NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
513452 | 2lax | 17539 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H ASP 170 H ASP 170 16.504 0.122 -7.171 2 HA ASP 170 HA ASP 170 13.923 1.420 -7.779 3 HB2 ASP 170 HB2 ASP 170 13.227 -0.968 -8.373 4 HB3 ASP 170 HB1 ASP 170 14.205 -0.098 -9.549 5 H VAL 171 HN VAL 171 15.943 0.006 -5.488 6 HA VAL 171 HA VAL 171 14.062 -1.489 -4.024 7 HB VAL 171 HB VAL 171 16.455 -1.841 -3.760 8 HG11 VAL 171 HG11 VAL 171 17.242 0.458 -3.858 9 HG12 VAL 171 HG12 VAL 171 17.831 -0.358 -2.410 10 HG13 VAL 171 HG13 VAL 171 16.497 0.788 -2.293 11 HG21 VAL 171 HG21 VAL 171 14.992 -2.645 -2.024 12 HG22 VAL 171 HG22 VAL 171 15.033 -1.079 -1.214 13 HG23 VAL 171 HG23 VAL 171 16.493 -2.066 -1.303 14 HA PRO 172 HA PRO 172 13.567 2.660 -1.353 15 HB2 PRO 172 HB2 PRO 172 12.823 4.695 -3.086 16 HB3 PRO 172 HB1 PRO 172 14.388 4.559 -2.279 17 HG2 PRO 172 HG2 PRO 172 13.604 3.749 -5.046 18 HG3 PRO 172 HG1 PRO 172 15.094 4.534 -4.484 19 HD2 PRO 172 HD2 PRO 172 15.066 1.936 -5.049 20 HD3 PRO 172 HD1 PRO 172 15.967 2.549 -3.646 21 H LEU 173 HN LEU 173 11.998 1.639 -4.299 22 HA LEU 173 HA LEU 173 9.417 1.861 -2.904 23 HB2 LEU 173 HB2 LEU 173 9.828 3.224 -5.093 24 HB3 LEU 173 HB1 LEU 173 9.650 1.677 -5.893 25 HG LEU 173 HG LEU 173 7.580 3.077 -5.865 26 HD11 LEU 173 HD11 LEU 173 7.376 0.433 -4.436 27 HD12 LEU 173 HD12 LEU 173 7.430 0.671 -6.182 28 HD13 LEU 173 HD13 LEU 173 6.056 1.271 -5.252 29 HD21 LEU 173 HD21 LEU 173 7.817 4.080 -3.672 30 HD22 LEU 173 HD22 LEU 173 7.661 2.500 -2.906 31 HD23 LEU 173 HD23 LEU 173 6.291 3.200 -3.772 32 HA PRO 174 HA PRO 174 10.319 -2.569 -2.824 33 HB2 PRO 174 HB2 PRO 174 7.632 -2.540 -1.538 34 HB3 PRO 174 HB1 PRO 174 9.139 -3.282 -0.992 35 HG2 PRO 174 HG2 PRO 174 8.223 -1.059 0.140 36 HG3 PRO 174 HG1 PRO 174 9.959 -1.297 -0.134 37 HD2 PRO 174 HD2 PRO 174 8.012 0.386 -1.649 38 HD3 PRO 174 HD1 PRO 174 9.708 0.709 -1.237 39 H ALA 175 HN ALA 175 9.469 -4.422 -3.874 40 HA ALA 175 HA ALA 175 8.067 -3.579 -6.281 41 HB1 ALA 175 HB1 ALA 175 8.934 -5.614 -7.274 42 HB2 ALA 175 HB2 ALA 175 9.522 -6.153 -5.701 43 HB3 ALA 175 HB3 ALA 175 10.225 -4.727 -6.464 44 H GLY 176 HN GLY 176 7.598 -5.765 -3.573 45 HA2 GLY 176 HA2 GLY 176 5.270 -6.992 -4.825 46 HA3 GLY 176 HA1 GLY 176 5.884 -7.336 -3.211 47 H TRP 177 HN TRP 177 5.605 -4.030 -3.899 48 HA TRP 177 HA TRP 177 3.220 -3.910 -2.182 49 HB2 TRP 177 HB2 TRP 177 5.559 -1.993 -2.329 50 HB3 TRP 177 HB1 TRP 177 4.136 -1.780 -1.316 51 HD1 TRP 177 HD1 TRP 177 6.660 -4.718 -1.771 52 HE1 TRP 177 HE1 TRP 177 7.380 -5.518 0.563 53 HE3 TRP 177 HE3 TRP 177 3.935 -1.464 1.063 54 HZ2 TRP 177 HZ2 TRP 177 6.864 -4.847 3.246 55 HZ3 TRP 177 HZ3 TRP 177 4.105 -1.607 3.512 56 HH2 TRP 177 HH2 TRP 177 5.545 -3.265 4.573 57 H GLU 178 HN GLU 178 1.550 -2.779 -2.842 58 HA GLU 178 HA GLU 178 1.641 -1.484 -5.455 59 HB2 GLU 178 HB2 GLU 178 -0.104 -3.104 -5.261 60 HB3 GLU 178 HB1 GLU 178 -0.605 -2.486 -3.692 61 HG2 GLU 178 HG2 GLU 178 -1.547 -0.542 -4.664 62 HG3 GLU 178 HG1 GLU 178 -0.794 -0.873 -6.223 63 H MET 179 HN MET 179 1.309 0.656 -5.749 64 HA MET 179 HA MET 179 1.144 2.343 -3.381 65 HB2 MET 179 HB2 MET 179 1.465 3.043 -6.301 66 HB3 MET 179 HB1 MET 179 1.412 4.220 -5.002 67 HG2 MET 179 HG2 MET 179 3.491 2.068 -5.294 68 HG3 MET 179 HG1 MET 179 3.664 3.745 -5.808 69 HE1 MET 179 HE1 MET 179 3.965 5.779 -4.233 70 HE2 MET 179 HE2 MET 179 3.720 5.719 -2.488 71 HE3 MET 179 HE3 MET 179 2.359 5.454 -3.578 72 H ALA 180 HN ALA 180 -0.995 2.032 -2.695 73 HA ALA 180 HA ALA 180 -3.095 2.765 -4.571 74 HB1 ALA 180 HB1 ALA 180 -3.508 0.892 -3.063 75 HB2 ALA 180 HB2 ALA 180 -4.643 2.210 -2.771 76 HB3 ALA 180 HB3 ALA 180 -3.287 1.956 -1.674 77 H LYS 181 HN LYS 181 -2.690 4.860 -4.973 78 HA LYS 181 HA LYS 181 -2.470 6.725 -2.747 79 HB2 LYS 181 HB2 LYS 181 -2.084 7.105 -5.726 80 HB3 LYS 181 HB1 LYS 181 -1.877 8.371 -4.524 81 HG2 LYS 181 HG2 LYS 181 -0.011 7.226 -3.542 82 HG3 LYS 181 HG1 LYS 181 -0.272 5.808 -4.562 83 HD2 LYS 181 HD2 LYS 181 0.396 8.554 -5.622 84 HD3 LYS 181 HD1 LYS 181 1.591 7.294 -5.309 85 HE2 LYS 181 HE2 LYS 181 0.395 5.812 -6.881 86 HE3 LYS 181 HE1 LYS 181 -0.730 7.123 -7.229 87 HZ1 LYS 181 HZ1 LYS 181 1.015 6.937 -8.900 88 HZ2 LYS 181 HZ2 LYS 181 2.202 7.208 -7.720 89 HZ3 LYS 181 HZ3 LYS 181 1.087 8.431 -8.101 90 H THR 182 HN THR 182 -4.451 7.091 -1.947 91 HA THR 182 HA THR 182 -6.728 7.436 -3.721 92 HB THR 182 HB THR 182 -6.643 7.591 -0.700 93 HG1 THR 182 HG1 THR 182 -7.697 5.300 -1.699 94 HG21 THR 182 HG21 THR 182 -9.024 7.056 -0.848 95 HG22 THR 182 HG22 THR 182 -8.921 7.053 -2.609 96 HG23 THR 182 HG23 THR 182 -8.655 8.548 -1.712 97 H SER 183 HN SER 183 -7.529 9.401 -4.315 98 HA SER 183 HA SER 183 -6.075 11.755 -3.822 99 HB2 SER 183 HB2 SER 183 -8.906 11.590 -4.865 100 HB3 SER 183 HB1 SER 183 -7.717 12.856 -5.178 101 HG SER 183 HG SER 183 -8.147 10.877 -6.715 102 H SER 184 HN SER 184 -8.500 10.246 -1.978 103 HA SER 184 HA SER 184 -9.605 12.522 -0.699 104 HB2 SER 184 HB2 SER 184 -9.404 9.713 0.400 105 HB3 SER 184 HB1 SER 184 -10.566 10.959 0.859 106 HG SER 184 HG SER 184 -11.221 10.890 -1.440 107 H GLY 185 HN GLY 185 -6.558 11.064 -0.496 108 HA2 GLY 185 HA2 GLY 185 -4.820 12.173 0.756 109 HA3 GLY 185 HA1 GLY 185 -6.008 12.528 2.004 110 H GLN 186 HN GLN 186 -5.532 9.446 0.378 111 HA GLN 186 HA GLN 186 -4.618 8.300 2.927 112 HB2 GLN 186 HB2 GLN 186 -6.632 7.097 1.014 113 HB3 GLN 186 HB1 GLN 186 -5.969 6.282 2.424 114 HG2 GLN 186 HG2 GLN 186 -6.948 8.040 3.853 115 HG3 GLN 186 HG1 GLN 186 -7.682 8.753 2.420 116 HE21 GLN 186 HE21 GLN 186 -8.281 6.144 1.207 117 HE22 GLN 186 HE22 GLN 186 -9.618 5.519 2.103 118 H ARG 187 HN ARG 187 -2.696 7.381 2.697 119 HA ARG 187 HA ARG 187 -2.072 6.140 0.110 120 HB2 ARG 187 HB2 ARG 187 0.344 6.456 0.729 121 HB3 ARG 187 HB1 ARG 187 -0.541 7.937 0.402 122 HG2 ARG 187 HG2 ARG 187 -0.769 8.319 2.818 123 HG3 ARG 187 HG1 ARG 187 0.158 6.850 3.123 124 HD2 ARG 187 HD2 ARG 187 1.188 9.189 1.528 125 HD3 ARG 187 HD1 ARG 187 1.466 8.985 3.256 126 HE ARG 187 HE ARG 187 2.586 6.819 2.584 127 HH11 ARG 187 HH11 ARG 187 2.359 9.503 0.353 128 HH12 ARG 187 HH12 ARG 187 3.892 9.174 -0.404 129 HH21 ARG 187 HH21 ARG 187 4.627 6.377 1.584 130 HH22 ARG 187 HH22 ARG 187 5.170 7.398 0.285 131 H TYR 188 HN TYR 188 -2.831 4.098 0.547 132 HA TYR 188 HA TYR 188 -1.503 2.726 2.779 133 HB2 TYR 188 HB2 TYR 188 -3.352 1.135 2.830 134 HB3 TYR 188 HB1 TYR 188 -3.944 2.772 3.051 135 HD1 TYR 188 HD2 TYR 188 -5.277 3.855 1.278 136 HD2 TYR 188 HD1 TYR 188 -3.979 -0.182 0.930 137 HE1 TYR 188 HE2 TYR 188 -6.935 3.480 -0.497 138 HE2 TYR 188 HE1 TYR 188 -5.639 -0.569 -0.838 139 HH TYR 188 HH TYR 188 -7.376 1.992 -2.331 140 H PHE 189 HN PHE 189 -0.562 0.745 2.409 141 HA PHE 189 HA PHE 189 0.054 0.309 -0.428 142 HB2 PHE 189 HB2 PHE 189 1.853 -0.026 1.989 143 HB3 PHE 189 HB1 PHE 189 2.298 -0.398 0.319 144 HD1 PHE 189 HD2 PHE 189 1.247 1.777 -1.202 145 HD2 PHE 189 HD1 PHE 189 3.079 1.862 2.632 146 HE1 PHE 189 HE2 PHE 189 1.892 4.120 -1.570 147 HE2 PHE 189 HE1 PHE 189 3.703 