SER 365 HN SER 365 2.777 6.293 13.261 679 HA SER 365 HA SER 365 2.036 8.782 11.863 680 HB2 SER 365 HB2 SER 365 2.841 8.507 14.766 681 HB3 SER 365 HB1 SER 365 2.444 10.013 13.937 682 HG SER 365 HG SER 365 0.639 7.844 14.040 683 H ASP 366 HN ASP 366 3.688 9.817 10.886 684 HA ASP 366 HA ASP 366 6.421 9.048 11.691 685 HB2 ASP 366 HB2 ASP 366 5.635 8.179 9.409 686 HB3 ASP 366 HB1 ASP 366 5.691 9.858 8.876 687 H SER 367 HN SER 367 7.739 10.664 12.221 688 HA SER 367 HA SER 367 6.976 13.386 11.427 689 HB2 SER 367 HB2 SER 367 8.161 12.678 14.112 690 HB3 SER 367 HB1 SER 367 7.451 14.215 13.610 691 HG SER 367 HG SER 367 5.610 12.404 13.197 692 HA PRO 368 HA PRO 368 11.105 13.522 9.839 693 HB2 PRO 368 HB2 PRO 368 11.372 16.253 9.736 694 HB3 PRO 368 HB1 PRO 368 10.517 15.295 8.524 695 HG2 PRO 368 HG2 PRO 368 9.408 16.874 10.786 696 HG3 PRO 368 HG1 PRO 368 8.792 16.687 9.131 697 HD2 PRO 368 HD2 PRO 368 7.726 15.360 11.223 698 HD3 PRO 368 HD1 PRO 368 7.793 14.666 9.589 Start of MODEL 19 1 H ASP 16 HT1 ASP 16 -6.576 15.970 10.848 2 HA ASP 16 HA ASP 16 -5.813 14.694 13.410 3 HB2 ASP 16 HB2 ASP 16 -8.415 14.819 11.888 4 HB3 ASP 16 HB1 ASP 16 -8.071 13.513 13.015 5 H HIS 17 HN HIS 17 -6.653 12.228 12.973 6 HA HIS 17 HA HIS 17 -4.860 11.253 10.931 7 HB2 HIS 17 HB2 HIS 17 -6.527 9.961 13.074 8 HB3 HIS 17 HB1 HIS 17 -5.797 8.990 11.803 9 HD2 HIS 17 HD2 HIS 17 -3.221 8.307 12.208 10 HE1 HIS 17 HE1 HIS 17 -2.529 10.870 15.503 11 HE2 HIS 17 HE2 HIS 17 -1.680 8.855 14.223 12 H ILE 18 HN ILE 18 -5.556 9.635 9.343 13 HA ILE 18 HA ILE 18 -8.312 10.131 8.418 14 HB ILE 18 HB ILE 18 -6.646 11.182 6.945 15 HG12 ILE 18 HG12 ILE 18 -7.864 8.765 5.604 16 HG13 ILE 18 HG11 ILE 18 -8.777 10.202 6.050 17 HG21 ILE 18 HG21 ILE 18 -5.109 9.786 5.618 18 HG22 ILE 18 HG22 ILE 18 -5.576 8.386 6.584 19 HG23 ILE 18 HG23 ILE 18 -4.745 9.745 7.342 20 HD11 ILE 18 HD11 ILE 18 -6.444 10.145 4.151 21 HD12 ILE 18 HD12 ILE 18 -7.430 11.550 4.559 22 HD13 ILE 18 HD13 ILE 18 -8.146 10.193 3.690 23 H ASN 19 HN ASN 19 -9.484 8.377 7.604 24 HA ASN 19 HA ASN 19 -8.378 5.755 8.348 25 HB2 ASN 19 HB2 ASN 19 -11.269 6.517 7.878 26 HB3 ASN 19 HB1 ASN 19 -10.678 4.981 8.504 27 HD21 ASN 19 HD21 ASN 19 -11.305 8.316 9.185 28 HD22 ASN 19 HD22 ASN 19 -11.095 8.217 10.905 29 H LEU 20 HN LEU 20 -7.441 4.825 6.654 30 HA LEU 20 HA LEU 20 -8.776 4.974 4.032 31 HB2 LEU 20 HB2 LEU 20 -5.944 4.151 4.704 32 HB3 LEU 20 HB1 LEU 20 -6.618 4.295 3.090 33 HG LEU 20 HG LEU 20 -6.378 6.615 5.005 34 HD11 LEU 20 HD11 LEU 20 -4.515 5.786 2.785 35 HD12 LEU 20 HD12 LEU 20 -4.158 5.763 4.511 36 HD13 LEU 20 HD13 LEU 20 -4.430 7.299 3.688 37 HD21 LEU 20 HD21 LEU 20 -6.605 7.917 2.889 38 HD22 LEU 20 HD22 LEU 20 -8.042 6.998 3.336 39 HD23 LEU 20 HD23 LEU 20 -6.979 6.405 2.060 40 H LYS 21 HN LYS 21 -9.224 3.072 2.872 41 HA LYS 21 HA LYS 21 -9.270 0.653 4.543 42 HB2 LYS 21 HB2 LYS 21 -10.927 1.430 2.143 43 HB3 LYS 21 HB1 LYS 21 -11.017 -0.134 2.938 44 HG2 LYS 21 HG2 LYS 21 -11.856 0.860 4.943 45 HG3 LYS 21 HG1 LYS 21 -11.566 2.485 4.317 46 HD2 LYS 21 HD2 LYS 21 -13.235 2.142 2.584 47 HD3 LYS 21 HD1 LYS 21 -13.477 0.479 3.122 48 HE2 LYS 21 HE2 LYS 21 -14.347 1.241 5.236 49 HE3 LYS 21 HE1 LYS 21 -13.980 2.916 4.825 50 HZ1 LYS 21 HZ1 LYS 21 -16.264 2.624 4.436 51 HZ2 LYS 21 HZ2 LYS 21 -16.036 1.155 3.618 52 HZ3 LYS 21 HZ3 LYS 21 -15.553 2.605 2.900 53 H VAL 22 HN VAL 22 -7.577 -0.608 4.156 54 HA VAL 22 HA VAL 22 -6.620 -0.907 1.394 55 HB VAL 22 HB VAL 22 -5.304 -1.906 3.929 56 HG11 VAL 22 HG11 VAL 22 -4.649 -3.121 1.920 57 HG12 VAL 22 HG12 VAL 22 -3.314 -2.146 2.531 58 HG13 VAL 22 HG13 VAL 22 -4.230 -1.603 1.126 59 HG21 VAL 22 HG21 VAL 22 -3.802 -0.018 3.791 60 HG22 VAL 22 HG22 VAL 22 -5.465 0.559 3.897 61 HG23 VAL 22 HG23 VAL 22 -4.625 0.567 2.347 62 H ALA 23 HN ALA 23 -7.899 -2.390 0.444 63 HA ALA 23 HA ALA 23 -8.389 -4.897 1.907 64 HB1 ALA 23 HB1 ALA 23 -10.343 -5.194 0.431 65 HB2 ALA 23 HB2 ALA 23 -10.008 -3.617 -0.286 66 HB3 ALA 23 HB3 ALA 23 -10.444 -3.736 1.417 67 H GLY 24 HN GLY 24 -7.991 -6.835 0.949 68 HA2 GLY 24 HA2 GLY 24 -6.191 -6.761 -1.350 69 HA3 GLY 24 HA1 GLY 24 -6.471 -8.136 -0.289 70 H GLN 25 HN GLN 25 -6.520 -9.062 -2.612 71 HA GLN 25 HA GLN 25 -9.063 -8.683 -3.965 72 HB2 GLN 25 HB2 GLN 25 -6.826 -10.601 -4.642 73 HB3 GLN 25 HB1 GLN 25 -8.164 -10.132 -5.683 74 HG2 GLN 25 HG2 GLN 25 -5.884 -8.413 -4.754 75 HG3 GLN 25 HG1 GLN 25 -6.226 -8.959 -6.396 76 HE21 GLN 25 HE21 GLN 25 -5.968 -6.272 -5.106 77 HE22 GLN 25 HE22 GLN 25 -7.404 -5.410 -5.578 78 H ASP 26 HN ASP 26 -9.337 -9.671 -1.394 79 HA ASP 26 HA ASP 26 -10.582 -12.235 -1.960 80 HB2 ASP 26 HB2 ASP 26 -9.741 -13.118 0.276 81 HB3 ASP 26 HB1 ASP 26 -8.572 -13.048 -1.034 82 H GLY 27 HN GLY 27 -10.189 -11.154 1.331 83 HA2 GLY 27 HA2 GLY 27 -12.697 -9.687 1.321 84 HA3 GLY 27 HA1 GLY 27 -12.737 -11.235 2.155 85 H SER 28 HN SER 28 -9.770 -9.492 2.167 86 HA SER 28 HA SER 28 -10.129 -8.939 5.024 87 HB2 SER 28 HB2 SER 28 -7.554 -8.543 4.811 88 HB3 SER 28 HB1 SER 28 -8.169 -10.195 4.756 89 HG SER 28 HG SER 28 -7.959 -10.199 2.540 90 H VAL 29 HN VAL 29 -10.423 -6.887 5.718 91 HA VAL 29 HA VAL 29 -9.527 -4.723 3.907 92 HB VAL 29 HB VAL 29 -12.083 -4.572 5.512 93 HG11 VAL 29 HG11 VAL 29 -12.538 -2.624 4.092 94 HG12 VAL 29 HG12 VAL 29 -10.982 -2.848 3.294 95 HG13 VAL 29 HG13 VAL 29 -11.043 -2.427 5.006 96 HG21 VAL 29 HG21 VAL 29 -13.304 -4.890 3.425 97 HG22 VAL 29 HG22 VAL 29 -12.313 -6.303 3.790 98 HG23 VAL 29 HG23 VAL 29 -11.786 -5.149 2.566 99 H VAL 30 HN VAL 30 -7.771 -4.030 5.062 100 HA VAL 30 HA VAL 30 -8.087 -3.654 7.935 101 HB VAL 30 HB VAL 30 -5.692 -3.138 8.008 102 HG11 VAL 30 HG11 VAL 30 -6.354 -5.661 6.490 103 HG12 VAL 30 HG12 VAL 30 -6.389 -5.448 8.241 104 HG13 VAL 30 HG13 VAL 30 -4.856 -5.364 7.373 105 HG21 VAL 30 HG21 VAL 30 -5.778 -3.562 5.023 106 HG22 VAL 30 HG22 VAL 30 -4.301 -3.478 5.983 107 HG23 VAL 30 HG23 VAL 30 -5.363 -2.074 5.875 108 H GLN 31 HN GLN 31 -8.168 -1.764 8.934 109 HA GLN 31 HA GLN 31 -8.668 0.594 7.293 110 HB2 GLN 31 HB2 GLN 31 -10.321 -0.105 9.002 111 HB3 GLN 31 HB1 GLN 31 -9.102 0.109 10.246 112 HG2 GLN 31 HG2 GLN 31 -9.003 2.498 9.738 113 HG3 GLN 31 HG1 GLN 31 -10.225 2.277 8.486 114 HE21 GLN 31 HE21 GLN 31 -10.282 3.903 10.944 115 HE22 GLN 31 HE22 GLN 31 -11.673 3.363 11.816 116 H PHE 32 HN PHE 32 -6.834 1.615 6.803 117 HA PHE 32 HA PHE 32 -4.676 1.761 8.738 118 HB2 PHE 32 HB2 PHE 32 -4.785 1.723 5.943 119 HB3 PHE 32 HB1 PHE 32 -4.267 3.355 6.358 120 HD1 PHE 32 HD1 PHE 32 -3.229 0.008 5.895 121 HD2 PHE 32 HD2 PHE 32 -2.360 3.557 8.071 122 HE1 PHE 32 HE1 PHE 32 -0.948 -0.816 6.326 123 HE2 PHE 32 HE2 PHE 32 -0.086 2.741 8.505 124 HZ PHE 32 HZ PHE 32 0.623 0.556 7.636 125 H LYS 33 HN LYS 33 -4.871 3.212 10.291 126 HA LYS 33 HA LYS 33 -6.079 5.808 9.628 127 HB2 LYS 33 HB2 LYS 33 -7.165 4.496 11.432 128 HB3 LYS 33 HB1 LYS 33 -5.668 4.554 12.346 129 HG2 LYS 33 HG2 LYS 33 -5.826 6.979 12.484 130 HG3 LYS 33 HG1 LYS 33 -7.312 6.941 11.532 131 HD2 LYS 33 HD2 LYS 33 -8.406 5.630 13.280 132 HD3 LYS 33 HD1 LYS 33 -6.915 5.641 14.225 133 HE2 LYS 33 HE2 LYS 33 -7.021 8.055 14.413 134 HE3 LYS 33 HE1 LYS 33 -8.465 8.091 13.404 135 HZ1 LYS 33 HZ1 LYS 33 -8.967 8.259 15.772 136 HZ2 LYS 33 HZ2 LYS 33 -8.265 6.746 16.041 137 HZ3 LYS 33 HZ3 LYS 33 -9.656 6.877 15.088 138 H ILE 34 HN ILE 34 -4.281 6.786 8.761 139 HA ILE 34 HA ILE 34 -2.071 7.298 10.648 140 HB ILE 34 HB ILE 34 -0.660 7.719 8.590 141 HG12 ILE 34 HG12 ILE 34 -2.828 6.130 7.198 142 HG13 ILE 34 HG11 ILE 34 -2.616 7.869 7.019 143 HG21 ILE 34 HG21 ILE 34 -0.329 5.246 8.172 144 HG22 ILE 34 HG22 ILE 34 -1.694 4.983 9.260 145 HG23 ILE 34 HG23 ILE 34 -0.240 5.781 9.850 146 HD11 ILE 34 HD11 ILE 34 -1.633 6.650 5.154 147 HD12 ILE 34 HD12 ILE 34 -0.591 5.769 6.273 148 HD13 ILE 34 HD13 ILE 34 -0.401 7.510 6.075 149 H LYS 35 HN LYS 35 -0.798 9.343 9.533 150 HA LYS 35 HA LYS 35 -2.796 11.454 9.647 151 HB2 LYS 35 HB2 LYS 35 0.227 11.603 9.604 152 HB3 LYS 35 HB1 LYS 35 -0.853 12.978 9.807 153 HG2 LYS 35 HG2 LYS 35 -1.742 11.922 11.863 154 HG3 LYS 35 HG1 LYS 35 -0.549 10.637 11.679 155 HD2 LYS 35 HD2 LYS 35 1.247 12.322 11.822 156 HD3 LYS 35 HD1 LYS 35 0.026 13.573 12.069 157 HE2 LYS 35 HE2 LYS 35 -0.749 12.309 14.080 158 HE3 LYS 35 HE1 LYS 35 0.627 11.229 13.864 159 HZ1 LYS 35 HZ1 LYS 35 2.097 13.154 14.101 160 HZ2 LYS 35 HZ2 LYS 35 1.146 12.917 15.475 161 HZ3 LYS 35 HZ3 LYS 35 0.757 14.148 14.384 162 H ARG 36 HN ARG 36 -2.898 13.118 8.018 163 HA ARG 36 HA ARG 36 -2.959 12.025 5.415 164 HB2 ARG 36 HB2 ARG 36 -3.262 14.867 6.372 165 HB3 ARG 36 HB1 ARG 36 -3.555 14.353 4.714 166 HG2 ARG 36 HG2 ARG 36 -5.288 12.799 5.539 167 HG3 ARG 36 HG1 ARG 36 -5.026 13.416 7.171 168 HD2 ARG 36 HD2 ARG 36 -6.942 14.509 6.223 169 HD3 ARG 36 HD1 ARG 36 -5.631 15.678 6.361 170 HE ARG 36 HE ARG 36 -5.313 15.506 3.982 171 HH11 ARG 36 HH11 ARG 36 -8.265 14.026 5.235 172 HH12 ARG 36 HH12 ARG 36 -9.109 14.081 3.633 173 HH21 ARG 36 HH21 ARG 36 -6.355 15.575 1.939 174 HH22 ARG 36 HH22 ARG 36 -8.033 14.908 1.791 175 H HIS 37 HN HIS 37 -0.371 13.379 7.119 176 HA HIS 37 HA HIS 37 1.036 13.996 4.613 177 HB2 HIS 37 HB2 HIS 37 2.698 15.172 6.093 178 HB3 HIS 37 HB1 HIS 37 1.093 15.889 6.059 179 HD2 HIS 37 HD2 HIS 37 -0.195 16.039 8.450 180 HE1 HIS 37 HE1 HIS 37 2.789 14.063 10.696 181 HE2 HIS 37 HE2 HIS 37 0.774 15.593 10.808 182 H THR 38 HN THR 38 0.596 11.413 6.430 183 HA THR 38 HA THR 38 3.333 10.593 6.863 184 HB THR 38 HB THR 38 0.791 8.962 7.049 185 HG1 THR 38 HG1 THR 38 1.840 10.902 8.635 186 HG21 THR 38 HG21 THR 38 3.596 8.470 8.045 187 HG22 THR 38 HG22 THR 38 2.687 7.500 6.888 188 HG23 THR 38 HG23 THR 38 2.188 7.552 8.580 189 HA PRO 39 HA PRO 39 4.008 9.317 2.626 190 HB2 PRO 39 HB2 PRO 39 6.053 7.627 3.982 191 HB3 PRO 39 HB1 PRO 39 6.230 8.720 2.603 192 HG2 PRO 39 HG2 PRO 39 7.126 9.440 4.986 193 HG3 PRO 39 HG1 PRO 39 6.328 10.615 3.919 194 HD2 PRO 39 HD2 PRO 39 5.270 9.250 6.348 195 HD3 PRO 39 HD1 PRO 39 4.981 10.900 5.758 196 H LEU 40 HN LEU 40 3.028 7.791 1.485 197 HA LEU 40 HA LEU 40 1.742 5.585 2.731 198 HB2 LEU 40 HB2 LEU 40 2.167 6.245 -0.182 199 HB3 LEU 40 HB1 LEU 40 1.152 4.936 0.396 200 HG LEU 40 HG LEU 40 0.704 7.853 1.038 201 HD11 LEU 40 HD11 LEU 40 -1.140 7.741 -0.547 202 HD12 LEU 40 HD12 LEU 40 -0.703 6.080 -0.955 203 HD13 LEU 40 HD13 LEU 40 0.396 7.404 -1.343 204 HD21 LEU 40 HD21 LEU 40 -0.972 5.391 1.516 205 HD22 LEU 40 HD22 LEU 40 -1.519 7.049 1.764 206 HD23 LEU 40 HD23 LEU 40 -0.201 6.399 2.740 207 H SER 41 HN SER 41 4.905 6.022 1.680 208 HA SER 41 HA SER 41 5.604 3.524 0.648 209 HB2 SER 41 HB2 SER 41 7.650 4.692 2.366 210 HB3 SER 41 HB1 SER 41 7.657 4.464 0.616 211 HG SER 41 HG SER 41 7.389 6.541 0.520 212 H LYS 42 HN LYS 42 5.369 4.702 3.964 213 HA LYS 42 HA LYS 42 6.279 2.246 5.130 214 HB2 LYS 42 HB2 LYS 42 5.195 4.835 6.154 215 HB3 LYS 42 HB1 LYS 42 5.162 3.438 7.221 216 HG2 LYS 42 HG2 LYS 42 7.349 3.570 7.622 217 HG3 LYS 42 HG1 LYS 42 7.732 3.772 5.912 218 HD2 LYS 42 HD2 LYS 42 7.227 6.144 6.051 219 HD3 LYS 42 HD1 LYS 42 6.742 5.965 7.741 220 HE2 LYS 42 HE2 LYS 42 8.957 5.469 8.418 221 HE3 LYS 42 HE1 LYS 42 9.490 5.229 6.755 222 HZ1 LYS 42 HZ1 LYS 42 9.229 7.568 6.342 223 HZ2 LYS 42 HZ2 LYS 42 10.216 7.354 7.695 224 HZ3 LYS 42 HZ3 LYS 42 8.606 7.832 7.893 225 H LEU 43 HN LEU 43 3.239 3.642 4.201 226 HA LEU 43 HA LEU 43 1.509 1.952 5.663 227 HB2 LEU 43 HB2 LEU 43 0.659 3.982 4.709 228 HB3 LEU 43 HB1 LEU 43 1.157 3.508 3.100 229 HG LEU 43 HG LEU 43 -0.791 1.698 4.386 230 HD11 LEU 43 HD11 LEU 43 -2.681 3.195 3.879 231 HD12 LEU 43 HD12 LEU 43 -1.539 4.501 3.558 232 HD13 LEU 43 HD13 LEU 43 -1.660 3.813 5.177 233 HD21 LEU 43 HD21 LEU 43 -0.654 3.016 1.670 234 HD22 LEU 43 HD22 LEU 43 -1.763 1.732 2.150 235 HD23 LEU 43 HD23 LEU 43 -0.030 1.416 2.071 236 H MET 44 HN MET 44 2.827 1.772 2.379 237 HA MET 44 HA MET 44 1.544 -0.636 1.644 238 HB2 MET 44 HB2 MET 44 4.099 0.609 0.605 239 HB3 MET 44 HB1 MET 44 3.261 -0.733 -0.159 240 HG2 MET 44 HG2 MET 44 1.271 0.724 -0.421 241 HG3 MET 44 HG1 MET 44 2.222 2.065 0.213 242 HE1 MET 44 HE1 MET 44 4.216 3.197 -1.020 243 HE2 MET 44 HE2 MET 44 4.912 2.613 -2.531 244 HE3 MET 44 HE3 MET 44 5.077 1.658 -1.059 245 H LYS 45 HN LYS 45 4.753 0.038 2.984 246 HA LYS 45 HA LYS 45 5.637 -2.646 2.959 247 HB2 LYS 45 HB2 LYS 45 6.539 -0.230 4.514 248 HB3 LYS 45 HB1 LYS 45 7.298 -1.803 4.705 249 HG2 LYS 45 HG2 LYS 45 7.607 -1.751 2.163 250 HG3 LYS 45 HG1 LYS 45 7.254 -0.030 2.297 251 HD2 LYS 45 HD2 LYS 45 9.405 -1.423 3.876 252 HD3 LYS 45 HD1 LYS 45 9.688 -0.619 2.332 253 HE2 LYS 45 HE2 LYS 45 8.997 1.494 3.256 254 HE3 LYS 45 HE1 LYS 45 8.535 0.724 4.771 255 HZ1 LYS 45 HZ1 LYS 45 10.775 0.263 5.275 256 HZ2 LYS 45 HZ2 LYS 45 10.746 1.875 4.763 257 HZ3 LYS 45 HZ3 LYS 45 11.301 0.663 3.719 258 H ALA 46 HN ALA 46 3.794 -0.769 5.280 259 HA ALA 46 HA ALA 46 4.043 -2.494 7.487 260 HB1 ALA 46 HB1 ALA 46 1.995 -1.420 8.316 261 HB2 ALA 46 HB2 ALA 46 1.753 -0.685 6.732 262 HB3 ALA 46 HB3 ALA 46 3.155 -0.240 7.703 263 H TYR 47 HN TYR 47 1.567 -2.314 4.936 264 HA TYR 47 HA TYR 47 0.047 -4.512 5.837 265 HB2 TYR 47 HB2 TYR 47 -0.734 -2.806 4.175 266 HB3 TYR 47 HB1 TYR 47 0.330 -3.544 2.983 267 HD1 TYR 47 HD1 TYR 47 -0.603 -5.092 1.537 268 HD2 TYR 47 HD2 TYR 47 -2.369 -4.546 5.368 269 HE1 TYR 47 HE1 TYR 47 -2.382 -6.684 0.940 270 HE2 TYR 47 HE2 TYR 47 -4.150 -6.137 4.783 271 HH TYR 47 HH TYR 47 -5.225 -7.002 2.674 272 H CYS 48 HN CYS 48 2.730 -4.214 3.583 273 HA CYS 48 HA CYS 48 2.793 -6.875 2.682 274 HB2 CYS 48 HB2 CYS 48 4.008 -4.781 1.784 275 HB3 CYS 48 HB1 CYS 48 5.243 -5.155 2.983 276 HG CYS 48 HG CYS 48 6.088 -7.472 1.897 277 H GLU 49 HN GLU 49 4.236 -5.295 5.474 278 HA GLU 49 HA GLU 49 5.957 -7.333 6.325 279 HB2 GLU 49 HB2 GLU 49 4.592 -5.021 7.627 280 HB3 GLU 49 HB1 GLU 49 5.332 -6.231 8.660 281 HG2 GLU 49 HG2 GLU 49 6.902 -5.033 6.430 282 HG3 GLU 49 HG1 GLU 49 6.675 -4.139 7.932 283 H ARG 50 HN ARG 50 2.593 -6.642 7.148 284 HA ARG 50 HA ARG 50 2.273 -8.776 8.965 285 HB2 ARG 50 HB2 ARG 50 0.211 -7.285 7.339 286 HB3 ARG 50 HB1 ARG 50 -0.142 -8.349 8.696 287 HG2 ARG 50 HG2 ARG 50 1.324 -6.854 10.098 288 HG3 ARG 50 HG1 ARG 50 1.318 -5.727 8.743 289 HD2 ARG 50 HD2 ARG 50 -1.029 -5.439 8.882 290 HD3 ARG 50 HD1 ARG 50 -1.191 -6.791 9.998 291 HE ARG 50 HE ARG 50 0.453 -4.625 10.961 292 HH11 ARG 50 HH11 ARG 50 -2.727 -6.084 10.795 293 HH12 ARG 50 HH12 ARG 50 -3.388 -5.100 12.161 294 HH21 ARG 50 HH21 ARG 50 -1.998 -3.684 13.322 295 HH22 ARG 50 HH22 ARG 50 -0.289 -3.452 12.792 296 H GLN 51 HN GLN 51 1.852 -8.536 5.487 297 HA GLN 51 HA GLN 51 0.614 -11.102 5.219 298 HB2 GLN 51 HB2 GLN 51 1.987 -9.373 3.149 299 HB3 GLN 51 HB1 GLN 51 1.014 -10.795 2.799 300 HG2 GLN 51 HG2 GLN 51 0.104 -8.168 3.938 301 HG3 GLN 51 HG1 GLN 51 -0.338 -8.895 2.394 302 HE21 GLN 51 HE21 GLN 51 -1.738 -10.689 2.393 303 HE22 GLN 51 HE22 GLN 51 -2.803 -10.996 3.719 304 H GLY 52 HN GLY 52 3.850 -9.939 5.448 305 HA2 GLY 52 HA2 GLY 52 5.810 -11.129 5.742 306 HA3 GLY 52 HA1 GLY 52 4.895 -12.617 5.543 307 H LEU 53 HN LEU 53 5.082 -9.903 3.293 308 HA LEU 53 HA LEU 53 6.484 -11.667 1.394 309 HB2 LEU 53 HB2 LEU 53 4.266 -9.726 0.737 310 HB3 LEU 53 HB1 LEU 53 5.144 -10.708 -0.418 311 HG LEU 53 HG LEU 53 3.421 -11.848 1.783 312 HD11 LEU 53 HD11 LEU 53 1.777 -12.293 0.026 313 HD12 LEU 53 HD12 LEU 53 2.774 -11.409 -1.128 314 HD13 LEU 53 HD13 LEU 53 2.051 -10.564 0.240 315 HD21 LEU 53 HD21 LEU 53 5.141 -13.371 1.015 316 HD22 LEU 53 HD22 LEU 53 4.676 -13.088 -0.662 317 HD23 LEU 53 HD23 LEU 53 3.561 -13.901 0.437 318 H SER 54 HN SER 54 7.053 -10.099 -0.630 319 HA SER 54 HA SER 54 8.685 -7.971 0.558 320 HB2 SER 54 HB2 SER 54 9.797 -9.782 -0.790 321 HB3 SER 54 HB1 SER 54 8.919 -9.198 -2.203 322 HG SER 54 HG SER 54 11.008 -7.996 -0.766 323 H MET 55 HN MET 55 8.638 -5.862 -0.252 324 HA MET 55 HA MET 55 6.134 -4.942 -1.177 325 HB2 MET 55 HB2 MET 55 7.766 -3.610 0.182 326 HB3 MET 55 HB1 MET 55 8.762 -3.450 -1.258 327 HG2 MET 55 HG2 MET 55 6.959 -2.270 -2.390 328 HG3 MET 55 HG1 MET 55 5.935 -2.452 -0.968 329 HE1 MET 55 HE1 MET 55 9.101 -0.829 -2.497 330 HE2 MET 55 HE2 MET 55 9.832 -1.566 -1.071 331 HE3 MET 55 HE3 MET 55 9.709 0.189 -1.193 332 H ARG 56 HN ARG 56 9.043 -5.896 -2.811 333 HA ARG 56 HA ARG 56 8.311 -4.703 -5.330 334 HB2 ARG 56 HB2 ARG 56 10.686 -5.154 -4.492 335 HB3 ARG 56 HB1 ARG 56 10.396 -6.839 -4.902 336 HG2 ARG 56 HG2 ARG 56 10.036 -6.243 -7.221 337 HG3 ARG 56 HG1 ARG 56 10.239 -4.533 -6.830 338 HD2 ARG 56 HD2 ARG 56 12.534 -5.022 -6.058 339 HD3 ARG 56 HD1 ARG 56 12.319 -6.697 -6.563 340 HE ARG 