4.220 2.273 148 HZ PHE 189 HZ PHE 189 3.115 5.343 0.174 149 H LEU 190 HN LEU 190 -0.446 -1.566 -1.235 150 HA LEU 190 HA LEU 190 -1.224 -3.765 0.490 151 HB2 LEU 190 HB2 LEU 190 -1.492 -3.113 -2.384 152 HB3 LEU 190 HB1 LEU 190 -1.447 -4.805 -1.963 153 HG LEU 190 HG LEU 190 -3.560 -2.789 -1.517 154 HD11 LEU 190 HD11 LEU 190 -3.905 -4.389 -3.207 155 HD12 LEU 190 HD12 LEU 190 -4.892 -4.933 -1.844 156 HD13 LEU 190 HD13 LEU 190 -3.348 -5.709 -2.180 157 HD21 LEU 190 HD21 LEU 190 -2.961 -3.359 0.793 158 HD22 LEU 190 HD22 LEU 190 -3.101 -5.074 0.406 159 HD23 LEU 190 HD23 LEU 190 -4.526 -4.038 0.348 160 H ASN 191 HN ASN 191 0.125 -5.537 0.922 161 HA ASN 191 HA ASN 191 2.410 -5.906 -0.868 162 HB2 ASN 191 HB2 ASN 191 1.555 -7.532 1.548 163 HB3 ASN 191 HB1 ASN 191 2.981 -7.853 0.571 164 HD21 ASN 191 HD21 ASN 191 1.865 -4.651 1.516 165 HD22 ASN 191 HD22 ASN 191 3.199 -4.303 2.554 166 H HIS 192 HN HIS 192 1.755 -6.715 -2.799 167 HA HIS 192 HA HIS 192 -0.690 -8.199 -3.007 168 HB2 HIS 192 HB2 HIS 192 1.299 -7.127 -4.912 169 HB3 HIS 192 HB1 HIS 192 0.392 -8.535 -5.457 170 HD1 HIS 192 HD1 HIS 192 -2.105 -8.230 -5.940 171 HD2 HIS 192 HD2 HIS 192 -0.236 -4.785 -4.554 172 HE1 HIS 192 HE1 HIS 192 -3.757 -6.368 -6.311 173 HE2 HIS 192 HE2 HIS 192 -2.660 -4.306 -5.341 174 H ILE 193 HN ILE 193 2.196 -9.162 -1.939 175 HA ILE 193 HA ILE 193 2.152 -11.817 -3.111 176 HB ILE 193 HB ILE 193 4.085 -12.214 -1.525 177 HG12 ILE 193 HG12 ILE 193 3.806 -9.224 -1.107 178 HG13 ILE 193 HG11 ILE 193 3.494 -10.459 0.112 179 HG21 ILE 193 HG21 ILE 193 4.313 -9.940 -3.493 180 HG22 ILE 193 HG22 ILE 193 4.422 -11.661 -3.866 181 HG23 ILE 193 HG23 ILE 193 5.660 -10.894 -2.870 182 HD11 ILE 193 HD11 ILE 193 5.617 -9.538 0.565 183 HD12 ILE 193 HD12 ILE 193 6.117 -9.687 -1.117 184 HD13 ILE 193 HD13 ILE 193 5.902 -11.134 -0.131 185 H ASP 194 HN ASP 194 1.615 -10.260 0.032 186 HA ASP 194 HA ASP 194 0.620 -12.789 1.126 187 HB2 ASP 194 HB2 ASP 194 2.328 -11.612 2.442 188 HB3 ASP 194 HB1 ASP 194 1.304 -10.189 2.514 189 H GLN 195 HN GLN 195 -0.539 -9.923 -0.233 190 HA GLN 195 HA GLN 195 -2.557 -8.861 -0.340 191 HB2 GLN 195 HB2 GLN 195 -3.436 -11.207 -0.591 192 HB3 GLN 195 HB1 GLN 195 -3.659 -11.264 1.149 193 HG2 GLN 195 HG2 GLN 195 -5.252 -9.415 1.007 194 HG3 GLN 195 HG1 GLN 195 -5.028 -9.362 -0.741 195 HE21 GLN 195 HE21 GLN 195 -6.303 -11.198 1.931 196 HE22 GLN 195 HE22 GLN 195 -7.346 -12.210 0.992 197 H THR 196 HN THR 196 -0.721 -8.282 1.635 198 HA THR 196 HA THR 196 -2.097 -7.992 4.174 199 HB THR 196 HB THR 196 0.440 -6.602 3.971 200 HG1 THR 196 HG1 THR 196 0.712 -9.370 3.581 201 HG21 THR 196 HG21 THR 196 -0.133 -9.150 5.463 202 HG22 THR 196 HG22 THR 196 -0.756 -7.591 6.014 203 HG23 THR 196 HG23 THR 196 0.985 -7.852 5.891 204 H THR 197 HN THR 197 -3.110 -6.214 4.809 205 HA THR 197 HA THR 197 -3.085 -3.851 3.121 206 HB THR 197 HB THR 197 -4.859 -3.113 4.868 207 HG1 THR 197 HG1 THR 197 -4.926 -5.927 5.352 208 HG21 THR 197 HG21 THR 197 -6.600 -4.410 3.730 209 HG22 THR 197 HG22 THR 197 -5.371 -5.503 3.092 210 HG23 THR 197 HG23 THR 197 -5.400 -3.814 2.585 211 H THR 198 HN THR 198 -1.565 -2.372 3.476 212 HA THR 198 HA THR 198 -0.480 -2.104 6.198 213 HB THR 198 HB THR 198 0.884 -1.451 3.581 214 HG1 THR 198 HG1 THR 198 0.443 -3.721 3.887 215 HG21 THR 198 HG21 THR 198 2.930 -1.483 4.952 216 HG22 THR 198 HG22 THR 198 1.940 -1.711 6.388 217 HG23 THR 198 HG23 THR 198 1.807 -0.223 5.458 218 H TRP 199 HN TRP 199 -0.931 -0.174 7.204 219 HA TRP 199 HA TRP 199 -1.523 2.169 5.542 220 HB2 TRP 199 HB2 TRP 199 -2.030 1.511 8.432 221 HB3 TRP 199 HB1 TRP 199 -2.073 3.175 7.869 222 HD1 TRP 199 HD1 TRP 199 -4.214 0.164 8.209 223 HE1 TRP 199 HE1 TRP 199 -6.487 0.563 7.071 224 HE3 TRP 199 HE3 TRP 199 -3.075 4.407 5.578 225 HZ2 TRP 199 HZ2 TRP 199 -7.637 2.419 5.279 226 HZ3 TRP 199 HZ3 TRP 199 -4.822 5.425 4.169 227 HH2 TRP 199 HH2 TRP 199 -7.054 4.449 4.025 228 H GLN 200 HN GLN 200 1.110 0.760 6.782 229 HA GLN 200 HA GLN 200 2.390 3.259 7.651 230 HB2 GLN 200 HB2 GLN 200 3.039 0.366 8.201 231 HB3 GLN 200 HB1 GLN 200 4.171 1.666 8.545 232 HG2 GLN 200 HG2 GLN 200 2.663 2.649 10.119 233 HG3 GLN 200 HG1 GLN 200 1.390 1.514 9.674 234 HE21 GLN 200 HE21 GLN 200 4.445 1.895 11.323 235 HE22 GLN 200 HE22 GLN 200 4.350 0.423 12.234 236 H ASP 201 HN ASP 201 3.846 4.171 6.370 237 HA ASP 201 HA ASP 201 4.596 3.168 3.855 238 HB2 ASP 201 HB2 ASP 201 4.691 5.559 4.424 239 HB3 ASP 201 HB1 ASP 201 5.988 5.237 5.573 240 HA PRO 202 HA PRO 202 7.390 -0.077 4.853 241 HB2 PRO 202 HB2 PRO 202 8.635 0.623 2.270 242 HB3 PRO 202 HB1 PRO 202 7.952 -0.908 2.816 243 HG2 PRO 202 HG2 PRO 202 6.718 0.738 1.037 244 HG3 PRO 202 HG1 PRO 202 5.855 -0.374 2.110 245 HD2 PRO 202 HD2 PRO 202 6.045 2.563 2.224 246 HD3 PRO 202 HD1 PRO 202 4.834 1.476 2.917 247 H ARG 203 HN ARG 203 8.465 3.148 4.047 248 HA ARG 203 HA ARG 203 11.177 2.489 4.947 249 HB2 ARG 203 HB2 ARG 203 10.037 4.807 3.409 250 HB3 ARG 203 HB1 ARG 203 11.607 4.931 4.192 251 HG2 ARG 203 HG2 ARG 203 11.811 4.330 1.830 252 HG3 ARG 203 HG1 ARG 203 12.441 3.065 2.883 253 HD2 ARG 203 HD2 ARG 203 10.171 1.953 2.658 254 HD3 ARG 203 HD1 ARG 203 9.843 3.095 1.358 255 HE ARG 203 HE ARG 203 11.480 2.038 0.043 256 HH11 ARG 203 HH11 ARG 203 11.102 0.534 3.179 257 HH12 ARG 203 HH12 ARG 203 11.890 -0.944 2.719 258 HH21 ARG 203 HH21 ARG 203 12.489 0.055 -0.590 259 HH22 ARG 203 HH22 ARG 203 12.628 -1.237 0.567 260 H LYS 204 HN LYS 204 8.293 3.847 6.047 261 HA LYS 204 HA LYS 204 9.545 5.362 8.192 262 HB2 LYS 204 HB2 LYS 204 7.655 6.492 7.459 263 HB3 LYS 204 HB1 LYS 204 6.755 5.014 7.166 264 HG2 LYS 204 HG2 LYS 204 5.780 6.215 9.005 265 HG3 LYS 204 HG1 LYS 204 6.492 4.714 9.594 266 HD2 LYS 204 HD2 LYS 204 8.495 6.011 10.296 267 HD3 LYS 204 HD1 LYS 204 7.651 7.489 9.823 268 HE2 LYS 204 HE2 LYS 204 7.417 7.155 12.203 269 HE3 LYS 204 HE1 LYS 204 5.854 6.936 11.419 270 HZ1 LYS 204 HZ1 LYS 204 6.348 4.482 11.465 271 HZ2 LYS 204 HZ2 LYS 204 6.083 5.200 12.975 272 HZ3 LYS 204 HZ3 LYS 204 7.660 4.835 12.479 273 H ALA 205 HN ALA 205 7.366 2.587 7.797 274 HA ALA 205 HA ALA 205 6.658 0.968 9.231 275 HB1 ALA 205 HB1 ALA 205 8.928 0.190 8.739 276 HB2 ALA 205 HB2 ALA 205 8.428 -0.256 10.371 277 HB3 ALA 205 HB3 ALA 205 9.537 1.094 10.125 278 H1 SER 201 HT1 SER 201 -4.104 -7.747 -11.299 279 H2 SER 201 HT2 SER 201 -3.170 -7.297 -9.953 280 H3 SER 201 HT3 SER 201 -2.421 -7.602 -11.438 281 HA SER 201 HA SER 201 -2.651 -5.211 -10.859 282 HB2 SER 201 HB2 SER 201 -3.960 -6.266 -13.379 283 HB3 SER 201 HB1 SER 201 -3.408 -4.604 -13.158 284 HG SER 201 HG SER 201 -1.969 -6.432 -14.142 285 H TPO 202 HN TPO 202 -5.027 -6.764 -9.655 286 HA TPO 202 HA TPO 202 -7.282 -5.091 -10.368 287 HB TPO 202 HB TPO 202 -7.150 -7.172 -8.178 288 HG21 TPO 202 HG21 TPO 202 -9.447 -6.086 -9.811 289 HG22 TPO 202 HG22 TPO 202 -9.104 -5.701 -8.124 290 HG23 TPO 202 HG23 TPO 202 -9.564 -7.342 -8.580 291 H TYR 203 HN TYR 203 -7.553 -3.148 -9.434 292 HA TYR 203 HA TYR 203 -6.304 -2.315 -7.040 293 HB2 TYR 203 HB2 TYR 203 -7.083 -0.656 -8.629 294 HB3 TYR 