56 HE ARG 56 12.270 -5.981 -8.821 341 HH11 ARG 56 HH11 ARG 56 13.719 -2.344 -7.773 342 HH12 ARG 56 HH12 ARG 56 13.004 -3.419 -6.515 343 HH21 ARG 56 HH21 ARG 56 13.808 -3.035 -9.971 344 HH22 ARG 56 HH22 ARG 56 13.146 -4.647 -10.439 345 H GLN 57 HN GLN 57 7.166 -7.303 -3.660 346 HA GLN 57 HA GLN 57 6.768 -9.030 -5.979 347 HB2 GLN 57 HB2 GLN 57 7.418 -10.085 -3.879 348 HB3 GLN 57 HB1 GLN 57 6.019 -9.390 -3.071 349 HG2 GLN 57 HG2 GLN 57 4.599 -10.675 -4.715 350 HG3 GLN 57 HG1 GLN 57 6.072 -11.530 -5.173 351 HE21 GLN 57 HE21 GLN 57 3.609 -12.499 -3.916 352 HE22 GLN 57 HE22 GLN 57 4.110 -13.253 -2.441 353 H ILE 58 HN ILE 58 4.962 -6.954 -3.797 354 HA ILE 58 HA ILE 58 2.482 -7.593 -5.219 355 HB ILE 58 HB ILE 58 1.356 -6.305 -3.410 356 HG12 ILE 58 HG12 ILE 58 4.103 -6.330 -2.133 357 HG13 ILE 58 HG11 ILE 58 3.303 -4.904 -2.776 358 HG21 ILE 58 HG21 ILE 58 1.495 -8.725 -3.312 359 HG22 ILE 58 HG22 ILE 58 1.644 -8.047 -1.690 360 HG23 ILE 58 HG23 ILE 58 3.077 -8.625 -2.541 361 HD11 ILE 58 HD11 ILE 58 2.477 -6.555 -0.412 362 HD12 ILE 58 HD12 ILE 58 1.472 -5.296 -1.125 363 HD13 ILE 58 HD13 ILE 58 3.037 -4.882 -0.422 364 H ARG 59 HN ARG 59 0.971 -5.629 -5.438 365 HA ARG 59 HA ARG 59 2.445 -3.214 -6.235 366 HB2 ARG 59 HB2 ARG 59 0.413 -4.665 -7.947 367 HB3 ARG 59 HB1 ARG 59 1.067 -3.076 -8.305 368 HG2 ARG 59 HG2 ARG 59 2.655 -5.631 -8.151 369 HG3 ARG 59 HG1 ARG 59 2.132 -4.827 -9.631 370 HD2 ARG 59 HD2 ARG 59 3.430 -2.825 -8.936 371 HD3 ARG 59 HD1 ARG 59 4.036 -3.745 -7.558 372 HE ARG 59 HE ARG 59 4.724 -4.133 -10.368 373 HH11 ARG 59 HH11 ARG 59 6.535 -6.113 -7.329 374 HH12 ARG 59 HH12 ARG 59 5.051 -5.127 -7.005 375 HH21 ARG 59 HH21 ARG 59 6.607 -5.347 -10.808 376 HH22 ARG 59 HH22 ARG 59 7.411 -6.230 -9.455 377 H PHE 60 HN PHE 60 1.458 -1.391 -5.562 378 HA PHE 60 HA PHE 60 -1.236 -1.655 -4.429 379 HB2 PHE 60 HB2 PHE 60 1.129 0.007 -3.773 380 HB3 PHE 60 HB1 PHE 60 -0.442 0.770 -3.564 381 HD1 PHE 60 HD1 PHE 60 1.473 -2.283 -2.644 382 HD2 PHE 60 HD2 PHE 60 -1.668 0.402 -1.639 383 HE1 PHE 60 HE1 PHE 60 1.214 -3.402 -0.471 384 HE2 PHE 60 HE2 PHE 60 -1.931 -0.717 0.535 385 HZ PHE 60 HZ PHE 60 -0.489 -2.622 1.121 386 H ARG 61 HN ARG 61 -2.930 -0.552 -5.195 387 HA ARG 61 HA ARG 61 -2.445 1.458 -7.299 388 HB2 ARG 61 HB2 ARG 61 -4.438 -0.805 -7.260 389 HB3 ARG 61 HB1 ARG 61 -4.613 0.585 -8.322 390 HG2 ARG 61 HG2 ARG 61 -2.055 -0.935 -8.359 391 HG3 ARG 61 HG1 ARG 61 -3.475 -1.620 -9.151 392 HD2 ARG 61 HD2 ARG 61 -3.727 0.485 -10.425 393 HD3 ARG 61 HD1 ARG 61 -2.229 1.065 -9.706 394 HE ARG 61 HE ARG 61 -1.318 -1.134 -10.781 395 HH11 ARG 61 HH11 ARG 61 -3.230 0.733 -13.824 396 HH12 ARG 61 HH12 ARG 61 -3.672 1.129 -12.121 397 HH21 ARG 61 HH21 ARG 61 -0.737 -1.643 -12.922 398 HH22 ARG 61 HH22 ARG 61 -1.580 -0.802 -14.273 399 H PHE 62 HN PHE 62 -3.466 3.349 -7.000 400 HA PHE 62 HA PHE 62 -5.693 3.405 -5.066 401 HB2 PHE 62 HB2 PHE 62 -3.888 4.579 -4.024 402 HB3 PHE 62 HB1 PHE 62 -3.499 5.439 -5.512 403 HD1 PHE 62 HD1 PHE 62 -6.278 5.004 -3.066 404 HD2 PHE 62 HD2 PHE 62 -4.307 7.581 -5.820 405 HE1 PHE 62 HE1 PHE 62 -7.753 6.853 -2.384 406 HE2 PHE 62 HE2 PHE 62 -5.774 9.437 -5.143 407 HZ PHE 62 HZ PHE 62 -7.501 9.074 -3.424 408 H ASP 63 HN ASP 63 -7.547 3.902 -5.966 409 HA ASP 63 HA ASP 63 -9.149 4.832 -7.277 410 HB2 ASP 63 HB2 ASP 63 -7.948 6.977 -6.871 411 HB3 ASP 63 HB1 ASP 63 -6.990 6.679 -8.317 412 H GLY 64 HN GLY 64 -6.105 4.687 -9.102 413 HA2 GLY 64 HA2 GLY 64 -7.095 2.635 -10.839 414 HA3 GLY 64 HA1 GLY 64 -7.033 4.205 -11.637 415 H GLN 65 HN GLN 65 -4.809 5.336 -10.645 416 HA GLN 65 HA GLN 65 -2.740 3.826 -11.971 417 HB2 GLN 65 HB2 GLN 65 -2.878 6.572 -10.738 418 HB3 GLN 65 HB1 GLN 65 -1.358 5.894 -11.308 419 HG2 GLN 65 HG2 GLN 65 -3.820 6.315 -12.992 420 HG3 GLN 65 HG1 GLN 65 -2.396 7.355 -12.970 421 HE21 GLN 65 HE21 GLN 65 -0.502 6.660 -13.936 422 HE22 GLN 65 HE22 GLN 65 -0.448 5.301 -15.003 423 HA PRO 66 HA PRO 66 -0.828 2.049 -8.416 424 HB2 PRO 66 HB2 PRO 66 1.789 2.043 -9.145 425 HB3 PRO 66 HB1 PRO 66 0.590 0.938 -9.833 426 HG2 PRO 66 HG2 PRO 66 1.706 3.448 -10.985 427 HG3 PRO 66 HG1 PRO 66 1.332 1.910 -11.783 428 HD2 PRO 66 HD2 PRO 66 -0.294 4.075 -11.934 429 HD3 PRO 66 HD1 PRO 66 -0.889 2.405 -12.009 430 H ILE 67 HN ILE 67 0.275 2.540 -6.542 431 HA ILE 67 HA ILE 67 0.688 5.363 -6.050 432 HB ILE 67 HB ILE 67 1.059 3.048 -4.142 433 HG12 ILE 67 HG12 ILE 67 -1.389 4.753 -4.650 434 HG13 ILE 67 HG11 ILE 67 -1.216 3.045 -5.044 435 HG21 ILE 67 HG21 ILE 67 0.609 5.987 -3.628 436 HG22 ILE 67 HG22 ILE 67 2.126 5.116 -3.410 437 HG23 ILE 67 HG23 ILE 67 0.734 4.731 -2.396 438 HD11 ILE 67 HD11 ILE 67 -1.339 4.299 -2.315 439 HD12 ILE 67 HD12 ILE 67 -0.911 2.612 -2.595 440 HD13 ILE 67 HD13 ILE 67 -2.506 3.206 -3.059 441 H ASN 68 HN ASN 68 2.616 6.331 -5.400 442 HA ASN 68 HA ASN 68 5.041 4.860 -6.155 443 HB2 ASN 68 HB2 ASN 68 4.613 7.820 -5.677 444 HB3 ASN 68 HB1 ASN 68 6.126 7.083 -6.191 445 HD21 ASN 68 HD21 ASN 68 2.997 8.146 -7.113 446 HD22 ASN 68 HD22 ASN 68 3.180 7.886 -8.821 447 H GLU 69 HN GLU 69 6.974 5.165 -4.818 448 HA GLU 69 HA GLU 69 6.373 4.721 -2.046 449 HB2 GLU 69 HB2 GLU 69 9.013 4.948 -3.494 450 HB3 GLU 69 HB1 GLU 69 8.824 4.436 -1.824 451 HG2 GLU 69 HG2 GLU 69 7.927 2.404 -2.400 452 HG3 GLU 69 HG1 GLU 69 7.347 2.983 -3.962 453 H THR 70 HN THR 70 6.323 7.471 -3.632 454 HA THR 70 HA THR 70 7.401 9.015 -1.374 455 HB THR 70 HB THR 70 7.674 10.824 -3.296 456 HG1 THR 70 HG1 THR 70 8.270 9.847 -5.254 457 HG21 THR 70 HG21 THR 70 9.463 9.966 -1.823 458 HG22 THR 70 HG22 THR 70 10.019 10.212 -3.478 459 HG23 THR 70 HG23 THR 70 9.663 8.584 -2.900 460 H ASP 71 HN ASP 71 4.659 7.989 -2.332 461 HA ASP 71 HA ASP 71 3.273 10.533 -2.724 462 HB2 ASP 71 HB2 ASP 71 2.546 7.667 -3.129 463 HB3 ASP 71 HB1 ASP 71 1.252 8.817 -2.808 464 H THR 72 HN THR 72 1.493 11.138 -1.433 465 HA THR 72 HA THR 72 1.317 9.905 1.222 466 HB THR 72 HB THR 72 0.966 12.388 2.016 467 HG1 THR 72 HG1 THR 72 2.908 12.986 0.091 468 HG21 THR 72 HG21 THR 72 3.702 11.262 1.402 469 HG22 THR 72 HG22 THR 72 2.747 10.964 2.855 470 HG23 THR 72 HG23 THR 72 3.375 12.580 2.529 471 HA PRO 73 HA PRO 73 -3.072 10.116 0.768 472 HB2 PRO 73 HB2 PRO 73 -3.218 11.628 3.331 473 HB3 PRO 73 HB1 PRO 73 -4.029 10.127 2.857 474 HG2 PRO 73 HG2 PRO 73 -1.980 10.074 4.542 475 HG3 PRO 73 HG1 PRO 73 -2.194 8.810 3.315 476 HD2 PRO 73 HD2 PRO 73 -0.271 11.092 3.353 477 HD3 PRO 73 HD1 PRO 73 -0.059 9.440 2.738 478 H ALA 74 HN ALA 74 -1.698 13.123 2.099 479 HA ALA 74 HA ALA 74 -3.750 14.802 1.113 480 HB1 ALA 74 HB1 ALA 74 -2.261 16.646 1.668 481 HB2 ALA 74 HB2 ALA 74 -0.914 15.522 1.840 482 HB3 ALA 74 HB3 ALA 74 -2.275 15.445 2.959 483 H GLN 75 HN GLN 75 -0.749 13.641 -0.281 484 HA GLN 75 HA GLN 75 -0.641 15.472 -2.444 485 HB2 GLN 75 HB2 GLN 75 1.343 14.249 -1.794 486 HB3 GLN 75 HB1 GLN 75 0.551 12.711 -2.105 487 HG2 GLN 75 HG2 GLN 75 1.998 13.106 -3.930 488 HG3 GLN 75 HG1 GLN 75 0.361 13.409 -4.509 489 HE21 GLN 75 HE21 GLN 75 0.879 14.781 -6.134 490 HE22 GLN 75 HE22 GLN 75 1.560 16.350 -5.883 491 H LEU 76 HN LEU 76 -1.808 12.121 -2.204 492 HA LEU 76 HA LEU 76 -2.825 12.165 -4.902 493 HB2 LEU 76 HB2 LEU 76 -3.147 10.129 -2.702 494 HB3 LEU 76 HB1 LEU 76 -3.657 9.903 -4.365 495 HG LEU 76 HG LEU 76 -0.813 10.242 -3.403 496 HD11 LEU 76 HD11 LEU 76 -2.246 7.856 -4.560 497 HD12 LEU 76 HD12 LEU 76 -1.773 8.066 -2.874 498 HD13 LEU 76 HD13 LEU 76 -0.539 7.933 -4.124 499 HD21 LEU 76 HD21 LEU 76 -1.117 11.273 -5.587 500 HD22 LEU 76 HD22 LEU 76 -1.882 9.803 -6.193 501 HD23 LEU 76 HD23 LEU 76 -0.182 9.787 -5.723 502 H GLU 77 HN GLU 77 -3.910 13.677 -2.299 503 HA GLU 77 HA GLU 77 -5.890 14.513 -1.577 504 HB2 GLU 77 HB2 GLU 77 -6.780 13.765 -4.369 505 HB3 GLU 77 HB1 GLU 77 -7.655 14.828 -3.276 506 HG2 GLU 77 HG2 GLU 77 -5.073 15.876 -3.412 507 HG3 GLU 77 HG1 GLU 77 -5.488 15.420 -5.064 508 H MET 78 HN MET 78 -5.413 11.959 -0.756 509 HA MET 78 HA MET 78 -7.715 10.281 -1.227 510 HB2 MET 78 HB2 MET 78 -5.644 9.950 0.946 511 HB3 MET 78 HB1 MET 78 -6.674 8.709 0.247 512 HG2 MET 78 HG2 MET 78 -5.483 8.800 -1.822 513 HG3 MET 78 HG1 MET 78 -4.544 10.183 -1.269 514 HE1 MET 78 HE1 MET 78 -5.525 6.758 0.525 515 HE2 MET 78 HE2 MET 78 -4.071 5.832 0.155 516 HE3 MET 78 HE3 MET 78 -5.122 6.384 -1.150 517 H GLU 79 HN GLU 79 -9.560 10.306 -0.088 518 HA GLU 79 HA GLU 79 -9.613 11.990 2.313 519 HB2 GLU 79 HB2 GLU 79 -11.760 11.260 0.333 520 HB3 GLU 79 HB1 GLU 79 -12.129 11.977 1.896 521 HG2 GLU 79 HG2 GLU 79 -10.630 13.174 -0.405 522 HG3 GLU 79 HG1 GLU 79 -12.085 13.767 0.397 523 H ASP 80 HN ASP 80 -11.690 11.262 3.676 524 HA ASP 80 HA ASP 80 -10.886 8.884 4.976 525 HB2 ASP 80 HB2 ASP 80 -12.159 10.987 5.867 526 HB3 ASP 80 HB1 ASP 80 -13.596 10.101 5.374 527 H GLU 81 HN GLU 81 -11.686 6.871 4.987 528 HA GLU 81 HA GLU 81 -12.848 5.009 4.438 529 HB2 GLU 81 HB2 GLU 81 -14.870 7.048 3.571 530 HB3 GLU 81 HB1 GLU 81 -15.119 5.340 3.246 531 HG2 GLU 81 HG2 GLU 81 -14.481 5.307 5.891 532 HG3 GLU 81 HG1 GLU 81 -15.348 6.835 5.744 533 H ASP 82 HN ASP 82 -11.095 6.642 2.434 534 HA ASP 82 HA ASP 82 -12.048 5.834 -0.130 535 HB2 ASP 82 HB2 ASP 82 -10.176 7.610 0.613 536 HB3 ASP 82 HB1 ASP 82 -9.131 6.245 0.225 537 H THR 83 HN THR 83 -10.633 4.377 -1.571 538 HA THR 83 HA THR 83 -10.036 1.939 -0.017 539 HB THR 83 HB THR 83 -10.785 1.714 -2.885 540 HG1 THR 83 HG1 THR 83 -12.351 2.946 -1.064 541 HG21 THR 83 HG21 THR 83 -11.855 -0.337 -2.088 542 HG22 THR 83 HG22 THR 83 -11.459 0.094 -0.424 543 HG23 THR 83 HG23 THR 83 -10.170 -0.261 -1.575 544 H ILE 84 HN ILE 84 -8.221 0.833 -0.399 545 HA ILE 84 HA ILE 84 -6.433 1.786 -2.540 546 HB ILE 84 HB ILE 84 -5.575 0.661 0.135 547 HG12 ILE 84 HG12 ILE 84 -5.454 3.530 -0.820 548 HG13 ILE 84 HG11 ILE 84 -6.647 2.911 0.318 549 HG21 ILE 84 HG21 ILE 84 -3.347 1.422 -0.538 550 HG22 ILE 84 HG22 ILE 84 -3.999 1.936 -2.095 551 HG23 ILE 84 HG23 ILE 84 -4.002 0.228 -1.659 552 HD11 ILE 84 HD11 ILE 84 -3.678 2.840 0.796 553 HD12 ILE 84 HD12 ILE 84 -4.968 2.494 1.950 554 HD13 ILE 84 HD13 ILE 84 -4.742 4.133 1.344 555 H ASP 85 HN ASP 85 -6.209 0.273 -4.054 556 HA ASP 85 HA ASP 85 -6.945 -2.476 -3.487 557 HB2 ASP 85 HB2 ASP 85 -6.959 -0.788 -5.784 558 HB3 ASP 85 HB1 ASP 85 -5.946 -2.184 -6.137 559 H VAL 86 HN VAL 86 -5.623 -4.202 -3.461 560 HA VAL 86 HA VAL 86 -2.738 -3.712 -3.821 561 HB VAL 86 HB VAL 86 -3.882 -5.780 -1.946 562 HG11 VAL 86 HG11 VAL 86 -1.640 -5.752 -0.983 563 HG12 VAL 86 HG12 VAL 86 -1.151 -4.518 -2.143 564 HG13 VAL 86 HG13 VAL 86 -1.585 -6.133 -2.706 565 HG21 VAL 86 HG21 VAL 86 -3.374 -4.237 -0.097 566 HG22 VAL 86 HG22 VAL 86 -4.645 -3.619 -1.153 567 HG23 VAL 86 HG23 VAL 86 -3.008 -2.970 -1.270 568 H PHE 87 HN PHE 87 -1.912 -4.825 -5.454 569 HA PHE 87 HA PHE 87 -3.200 -7.362 -6.240 570 HB2 PHE 87 HB2 PHE 87 -1.867 -5.262 -7.964 571 HB3 PHE 87 HB1 PHE 87 -2.313 -6.860 -8.547 572 HD1 PHE 87 HD1 PHE 87 -4.711 -7.504 -8.639 573 HD2 PHE 87 HD2 PHE 87 -3.454 -3.536 -7.759 574 HE1 PHE 87 HE1 PHE 87 -6.960 -6.676 -9.195 575 HE2 PHE 87 HE2 PHE 87 -5.700 -2.698 -8.311 576 HZ PHE 87 HZ PHE 87 -7.454 -4.267 -9.030 577 H GLN 88 HN GLN 88 -1.519 -8.614 -7.734 578 HA GLN 88 HA GLN 88 1.084 -8.587 -6.351 579 HB2 GLN 88 HB2 GLN 88 -0.549 -10.971 -7.230 580 HB3 GLN 88 HB1 GLN 88 1.139 -11.075 -6.760 581 HG2 GLN 88 HG2 GLN 88 -0.048 -9.742 -4.653 582 HG3 GLN 88 HG1 GLN 88 -1.240 -10.952 -5.119 583 HE21 GLN 88 HE21 GLN 88 -1.008 -12.323 -3.431 584 HE22 GLN 88 HE22 GLN 88 0.446 -13.183 -3.073 585 H GLN 89 HN GLN 89 2.873 -9.413 -7.638 586 HA GLN 89 HA GLN 89 2.588 -8.603 -10.412 587 HB2 GLN 89 HB2 GLN 89 4.499 -7.804 -9.045 588 HB3 GLN 89 HB1 GLN 89 5.053 -9.464 -8.885 589 HG2 GLN 89 HG2 GLN 89 6.306 -8.256 -10.583 590 HG3 GLN 89 HG1 GLN 89 5.413 -9.609 -11.275 591 HE21 GLN 89 HE21 GLN 89 5.352 -8.790 -13.326 592 HE22 GLN 89 HE22 GLN 89 4.401 -7.410 -13.757 593 H GLN 90 HN GLN 90 2.848 -9.929 -12.160 594 HA GLN 90 HA GLN 90 2.122 -12.615 -11.953 595 HB2 GLN 90 HB2 GLN 90 3.337 -10.984 -14.162 596 HB3 GLN 90 HB1 GLN 90 3.064 -12.706 -14.369 597 HG2 GLN 90 HG2 GLN 90 1.217 -11.560 -15.314 598 HG3 GLN 90 HG1 GLN 90 0.664 -12.317 -13.821 599 HE21 GLN 90 HE21 GLN 90 -1.033 -10.936 -13.519 600 HE22 GLN 90 HE22 GLN 90 -0.837 -9.274 -13.097 601 H THR 91 HN THR 91 3.220 -14.478 -11.755 602 HA THR 91 HA THR 91 6.011 -14.325 -11.034 603 HB THR 91 HB THR 91 5.081 -17.024 -11.164 604 HG1 THR 91 HG1 THR 91 3.159 -16.919 -10.143 605 HG21 THR 91 HG21 THR 91 5.500 -15.186 -8.801 606 HG22 THR 91 HG22 THR 91 6.765 -16.112 -9.610 607 HG23 THR 91 HG23 THR 91 5.466 -16.949 -8.761 608 H GLY 92 HN GLY 92 6.269 -13.583 -13.445 609 HA2 GLY 92 HA2 GLY 92 7.693 -14.182 -15.211 610 HA3 GLY 92 HA1 GLY 92 7.430 -15.877 -14.818 611 H ASN 357 HT1 ASN 357 -16.068 -11.078 8.553 612 HA ASN 357 HA ASN 357 -14.556 -9.987 6.256 613 HB2 ASN 357 HB2 ASN 357 -16.895 -9.035 7.233 614 HB3 ASN 357 HB1 ASN 357 -15.769 -8.253 8.334 615 HD21 ASN 357 HD21 ASN 357 -17.494 -7.106 6.278 616 HD22 ASN 357 HD22 ASN 357 -16.447 -6.247 5.200 617 H ASN 358 HN ASN 358 -12.586 -9.010 6.776 618 HA ASN 358 HA ASN 358 -11.846 -9.187 9.619 619 HB2 ASN 358 HB2 ASN 358 -10.193 -9.714 7.159 620 HB3 ASN 358 HB1 ASN 358 -9.449 -9.380 8.719 621 HD21 ASN 358 HD21 ASN 358 -10.663 -10.749 10.510 622 HD22 ASN 358 HD22 ASN 358 -10.733 -12.436 10.151 623 H ARG 359 HN ARG 359 -11.565 -7.279 10.527 624 HA ARG 359 HA ARG 359 -10.428 -5.144 8.869 625 HB2 ARG 359 HB2 ARG 359 -11.872 -3.522 10.204 626 HB3 ARG 359 HB1 ARG 359 -12.705 -4.498 9.002 627 HG2 ARG 359 HG2 ARG 359 -13.557 -5.957 10.703 628 HG3 ARG 359 HG1 ARG 359 -12.597 -5.138 11.936 629 HD2 ARG 359 HD2 ARG 359 -13.866 -3.072 11.523 630 HD3 ARG 359 HD1 ARG 359 -14.851 -3.923 10.331 631 HE ARG 359 HE ARG 359 -14.747 -4.759 13.157 632 HH11 ARG 359 HH11 ARG 359 -16.605 -3.798 10.303 633 HH12 ARG 359 HH12 ARG 359 -18.175 -4.280 11.049 634 HH21 ARG 359 HH21 ARG 359 -16.712 -5.313 14.132 635 HH22 ARG 359 HH22 ARG 359 -18.238 -5.118 13.187 636 H ASP 360 HN ASP 360 -8.643 -4.389 9.669 637 HA ASP 360 HA ASP 360 -8.307 -4.338 12.587 638 HB2 ASP 360 HB2 ASP 360 -6.904 -6.153 11.524 639 HB3 ASP 360 HB1 ASP 360 -5.999 -4.872 10.714 640 HA PRO 361 HA PRO 361 -7.108 -0.221 11.369 641 HB2 PRO 361 HB2 PRO 361 -7.515 0.984 13.745 642 HB3 PRO 361 HB1 PRO 361 -8.867 0.373 12.781 643 HG2 PRO 361 HG2 PRO 361 -7.815 -0.651 15.308 644 HG3 PRO 361 HG1 PRO 361 -9.362 -0.991 14.513 645 HD2 PRO 361 HD2 PRO 361 -6.910 -2.577 14.484 646 HD3 PRO 361 HD1 PRO 361 -8.536 -3.013 13.925 647 H ILE 362 HN ILE 362 -5.144 0.490 11.110 648 HA ILE 362 HA ILE 362 -3.138 0.081 13.220 649 HB ILE 362 HB ILE 362 -2.398 0.375 10.338 650 HG12 ILE 362 HG12 ILE 362 -2.731 -2.363 11.513 651 HG13 ILE 362 HG11 ILE 362 -4.132 -1.544 10.833 652 HG21 ILE 362 HG21 ILE 362 -1.065 -1.061 12.629 653 HG22 ILE 362 HG22 ILE 362 -0.642 0.541 12.024 654 HG23 ILE 362 HG23 ILE 362 -0.418 -0.876 10.999 655 HD11 ILE 362 HD11 ILE 362 -1.575 -2.187 9.388 656 HD12 ILE 362 HD12 ILE 362 -2.944 -1.313 8.703 657 HD13 ILE 362 HD13 ILE 362 -3.130 -2.998 9.191 658 H VAL 363 HN VAL 363 -2.057 1.823 13.909 659 HA VAL 363 HA VAL 363 -2.455 4.324 12.391 660 HB VAL 363 HB VAL 363 -1.988 4.010 15.372 661 HG11 VAL 363 HG11 VAL 363 -1.078 6.083 14.444 662 HG12 VAL 363 HG12 VAL 363 -2.451 6.390 15.507 663 HG13 VAL 363 HG13 VAL 363 -2.656 6.466 13.757 664 HG21 VAL 363 HG21 VAL 363 -4.278 4.576 15.720 665 HG22 VAL 363 HG22 VAL 363 -4.230 3.235 14.577 666 HG23 VAL 363 HG23 VAL 363 -4.526 4.876 14.001 667 H ILE 364 HN ILE 364 -0.658 5.143 11.590 668 HA ILE 364 HA ILE 364 1.913 4.415 12.813 669 HB ILE 364 HB ILE 364 1.244 4.628 9.878 670 HG12 ILE 364 HG12 ILE 364 2.419 2.450 11.610 671 HG13 ILE 364 HG11 ILE 364 0.861 2.438 10.793 672 HG21 ILE 364 HG21 ILE 364 3.988 4.533 11.119 673 HG22 ILE 364 HG22 ILE 364 3.291 5.876 10.212 674 HG23 ILE 364 HG23 ILE 364 3.634 4.346 9.402 675 HD11 ILE 364 HD11 ILE 364 1.969 2.339 8.635 676 HD12 ILE 364 HD12 ILE 364 2.514 1.022 9.674 677 HD13 ILE 364 HD13 ILE 364 3.543 2.430 9.422 678 H SER 365 HN SER 365 3.187 6.026 13.344 679 HA SER 365 HA SER 365 2.497 8.725 12.400 680 HB2 SER 365 HB2 SER 365 3.731 7.919 15.055 681 HB3 SER 365 HB1 SER 365 3.326 9.565 14.563 682 HG SER 365 HG SER 365 1.534 7.402 14.994 683 H ASP 366 HN ASP 366 4.120 9.892 11.483 684 HA ASP 366 HA ASP 366 6.767 8.588 11.390 685 HB2 ASP 366 HB2 ASP 366 5.297 8.821 9.221 686 HB3 ASP 366 HB1 ASP 366 5.824 10.502 9.265 687 H SER 367 HN SER 367 8.441 9.716 12.059 688 HA SER 367 HA SER 367 7.988 12.472 12.940 689 HB2 SER 367 