203 HB1 TYR 203 -8.740 -1.230 -8.481 295 HD1 TYR 203 HD2 TYR 203 -5.990 0.293 -6.469 296 HD2 TYR 203 HD1 TYR 203 -10.186 -0.199 -6.969 297 HE1 TYR 203 HE2 TYR 203 -6.390 1.916 -4.665 298 HE2 TYR 203 HE1 TYR 203 -10.599 1.424 -5.167 299 HH TYR 203 HH TYR 203 -9.367 2.304 -3.140 300 HA PRO 204 HA PRO 204 -9.108 -4.372 -4.223 301 HB2 PRO 204 HB2 PRO 204 -7.873 -3.691 -1.957 302 HB3 PRO 204 HB1 PRO 204 -7.120 -4.827 -3.086 303 HG2 PRO 204 HG2 PRO 204 -6.612 -1.889 -2.746 304 HG3 PRO 204 HG1 PRO 204 -5.438 -3.212 -2.886 305 HD2 PRO 204 HD2 PRO 204 -6.163 -1.625 -4.982 306 HD3 PRO 204 HD1 PRO 204 -5.640 -3.311 -5.172 307 H HIS 205 HN HIS 205 -8.997 -2.846 -1.597 308 HA HIS 205 HA HIS 205 -10.205 -0.289 -2.232 309 HB2 HIS 205 HB2 HIS 205 -12.122 -1.860 -2.195 310 HB3 HIS 205 HB1 HIS 205 -11.660 -2.368 -0.572 311 HD1 HIS 205 HD1 HIS 205 -12.721 -1.123 1.281 312 HD2 HIS 205 HD2 HIS 205 -12.771 1.020 -2.273 313 HE1 HIS 205 HE1 HIS 205 -13.964 1.000 1.791 314 HE2 HIS 205 HE2 HIS 205 -13.638 2.406 -0.277 315 H SEP 206 HN SEP 206 -9.996 1.189 -0.570 316 HA SEP 206 HA SEP 206 -7.964 1.028 1.241 317 HB2 SEP 206 HB2 SEP 206 -9.562 2.770 2.515 318 HB3 SEP 206 HB1 SEP 206 -8.715 3.175 1.025 319 HA PRO 207 HA PRO 207 -8.993 -2.241 3.875 320 HB2 PRO 207 HB2 PRO 207 -7.318 -0.846 5.891 321 HB3 PRO 207 HB1 PRO 207 -7.161 -2.472 5.216 322 HG2 PRO 207 HG2 PRO 207 -5.514 -0.522 4.465 323 HG3 PRO 207 HG1 PRO 207 -6.109 -1.716 3.295 324 HD2 PRO 207 HD2 PRO 207 -6.975 1.113 3.725 325 HD3 PRO 207 HD1 PRO 207 -6.770 0.214 2.208 326 H THR 208 HN THR 208 -9.830 0.969 4.843 327 HA THR 208 HA THR 208 -11.620 -0.198 6.830 328 HB THR 208 HB THR 208 -9.790 0.614 8.157 329 HG1 THR 208 HG1 THR 208 -11.597 1.027 9.270 330 HG21 THR 208 HG21 THR 208 -10.196 3.288 6.814 331 HG22 THR 208 HG22 THR 208 -8.811 2.217 6.606 332 HG23 THR 208 HG23 THR 208 -9.112 2.976 8.170 333 H SER 209 HN SER 209 -13.548 0.164 6.036 334 HA SER 209 HA SER 209 -14.435 2.909 5.795 335 HB2 SER 209 HB2 SER 209 -14.779 0.935 3.520 336 HB3 SER 209 HB1 SER 209 -15.579 2.502 3.628 337 HG SER 209 HG SER 209 -12.911 2.763 3.986 Start of MODEL 2 1 H ASP 170 H ASP 170 15.339 0.632 -6.644 2 HA ASP 170 HA ASP 170 13.486 -0.597 -5.783 3 HB2 ASP 170 HB2 ASP 170 14.695 -2.520 -4.943 4 HB3 ASP 170 HB1 ASP 170 15.646 -1.746 -6.206 5 H VAL 171 HN VAL 171 15.284 1.146 -3.361 6 HA VAL 171 HA VAL 171 13.794 0.051 -1.158 7 HB VAL 171 HB VAL 171 15.561 2.495 -1.192 8 HG11 VAL 171 HG11 VAL 171 14.552 0.812 1.101 9 HG12 VAL 171 HG12 VAL 171 14.029 2.449 0.703 10 HG13 VAL 171 HG13 VAL 171 15.687 2.157 1.231 11 HG21 VAL 171 HG21 VAL 171 16.792 0.516 -1.884 12 HG22 VAL 171 HG22 VAL 171 16.202 -0.366 -0.476 13 HG23 VAL 171 HG23 VAL 171 17.285 1.010 -0.263 14 HA PRO 172 HA PRO 172 11.656 4.440 -1.228 15 HB2 PRO 172 HB2 PRO 172 11.604 5.685 -3.670 16 HB3 PRO 172 HB1 PRO 172 12.775 6.043 -2.398 17 HG2 PRO 172 HG2 PRO 172 13.068 4.305 -4.812 18 HG3 PRO 172 HG1 PRO 172 14.225 5.452 -4.109 19 HD2 PRO 172 HD2 PRO 172 14.444 2.803 -3.722 20 HD3 PRO 172 HD1 PRO 172 14.883 3.971 -2.460 21 H LEU 173 HN LEU 173 11.541 2.004 -3.601 22 HA LEU 173 HA LEU 173 8.652 1.970 -3.362 23 HB2 LEU 173 HB2 LEU 173 9.503 3.213 -5.538 24 HB3 LEU 173 HB1 LEU 173 9.762 1.581 -6.113 25 HG LEU 173 HG LEU 173 7.622 2.481 -6.887 26 HD11 LEU 173 HD11 LEU 173 7.291 0.260 -4.879 27 HD12 LEU 173 HD12 LEU 173 7.783 0.083 -6.563 28 HD13 LEU 173 HD13 LEU 173 6.161 0.656 -6.174 29 HD21 LEU 173 HD21 LEU 173 5.835 3.035 -5.402 30 HD22 LEU 173 HD22 LEU 173 7.252 3.977 -4.934 31 HD23 LEU 173 HD23 LEU 173 6.781 2.560 -3.993 32 HA PRO 174 HA PRO 174 10.497 -2.154 -2.720 33 HB2 PRO 174 HB2 PRO 174 7.935 -2.510 -1.255 34 HB3 PRO 174 HB1 PRO 174 9.599 -2.764 -0.708 35 HG2 PRO 174 HG2 PRO 174 8.167 -0.689 0.158 36 HG3 PRO 174 HG1 PRO 174 9.903 -0.529 -0.175 37 HD2 PRO 174 HD2 PRO 174 7.567 0.291 -1.874 38 HD3 PRO 174 HD1 PRO 174 9.058 1.187 -1.507 39 H ALA 175 HN ALA 175 10.121 -4.023 -3.865 40 HA ALA 175 HA ALA 175 8.170 -3.656 -5.991 41 HB1 ALA 175 HB1 ALA 175 10.386 -5.680 -5.759 42 HB2 ALA 175 HB2 ALA 175 10.514 -4.102 -6.536 43 HB3 ALA 175 HB3 ALA 175 9.431 -5.327 -7.199 44 H GLY 176 HN GLY 176 7.681 -4.929 -3.151 45 HA2 GLY 176 HA2 GLY 176 5.996 -7.088 -4.273 46 HA3 GLY 176 HA1 GLY 176 6.568 -7.076 -2.604 47 H TRP 177 HN TRP 177 5.712 -4.042 -3.895 48 HA TRP 177 HA TRP 177 3.298 -4.073 -2.217 49 HB2 TRP 177 HB2 TRP 177 5.377 -1.879 -2.403 50 HB3 TRP 177 HB1 TRP 177 3.913 -1.829 -1.423 51 HD1 TRP 177 HD1 TRP 177 6.989 -4.190 -1.720 52 HE1 TRP 177 HE1 TRP 177 7.680 -4.934 0.640 53 HE3 TRP 177 HE3 TRP 177 3.398 -1.760 0.946 54 HZ2 TRP 177 HZ2 TRP 177 6.813 -4.524 3.281 55 HZ3 TRP 177 HZ3 TRP 177 3.395 -1.979 3.393 56 HH2 TRP 177 HH2 TRP 177 5.078 -3.333 4.527 57 H GLU 178 HN GLU 178 1.557 -3.056 -2.936 58 HA GLU 178 HA GLU 178 1.601 -2.075 -5.701 59 HB2 GLU 178 HB2 GLU 178 0.107 -4.004 -5.021 60 HB3 GLU 178 HB1 GLU 178 -0.781 -2.879 -4.005 61 HG2 GLU 178 HG2 GLU 178 -1.903 -3.236 -6.129 62 HG3 GLU 178 HG1 GLU 178 -1.365 -1.561 -5.974 63 H MET 179 HN MET 179 0.885 -0.023 -6.214 64 HA MET 179 HA MET 179 0.623 1.803 -3.963 65 HB2 MET 179 HB2 MET 179 0.642 2.521 -6.890 66 HB3 MET 179 HB1 MET 179 0.857 3.602 -5.517 67 HG2 MET 179 HG2 MET 179 2.774 1.406 -6.227 68 HG3 MET 179 HG1 MET 179 2.910 3.080 -6.769 69 HE1 MET 179 HE1 MET 179 3.533 5.106 -5.265 70 HE2 MET 179 HE2 MET 179 3.536 5.046 -3.502 71 HE3 MET 179 HE3 MET 179 2.029 4.818 -4.389 72 H ALA 180 HN ALA 180 -1.390 1.709 -3.139 73 HA ALA 180 HA ALA 180 -3.586 2.270 -5.006 74 HB1 ALA 180 HB1 ALA 180 -3.715 1.357 -2.135 75 HB2 ALA 180 HB2 ALA 180 -3.939 0.334 -3.554 76 HB3 ALA 180 HB3 ALA 180 -5.094 1.620 -3.203 77 H LYS 181 HN LYS 181 -3.236 4.413 -5.331 78 HA LYS 181 HA LYS 181 -2.967 6.158 -3.001 79 HB2 LYS 181 HB2 LYS 181 -2.641 6.782 -5.949 80 HB3 LYS 181 HB1 LYS 181 -2.308 7.885 -4.622 81 HG2 LYS 181 HG2 LYS 181 -0.522 6.376 -3.839 82 HG3 LYS 181 HG1 LYS 181 -0.823 5.315 -5.221 83 HD2 LYS 181 HD2 LYS 181 -0.020 8.219 -5.409 84 HD3 LYS 181 HD1 LYS 181 1.083 6.852 -5.572 85 HE2 LYS 181 HE2 LYS 181 -0.235 6.055 -7.496 86 HE3 LYS 181 HE1 LYS 181 -1.282 7.465 -7.344 87 HZ1 LYS 181 HZ1 LYS 181 0.615 8.890 -7.783 88 HZ2 LYS 181 HZ2 LYS 181 0.414 7.776 -9.048 89 HZ3 LYS 181 HZ3 LYS 181 1.635 7.541 -7.901 90 H THR 182 HN THR 182 -4.892 6.664 -2.169 91 HA THR 182 HA THR 182 -7.200 7.054 -3.886 92 HB THR 182 HB THR 182 -6.968 7.204 -0.868 93 HG1 THR 182 HG1 THR 182 -8.336 5.073 -1.785 94 HG21 THR 182 HG21 THR 182 -9.403 6.948 -0.876 95 HG22 THR 182 HG22 THR 182 -9.407 6.980 -2.639 96 HG23 THR 182 HG23 THR 182 -8.918 8.412 -1.733 97 H SER 183 HN SER 183 -8.060 9.015 -4.413 98 HA SER 183 HA SER 183 -6.448 11.301 -4.236 99 HB2 SER 183 HB2 SER 183 -8.550 12.436 -5.177 100 HB3 SER 183 HB1 SER 183 -7.836 11.127 -6.121 101 HG SER 183 HG SER 183 -10.307 11.289 -5.274 102 H SER 184 HN SER 184 -8.732 10.075 -2.013 103 HA SER 184 HA SER 184 -9.485 12.478 -0.731 104 HB2 SER 184 HB2 SER 184 -9.175 9.774 0.588 105 HB3 SER 184 