HB2 SER 367 10.438 10.989 13.736 690 HB3 SER 367 HB1 SER 367 9.382 12.038 14.682 691 HG SER 367 HG SER 367 8.380 10.339 15.354 692 HA PRO 368 HA PRO 368 11.001 13.308 9.633 693 HB2 PRO 368 HB2 PRO 368 9.584 15.517 8.688 694 HB3 PRO 368 HB1 PRO 368 9.463 13.873 8.051 695 HG2 PRO 368 HG2 PRO 368 7.442 15.325 9.388 696 HG3 PRO 368 HG1 PRO 368 7.403 13.621 8.915 697 HD2 PRO 368 HD2 PRO 368 8.004 14.821 11.561 698 HD3 PRO 368 HD1 PRO 368 7.279 13.248 11.167 Start of MODEL 20 1 H ASP 16 HT1 ASP 16 -5.474 16.104 11.894 2 HA ASP 16 HA ASP 16 -6.548 14.276 13.952 3 HB2 ASP 16 HB2 ASP 16 -7.829 15.368 11.442 4 HB3 ASP 16 HB1 ASP 16 -8.443 13.977 12.327 5 H HIS 17 HN HIS 17 -7.396 12.291 12.477 6 HA HIS 17 HA HIS 17 -5.068 11.480 10.863 7 HB2 HIS 17 HB2 HIS 17 -6.814 9.781 12.664 8 HB3 HIS 17 HB1 HIS 17 -5.556 9.151 11.608 9 HD2 HIS 17 HD2 HIS 17 -2.913 9.729 12.415 10 HE1 HIS 17 HE1 HIS 17 -4.065 10.978 16.289 11 HE2 HIS 17 HE2 HIS 17 -2.159 10.115 14.868 12 H ILE 18 HN ILE 18 -5.620 9.661 9.329 13 HA ILE 18 HA ILE 18 -8.337 9.996 8.246 14 HB ILE 18 HB ILE 18 -6.747 11.276 6.876 15 HG12 ILE 18 HG12 ILE 18 -7.670 8.780 5.435 16 HG13 ILE 18 HG11 ILE 18 -8.711 10.145 5.835 17 HG21 ILE 18 HG21 ILE 18 -4.999 10.128 5.585 18 HG22 ILE 18 HG22 ILE 18 -5.361 8.631 6.447 19 HG23 ILE 18 HG23 ILE 18 -4.718 10.021 7.324 20 HD11 ILE 18 HD11 ILE 18 -6.340 10.163 3.988 21 HD12 ILE 18 HD12 ILE 18 -7.261 11.594 4.452 22 HD13 ILE 18 HD13 ILE 18 -8.038 10.297 3.542 23 H ASN 19 HN ASN 19 -9.333 8.136 7.524 24 HA ASN 19 HA ASN 19 -7.879 5.643 8.088 25 HB2 ASN 19 HB2 ASN 19 -10.864 6.085 7.897 26 HB3 ASN 19 HB1 ASN 19 -10.066 4.585 8.357 27 HD21 ASN 19 HD21 ASN 19 -10.863 7.823 9.313 28 HD22 ASN 19 HD22 ASN 19 -10.538 7.611 11.009 29 H LEU 20 HN LEU 20 -7.244 4.462 6.446 30 HA LEU 20 HA LEU 20 -8.655 4.738 3.875 31 HB2 LEU 20 HB2 LEU 20 -5.786 3.912 4.340 32 HB3 LEU 20 HB1 LEU 20 -6.559 4.145 2.784 33 HG LEU 20 HG LEU 20 -6.176 6.357 4.799 34 HD11 LEU 20 HD11 LEU 20 -4.496 5.654 2.401 35 HD12 LEU 20 HD12 LEU 20 -4.009 5.530 4.090 36 HD13 LEU 20 HD13 LEU 20 -4.332 7.112 3.382 37 HD21 LEU 20 HD21 LEU 20 -6.605 7.797 2.844 38 HD22 LEU 20 HD22 LEU 20 -7.981 6.770 3.246 39 HD23 LEU 20 HD23 LEU 20 -6.941 6.356 1.884 40 H LYS 21 HN LYS 21 -9.347 2.914 2.844 41 HA LYS 21 HA LYS 21 -9.259 0.447 4.424 42 HB2 LYS 21 HB2 LYS 21 -10.949 1.077 2.000 43 HB3 LYS 21 HB1 LYS 21 -11.132 -0.296 3.080 44 HG2 LYS 21 HG2 LYS 21 -12.015 1.015 4.791 45 HG3 LYS 21 HG1 LYS 21 -11.398 2.514 4.083 46 HD2 LYS 21 HD2 LYS 21 -12.967 2.333 2.248 47 HD3 LYS 21 HD1 LYS 21 -13.529 0.770 2.849 48 HE2 LYS 21 HE2 LYS 21 -14.502 1.765 4.767 49 HE3 LYS 21 HE1 LYS 21 -13.708 3.306 4.453 50 HZ1 LYS 21 HZ1 LYS 21 -15.998 3.448 3.809 51 HZ2 LYS 21 HZ2 LYS 21 -15.863 2.065 2.837 52 HZ3 LYS 21 HZ3 LYS 21 -15.044 3.477 2.407 53 H VAL 22 HN VAL 22 -7.767 -1.000 3.903 54 HA VAL 22 HA VAL 22 -6.905 -1.187 1.090 55 HB VAL 22 HB VAL 22 -5.487 -2.184 3.575 56 HG11 VAL 22 HG11 VAL 22 -5.034 -3.587 1.635 57 HG12 VAL 22 HG12 VAL 22 -3.607 -2.651 2.081 58 HG13 VAL 22 HG13 VAL 22 -4.583 -2.161 0.698 59 HG21 VAL 22 HG21 VAL 22 -3.890 -0.410 3.202 60 HG22 VAL 22 HG22 VAL 22 -5.508 0.276 3.355 61 HG23 VAL 22 HG23 VAL 22 -4.763 0.116 1.764 62 H ALA 23 HN ALA 23 -8.222 -2.625 0.149 63 HA ALA 23 HA ALA 23 -8.924 -5.070 1.615 64 HB1 ALA 23 HB1 ALA 23 -10.785 -5.296 0.081 65 HB2 ALA 23 HB2 ALA 23 -10.232 -3.892 -0.832 66 HB3 ALA 23 HB3 ALA 23 -10.800 -3.699 0.826 67 H GLY 24 HN GLY 24 -8.391 -7.033 0.910 68 HA2 GLY 24 HA2 GLY 24 -6.464 -7.222 -1.257 69 HA3 GLY 24 HA1 GLY 24 -6.941 -8.514 -0.161 70 H GLN 25 HN GLN 25 -6.804 -9.537 -2.466 71 HA GLN 25 HA GLN 25 -9.128 -9.070 -4.115 72 HB2 GLN 25 HB2 GLN 25 -7.058 -11.260 -4.339 73 HB3 GLN 25 HB1 GLN 25 -8.208 -10.780 -5.577 74 HG2 GLN 25 HG2 GLN 25 -5.903 -9.164 -4.518 75 HG3 GLN 25 HG1 GLN 25 -6.053 -9.886 -6.118 76 HE21 GLN 25 HE21 GLN 25 -5.741 -7.071 -5.098 77 HE22 GLN 25 HE22 GLN 25 -7.011 -6.175 -5.872 78 H ASP 26 HN ASP 26 -8.584 -10.742 -1.325 79 HA ASP 26 HA ASP 26 -10.450 -12.910 -1.921 80 HB2 ASP 26 HB2 ASP 26 -9.842 -13.488 0.568 81 HB3 ASP 26 HB1 ASP 26 -8.698 -13.833 -0.724 82 H GLY 27 HN GLY 27 -10.005 -10.826 0.921 83 HA2 GLY 27 HA2 GLY 27 -12.482 -9.520 0.792 84 HA3 GLY 27 HA1 GLY 27 -12.689 -10.974 1.755 85 H SER 28 HN SER 28 -9.561 -10.145 2.199 86 HA SER 28 HA SER 28 -9.988 -9.176 4.840 87 HB2 SER 28 HB2 SER 28 -7.378 -8.993 3.341 88 HB3 SER 28 HB1 SER 28 -7.636 -9.253 5.067 89 HG SER 28 HG SER 28 -8.118 -11.072 2.931 90 H VAL 29 HN VAL 29 -10.253 -7.121 5.526 91 HA VAL 29 HA VAL 29 -9.349 -4.955 3.737 92 HB VAL 29 HB VAL 29 -11.946 -4.847 5.281 93 HG11 VAL 29 HG11 VAL 29 -12.357 -2.829 3.962 94 HG12 VAL 29 HG12 VAL 29 -10.781 -3.010 3.192 95 HG13 VAL 29 HG13 VAL 29 -10.885 -2.685 4.922 96 HG21 VAL 29 HG21 VAL 29 -13.111 -5.071 3.164 97 HG22 VAL 29 HG22 VAL 29 -12.102 -6.488 3.453 98 HG23 VAL 29 HG23 VAL 29 -11.577 -5.248 2.311 99 H VAL 30 HN VAL 30 -7.625 -4.315 4.916 100 HA VAL 30 HA VAL 30 -7.867 -4.014 7.787 101 HB VAL 30 HB VAL 30 -5.502 -3.414 7.773 102 HG11 VAL 30 HG11 VAL 30 -6.138 -5.813 6.056 103 HG12 VAL 30 HG12 VAL 30 -6.066 -5.773 7.819 104 HG13 VAL 30 HG13 VAL 30 -4.600 -5.526 6.869 105 HG21 VAL 30 HG21 VAL 30 -5.623 -3.709 4.776 106 HG22 VAL 30 HG22 VAL 30 -4.197 -3.333 5.743 107 HG23 VAL 30 HG23 VAL 30 -5.518 -2.169 5.630 108 H GLN 31 HN GLN 31 -7.553 -2.058 8.898 109 HA GLN 31 HA GLN 31 -8.404 0.298 7.347 110 HB2 GLN 31 HB2 GLN 31 -9.952 -0.476 9.117 111 HB3 GLN 31 HB1 GLN 31 -8.677 -0.258 10.309 112 HG2 GLN 31 HG2 GLN 31 -8.634 2.152 9.761 113 HG3 GLN 31 HG1 GLN 31 -9.990 1.895 8.663 114 HE21 GLN 31 HE21 GLN 31 -9.868 3.587 11.019 115 HE22 GLN 31 HE22 GLN 31 -11.097 3.014 12.095 116 H PHE 32 HN PHE 32 -6.651 1.446 6.812 117 HA PHE 32 HA PHE 32 -4.426 1.654 8.675 118 HB2 PHE 32 HB2 PHE 32 -4.847 2.165 5.799 119 HB3 PHE 32 HB1 PHE 32 -3.760 3.289 6.606 120 HD1 PHE 32 HD1 PHE 32 -4.262 -0.151 5.523 121 HD2 PHE 32 HD2 PHE 32 -1.658 2.538 7.543 122 HE1 PHE 32 HE1 PHE 32 -2.440 -1.796 5.351 123 HE2 PHE 32 HE2 PHE 32 0.169 0.901 7.375 124 HZ PHE 32 HZ PHE 32 -0.219 -1.269 6.278 125 H LYS 33 HN LYS 33 -4.645 3.076 10.275 126 HA LYS 33 HA LYS 33 -6.010 5.618 9.669 127 HB2 LYS 33 HB2 LYS 33 -7.000 4.225 11.483 128 HB3 LYS 33 HB1 LYS 33 -5.491 4.374 12.375 129 HG2 LYS 33 HG2 LYS 33 -5.803 6.678 12.728 130 HG3 LYS 33 HG1 LYS 33 -7.082 6.770 11.512 131 HD2 LYS 33 HD2 LYS 33 -8.451 5.263 12.954 132 HD3 LYS 33 HD1 LYS 33 -7.202 5.398 14.194 133 HE2 LYS 33 HE2 LYS 33 -7.568 7.749 14.408 134 HE3 LYS 33 HE1 LYS 33 -8.621 7.769 12.994 135 HZ1 LYS 33 HZ1 LYS 33 -9.793 7.827 15.168 136 HZ2 LYS 33 HZ2 LYS 33 -9.237 6.258 15.466 137 HZ3 LYS 33 HZ3 LYS 33 -10.266 6.553 14.160 138 H ILE 34 HN ILE 34 -4.299 6.702 8.802 139 HA ILE 34 HA ILE 34 -2.031 7.196 10.619 140 HB ILE 34 HB ILE 34 -0.598 7.516 8.651 141 HG12 ILE 34 HG12 ILE 34 -2.931 6.457 7.034 142 HG13 ILE 34 HG11 ILE 34 -2.466 8.154 7.087 143 HG21 ILE 34 HG21 ILE 34 -0.418 5.160 8.008 144 HG22 ILE 34 HG22 ILE 34 -2.019 4.853 8.678 145 HG23 ILE 34 HG23 ILE 34 -0.697 5.331 9.741 146 HD11 ILE 34 HD11 ILE 34 -1.644 6.992 5.089 147 HD12 ILE 34 HD12 ILE 34 -0.710 5.910 6.121 148 HD13 ILE 34 HD13 ILE 34 -0.335 7.632 6.083 149 H LYS 35 HN LYS 35 -0.788 9.235 9.511 150 HA LYS 35 HA LYS 35 -2.764 11.374 9.644 151 HB2 LYS 35 HB2 LYS 35 0.262 11.491 9.727 152 HB3 LYS 35 HB1 LYS 35 -0.817 12.863 9.952 153 HG2 LYS 35 HG2 LYS 35 -1.795 11.629 11.913 154 HG3 LYS 35 HG1 LYS 35 -0.476 10.472 11.742 155 HD2 LYS 35 HD2 LYS 35 1.149 12.260 12.067 156 HD3 LYS 35 HD1 LYS 35 -0.159 13.437 12.198 157 HE2 LYS 35 HE2 LYS 35 -1.022 12.063 14.137 158 HE3 LYS 35 HE1 LYS 35 0.507 11.187 14.082 159 HZ1 LYS 35 HZ1 LYS 35 1.663 13.294 14.422 160 HZ2 LYS 35 HZ2 LYS 35 0.597 12.964 15.692 161 HZ3 LYS 35 HZ3 LYS 35 0.180 14.104 14.516 162 H ARG 36 HN ARG 36 -2.707 13.109 8.076 163 HA ARG 36 HA ARG 36 -2.626 12.114 5.426 164 HB2 ARG 36 HB2 ARG 36 -3.040 14.864 6.569 165 HB3 ARG 36 HB1 ARG 36 -3.061 14.557 4.837 166 HG2 ARG 36 HG2 ARG 36 -4.856 12.854 5.266 167 HG3 ARG 36 HG1 ARG 36 -4.923 13.459 6.923 168 HD2 ARG 36 HD2 ARG 36 -6.215 15.148 6.288 169 HD3 ARG 36 HD1 ARG 36 -5.018 15.662 5.102 170 HE ARG 