HB1 SER 184 -10.246 11.090 1.069 106 HG SER 184 HG SER 184 -11.131 10.750 -1.200 107 H GLY 185 HN GLY 185 -6.514 10.901 -0.966 108 HA2 GLY 185 HA2 GLY 185 -4.515 11.875 -0.070 109 HA3 GLY 185 HA1 GLY 185 -5.449 12.427 1.318 110 H GLN 186 HN GLN 186 -6.247 9.292 0.361 111 HA GLN 186 HA GLN 186 -4.857 8.241 2.705 112 HB2 GLN 186 HB2 GLN 186 -7.106 7.049 1.066 113 HB3 GLN 186 HB1 GLN 186 -6.386 6.299 2.487 114 HG2 GLN 186 HG2 GLN 186 -7.042 8.348 3.770 115 HG3 GLN 186 HG1 GLN 186 -7.958 8.856 2.355 116 HE21 GLN 186 HE21 GLN 186 -8.772 6.062 1.736 117 HE22 GLN 186 HE22 GLN 186 -9.997 5.687 2.901 118 H ARG 187 HN ARG 187 -2.948 7.436 2.341 119 HA ARG 187 HA ARG 187 -2.419 6.075 -0.202 120 HB2 ARG 187 HB2 ARG 187 0.019 6.430 0.474 121 HB3 ARG 187 HB1 ARG 187 -0.898 7.855 0.001 122 HG2 ARG 187 HG2 ARG 187 -1.153 8.542 2.274 123 HG3 ARG 187 HG1 ARG 187 -0.482 7.022 2.865 124 HD2 ARG 187 HD2 ARG 187 1.036 9.010 1.182 125 HD3 ARG 187 HD1 ARG 187 1.103 8.944 2.943 126 HE ARG 187 HE ARG 187 1.706 6.420 1.778 127 HH11 ARG 187 HH11 ARG 187 3.068 9.564 2.488 128 HH12 ARG 187 HH12 ARG 187 4.711 8.993 2.522 129 HH21 ARG 187 HH21 ARG 187 3.855 5.650 1.866 130 HH22 ARG 187 HH22 ARG 187 5.152 6.741 2.224 131 H TYR 188 HN TYR 188 -2.753 3.904 0.070 132 HA TYR 188 HA TYR 188 -1.355 2.669 2.331 133 HB2 TYR 188 HB2 TYR 188 -3.164 1.006 2.535 134 HB3 TYR 188 HB1 TYR 188 -3.738 2.635 2.853 135 HD1 TYR 188 HD2 TYR 188 -5.209 3.772 1.219 136 HD2 TYR 188 HD1 TYR 188 -3.996 -0.272 0.695 137 HE1 TYR 188 HE2 TYR 188 -7.014 3.448 -0.419 138 HE2 TYR 188 HE1 TYR 188 -5.799 -0.607 -0.940 139 HH TYR 188 HH TYR 188 -7.659 2.021 -2.200 140 H PHE 189 HN PHE 189 -0.336 0.754 1.923 141 HA PHE 189 HA PHE 189 -0.026 0.156 -0.941 142 HB2 PHE 189 HB2 PHE 189 1.944 -0.266 1.320 143 HB3 PHE 189 HB1 PHE 189 2.226 -0.647 -0.377 144 HD1 PHE 189 HD2 PHE 189 1.415 1.544 -1.876 145 HD2 PHE 189 HD1 PHE 189 3.179 1.569 1.988 146 HE1 PHE 189 HE2 PHE 189 2.242 3.821 -2.293 147 HE2 PHE 189 HE1 PHE 189 4.007 3.851 1.599 148 HZ PHE 189 HZ PHE 189 3.541 4.983 -0.542 149 H LEU 190 HN LEU 190 -0.295 -1.873 -1.667 150 HA LEU 190 HA LEU 190 -1.219 -3.917 0.185 151 HB2 LEU 190 HB2 LEU 190 -1.184 -3.587 -2.765 152 HB3 LEU 190 HB1 LEU 190 -1.167 -5.217 -2.147 153 HG LEU 190 HG LEU 190 -3.332 -3.169 -2.018 154 HD11 LEU 190 HD11 LEU 190 -4.125 -4.559 -3.564 155 HD12 LEU 190 HD12 LEU 190 -4.245 -5.815 -2.320 156 HD13 LEU 190 HD13 LEU 190 -2.789 -5.676 -3.301 157 HD21 LEU 190 HD21 LEU 190 -4.499 -4.509 -0.335 158 HD22 LEU 190 HD22 LEU 190 -3.000 -3.843 0.313 159 HD23 LEU 190 HD23 LEU 190 -3.079 -5.539 -0.162 160 H ASN 191 HN ASN 191 0.144 -5.564 0.946 161 HA ASN 191 HA ASN 191 2.684 -5.927 -0.430 162 HB2 ASN 191 HB2 ASN 191 1.612 -7.648 1.823 163 HB3 ASN 191 HB1 ASN 191 3.281 -7.479 1.291 164 HD21 ASN 191 HD21 ASN 191 3.936 -7.015 3.385 165 HD22 ASN 191 HD22 ASN 191 3.629 -5.485 4.129 166 H HIS 192 HN HIS 192 2.402 -6.901 -2.371 167 HA HIS 192 HA HIS 192 0.222 -8.598 -2.995 168 HB2 HIS 192 HB2 HIS 192 2.754 -7.848 -4.378 169 HB3 HIS 192 HB1 HIS 192 1.905 -9.277 -4.951 170 HD1 HIS 192 HD1 HIS 192 -0.841 -8.681 -5.373 171 HD2 HIS 192 HD2 HIS 192 1.994 -5.649 -5.725 172 HE1 HIS 192 HE1 HIS 192 -1.911 -6.905 -6.795 173 HE2 HIS 192 HE2 HIS 192 -0.124 -5.159 -7.141 174 H ILE 193 HN ILE 193 3.052 -9.183 -1.311 175 HA ILE 193 HA ILE 193 3.237 -12.002 -1.965 176 HB ILE 193 HB ILE 193 5.091 -11.945 -0.243 177 HG12 ILE 193 HG12 ILE 193 4.584 -8.959 -0.397 178 HG13 ILE 193 HG11 ILE 193 4.207 -9.984 0.992 179 HG21 ILE 193 HG21 ILE 193 5.290 -10.030 -2.565 180 HG22 ILE 193 HG22 ILE 193 5.541 -11.774 -2.630 181 HG23 ILE 193 HG23 ILE 193 6.652 -10.757 -1.715 182 HD11 ILE 193 HD11 ILE 193 6.179 -9.112 1.663 183 HD12 ILE 193 HD12 ILE 193 6.791 -8.953 0.023 184 HD13 ILE 193 HD13 ILE 193 6.780 -10.535 0.809 185 H ASP 194 HN ASP 194 2.154 -9.917 0.652 186 HA ASP 194 HA ASP 194 1.657 -12.247 2.355 187 HB2 ASP 194 HB2 ASP 194 2.912 -10.002 3.052 188 HB3 ASP 194 HB1 ASP 194 1.265 -9.450 3.370 189 H GLN 195 HN GLN 195 0.056 -10.151 0.270 190 HA GLN 195 HA GLN 195 -2.111 -9.549 -0.158 191 HB2 GLN 195 HB2 GLN 195 -2.214 -12.205 0.249 192 HB3 GLN 195 HB1 GLN 195 -3.156 -11.707 1.645 193 HG2 GLN 195 HG2 GLN 195 -3.773 -11.295 -1.264 194 HG3 GLN 195 HG1 GLN 195 -4.706 -12.175 -0.059 195 HE21 GLN 195 HE21 GLN 195 -6.049 -11.041 1.332 196 HE22 GLN 195 HE22 GLN 195 -6.451 -9.381 1.083 197 H THR 196 HN THR 196 -0.713 -8.312 1.811 198 HA THR 196 HA THR 196 -2.605 -7.915 4.024 199 HB THR 196 HB THR 196 0.344 -8.221 3.920 200 HG1 THR 196 HG1 THR 196 -0.186 -9.748 5.263 201 HG21 THR 196 HG21 THR 196 0.837 -6.968 5.826 202 HG22 THR 196 HG22 THR 196 -0.865 -6.639 6.171 203 HG23 THR 196 HG23 THR 196 -0.078 -5.871 4.789 204 H THR 197 HN THR 197 -3.280 -5.895 4.442 205 HA THR 197 HA THR 197 -2.499 -3.827 2.544 206 HB THR 197 HB THR 197 -4.628 -3.150 4.426 207 HG1 THR 197 HG1 THR 197 -5.062 -5.356 2.663 208 HG21 THR 197 HG21 THR 197 -4.215 -1.941 2.341 209 HG22 THR 197 HG22 THR 197 -5.821 -2.671 2.325 210 HG23 THR 197 HG23 THR 197 -4.504 -3.417 1.416 211 H THR 198 HN THR 198 -1.335 -2.097 3.087 212 HA THR 198 HA THR 198 -0.571 -1.791 5.919 213 HB THR 198 HB THR 198 1.068 -1.369 3.412 214 HG1 THR 198 HG1 THR 198 1.256 -3.474 3.666 215 HG21 THR 198 HG21 THR 198 1.640 0.165 5.312 216 HG22 THR 198 HG22 THR 198 2.943 -0.904 4.797 217 HG23 THR 198 HG23 THR 198 2.036 -1.265 6.260 218 H TRP 199 HN TRP 199 -1.113 0.176 6.809 219 HA TRP 199 HA TRP 199 -1.788 2.431 5.082 220 HB2 TRP 199 HB2 TRP 199 -2.062 1.850 8.003 221 HB3 TRP 199 HB1 TRP 199 -2.034 3.526 7.481 222 HD1 TRP 199 HD1 TRP 199 -4.392 0.878 8.227 223 HE1 TRP 199 HE1 TRP 199 -6.717 1.387 7.241 224 HE3 TRP 199 HE3 TRP 199 -3.090 4.592 4.958 225 HZ2 TRP 199 HZ2 TRP 199 -7.837 3.112 5.314 226 HZ3 TRP 199 HZ3 TRP 199 -4.854 5.619 3.579 227 HH2 TRP 199 HH2 TRP 199 -7.176 4.888 3.754 228 H GLN 200 HN GLN 200 0.878 1.241 6.795 229 HA GLN 200 HA GLN 200 2.031 3.884 7.275 230 HB2 GLN 200 HB2 GLN 200 3.647 2.622 8.696 231 HB3 GLN 200 HB1 GLN 200 1.973 2.458 9.205 232 HG2 GLN 200 HG2 GLN 200 2.026 0.300 7.760 233 HG3 GLN 200 HG1 GLN 200 3.775 0.446 7.942 234 HE21 GLN 200 HE21 GLN 200 4.696 0.231 9.991 235 HE22 GLN 200 HE22 GLN 200 3.824 -0.494 11.302 236 H ASP 201 HN ASP 201 4.138 4.407 6.619 237 HA ASP 201 HA ASP 201 4.858 3.393 4.046 238 HB2 ASP 201 HB2 ASP 201 5.164 5.760 4.769 239 HB3 ASP 201 HB1 ASP 201 6.423 5.226 5.876 240 HA PRO 202 HA PRO 202 6.840 -0.254 5.697 241 HB2 PRO 202 HB2 PRO 202 8.118 -0.832 3.261 242 HB3 PRO 202 HB1 PRO 202 6.572 -1.461 3.833 243 HG2 PRO 202 HG2 PRO 202 7.130 0.747 1.935 244 HG3 PRO 202 HG1 PRO 202 5.754 -0.365 2.004 245 HD2 PRO 202 HD2 PRO 202 5.544 2.203 2.785 246 HD3 PRO 202 HD1 PRO 202 4.632 0.895 3.578 247 H ARG 203 HN ARG 203 8.785 2.090 3.803 248 HA ARG 203 HA ARG 203 11.230 0.862 4.717 249 HB2 ARG 203 HB2 ARG 203 12.398 2.643 3.525 250 HB3 ARG 203 HB1 ARG 203 11.153 1.934 2.507 251 HG2 ARG 203 HG2 ARG 203 9.886 4.041 3.785 252 HG3 ARG 203 HG1 ARG 203 11.490 4.658 3.382 253 HD2 ARG 203 HD2 ARG 203 11.160 4.405 1.112 254 HD3 ARG 203 HD1 ARG 203 9.928 3.154 1.327 255 HE ARG 203 HE ARG 203 8.557 5.082 2.296 256 HH11 ARG 203 HH11 ARG 203 10.929 5.533 -0.247 257 HH12 ARG 203 HH12 ARG 203 10.038 6.805 -1.015 258 HH21 ARG 203 HH21 ARG 203 7.410 6.738 1.312 259 HH22 ARG 203 HH22 ARG 203 8.022 7.496 -0.135 260 H LYS 204 HN LYS 204 9.046 3.134 5.924 261 HA LYS 204 HA LYS 204 10.914 4.313 7.816 262 HB2 LYS 204 HB2 LYS 204 8.884 5.487 6.730 263 HB3 LYS 204 HB1 LYS 204 7.899 4.546 7.833 264 HG2 LYS 204 HG2 LYS 204 10.097 6.313 8.841 265 HG3 LYS 204 HG1 LYS 204 8.510 6.961 8.449 266 HD2 LYS 204 HD2 LYS 204 9.050 4.756 10.441 267 HD3 LYS 204 HD1 LYS 204 8.770 6.447 10.847 268 HE2 LYS 204 HE2 LYS 204 6.693 5.464 11.188 269 HE3 LYS 204 HE1 LYS 204 6.547 6.163 9.579 270 HZ1 LYS 204 HZ1 LYS 204 7.182 3.306 10.139 271 HZ2 LYS 204 HZ2 LYS 204 6.913 4.001 8.614 272 HZ3 LYS 204 HZ3 LYS 204 5.645 3.900 9.732 273 H ALA 205 HN ALA 205 9.061 1.542 7.447 274 HA ALA 205 HA ALA 205 8.535 -0.236 8.735 275 HB1 ALA 205 HB1 ALA 205 10.772 -0.026 9.708 276 HB2 ALA 205 HB2 ALA 205 9.592 -0.569 10.900 277 HB3 ALA 205 HB3 ALA 205 10.143 1.106 10.905 278 H1 SER 201 HT1 SER 201 -6.747 -6.180 -13.882 279 H2 SER 201 HT2 SER 201 -5.192 -5.973 -14.528 280 H3 SER 201 HT3 SER 201 -6.443 -4.922 -14.975 281 HA SER 201 HA SER 201 -5.239 -5.182 -12.291 282 HB2 SER 201 HB2 SER 201 -3.927 -3.939 -14.080 283 HB3 SER 201 HB1 SER 201 -5.251 -2.774 -14.126 284 HG SER 201 HG SER 201 -4.822 -2.204 -12.016 285 H TPO 202 HN TPO 202 -6.674 -4.881 -10.765 286 HA TPO 202 HA TPO 202 -9.033 -3.206 -11.321 287 HB TPO 202 HB TPO 202 -8.941 -5.562 -9.420 288 HG21 TPO 202 HG21 TPO 202 -10.743 -3.942 -9.033 289 HG22 TPO 202 HG22 TPO 202 -11.379 -5.477 -9.625 290 HG23 TPO 202 HG23 TPO 202 -11.247 -4.097 -10.717 291 H TYR 203 HN TYR 203 -9.949 -2.152 -9.383 292 HA TYR 203 HA TYR 203 -7.861 -1.246 -7.578 293 HB2 TYR 203 HB2 TYR 203 -9.337 0.441 -8.545 294 HB3 TYR 203 HB1 TYR 203 -10.749 -0.391 -7.905 295 HD1 TYR 203 HD2 TYR 203 -7.571 1.203 -6.742 296 HD2 TYR 203 HD1 TYR 203 -11.651 0.329 -5.894 297 HE1 TYR 203 HE2 TYR 203 -7.426 2.547 -4.688 298 HE2 TYR 203 HE1 TYR 203 -11.518 1.675 -3.839 299 HH TYR 203 HH TYR 203 -9.816 2.473 -2.252 300 HA PRO 204 HA PRO 204 -9.280 -4.167 -4.464 301 HB2 PRO 204 HB2 PRO 204 -7.499 -3.458 -2.556 302 HB3 PRO 204 HB1 PRO 204 -7.040 -4.446 -3.948 303 HG2 PRO 204 HG2 PRO 204 -6.664 -1.509 -3.505 304 HG3 PRO 204 HG1 PRO 204 -5.523 -2.694 -4.168 305 HD2 PRO 204 HD2 PRO 204 -6.981 -1.013 -5.726 306 HD3 PRO 204 HD1 PRO 204 -6.480 -2.630 -6.259 307 H HIS 205 HN HIS 205 -8.769 -3.092 -1.706 308 HA HIS 205 HA HIS 205 -10.403 -0.680 -1.652 309 HB2 HIS 205 HB2 HIS 205 -11.990 -2.609 -1.463 310 HB3 HIS 205 HB1 HIS 205 -11.147 -3.103 0.005 311 HD1 HIS 205 HD1 HIS 205 -12.141 -2.215 2.101 312 HD2 HIS 205 HD2 HIS 205 -12.969 0.207 -1.171 313 HE1 HIS 205 HE1 HIS 205 -13.573 -0.347 2.984 314 HE2 HIS 205 HE2 HIS 205 -13.747 1.261 1.051 315 H SEP 206 HN SEP 206 -9.860 0.683 -0.073 316 HA SEP 206 HA SEP 206 -7.578 0.553 1.421 317 HB2 SEP 206 HB2 SEP 206 -8.930 2.188 2.966 318 HB3 SEP 206 HB1 SEP 206 -8.576 2.649 1.301 319 HA PRO 207 HA PRO 207 -8.173 -2.625 4.387 320 HB2 PRO 207 HB2 PRO 207 -6.596 -1.581 6.419 321 HB3 PRO 207 HB1 PRO 207 -6.012 -2.552 5.065 322 HG2 PRO 207 HG2 PRO 207 -5.949 0.396 5.452 323 HG3 PRO 207 HG1 PRO 207 -4.780 -0.660 4.642 324 HD2 PRO 207 HD2 PRO 207 -6.512 0.922 3.290 325 HD3 PRO 207 HD1 PRO 207 -5.948 -0.638 2.658 326 H THR 208 HN THR 208 -8.823 0.680 5.117 327 HA THR 208 HA THR 208 -10.716 -0.185 7.188 328 HB THR 208 HB THR 208 -9.628 2.618 6.936 329 HG1 THR 208 HG1 THR 208 -8.587 0.435 8.475 330 HG21 THR 208 HG21 THR 208 -10.835 1.086 9.245 331 HG22 THR 208 HG22 THR 208 -11.649 2.325 8.289 332 HG23 THR 208 HG23 THR 208 -10.268 2.755 9.298 333 H SER 209 HN SER 209 -11.025 3.044 6.250 334 HA SER 209 HA SER 209 -12.452 2.811 3.822 335 HB2 SER 209 HB2 SER 209 -14.098 3.183 6.344 336 HB3 SER 209 HB1 SER 209 -14.685 3.557 4.727 337 HG SER 209 HG SER 209 -13.611 1.028 5.037 Start of MODEL 3 1 H ASP 170 H ASP 170 12.486 1.367 -6.351 2 HA ASP 170 HA ASP 170 11.669 -0.845 -6.033 3 HB2 ASP 170 HB2 ASP 170 13.480 -2.639 -5.579 4 HB3 ASP 170 HB1 ASP 170 13.080 -2.242 -7.250 5 H VAL 171 HN VAL 171 14.568 0.652 -4.633 6 HA VAL 171 HA VAL 171 13.903 -0.315 -2.006 7 HB VAL 171 HB VAL 171 15.976 1.660 -2.942 8 HG11 VAL 171 HG11 VAL 171 15.453 0.714 -0.119 9 HG12 VAL 171 HG12 VAL 171 15.228 2.357 -0.718 10 HG13 VAL 171 HG13 VAL 171 16.846 1.660 -0.644 11 HG21 VAL 171 HG21 VAL 171 17.515 -0.104 -2.206 12 HG22 VAL 171 HG22 VAL 171 16.397 -0.684 -3.444 13 HG23 VAL 171 HG23 VAL 171 16.134 -1.103 -1.752 14 HA PRO 172 HA PRO 172 12.432 4.187 -1.250 15 HB2 PRO 172 HB2 PRO 172 12.053 5.431 -3.866 16 HB3 PRO 172 HB1 PRO 172 12.958 6.019 -2.471 17 HG2 PRO 172 HG2 PRO 172 14.169 5.196 -4.743 18 HG3 PRO 172 HG1 PRO 172 14.910 5.012 -3.142 19 HD2 PRO 172 HD2 PRO 172 13.481 2.976 -4.812 20 HD3 PRO 172 HD1 PRO 172 14.970 2.806 -3.857 21 H LEU 173 HN LEU 173 11.394 2.148 -3.751 22 HA LEU 173 HA LEU 173 8.660 2.371 -2.824 23 HB2 LEU 173 HB2 LEU 173 9.173 3.874 -4.945 24 HB3 LEU 173 HB1 LEU 173 9.048 2.343 -5.787 25 HG LEU 173 HG LEU 173 6.945 3.643 -5.825 26 HD11 LEU 173 HD11 LEU 173 6.767 1.065 -4.271 27 HD12 LEU 173 HD12 LEU 173 6.849 1.218 -6.026 28 HD13 LEU 173 HD13 LEU 173 5.447 1.835 -5.153 29 HD21 LEU 173 HD21 LEU 173 7.133 4.749 -3.675 30 HD22 LEU 173 HD22 LEU 173 6.982 3.201 -2.843 31 HD23 LEU 173 HD23 LEU 173 5.621 3.842 -3.767 32 HA PRO 174 HA PRO 174 9.912 -1.988 -3.128 33 HB2 PRO 174 HB2 PRO 174 7.339 -2.278 -1.659 34 HB3 PRO 174 HB1 PRO 174 8.946 -2.898 -1.266 35 HG2 PRO 174 HG2 PRO 174 7.901 -0.857 0.084 36 HG3 PRO 174 HG1 PRO 174 9.630 -0.898 -0.317 37 HD2 PRO 174 HD2 PRO 174 7.416 0.635 -1.630 38 HD3 PRO 174 HD1 PRO 174 9.067 1.155 -1.227 39 H ALA 175 HN ALA 175 9.305 -3.567 -4.547 40 HA ALA 175 HA ALA 175 7.354 -2.670 -6.514 41 HB1 ALA 175 HB1 ALA 175 8.407 -4.266 -8.012 42 HB2 ALA 175 HB2 ALA 175 9.380 -4.895 -6.683 43 HB3 ALA 175 HB3 ALA 175 9.620 -3.240 -7.245 44 H GLY 176 HN GLY 176 7.749 -5.191 -4.155 45 HA2 GLY 176 HA2 GLY 176 5.672 -6.868 -5.295 46 HA3 GLY 176 HA1 GLY 176 6.478 -7.107 -3.750 47 H TRP 177 HN TRP 177 5.394 -3.959 -4.175 48 HA TRP 177 HA TRP 177 3.101 -4.485 -2.413 49 HB2 TRP 177 HB2 TRP 177 4.936 -2.083 -2.553 50 HB3 TRP 177 HB1 TRP 177 3.495 -2.176 -1.545 51 HD1 TRP 177 HD1 TRP 177 6.603 -4.483 -2.007 52 HE1 TRP 177 HE1 TRP 177 7.450 -5.156 0.324 53 HE3 TRP 177 HE3 TRP 177 3.185 -1.976 0.849 54 HZ2 TRP 177 HZ2 TRP 177 6.761 -4.689 3.002 55 HZ3 TRP 177 HZ3 TRP 177 3.359 -2.140 3.293 56 HH2 TRP 177 HH2 TRP 177 5.116 -3.467 4.336 57 H GLU 178 HN GLU 178 1.182 -3.641 -2.896 58 HA GLU 178 HA GLU 178 0.845 -2.543 -5.574 59 HB2 GLU 178 HB2 GLU 178 -0.570 -4.423 -4.810 60 HB3 GLU 178 HB1 GLU 178 -1.209 -3.411 -3.522 61 HG2 GLU 178 HG2 GLU 178 -2.795 -3.508 -5.319 62 HG3 GLU 178 HG1 GLU 