36 HE ARG 36 -6.108 13.844 3.662 171 HH11 ARG 36 HH11 ARG 36 -7.817 15.816 6.023 172 HH12 ARG 36 HH12 ARG 36 -9.382 15.707 5.138 173 HH21 ARG 36 HH21 ARG 36 -8.074 13.652 2.531 174 HH22 ARG 36 HH22 ARG 36 -9.543 14.485 3.190 175 H HIS 37 HN HIS 37 -0.183 13.442 7.383 176 HA HIS 37 HA HIS 37 1.416 14.177 5.038 177 HB2 HIS 37 HB2 HIS 37 2.961 15.262 6.664 178 HB3 HIS 37 HB1 HIS 37 1.338 15.934 6.687 179 HD2 HIS 37 HD2 HIS 37 0.029 15.806 9.075 180 HE1 HIS 37 HE1 HIS 37 3.074 13.724 11.142 181 HE2 HIS 37 HE2 HIS 37 1.004 15.156 11.390 182 H THR 38 HN THR 38 0.812 11.437 6.442 183 HA THR 38 HA THR 38 3.547 10.554 6.937 184 HB THR 38 HB THR 38 0.993 8.944 7.095 185 HG1 THR 38 HG1 THR 38 1.975 10.887 8.703 186 HG21 THR 38 HG21 THR 38 2.951 7.539 6.924 187 HG22 THR 38 HG22 THR 38 2.364 7.504 8.588 188 HG23 THR 38 HG23 THR 38 3.776 8.475 8.171 189 HA PRO 39 HA PRO 39 4.094 9.456 2.630 190 HB2 PRO 39 HB2 PRO 39 6.113 7.637 3.846 191 HB3 PRO 39 HB1 PRO 39 6.295 8.811 2.534 192 HG2 PRO 39 HG2 PRO 39 7.253 9.354 4.945 193 HG3 PRO 39 HG1 PRO 39 6.476 10.613 3.965 194 HD2 PRO 39 HD2 PRO 39 5.408 9.138 6.323 195 HD3 PRO 39 HD1 PRO 39 5.168 10.829 5.840 196 H LEU 40 HN LEU 40 3.149 7.975 1.383 197 HA LEU 40 HA LEU 40 1.756 5.778 2.540 198 HB2 LEU 40 HB2 LEU 40 2.232 6.587 -0.322 199 HB3 LEU 40 HB1 LEU 40 1.242 5.215 0.133 200 HG LEU 40 HG LEU 40 0.700 8.078 0.924 201 HD11 LEU 40 HD11 LEU 40 -1.140 7.976 -0.656 202 HD12 LEU 40 HD12 LEU 40 -0.684 6.334 -1.111 203 HD13 LEU 40 HD13 LEU 40 0.392 7.684 -1.477 204 HD21 LEU 40 HD21 LEU 40 -0.850 5.530 1.358 205 HD22 LEU 40 HD22 LEU 40 -1.508 7.148 1.602 206 HD23 LEU 40 HD23 LEU 40 -0.160 6.587 2.588 207 H SER 41 HN SER 41 4.946 6.129 1.505 208 HA SER 41 HA SER 41 5.530 3.608 0.432 209 HB2 SER 41 HB2 SER 41 7.784 4.415 1.888 210 HB3 SER 41 HB1 SER 41 7.452 4.766 0.190 211 HG SER 41 HG SER 41 7.193 6.772 0.725 212 H LYS 42 HN LYS 42 5.551 4.827 3.744 213 HA LYS 42 HA LYS 42 6.398 2.372 4.913 214 HB2 LYS 42 HB2 LYS 42 5.052 4.761 6.193 215 HB3 LYS 42 HB1 LYS 42 5.902 3.475 7.045 216 HG2 LYS 42 HG2 LYS 42 7.976 4.086 5.902 217 HG3 LYS 42 HG1 LYS 42 7.129 5.389 5.072 218 HD2 LYS 42 HD2 LYS 42 6.678 6.478 7.201 219 HD3 LYS 42 HD1 LYS 42 7.465 5.147 8.061 220 HE2 LYS 42 HE2 LYS 42 9.530 5.657 6.704 221 HE3 LYS 42 HE1 LYS 42 8.718 7.127 6.170 222 HZ1 LYS 42 HZ1 LYS 42 8.777 8.023 8.291 223 HZ2 LYS 42 HZ2 LYS 42 10.279 7.250 8.163 224 HZ3 LYS 42 HZ3 LYS 42 9.031 6.523 9.036 225 H LEU 43 HN LEU 43 3.357 3.729 3.981 226 HA LEU 43 HA LEU 43 1.656 2.096 5.547 227 HB2 LEU 43 HB2 LEU 43 0.738 4.054 4.513 228 HB3 LEU 43 HB1 LEU 43 1.268 3.540 2.924 229 HG LEU 43 HG LEU 43 -0.616 1.694 4.229 230 HD11 LEU 43 HD11 LEU 43 -2.563 3.139 3.692 231 HD12 LEU 43 HD12 LEU 43 -1.447 4.483 3.449 232 HD13 LEU 43 HD13 LEU 43 -1.590 3.734 5.040 233 HD21 LEU 43 HD21 LEU 43 -0.553 3.016 1.517 234 HD22 LEU 43 HD22 LEU 43 -1.596 1.680 2.002 235 HD23 LEU 43 HD23 LEU 43 0.147 1.446 1.910 236 H MET 44 HN MET 44 3.031 1.803 2.310 237 HA MET 44 HA MET 44 1.834 -0.667 1.645 238 HB2 MET 44 HB2 MET 44 4.374 0.643 0.656 239 HB3 MET 44 HB1 MET 44 3.701 -0.823 -0.038 240 HG2 MET 44 HG2 MET 44 1.613 0.460 -0.514 241 HG3 MET 44 HG1 MET 44 2.466 1.914 -0.006 242 HE1 MET 44 HE1 MET 44 4.352 3.091 -1.354 243 HE2 MET 44 HE2 MET 44 5.209 2.343 -2.700 244 HE3 MET 44 HE3 MET 44 5.345 1.660 -1.079 245 H LYS 45 HN LYS 45 4.928 0.188 3.118 246 HA LYS 45 HA LYS 45 5.992 -2.402 3.288 247 HB2 LYS 45 HB2 LYS 45 6.478 0.103 4.894 248 HB3 LYS 45 HB1 LYS 45 7.352 -1.390 5.207 249 HG2 LYS 45 HG2 LYS 45 7.303 -0.060 2.513 250 HG3 LYS 45 HG1 LYS 45 8.514 0.292 3.746 251 HD2 LYS 45 HD2 LYS 45 8.011 -2.546 2.973 252 HD3 LYS 45 HD1 LYS 45 8.967 -1.523 1.902 253 HE2 LYS 45 HE2 LYS 45 9.641 -1.529 4.796 254 HE3 LYS 45 HE1 LYS 45 10.075 -2.948 3.846 255 HZ1 LYS 45 HZ1 LYS 45 11.336 -1.567 2.356 256 HZ2 LYS 45 HZ2 LYS 45 11.859 -1.288 3.940 257 HZ3 LYS 45 HZ3 LYS 45 10.860 -0.165 3.172 258 H ALA 46 HN ALA 46 4.049 -0.515 5.583 259 HA ALA 46 HA ALA 46 4.066 -2.305 7.724 260 HB1 ALA 46 HB1 ALA 46 3.252 -0.063 7.998 261 HB2 ALA 46 HB2 ALA 46 1.959 -1.188 8.414 262 HB3 ALA 46 HB3 ALA 46 1.936 -0.354 6.862 263 H TYR 47 HN TYR 47 1.714 -2.035 5.045 264 HA TYR 47 HA TYR 47 0.082 -4.172 5.873 265 HB2 TYR 47 HB2 TYR 47 -0.589 -2.507 4.154 266 HB3 TYR 47 HB1 TYR 47 0.574 -3.221 3.041 267 HD1 TYR 47 HD1 TYR 47 -0.240 -4.752 1.505 268 HD2 TYR 47 HD2 TYR 47 -2.267 -4.294 5.219 269 HE1 TYR 47 HE1 TYR 47 -1.936 -6.372 0.772 270 HE2 TYR 47 HE2 TYR 47 -3.968 -5.914 4.492 271 HH TYR 47 HH TYR 47 -4.873 -6.853 2.467 272 H CYS 48 HN CYS 48 2.910 -4.026 3.775 273 HA CYS 48 HA CYS 48 2.901 -6.703 2.931 274 HB2 CYS 48 HB2 CYS 48 4.287 -4.668 2.099 275 HB3 CYS 48 HB1 CYS 48 5.432 -5.145 3.348 276 HG CYS 48 HG CYS 48 6.340 -7.337 2.217 277 H GLU 49 HN GLU 49 4.182 -5.138 5.806 278 HA GLU 49 HA GLU 49 5.744 -7.256 6.789 279 HB2 GLU 49 HB2 GLU 49 4.296 -5.002 8.179 280 HB3 GLU 49 HB1 GLU 49 5.301 -6.155 9.043 281 HG2 GLU 49 HG2 GLU 49 6.280 -4.418 6.793 282 HG3 GLU 49 HG1 GLU 49 6.427 -4.015 8.502 283 H ARG 50 HN ARG 50 2.345 -6.406 7.319 284 HA ARG 50 HA ARG 50 1.826 -8.548 9.119 285 HB2 ARG 50 HB2 ARG 50 -0.088 -6.899 7.458 286 HB3 ARG 50 HB1 ARG 50 -0.557 -7.989 8.758 287 HG2 ARG 50 HG2 ARG 50 1.169 -6.502 10.111 288 HG3 ARG 50 HG1 ARG 50 0.723 -5.323 8.878 289 HD2 ARG 50 HD2 ARG 50 -1.487 -5.244 9.569 290 HD3 ARG 50 HD1 ARG 50 -1.407 -6.831 10.339 291 HE ARG 50 HE ARG 50 0.362 -5.226 11.712 292 HH11 ARG 50 HH11 ARG 50 -3.113 -5.170 11.032 293 HH12 ARG 50 HH12 ARG 50 -3.495 -4.395 12.614 294 HH21 ARG 50 HH21 ARG 50 -1.822 -3.851 14.092 295 HH22 ARG 50 HH22 ARG 50 -0.107 -4.231 13.683 296 H GLN 51 HN GLN 51 1.904 -8.277 5.676 297 HA GLN 51 HA GLN 51 0.385 -10.695 5.234 298 HB2 GLN 51 HB2 GLN 51 1.925 -8.860 3.405 299 HB3 GLN 51 HB1 GLN 51 1.196 -10.356 2.839 300 HG2 GLN 51 HG2 GLN 51 -0.162 -7.905 3.906 301 HG3 GLN 51 HG1 GLN 51 -0.341 -8.661 2.324 302 HE21 GLN 51 HE21 GLN 51 -1.502 -10.626 2.177 303 HE22 GLN 51 HE22 GLN 51 -2.657 -11.069 3.380 304 H GLY 52 HN GLY 52 3.743 -9.737 5.459 305 HA2 GLY 52 HA2 GLY 52 5.587 -11.083 5.857 306 HA3 GLY 52 HA1 GLY 52 4.544 -12.494 5.743 307 H LEU 53 HN LEU 53 5.192 -9.888 3.438 308 HA LEU 53 HA LEU 53 6.439 -11.816 1.619 309 HB2 LEU 53 HB2 LEU 53 4.192 -9.936 0.875 310 HB3 LEU 53 HB1 LEU 53 5.125 -10.885 -0.265 311 HG LEU 53 HG LEU 53 3.511 -12.167 1.930 312 HD11 LEU 53 HD11 LEU 53 1.736 -12.502 0.302 313 HD12 LEU 53 HD12 LEU 53 2.631 -11.556 -0.887 314 HD13 LEU 53 HD13 LEU 53 2.017 -10.782 0.574 315 HD21 LEU 53 HD21 LEU 53 5.295 -13.477 0.778 316 HD22 LEU 53 HD22 LEU 53 4.428 -13.228 -0.736 317 HD23 LEU 53 HD23 LEU 53 3.670 -14.133 0.577 318 H SER 54 HN SER 54 6.871 -10.271 -0.529 319 HA SER 54 HA SER 54 8.603 -8.157 0.524 320 HB2 SER 54 HB2 SER 54 9.905 -9.619 -0.779 321 HB3 SER 54 HB1 SER 54 8.640 -9.815 -1.991 322 HG SER 54 HG SER 54 10.533 -8.388 -2.478 323 H MET 55 HN MET 55 8.394 -6.049 -0.139 324 HA MET 55 HA MET 55 5.862 -5.216 -1.092 325 HB2 MET 55 HB2 MET 55 7.686 -3.963 0.358 326 HB3 MET 55 HB1 MET 55 8.215 -3.377 -1.214 327 HG2 MET 55 HG2 MET 55 5.830 -2.641 -1.603 328 HG3 MET 55 HG1 MET 55 5.547 -2.982 0.103 329 HE1 MET 55 HE1 MET 55 7.024 -0.594 -2.524 330 HE2 MET 55 HE2 MET 55 8.520 -1.323 -1.941 331 HE3 MET 55 HE3 MET 55 8.181 0.375 -1.610 332 H ARG 56 HN ARG 56 8.616 -6.325 -2.692 333 HA ARG 56 HA ARG 56 8.124 -4.854 -5.154 334 HB2 ARG 56 HB2 ARG 56 10.435 -5.513 -4.281 335 HB3 ARG 56 HB1 ARG 56 10.036 -7.156 -4.758 336 HG2 ARG 56 HG2 ARG 56 9.768 -6.432 -7.071 337 HG3 ARG 56 HG1 ARG 56 10.141 -4.775 -6.600 338 HD2 ARG 56 HD2 ARG 56 12.353 -5.543 -5.808 339 HD3 ARG 56 HD1 ARG 56 11.970 -7.160 -6.397 340 HE ARG 56 HE ARG 56 12.184 -6.402 -8.595 341 HH11 ARG 56 HH11 ARG 56 13.422 -2.712 -7.463 342 HH12 ARG 56 HH12 ARG 56 12.681 -3.824 -6.251 343 HH21 ARG 56 HH21 ARG 56 13.679 -3.392 -9.650 344 HH22 ARG 56 HH22 ARG 56 13.106 -5.028 -10.159 345 H GLN 57 HN GLN 57 6.916 -7.557 -3.617 346 HA GLN 57 HA GLN 57 6.370 -9.072 -6.047 347 HB2 GLN 57 HB2 GLN 57 7.061 -10.299 -4.051 348 HB3 GLN 57 HB1 GLN 57 5.702 -9.637 -3.151 349 HG2 GLN 57 HG2 GLN 57 4.170 -10.787 -4.725 350 HG3 GLN 57 HG1 GLN 57 5.576 -11.527 -5.488 