178 -2.122 -1.879 -5.236 63 H MET 179 HN MET 179 0.514 -0.439 -5.938 64 HA MET 179 HA MET 179 0.305 1.320 -3.638 65 HB2 MET 179 HB2 MET 179 0.640 2.047 -6.544 66 HB3 MET 179 HB1 MET 179 0.775 3.139 -5.171 67 HG2 MET 179 HG2 MET 179 2.580 0.771 -5.565 68 HG3 MET 179 HG1 MET 179 2.929 2.380 -6.195 69 HE1 MET 179 HE1 MET 179 3.418 4.517 -3.021 70 HE2 MET 179 HE2 MET 179 1.991 4.375 -4.047 71 HE3 MET 179 HE3 MET 179 3.597 4.431 -4.774 72 H ALA 180 HN ALA 180 -1.761 1.425 -2.917 73 HA ALA 180 HA ALA 180 -3.826 2.137 -4.876 74 HB1 ALA 180 HB1 ALA 180 -4.394 0.331 -3.338 75 HB2 ALA 180 HB2 ALA 180 -5.431 1.735 -3.073 76 HB3 ALA 180 HB3 ALA 180 -4.103 1.397 -1.964 77 H LYS 181 HN LYS 181 -3.274 4.238 -5.302 78 HA LYS 181 HA LYS 181 -3.094 6.090 -3.032 79 HB2 LYS 181 HB2 LYS 181 -2.305 6.575 -5.910 80 HB3 LYS 181 HB1 LYS 181 -1.986 7.632 -4.545 81 HG2 LYS 181 HG2 LYS 181 -0.587 5.758 -3.584 82 HG3 LYS 181 HG1 LYS 181 -0.745 4.957 -5.151 83 HD2 LYS 181 HD2 LYS 181 0.486 7.655 -4.601 84 HD3 LYS 181 HD1 LYS 181 1.321 6.188 -5.105 85 HE2 LYS 181 HE2 LYS 181 -0.780 7.593 -6.747 86 HE3 LYS 181 HE1 LYS 181 0.952 7.852 -6.932 87 HZ1 LYS 181 HZ1 LYS 181 -0.444 5.249 -7.298 88 HZ2 LYS 181 HZ2 LYS 181 1.214 5.534 -7.520 89 HZ3 LYS 181 HZ3 LYS 181 0.082 6.266 -8.549 90 H THR 182 HN THR 182 -4.919 7.151 -2.588 91 HA THR 182 HA THR 182 -6.723 7.803 -4.814 92 HB THR 182 HB THR 182 -8.386 8.343 -2.997 93 HG1 THR 182 HG1 THR 182 -7.089 6.783 -1.152 94 HG21 THR 182 HG21 THR 182 -8.926 6.004 -2.514 95 HG22 THR 182 HG22 THR 182 -7.318 5.517 -3.048 96 HG23 THR 182 HG23 THR 182 -8.456 6.214 -4.201 97 H SER 183 HN SER 183 -7.378 9.904 -5.172 98 HA SER 183 HA SER 183 -5.443 11.897 -4.616 99 HB2 SER 183 HB2 SER 183 -7.195 13.408 -5.726 100 HB3 SER 183 HB1 SER 183 -6.553 12.077 -6.691 101 HG SER 183 HG SER 183 -8.949 12.429 -6.608 102 H SER 184 HN SER 184 -8.137 10.789 -2.889 103 HA SER 184 HA SER 184 -8.833 13.173 -1.523 104 HB2 SER 184 HB2 SER 184 -9.203 10.303 -0.640 105 HB3 SER 184 HB1 SER 184 -10.057 11.711 -0.004 106 HG SER 184 HG SER 184 -10.398 11.829 -2.590 107 H GLY 185 HN GLY 185 -6.143 11.103 -1.318 108 HA2 GLY 185 HA2 GLY 185 -4.221 11.872 -0.086 109 HA3 GLY 185 HA1 GLY 185 -5.311 12.494 1.143 110 H GLN 186 HN GLN 186 -5.473 9.314 -0.361 111 HA GLN 186 HA GLN 186 -4.624 8.130 2.193 112 HB2 GLN 186 HB2 GLN 186 -6.986 7.342 0.484 113 HB3 GLN 186 HB1 GLN 186 -6.313 6.303 1.733 114 HG2 GLN 186 HG2 GLN 186 -6.867 7.858 3.440 115 HG3 GLN 186 HG1 GLN 186 -7.298 9.091 2.260 116 HE21 GLN 186 HE21 GLN 186 -8.237 5.748 1.812 117 HE22 GLN 186 HE22 GLN 186 -9.916 5.991 2.124 118 H ARG 187 HN ARG 187 -3.009 6.766 1.996 119 HA ARG 187 HA ARG 187 -2.618 5.391 -0.568 120 HB2 ARG 187 HB2 ARG 187 -0.100 5.698 -0.122 121 HB3 ARG 187 HB1 ARG 187 -1.005 7.064 -0.760 122 HG2 ARG 187 HG2 ARG 187 -1.159 8.003 1.504 123 HG3 ARG 187 HG1 ARG 187 -0.211 6.647 2.117 124 HD2 ARG 187 HD2 ARG 187 0.810 8.419 -0.076 125 HD3 ARG 187 HD1 ARG 187 1.001 8.856 1.619 126 HE ARG 187 HE ARG 187 2.025 6.392 1.592 127 HH11 ARG 187 HH11 ARG 187 2.495 9.038 -0.649 128 HH12 ARG 187 HH12 ARG 187 4.173 8.669 -0.935 129 HH21 ARG 187 HH21 ARG 187 4.241 5.898 1.218 130 HH22 ARG 187 HH22 ARG 187 5.163 6.889 0.126 131 H TYR 188 HN TYR 188 -3.366 3.452 0.215 132 HA TYR 188 HA TYR 188 -1.793 2.259 2.396 133 HB2 TYR 188 HB2 TYR 188 -3.655 0.614 2.612 134 HB3 TYR 188 HB1 TYR 188 -4.136 2.267 2.968 135 HD1 TYR 188 HD2 TYR 188 -5.585 3.494 1.395 136 HD2 TYR 188 HD1 TYR 188 -4.598 -0.597 0.777 137 HE1 TYR 188 HE2 TYR 188 -7.454 3.288 -0.190 138 HE2 TYR 188 HE1 TYR 188 -6.461 -0.815 -0.806 139 HH TYR 188 HH TYR 188 -8.265 1.954 -1.914 140 H PHE 189 HN PHE 189 -0.666 0.427 2.026 141 HA PHE 189 HA PHE 189 -0.413 -0.259 -0.822 142 HB2 PHE 189 HB2 PHE 189 1.650 -0.535 1.377 143 HB3 PHE 189 HB1 PHE 189 1.900 -0.833 -0.344 144 HD1 PHE 189 HD2 PHE 189 0.389 1.531 -1.403 145 HD2 PHE 189 HD1 PHE 189 3.211 1.176 1.749 146 HE1 PHE 189 HE2 PHE 189 1.044 3.875 -1.749 147 HE2 PHE 189 HE1 PHE 189 3.868 3.524 1.433 148 HZ PHE 189 HZ PHE 189 2.783 4.880 -0.316 149 H LEU 190 HN LEU 190 -0.602 -2.314 -1.482 150 HA LEU 190 HA LEU 190 -1.336 -4.339 0.471 151 HB2 LEU 190 HB2 LEU 190 -1.256 -4.268 -2.527 152 HB3 LEU 190 HB1 LEU 190 -1.463 -5.769 -1.670 153 HG LEU 190 HG LEU 190 -3.369 -3.530 -2.057 154 HD11 LEU 190 HD11 LEU 190 -4.599 -5.141 -3.032 155 HD12 LEU 190 HD12 LEU 190 -4.246 -6.313 -1.761 156 HD13 LEU 190 HD13 LEU 190 -3.080 -6.050 -3.062 157 HD21 LEU 190 HD21 LEU 190 -4.755 -4.361 -0.198 158 HD22 LEU 190 HD22 LEU 190 -3.241 -3.651 0.364 159 HD23 LEU 190 HD23 LEU 190 -3.425 -5.403 0.309 160 H ASN 191 HN ASN 191 0.053 -6.024 1.100 161 HA ASN 191 HA ASN 191 2.609 -6.270 -0.297 162 HB2 ASN 191 HB2 ASN 191 1.455 -7.895 1.993 163 HB3 ASN 191 HB1 ASN 191 3.047 -8.142 1.295 164 HD21 ASN 191 HD21 ASN 191 1.471 -5.068 2.059 165 HD22 ASN 191 HD22 ASN 191 2.617 -4.586 3.254 166 H HIS 192 HN HIS 192 2.296 -7.168 -2.288 167 HA HIS 192 HA HIS 192 0.063 -8.849 -2.832 168 HB2 HIS 192 HB2 HIS 192 2.356 -7.815 -4.390 169 HB3 HIS 192 HB1 HIS 192 1.686 -9.339 -4.956 170 HD1 HIS 192 HD1 HIS 192 -1.178 -9.129 -5.009 171 HD2 HIS 192 HD2 HIS 192 1.182 -5.760 -5.666 172 HE1 HIS 192 HE1 HIS 192 -2.643 -7.497 -6.248 173 HE2 HIS 192 HE2 HIS 192 -1.160 -5.515 -6.747 174 H ILE 193 HN ILE 193 3.187 -9.451 -1.591 175 HA ILE 193 HA ILE 193 3.161 -12.247 -2.365 176 HB ILE 193 HB ILE 193 5.253 -11.964 -0.573 177 HG12 ILE 193 HG12 ILE 193 6.453 -9.953 -1.751 178 HG13 ILE 193 HG11 ILE 193 4.817 -9.394 -2.068 179 HG21 ILE 193 HG21 ILE 193 5.266 -11.700 -3.571 180 HG22 ILE 193 HG22 ILE 193 5.290 -13.204 -2.651 181 HG23 ILE 193 HG23 ILE 193 6.662 -12.096 -2.569 182 HD11 ILE 193 HD11 ILE 193 4.360 -9.174 0.242 183 HD12 ILE 193 HD12 ILE 193 5.931 -8.438 -0.041 184 HD13 ILE 193 HD13 ILE 193 5.826 -10.040 0.686 185 H ASP 194 HN ASP 194 2.350 -10.302 0.372 186 HA ASP 194 HA ASP 194 2.128 -12.660 2.091 187 HB2 ASP 194 HB2 ASP 194 3.303 -10.531 2.862 188 HB3 ASP 194 HB1 ASP 194 1.712 -9.787 2.906 189 H GLN 195 HN GLN 195 0.281 -10.509 0.202 190 HA GLN 195 HA GLN 195 -1.915 -10.229 -0.235 191 HB2 GLN 195 HB2 GLN 195 -1.817 -12.803 -0.093 192 HB3 GLN 195 HB1 GLN 195 -2.547 -12.618 1.494 193 HG2 GLN 195 HG2 GLN 195 -4.262 -13.081 -0.116 194 HG3 GLN 195 HG1 GLN 195 -4.438 -11.424 0.455 195 HE21 GLN 195 HE21 GLN 195 -5.385 -12.688 -2.008 196 HE22 GLN 195 HE22 GLN 195 -4.726 -11.757 -3.307 197 H THR 196 HN THR 196 -0.701 -8.878 1.940 198 HA THR 196 HA THR 196 -3.034 -8.561 3.729 199 HB THR 196 HB THR 196 -0.956 -9.519 4.859 200 HG1 THR 196 HG1 THR 196 -1.217 -7.967 6.657 201 HG21 THR 196 HG21 THR 196 0.850 -8.048 5.399 202 HG22 THR 196 HG22 THR 196 0.024 -6.673 4.671 203 HG23 THR 196 HG23 THR 196 0.631 -7.973 3.651 204 H THR 197 HN THR 197 -3.536 -6.432 4.416 205 HA THR 197 HA THR 197 -2.593 -4.384 2.541 206 HB THR 197 HB THR 197 -4.946 -4.094 4.401 207 HG1 THR 197 HG1 THR 197 -4.720 -5.921 2.501 208 HG21 THR 197 HG21 THR 197 -4.158 -2.073 3.293 209 HG22 THR 197 HG22 THR 197 -5.714 -2.563 2.623 210 HG23 THR 197 HG23 THR 197 -4.227 -2.881 1.729 211 H THR 198 HN THR 198 -1.513 -2.593 3.232 212 HA THR 198 HA THR 198 -1.117 -2.303 6.133 213 HB THR 198 HB THR 198 1.029 -1.965 4.026 214 HG1 THR 198 HG1 THR 198 0.140 -4.167 5.476 215 HG21 THR 198 HG21 THR 198 1.226 -2.090 7.036 216 HG22 THR 198 HG22 THR 198 1.338 -0.620 6.069 217 HG23 THR 198 HG23 THR 198 2.563 -1.877 5.904 218 H TRP 199 HN TRP 199 -1.684 -0.274 6.830 219 HA TRP 199 HA TRP 199 -2.019 1.881 4.915 220 HB2 TRP 199 HB2 TRP 199 -2.610 1.516 7.833 221 HB3 TRP 199 HB1 TRP 199 -2.556 3.138 7.159 222 HD1 TRP 199 HD1 TRP 199 -4.818 0.150 7.487 223 HE1 TRP 199 HE1 TRP 199 -7.051 0.650 6.332 224 HE3 TRP 199 HE3 TRP 199 -3.513 4.416 4.976 225 HZ2 TRP 199 HZ2 TRP 199 -8.128 2.575 4.570 226 HZ3 TRP 199 HZ3 TRP 199 -5.207 5.524 3.573 227 HH2 TRP 199 HH2 TRP 199 -7.467 4.618 3.379 228 H GLN 200 HN GLN 200 0.540 0.678 6.658 229 HA GLN 200 HA GLN 200 1.753 3.306 7.155 230 HB2 GLN 200 HB2 GLN 200 1.530 1.760 9.073 231 HB3 GLN 200 HB1 GLN 200 2.518 0.581 8.225 232 HG2 GLN 200 HG2 GLN 200 4.439 1.981 8.363 233 HG3 GLN 200 HG1 GLN 200 3.478 3.330 8.968 234 HE21 GLN 200 HE21 GLN 200 1.881 1.669 10.742 235 HE22 GLN 200 HE22 GLN 200 2.908 1.250 12.070 236 H ASP 201 HN ASP 201 3.557 3.940 6.104 237 HA ASP 201 HA ASP 201 4.295 2.652 3.702 238 HB2 ASP 201 HB2 ASP 201 4.458 5.099 4.063 239 HB3 ASP 201 HB1 ASP 201 5.782 4.827 5.191 240 HA PRO 202 HA PRO 202 6.993 -0.435 5.338 241 HB2 PRO 202 HB2 PRO 202 8.196 -1.093 2.955 242 HB3 PRO 202 HB1 PRO 202 6.636 -1.706 3.505 243 HG2 PRO 202 HG2 PRO 202 7.242 0.472 1.567 244 HG3 PRO 202 HG1 PRO 202 5.942 -0.730 1.542 245 HD2 PRO 202 HD2 PRO 202 5.535 1.842 2.289 246 HD3 PRO 202 HD1 PRO 202 4.608 0.488 2.960 247 H ARG 203 HN ARG 203 8.146 2.446 3.799 248 HA ARG 203 HA ARG 203 10.917 1.695 4.382 249 HB2 ARG 203 HB2 ARG 203 9.651 3.683 2.604 250 HB3 ARG 203 HB1 ARG 203 11.146 4.197 3.375 251 HG2 ARG 203 HG2 ARG 203 11.444 3.147 1.136 252 HG3 ARG 203 HG1 ARG 203 12.351 2.369 2.433 253 HD2 ARG 203 HD2 ARG 203 10.293 0.820 2.615 254 HD3 ARG 203 HD1 ARG 203 9.902 1.407 1.002 255 HE ARG 203 HE ARG 203 11.921 0.415 0.208 256 HH11 ARG 203 HH11 ARG 203 11.138 -0.333 3.540 257 HH12 ARG 203 HH12 ARG 203 12.129 -1.757 3.600 258 HH21 ARG 203 HH21 ARG 203 13.199 -1.508 0.258 259 HH22 ARG 203 HH22 ARG 203 13.302 -2.424 1.736 260 H LYS 204 HN LYS 204 8.330 3.488 5.689 261 HA LYS 204 HA LYS 204 10.072 4.931 7.520 262 HB2 LYS 204 HB2 LYS 204 7.052 4.777 7.422 263 HB3 LYS 204 HB1 LYS 204 7.988 5.837 8.466 264 HG2 LYS 204 HG2 LYS 204 8.939 6.897 6.416 265 HG3 LYS 204 HG1 LYS 204 7.819 5.925 5.462 266 HD2 LYS 204 HD2 LYS 204 6.696 7.937 5.685 267 HD3 LYS 204 HD1 LYS 204 5.999 6.965 6.976 268 HE2 LYS 204 HE2 LYS 204 8.227 8.967 7.314 269 HE3 LYS 204 HE1 LYS 204 6.533 9.272 7.680 270 HZ1 LYS 204 HZ1 LYS 204 6.674 7.414 9.307 271 HZ2 LYS 204 HZ2 LYS 204 7.653 8.744 9.692 272 HZ3 LYS 204 HZ3 LYS 204 8.347 7.349 9.032 273 H ALA 205 HN ALA 205 8.516 1.952 7.243 274 HA ALA 205 HA ALA 205 8.630 1.413 10.113 275 HB1 ALA 205 HB1 ALA 205 7.512 -0.691 9.568 276 HB2 ALA 205 HB2 ALA 205 7.618 -0.312 7.849 277 HB3 ALA 205 HB3 ALA 205 6.623 0.683 8.912 278 H1 SER 201 HT1 SER 201 -0.283 -3.471 -10.235 279 H2 SER 201 HT2 SER 201 -1.724 -4.320 -10.501 280 H3 SER 201 HT3 SER 201 -1.464 -3.531 -9.024 281 HA SER 201 HA SER 201 -1.529 -1.405 -10.060 282 HB2 SER 201 HB2 SER 201 -2.246 -1.440 -12.561 283 HB3 SER 201 HB1 SER 201 -0.554 -1.733 -12.163 284 HG SER 201 HG SER 201 -2.454 -3.828 -12.516 285 H TPO 202 HN TPO 202 -3.288 -3.910 -9.264 286 HA TPO 202 HA TPO 202 -5.877 -2.992 -10.230 287 HB TPO 202 HB TPO 202 -5.090 -5.405 -8.576 288 HG21 TPO 202 HG21 TPO 202 -7.356 -4.688 -8.029 289 HG22 TPO 202 HG22 TPO 202 -7.383 -6.191 -8.953 290 HG23 TPO 202 HG23 TPO 202 -7.773 -4.662 -9.743 291 H TYR 203 HN TYR 203 -7.301 -1.878 -8.991 292 HA TYR 203 HA TYR 203 -6.402 -0.921 -6.417 293 HB2 TYR 203 HB2 TYR 203 -7.462 0.598 -8.061 294 HB3 TYR 203 HB1 TYR 203 -8.952 -0.328 -7.941 295 HD1 TYR 203 HD2 TYR 203 -6.624 1.819 -6.024 296 HD2 TYR 203 HD1 TYR 203 -10.520 0.124 -6.226 297 HE1 TYR 203 HE2 TYR 203 -7.330 3.236 -4.151 298 HE2 TYR 203 HE1 TYR 203 -11.239 1.539 -4.346 299 HH TYR 203 HH TYR 203 -10.125 2.721 -2.380 300 HA PRO 204 HA PRO 204 -8.954 -3.957 -4.292 301 HB2 PRO 204 HB2 PRO 204 -7.798 -3.699 -1.891 302 HB3 PRO 204 HB1 PRO 204 -6.968 -4.509 -3.223 303 HG2 PRO 204 HG2 PRO 204 -6.559 -1.775 -2.117 304 HG3 PRO 204 HG1 PRO 204 -5.368 -2.912 -2.772 305 HD2 PRO 204 HD2 PRO 204 -6.506 -0.739 -4.132 306 HD3 PRO 204 HD1 PRO 204 -5.614 -2.082 -4.871 307 H HIS 205 HN HIS 205 -8.886 -2.878 -1.331 308 HA HIS 205 HA HIS 205 -10.526 -0.505 -1.567 309 HB2 HIS 205 HB2 HIS 205 -12.113 -2.474 -1.719 310 HB3 HIS 205 HB1 HIS 205 -11.632 -2.892 -0.077 311 HD1 HIS 205 HD1 HIS 205 -13.119 -1.952 1.681 312 HD2 HIS 205 HD2 HIS 205 -13.134 0.357 -1.781 313 HE1 HIS 205 HE1 HIS 205 -14.746 -0.087 2.113 314 HE2 HIS 205 HE2 HIS 205 -14.566 1.406 0.092 315 H SEP 206 HN SEP 206 -10.401 0.786 0.192 316 HA SEP 206 HA SEP 206 -8.244 0.462 1.930 317 HB2 SEP 206 HB2 SEP 206 -9.587 2.400 3.162 318 HB3 SEP 206 HB1 SEP 206 -8.772 2.667 1.625 319 HA PRO 207 HA PRO 207 -10.011 -2.433 4.833 320 HB2 PRO 207 HB2 PRO 207 -7.872 -2.286 6.579 321 HB3 PRO 207 HB1 PRO 207 -7.946 -3.327 5.151 322 HG2 PRO 207 HG2 PRO 207 -6.603 -0.697 5.530 323 HG3 PRO 207 HG1 PRO 207 -6.068 -2.112 4.604 324 HD2 PRO 207 HD2 PRO 207 -7.117 0.086 3.434 325 HD3 PRO 207 HD1 PRO 207 -7.331 -1.543 2.769 326 H THR 208 HN THR 208 -9.258 0.849 5.423 327 HA THR 208 HA THR 208 -10.728 0.763 7.968 328 HB THR 208 HB THR 208 -8.291 2.463 7.386 329 HG1 THR 208 HG1 THR 208 -8.559 0.464 9.389 330 HG21 THR 208 HG21 THR 208 -9.893 3.633 8.806 331 HG22 THR 208 HG22 THR 208 -8.475 3.149 9.739 332 HG23 THR 208 HG23 THR 208 -9.978 2.237 9.879 333 H SER 209 HN SER 209 -12.608 1.705 7.502 334 HA SER 209 HA SER 209 -12.577 4.157 5.879 335 HB2 SER 209 HB2 SER 209 -14.909 2.270 6.305 336 HB3 SER 209 HB1 SER 209 -14.829 3.621 5.174 337 HG SER 209 HG SER 209 -12.852 2.308 4.400 Start of MODEL 4 1 H ASP 170 H ASP 170 13.384 0.716 -6.131 2 HA ASP 170 HA ASP 170 12.668 -1.540 -5.785 3 HB2 ASP 170 HB2 ASP 170 14.757 -2.628 -6.509 4 HB3 ASP 170 HB1 ASP 170 15.563 -2.035 -5.060 5 H VAL 171 HN VAL 171 15.138 0.205 -3.904 6 HA VAL 171 HA VAL 171 13.844 -0.451 -1.418 7 HB VAL 171 HB VAL 171 16.113 1.452 -1.997 8 HG11 VAL 171 HG11 VAL 171 15.060 0.468 0.656 9 HG12 VAL 171 HG12 VAL 171 14.936 2.116 0.039 10 HG13 VAL 171 HG13 VAL 171 16.517 1.435 0.418 11 HG21 VAL 171 HG21 VAL 171 17.490 -0.319 -1.007 12 HG22 VAL 171 HG22 VAL 171 16.636 -0.878 -2.447 13 HG23 VAL 171 HG23 VAL 171 16.054 -1.330 -0.845 14 HA PRO 172 HA PRO 172 12.682 4.259 -1.436 15 HB2 PRO 172 HB2 PRO 172 12.460 5.445 -3.889 16 HB3 PRO 172 HB1 PRO 172 13.896 5.553 -2.867 17 HG2 PRO 172 HG2 PRO 172 13.359 3.764 -5.200 18 HG3 PRO 172 HG1 PRO 172 14.841 4.640 -4.775 19 HD2 PRO 172 HD2 PRO 172 