351 HE21 GLN 57 HE21 GLN 57 3.268 -12.674 -4.028 352 HE22 GLN 57 HE22 GLN 57 3.968 -13.655 -2.783 353 H ILE 58 HN ILE 58 4.784 -6.912 -3.830 354 HA ILE 58 HA ILE 58 2.212 -7.450 -5.146 355 HB ILE 58 HB ILE 58 1.196 -6.178 -3.246 356 HG12 ILE 58 HG12 ILE 58 3.991 -6.404 -2.098 357 HG13 ILE 58 HG11 ILE 58 3.181 -4.910 -2.553 358 HG21 ILE 58 HG21 ILE 58 1.216 -8.620 -3.307 359 HG22 ILE 58 HG22 ILE 58 1.373 -8.027 -1.653 360 HG23 ILE 58 HG23 ILE 58 2.789 -8.632 -2.510 361 HD11 ILE 58 HD11 ILE 58 2.409 -6.783 -0.331 362 HD12 ILE 58 HD12 ILE 58 1.474 -5.372 -0.824 363 HD13 ILE 58 HD13 ILE 58 3.102 -5.169 -0.174 364 H ARG 59 HN ARG 59 0.792 -5.531 -5.457 365 HA ARG 59 HA ARG 59 2.266 -3.048 -6.002 366 HB2 ARG 59 HB2 ARG 59 0.520 -4.549 -7.958 367 HB3 ARG 59 HB1 ARG 59 0.942 -2.855 -8.159 368 HG2 ARG 59 HG2 ARG 59 2.879 -5.155 -8.055 369 HG3 ARG 59 HG1 ARG 59 2.356 -4.303 -9.507 370 HD2 ARG 59 HD2 ARG 59 3.302 -2.213 -8.563 371 HD3 ARG 59 HD1 ARG 59 3.912 -3.144 -7.197 372 HE ARG 59 HE ARG 59 4.972 -3.076 -9.884 373 HH11 ARG 59 HH11 ARG 59 6.396 -5.680 -7.124 374 HH12 ARG 59 HH12 ARG 59 4.867 -4.771 -6.799 375 HH21 ARG 59 HH21 ARG 59 6.932 -4.150 -10.305 376 HH22 ARG 59 HH22 ARG 59 7.564 -5.311 -9.078 377 H PHE 60 HN PHE 60 1.188 -1.286 -5.348 378 HA PHE 60 HA PHE 60 -1.553 -1.640 -4.389 379 HB2 PHE 60 HB2 PHE 60 0.603 0.375 -3.793 380 HB3 PHE 60 HB1 PHE 60 -1.071 0.670 -3.343 381 HD1 PHE 60 HD1 PHE 60 1.572 -1.943 -2.997 382 HD2 PHE 60 HD2 PHE 60 -1.786 0.013 -1.264 383 HE1 PHE 60 HE1 PHE 60 1.912 -3.204 -0.916 384 HE2 PHE 60 HE2 PHE 60 -1.455 -1.253 0.816 385 HZ PHE 60 HZ PHE 60 0.399 -2.859 0.993 386 H ARG 61 HN ARG 61 -3.257 -0.559 -5.215 387 HA ARG 61 HA ARG 61 -2.723 1.387 -7.365 388 HB2 ARG 61 HB2 ARG 61 -3.715 -1.091 -7.812 389 HB3 ARG 61 HB1 ARG 61 -5.207 -0.210 -7.525 390 HG2 ARG 61 HG2 ARG 61 -4.762 1.288 -9.324 391 HG3 ARG 61 HG1 ARG 61 -3.135 0.635 -9.535 392 HD2 ARG 61 HD2 ARG 61 -4.132 -1.553 -10.119 393 HD3 ARG 61 HD1 ARG 61 -5.733 -0.824 -9.999 394 HE ARG 61 HE ARG 61 -4.497 0.775 -11.786 395 HH11 ARG 61 HH11 ARG 61 -4.839 -2.958 -13.327 396 HH12 ARG 61 HH12 ARG 61 -4.914 -2.710 -11.546 397 HH21 ARG 61 HH21 ARG 61 -4.431 0.502 -14.054 398 HH22 ARG 61 HH22 ARG 61 -4.569 -1.165 -14.727 399 H PHE 62 HN PHE 62 -3.764 3.262 -7.223 400 HA PHE 62 HA PHE 62 -6.024 3.490 -5.345 401 HB2 PHE 62 HB2 PHE 62 -4.254 4.537 -4.180 402 HB3 PHE 62 HB1 PHE 62 -3.604 5.265 -5.646 403 HD1 PHE 62 HD1 PHE 62 -6.566 5.360 -3.397 404 HD2 PHE 62 HD2 PHE 62 -4.121 7.459 -6.175 405 HE1 PHE 62 HE1 PHE 62 -7.794 7.434 -2.910 406 HE2 PHE 62 HE2 PHE 62 -5.346 9.535 -5.692 407 HZ PHE 62 HZ PHE 62 -7.183 9.523 -4.056 408 H ASP 63 HN ASP 63 -7.798 4.111 -6.358 409 HA ASP 63 HA ASP 63 -9.246 4.989 -7.866 410 HB2 ASP 63 HB2 ASP 63 -8.109 7.083 -6.932 411 HB3 ASP 63 HB1 ASP 63 -7.179 7.113 -8.425 412 H GLY 64 HN GLY 64 -7.109 3.105 -8.759 413 HA2 GLY 64 HA2 GLY 64 -7.160 1.993 -10.861 414 HA3 GLY 64 HA1 GLY 64 -7.514 3.528 -11.634 415 H GLN 65 HN GLN 65 -5.250 4.701 -9.889 416 HA GLN 65 HA GLN 65 -3.131 3.902 -11.761 417 HB2 GLN 65 HB2 GLN 65 -3.655 6.444 -10.245 418 HB3 GLN 65 HB1 GLN 65 -2.071 6.098 -10.923 419 HG2 GLN 65 HG2 GLN 65 -4.668 6.474 -12.380 420 HG3 GLN 65 HG1 GLN 65 -3.199 7.440 -12.497 421 HE21 GLN 65 HE21 GLN 65 -1.377 6.535 -13.562 422 HE22 GLN 65 HE22 GLN 65 -1.574 5.278 -14.733 423 HA PRO 66 HA PRO 66 -0.724 2.069 -8.558 424 HB2 PRO 66 HB2 PRO 66 1.795 2.542 -9.460 425 HB3 PRO 66 HB1 PRO 66 0.717 1.350 -10.204 426 HG2 PRO 66 HG2 PRO 66 1.330 4.138 -11.082 427 HG3 PRO 66 HG1 PRO 66 1.172 2.661 -12.054 428 HD2 PRO 66 HD2 PRO 66 -0.811 4.481 -11.872 429 HD3 PRO 66 HD1 PRO 66 -1.122 2.745 -12.065 430 H ILE 67 HN ILE 67 0.582 2.529 -6.755 431 HA ILE 67 HA ILE 67 0.764 5.385 -6.118 432 HB ILE 67 HB ILE 67 0.986 3.015 -4.253 433 HG12 ILE 67 HG12 ILE 67 -1.350 4.849 -4.838 434 HG13 ILE 67 HG11 ILE 67 -1.245 3.138 -5.237 435 HG21 ILE 67 HG21 ILE 67 0.600 5.945 -3.637 436 HG22 ILE 67 HG22 ILE 67 2.118 5.063 -3.469 437 HG23 ILE 67 HG23 ILE 67 0.732 4.634 -2.467 438 HD11 ILE 67 HD11 ILE 67 -1.413 4.372 -2.501 439 HD12 ILE 67 HD12 ILE 67 -1.083 2.666 -2.791 440 HD13 ILE 67 HD13 ILE 67 -2.616 3.367 -3.307 441 H ASN 68 HN ASN 68 2.647 6.369 -5.537 442 HA ASN 68 HA ASN 68 5.116 4.851 -6.031 443 HB2 ASN 68 HB2 ASN 68 4.732 7.852 -5.871 444 HB3 ASN 68 HB1 ASN 68 6.189 7.009 -6.383 445 HD21 ASN 68 HD21 ASN 68 2.973 7.969 -7.244 446 HD22 ASN 68 HD22 ASN 68 3.102 7.606 -8.936 447 H GLU 69 HN GLU 69 6.968 5.326 -4.619 448 HA GLU 69 HA GLU 69 6.243 5.126 -1.880 449 HB2 GLU 69 HB2 GLU 69 8.885 5.416 -3.295 450 HB3 GLU 69 HB1 GLU 69 8.771 5.342 -1.543 451 HG2 GLU 69 HG2 GLU 69 7.601 3.154 -1.792 452 HG3 GLU 69 HG1 GLU 69 7.961 3.226 -3.518 453 H THR 70 HN THR 70 6.909 7.772 -3.948 454 HA THR 70 HA THR 70 7.541 9.586 -1.764 455 HB THR 70 HB THR 70 7.277 11.094 -4.071 456 HG1 THR 70 HG1 THR 70 8.538 9.722 -5.572 457 HG21 THR 70 HG21 THR 70 9.110 11.216 -2.444 458 HG22 THR 70 HG22 THR 70 9.732 11.078 -4.089 459 HG23 THR 70 HG23 THR 70 9.730 9.673 -3.026 460 H ASP 71 HN ASP 71 4.754 8.293 -2.745 461 HA ASP 71 HA ASP 71 3.201 10.729 -3.006 462 HB2 ASP 71 HB2 ASP 71 2.522 7.807 -3.153 463 HB3 ASP 71 HB1 ASP 71 1.253 9.015 -2.996 464 H THR 72 HN THR 72 1.485 11.290 -1.630 465 HA THR 72 HA THR 72 1.516 10.152 1.074 466 HB THR 72 HB THR 72 1.103 12.972 1.284 467 HG1 THR 72 HG1 THR 72 3.490 12.219 -0.097 468 HG21 THR 72 HG21 THR 72 3.490 11.345 2.156 469 HG22 THR 72 HG22 THR 72 1.963 11.411 3.031 470 HG23 THR 72 HG23 THR 72 2.935 12.870 2.844 471 HA PRO 73 HA PRO 73 -2.917 10.252 0.770 472 HB2 PRO 73 HB2 PRO 73 -2.967 11.612 3.420 473 HB3 PRO 73 HB1 PRO 73 -3.777 10.126 2.898 474 HG2 PRO 73 HG2 PRO 73 -1.654 9.997 4.482 475 HG3 PRO 73 HG1 PRO 73 -1.891 8.820 3.175 476 HD2 PRO 73 HD2 PRO 73 -0.037 11.150 3.294 477 HD3 PRO 73 HD1 PRO 73 0.206 9.546 2.578 478 H ALA 74 HN ALA 74 -1.521 13.212 2.185 479 HA ALA 74 HA ALA 74 -3.675 14.879 1.303 480 HB1 ALA 74 HB1 ALA 74 -2.436 16.698 2.180 481 HB2 ALA 74 HB2 ALA 74 -0.924 15.798 2.099 482 HB3 ALA 74 HB3 ALA 74 -2.161 15.339 3.270 483 H GLN 75 HN GLN 75 -0.736 13.734 -0.093 484 HA GLN 75 HA GLN 75 -0.497 15.780 -2.085 485 HB2 GLN 75 HB2 GLN 75 1.360 14.257 -1.174 486 HB3 GLN 75 HB1 GLN 75 0.710 13.026 -2.246 487 HG2 GLN 75 HG2 GLN 75 2.583 14.126 -3.284 488 HG3 GLN 75 HG1 GLN 75 1.102 14.503 -4.162 489 HE21 GLN 75 HE21 GLN 75 0.381 16.581 -4.256 490 HE22 GLN 75 HE22 GLN 75 1.269 17.927 -3.627 491 H LEU 76 HN LEU 76 -1.883 12.537 -1.937 492 HA LEU 76 HA LEU 76 -2.695 12.664 -4.728 493 HB2 LEU 76 HB2 LEU 76 -2.994 10.565 -2.588 494 HB3 LEU 76 HB1 LEU 76 -3.734 10.412 -4.170 495 HG LEU 76 HG LEU 76 -0.767 10.642 -3.656 496 HD11 LEU 76 HD11 LEU 76 -2.451 8.264 -4.434 497 HD12 LEU 76 HD12 LEU 76 -1.677 8.519 -2.870 498 HD13 LEU 76 HD13 LEU 76 -0.692 8.288 -4.314 499 HD21 LEU 76 HD21 LEU 76 -1.321 11.573 -5.803 500 HD22 LEU 76 HD22 LEU 76 -2.352 10.195 -6.185 501 HD23 LEU 76 HD23 LEU 76 -0.607 9.980 -6.049 502 H GLU 77 HN GLU 77 -3.774 14.078 -2.074 503 HA GLU 77 HA GLU 77 -5.724 14.936 -1.303 504 HB2 GLU 77 HB2 GLU 77 -6.442 14.575 -4.214 505 HB3 GLU 77 HB1 GLU 77 -7.420 15.479 -3.066 506 HG2 GLU 77 HG2 GLU 77 -5.721 17.102 -2.758 507 HG3 GLU 77 HG1 GLU 77 -4.539 16.122 -3.622 508 H MET 78 HN MET 78 -5.479 12.364 -0.625 509 HA MET 78 HA MET 78 -7.838 10.856 -1.350 510 HB2 MET 78 HB2 MET 78 -5.803 10.258 0.805 511 HB3 MET 78 HB1 MET 78 -6.953 9.131 0.096 512 HG2 MET 78 HG2 MET 78 -5.808 9.103 -1.962 513 HG3 MET 78 HG1 MET 78 -4.836 10.504 -1.520 514 HE1 MET 78 HE1 MET 78 -5.205 6.641 -1.380 515 HE2 MET 78 HE2 MET 78 -5.800 7.105 0.212 516 HE3 MET 78 HE3 MET 78 -4.286 6.217 0.064 517 H GLU 79 HN GLU 79 -9.547 10.356 0.012 518 HA GLU 79 HA GLU 79 -9.860 12.159 2.319 519 HB2 GLU 79 HB2 GLU 79 -11.713 11.238 0.188 520 HB3 GLU 79 HB1 GLU 79 -12.389 11.441 1.799 521 HG2 GLU 79 HG2 GLU 79 -10.789 13.602 0.477 522 HG3 GLU 79 HG1 GLU 79 -12.519 13.412 0.190 523 H ASP 80 HN ASP 80 -11.554 11.256 3.921 524 HA ASP 80 HA ASP 80 -10.523 8.835 4.981 525 HB2 ASP 80 HB2 ASP 80 -11.480 10.661 6.371 526 HB3 ASP 80 HB1 ASP 80 -13.076 10.284 5.728 527 H GLU 81 HN GLU 81 -11.311 6.802 4.950 528 HA GLU 81 HA GLU 81 -12.574 4.995 4.439 529 HB2 GLU 81 HB2 GLU 81 -14.607 7.083 3.722 530 HB3 GLU 81 HB1 GLU 81 -14.879 5.390 3.333 531 HG2 GLU 81 HG2 GLU 81 -14.329 4.999 5.835 532 HG3 GLU 81 HG1 GLU 81 -14.707 6.710 5.999 533 H ASP 82 HN ASP 82 -10.735 6.466 2.580 534 HA ASP 82 HA ASP 82 -11.707 5.932 -0.065 535 HB2 ASP 82 HB2 ASP 82 -9.719 7.508 0.828 536 HB3 ASP 82 HB1 ASP 82 -8.775 6.080 0.412 537 H THR 83 HN THR 83 -10.498 4.370 -1.544 538 HA THR 83 HA THR 83 -9.951 1.893 -0.031 539 HB THR 83 HB THR 83 -11.051 1.793 -2.813 540 HG1 THR 83 HG1 THR 83 -12.450 3.147 -1.512 541 HG21 THR 83 HG21 THR 83 -11.949 -0.340 -2.025 542 HG22 THR 83 HG22 THR 83 -11.329 -0.014 -0.407 543 HG23 THR 83 HG23 THR 83 -10.210 -0.253 -1.750 544 H ILE 84 HN ILE 84 -8.116 0.863 -0.434 545 HA ILE 84 HA ILE 84 -6.554 1.637 -2.819 546 HB ILE 84 HB ILE 84 -5.420 0.634 -0.202 547 HG12 ILE 84 HG12 ILE 84 -5.468 3.480 -1.238 548 HG13 ILE 84 HG11 ILE 84 -6.493 2.867 0.056 549 HG21 ILE 84 HG21 ILE 84 -3.288 1.459 -1.152 550 HG22 ILE 84 HG22 ILE 84 -4.137 1.826 -2.654 551 HG23 ILE 84 HG23 ILE 84 -4.011 0.157 -2.098 552 HD11 ILE 84 HD11 ILE 84 -3.491 3.060 0.094 553 HD12 ILE 84 HD12 ILE 84 -4.484 2.373 1.378 554 HD13 ILE 84 HD13 ILE 84 -4.628 4.083 0.974 555 H ASP 85 HN ASP 85 -6.176 0.028 -4.207 556 HA ASP 85 HA ASP 85 -6.930 -2.688 -3.434 557 HB2 ASP 85 HB2 ASP 85 -7.371 -1.233 -5.739 558 HB3 ASP 85 HB1 ASP 85 -6.037 -2.289 -6.194 559 H VAL 86 HN VAL 86 -5.569 -4.458 -3.656 560 HA VAL 86 HA VAL 86 -2.718 -3.857 -4.093 561 HB VAL 86 HB VAL 86 -3.741 -5.786 -2.003 562 HG11 VAL 86 HG11 VAL 86 -1.418 -5.808 -1.241 563 HG12 VAL 86 HG12 VAL 86 -0.973 -4.710 -2.546 564 HG13 VAL 86 HG13 VAL 86 -1.543 -6.338 -2.918 565 HG21 VAL 86 HG21 VAL 86 -3.028 -4.146 -0.336 566 HG22 VAL 86 HG22 VAL 86 -4.301 -3.496 -1.367 567 HG23 VAL 86 HG23 VAL 86 -2.624 -3.010 -1.622 568 H PHE 87 HN PHE 87 -2.095 -4.914 -5.834 569 HA PHE 87 HA PHE 87 -3.271 -7.558 -6.406 570 HB2 PHE 87 HB2 PHE 87 -1.973 -5.555 -8.269 571 HB3 PHE 87 HB1 PHE 87 -2.513 -7.160 -8.751 572 HD1 PHE 87 HD1 PHE 87 -4.933 -7.704 -8.728 573 HD2 PHE 87 HD2 PHE 87 -3.492 -3.761 -8.028 574 HE1 PHE 87 HE1 PHE 87 -7.178 -6.807 -9.191 575 HE2 PHE 87 HE2 PHE 87 -5.733 -2.856 -8.483 576 HZ PHE 87 HZ PHE 87 -7.582 -4.379 -9.064 577 H GLN 88 HN GLN 88 -1.694 -9.022 -7.641 578 HA GLN 88 HA GLN 88 0.925 -8.864 -6.306 579 HB2 GLN 88 HB2 GLN 88 -0.694 -11.231 -7.235 580 HB3 GLN 88 HB1 GLN 88 0.995 -11.361 -6.765 581 HG2 GLN 88 HG2 GLN 88 -0.355 -9.985 -4.697 582 HG3 GLN 88 HG1 GLN 88 -1.326 -11.393 -5.127 583 HE21 GLN 88 HE21 GLN 88 -0.871 -12.437 -3.191 584 HE22 GLN 88 HE22 GLN 88 0.678 -13.125 -2.855 585 H GLN 89 HN GLN 89 2.793 -9.304 -7.474 586 HA GLN 89 HA GLN 89 2.676 -8.555 -10.243 587 HB2 GLN 89 HB2 GLN 89 4.506 -7.974 -8.524 588 HB3 GLN 89 HB1 GLN 89 5.110 -9.600 -8.808 589 HG2 GLN 89 HG2 GLN 89 6.315 -7.978 -10.145 590 HG3 GLN 89 HG1 GLN 89 5.408 -9.090 -11.171 591 HE21 GLN 89 HE21 GLN 89 5.395 -7.656 -12.891 592 HE22 GLN 89 HE22 GLN 89 4.418 -6.230 -12.899 593 H GLN 90 HN GLN 90 3.545 -9.812 -11.989 594 HA GLN 90 HA GLN 90 2.562 -12.454 -12.072 595 HB2 GLN 90 HB2 GLN 90 4.345 -10.874 -13.917 596 HB3 GLN 90 HB1 GLN 90 3.885 -12.534 -14.263 597 HG2 GLN 90 HG2 GLN 90 2.408 -11.150 -15.470 598 HG3 GLN 90 HG1 GLN 90 1.491 -11.799 -14.113 599 HE21 GLN 90 HE21 GLN 90 -0.004 -10.142 -14.191 600 HE22 GLN 90 HE22 GLN 90 0.363 -8.539 -13.669 601 H THR 91 HN THR 91 3.635 -14.423 -12.165 602 HA THR 91 HA THR 91 6.113 -14.503 -10.659 603 HB THR 91 HB THR 91 5.111 -17.080 -11.548 604 HG1 THR 91 HG1 THR 91 3.193 -16.679 -9.996 605 HG21 THR 91 HG21 THR 91 5.443 -15.769 -8.847 606 HG22 THR 91 HG22 THR 91 6.597 -16.829 -9.654 607 HG23 THR 91 HG23 THR 91 5.053 -17.472 -9.097 608 H GLY 92 HN GLY 92 5.187 -14.524 -13.910 609 HA2 GLY 92 HA2 GLY 92 7.693 -14.584 -14.998 610 HA3 GLY 92 HA1 GLY 92 7.210 -16.273 -14.921 611 H ASN 357 HT1 ASN 357 -13.862 -12.315 6.621 612 HA ASN 357 HA ASN 357 -12.441 -10.169 5.167 613 HB2 ASN 357 HB2 ASN 357 -14.530 -8.809 5.992 614 HB3 ASN 357 HB1 ASN 357 -14.616 -9.724 4.491 615 HD21 ASN 357 HD21 ASN 357 -15.671 -9.500 7.779 616 HD22 ASN 357 HD22 ASN 357 -16.921 -10.692 7.670 617 H ASN 358 HN ASN 358 -10.895 -9.614 6.557 618 HA ASN 358 HA ASN 358 -11.633 -9.338 9.387 619 HB2 ASN 358 HB2 ASN 358 -9.352 -9.890 10.008 620 HB3 ASN 358 HB1 ASN 358 -9.993 -11.166 8.983 621 HD21 ASN 358 HD21 ASN 358 -7.701 -8.561 9.234 622 HD22 ASN 358 HD22 ASN 358 -6.808 -8.944 7.808 623 H ARG 359 HN ARG 359 -11.346 -7.409 10.344 624 HA ARG 359 HA ARG 359 -9.839 -5.398 8.782 625 HB2 ARG 359 HB2 ARG 359 -11.807 -4.291 10.628 626 HB3 ARG 359 HB1 ARG 359 -11.564 -3.950 8.920 627 HG2 ARG 359 HG2 ARG 359 -12.790 -6.072 8.414 628 HG3 ARG 359 HG1 ARG 359 -13.197 -6.171 10.128 629 HD2 ARG 359 HD2 ARG 359 -15.043 -5.144 9.155 630 HD3 ARG 359 HD1 ARG 359 -14.128 -3.808 9.852 631 HE ARG 359 HE ARG 359 -13.946 -4.513 6.997 632 HH11 ARG 359 HH11 ARG 359 -14.375 -2.174 9.579 633 HH12 ARG 359 HH12 ARG 359 -14.417 -0.772 8.448 634 HH21 ARG 359 HH21 ARG 359 -13.958 -2.772 5.533 635 HH22 ARG 359 HH22 ARG 359 -14.180 -1.105 6.185 636 H ASP 360 HN ASP 360 -8.128 -4.704 9.740 637 HA ASP 360 HA ASP 360 -8.025 -4.491 12.652 638 HB2 ASP 360 HB2 ASP 360 -5.505 -4.942 12.440 639 HB3 ASP 360 HB1 ASP 360 -6.596 -6.311 12.331 640 HA PRO 361 HA PRO 361 -6.684 -0.446 11.400 641 HB2 PRO 361 HB2 PRO 361 -7.033 0.772 13.762 642 HB3 PRO 361 HB1 PRO 361 -8.408 0.118 12.861 643 HG2 PRO 361 HG2 PRO 361 -7.199 -0.859 15.350 644 HG3 PRO 361 HG1 PRO 361 -8.804 -1.186 14.673 645 HD2 PRO 361 HD2 PRO 361 -6.402 -2.820 14.507 646 HD3 PRO 361 HD1 PRO 361 -8.059 -3.216 14.009 647 H ILE 362 HN ILE 362 -4.764 0.358 11.095 648 HA ILE 362 HA ILE 362 -2.654 -0.029 13.117 649 HB ILE 362 HB ILE 362 -2.196 0.290 10.156 650 HG12 ILE 362 HG12 ILE 362 -1.996 -2.367 11.551 651 HG13 ILE 362 HG11 ILE 362 -3.536 -1.812 10.900 652 HG21 ILE 362 HG21 ILE 362 -0.385 -0.709 12.353 653 HG22 ILE 362 HG22 ILE 362 -0.295 0.862 11.558 654 HG23 ILE 362 HG23 ILE 362 0.033 -0.611 10.643 655 HD11 ILE 362 HD11 ILE 362 -0.990 -2.199 9.345 656 HD12 ILE 362 HD12 ILE 362 -2.519 -1.617 8.689 657 HD13 ILE 362 HD13 ILE 362 -2.401 -3.257 9.325 658 H VAL 363 HN VAL 363 -1.698 1.789 13.897 659 HA VAL 363 HA VAL 363 -2.089 4.266 12.327 660 HB VAL 363 HB VAL 363 -1.757 4.096 15.329 661 HG11 VAL 363 HG11 VAL 363 -0.931 6.163 14.348 662 HG12 VAL 363 HG12 VAL 363 -2.373 6.459 15.317 663 HG13 VAL 363 HG13 VAL 363 -2.485 6.429 13.557 664 HG21 VAL 363 HG21 VAL 363 -4.321 4.948 14.070 665 HG22 VAL 363 HG22 VAL 363 -4.022 4.258 15.667 666 HG23 VAL 363 HG23 VAL 363 -3.973 3.227 14.235 667 H ILE 364 HN ILE 364 -0.269 5.089 11.586 668 HA ILE 364 HA ILE 364 2.170 4.736 13.174 669 HB ILE 364 HB ILE 364 2.343 3.281 11.196 670 HG12 ILE 364 HG12 ILE 364 4.529 4.110 10.392 671 HG13 ILE 364 HG11 ILE 364 4.189 5.681 11.108 672 HG21 ILE 364 HG21 ILE 364 2.012 5.841 9.651 673 HG22 ILE 364 HG22 ILE 364 0.997 4.402 9.576 674 HG23 ILE 364 HG23 ILE 364 2.642 4.349 8.952 675 HD11 ILE 364 HD11 ILE 364 4.249 4.747 13.319 676 HD12 ILE 364 HD12 ILE 364 5.715 4.278 12.456 677 HD13 ILE 364 HD13 ILE 364 4.407 3.115 12.670 678 H SER 365 HN SER 365 3.285 6.532 13.587 679 HA SER 365 HA SER 365 2.428 8.970 12.175 680 HB2 SER 365 HB2 SER 365 3.265 8.742 15.090 681 HB3 SER 365 HB1 SER 365 2.799 10.226 14.254 682 HG SER 365 HG SER 365 0.973 8.219 13.961 683 H ASP 366 HN ASP 366 4.014 10.169 11.277 684 HA ASP 366 HA ASP 366 6.780 9.335 11.835 685 HB2 ASP 366 HB2 ASP 366 5.720 8.834 9.516 686 HB3 ASP 366 HB1 ASP 366 5.880 10.564 9.233 687 H SER 367 HN SER 367 8.157 10.861 12.423 688 HA SER 367 HA SER 367 7.230 13.650 12.364 689 HB2 SER 367 HB2 SER 367 9.133 12.411 14.366 690 HB3 SER 367 HB1 SER 367 8.414 14.015 14.439 691 HG SER 367 HG SER 367 6.354 12.973 14.616 692 HA PRO 368 HA PRO 368 10.879 13.966 9.734 693 HB2 PRO 368 HB2 PRO 368 10.345 16.420 8.763 694 HB3 PRO 368 HB1 PRO 368 9.450 14.991 8.224 695 HG2 PRO 368 HG2 PRO 368 8.643 17.077 10.194 696 HG3 PRO 368 HG1 PRO 368 7.679 16.295 8.925 697 HD2 PRO 368 HD2 PRO 368 7.593 15.573 11.560 698 HD3 PRO 368 HD1 PRO 368 7.219 14.468 10.224
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