14.553 2.005 -4.290 20 HD3 PRO 172 HD1 PRO 172 15.471 3.066 -3.203 21 H LEU 173 HN LEU 173 11.714 1.970 -3.811 22 HA LEU 173 HA LEU 173 8.933 2.455 -3.102 23 HB2 LEU 173 HB2 LEU 173 9.694 3.518 -5.392 24 HB3 LEU 173 HB1 LEU 173 9.578 1.867 -5.963 25 HG LEU 173 HG LEU 173 7.554 3.185 -6.442 26 HD11 LEU 173 HD11 LEU 173 7.376 0.768 -6.182 27 HD12 LEU 173 HD12 LEU 173 5.922 1.587 -5.614 28 HD13 LEU 173 HD13 LEU 173 7.097 0.971 -4.451 29 HD21 LEU 173 HD21 LEU 173 7.609 4.680 -4.542 30 HD22 LEU 173 HD22 LEU 173 7.320 3.331 -3.441 31 HD23 LEU 173 HD23 LEU 173 6.070 3.817 -4.588 32 HA PRO 174 HA PRO 174 10.076 -1.884 -2.454 33 HB2 PRO 174 HB2 PRO 174 7.385 -2.036 -1.230 34 HB3 PRO 174 HB1 PRO 174 8.965 -2.408 -0.544 35 HG2 PRO 174 HG2 PRO 174 7.568 -0.221 0.160 36 HG3 PRO 174 HG1 PRO 174 9.339 -0.251 0.123 37 HD2 PRO 174 HD2 PRO 174 7.418 0.949 -1.818 38 HD3 PRO 174 HD1 PRO 174 9.008 1.524 -1.285 39 H ALA 175 HN ALA 175 9.720 -3.638 -3.692 40 HA ALA 175 HA ALA 175 7.959 -3.164 -5.959 41 HB1 ALA 175 HB1 ALA 175 10.325 -3.638 -6.346 42 HB2 ALA 175 HB2 ALA 175 9.280 -4.842 -7.100 43 HB3 ALA 175 HB3 ALA 175 10.125 -5.223 -5.600 44 H GLY 176 HN GLY 176 8.200 -5.343 -3.256 45 HA2 GLY 176 HA2 GLY 176 6.271 -7.202 -4.405 46 HA3 GLY 176 HA1 GLY 176 6.959 -7.283 -2.784 47 H TRP 177 HN TRP 177 5.928 -4.205 -3.512 48 HA TRP 177 HA TRP 177 3.516 -4.594 -1.876 49 HB2 TRP 177 HB2 TRP 177 5.340 -2.178 -2.022 50 HB3 TRP 177 HB1 TRP 177 3.921 -2.336 -0.996 51 HD1 TRP 177 HD1 TRP 177 7.157 -4.444 -1.485 52 HE1 TRP 177 HE1 TRP 177 8.068 -5.058 0.837 53 HE3 TRP 177 HE3 TRP 177 3.599 -2.177 1.391 54 HZ2 TRP 177 HZ2 TRP 177 7.368 -4.638 3.528 55 HZ3 TRP 177 HZ3 TRP 177 3.806 -2.319 3.836 56 HH2 TRP 177 HH2 TRP 177 5.654 -3.518 4.866 57 H GLU 178 HN GLU 178 1.663 -3.597 -2.486 58 HA GLU 178 HA GLU 178 1.563 -2.558 -5.212 59 HB2 GLU 178 HB2 GLU 178 -0.035 -4.313 -4.494 60 HB3 GLU 178 HB1 GLU 178 -0.681 -3.211 -3.283 61 HG2 GLU 178 HG2 GLU 178 -2.117 -3.285 -5.233 62 HG3 GLU 178 HG1 GLU 178 -1.392 -1.684 -5.063 63 H MET 179 HN MET 179 1.185 -0.464 -5.690 64 HA MET 179 HA MET 179 1.219 1.408 -3.455 65 HB2 MET 179 HB2 MET 179 1.431 1.911 -6.432 66 HB3 MET 179 HB1 MET 179 1.570 3.138 -5.183 67 HG2 MET 179 HG2 MET 179 3.420 0.787 -5.399 68 HG3 MET 179 HG1 MET 179 3.705 2.347 -6.171 69 HE1 MET 179 HE1 MET 179 4.072 4.767 -3.171 70 HE2 MET 179 HE2 MET 179 2.618 4.422 -4.105 71 HE3 MET 179 HE3 MET 179 4.174 4.576 -4.921 72 H ALA 180 HN ALA 180 -0.929 1.322 -2.681 73 HA ALA 180 HA ALA 180 -2.976 2.158 -4.574 74 HB1 ALA 180 HB1 ALA 180 -3.531 0.443 -2.889 75 HB2 ALA 180 HB2 ALA 180 -4.566 1.868 -2.786 76 HB3 ALA 180 HB3 ALA 180 -3.262 1.635 -1.619 77 H LYS 181 HN LYS 181 -2.302 4.145 -5.130 78 HA LYS 181 HA LYS 181 -1.951 6.202 -3.101 79 HB2 LYS 181 HB2 LYS 181 -1.787 6.412 -6.117 80 HB3 LYS 181 HB1 LYS 181 -1.280 7.633 -4.958 81 HG2 LYS 181 HG2 LYS 181 0.493 6.172 -4.157 82 HG3 LYS 181 HG1 LYS 181 -0.033 4.895 -5.259 83 HD2 LYS 181 HD2 LYS 181 0.930 7.627 -6.093 84 HD3 LYS 181 HD1 LYS 181 1.900 6.156 -6.108 85 HE2 LYS 181 HE2 LYS 181 -0.669 6.511 -7.644 86 HE3 LYS 181 HE1 LYS 181 0.933 6.785 -8.322 87 HZ1 LYS 181 HZ1 LYS 181 1.476 4.467 -7.854 88 HZ2 LYS 181 HZ2 LYS 181 0.137 4.592 -8.883 89 HZ3 LYS 181 HZ3 LYS 181 -0.084 4.207 -7.249 90 H THR 182 HN THR 182 -3.952 6.557 -2.280 91 HA THR 182 HA THR 182 -6.219 6.479 -4.103 92 HB THR 182 HB THR 182 -6.356 6.552 -1.097 93 HG1 THR 182 HG1 THR 182 -5.285 4.715 -1.226 94 HG21 THR 182 HG21 THR 182 -8.148 5.345 -3.206 95 HG22 THR 182 HG22 THR 182 -8.455 6.847 -2.332 96 HG23 THR 182 HG23 THR 182 -8.426 5.311 -1.464 97 H SER 183 HN SER 183 -7.639 8.134 -4.412 98 HA SER 183 HA SER 183 -6.755 10.785 -3.957 99 HB2 SER 183 HB2 SER 183 -8.079 10.094 -5.934 100 HB3 SER 183 HB1 SER 183 -9.463 9.789 -4.887 101 HG SER 183 HG SER 183 -8.177 12.316 -5.025 102 H SER 184 HN SER 184 -8.569 8.596 -2.090 103 HA SER 184 HA SER 184 -10.137 10.313 -0.531 104 HB2 SER 184 HB2 SER 184 -8.767 7.836 0.517 105 HB3 SER 184 HB1 SER 184 -10.327 8.503 0.996 106 HG SER 184 HG SER 184 -10.211 6.593 -0.534 107 H GLY 185 HN GLY 185 -6.769 10.058 -0.788 108 HA2 GLY 185 HA2 GLY 185 -5.234 11.513 0.262 109 HA3 GLY 185 HA1 GLY 185 -6.398 11.767 1.559 110 H GLN 186 HN GLN 186 -5.526 8.627 0.297 111 HA GLN 186 HA GLN 186 -4.160 8.024 2.830 112 HB2 GLN 186 HB2 GLN 186 -6.194 6.167 1.592 113 HB3 GLN 186 HB1 GLN 186 -5.460 6.055 3.184 114 HG2 GLN 186 HG2 GLN 186 -6.640 8.146 3.806 115 HG3 GLN 186 HG1 GLN 186 -7.467 8.095 2.252 116 HE21 GLN 186 HE21 GLN 186 -8.925 6.340 1.851 117 HE22 GLN 186 HE22 GLN 186 -9.689 5.534 3.171 118 H ARG 187 HN ARG 187 -2.215 7.195 2.379 119 HA ARG 187 HA ARG 187 -1.922 5.661 -0.108 120 HB2 ARG 187 HB2 ARG 187 0.565 5.994 0.264 121 HB3 ARG 187 HB1 ARG 187 -0.362 7.422 -0.166 122 HG2 ARG 187 HG2 ARG 187 -0.387 8.106 2.187 123 HG3 ARG 187 HG1 ARG 187 0.571 6.682 2.602 124 HD2 ARG 187 HD2 ARG 187 1.496 8.692 0.567 125 HD3 ARG 187 HD1 ARG 187 1.810 8.901 2.288 126 HE ARG 187 HE ARG 187 2.792 6.464 1.911 127 HH11 ARG 187 HH11 ARG 187 3.120 9.277 -0.154 128 HH12 ARG 187 HH12 ARG 187 4.765 8.917 -0.594 129 HH21 ARG 187 HH21 ARG 187 4.957 5.983 1.322 130 HH22 ARG 187 HH22 ARG 187 5.796 7.052 0.233 131 H TYR 188 HN TYR 188 -2.455 3.584 0.422 132 HA TYR 188 HA TYR 188 -0.999 2.383 2.683 133 HB2 TYR 188 HB2 TYR 188 -2.903 0.722 2.786 134 HB3 TYR 188 HB1 TYR 188 -3.309 2.359 3.284 135 HD1 TYR 188 HD2 TYR 188 -4.707 3.780 1.843 136 HD2 TYR 188 HD1 TYR 188 -3.918 -0.279 0.854 137 HE1 TYR 188 HE2 TYR 188 -6.559 3.820 0.238 138 HE2 TYR 188 HE1 TYR 188 -5.774 -0.252 -0.757 139 HH TYR 188 HH TYR 188 -7.331 2.668 -1.706 140 H PHE 189 HN PHE 189 0.172 0.587 2.274 141 HA PHE 189 HA PHE 189 0.322 -0.172 -0.557 142 HB2 PHE 189 HB2 PHE 189 2.378 -0.481 1.646 143 HB3 PHE 189 HB1 PHE 189 2.593 -1.004 -0.023 144 HD1 PHE 189 HD2 PHE 189 1.093 1.491 -1.158 145 HD2 PHE 189 HD1 PHE 189 4.307 0.982 1.595 146 HE1 PHE 189 HE2 PHE 189 1.951 3.720 -1.750 147 HE2 PHE 189 HE1 PHE 189 5.156 3.213 1.016 148 HZ PHE 189 HZ PHE 189 3.982 4.584 -0.656 149 H LEU 190 HN LEU 190 0.049 -2.212 -1.206 150 HA LEU 190 HA LEU 190 -0.966 -4.138 0.724 151 HB2 LEU 190 HB2 LEU 190 -0.782 -4.057 -2.268 152 HB3 LEU 190 HB1 LEU 190 -1.121 -5.555 -1.448 153 HG LEU 190 HG LEU 190 -2.839 -3.136 -1.744 154 HD11 LEU 190 HD11 LEU 190 -4.220 -4.562 -2.849 155 HD12 LEU 190 HD12 LEU 190 -3.812 -5.930 -1.811 156 HD13 LEU 190 HD13 LEU 190 -2.706 -5.446 -3.100 157 HD21 LEU 190 HD21 LEU 190 -3.193 -5.281 0.349 158 HD22 LEU 190 HD22 LEU 190 -4.349 -4.008 -0.040 159 HD23 LEU 190 HD23 LEU 190 -2.786 -3.595 0.665 160 H ASN 191 HN ASN 191 0.209 -5.964 1.387 161 HA ASN 191 HA ASN 191 2.767 -6.453 0.079 162 HB2 ASN 191 HB2 ASN 191 1.387 -7.625 2.479 163 HB3 ASN 191 HB1 ASN 191 2.690 -8.513 1.697 164 HD21 ASN 191 HD21 ASN 191 1.850 -5.660 3.513 165 HD22 ASN 191 HD22 ASN 191 3.463 -5.227 3.943 166 H HIS 192 HN HIS 192 2.408 -7.212 -1.940 167 HA HIS 192 HA HIS 192 0.049 -8.608 -2.667 168 HB2 HIS 192 HB2 HIS 192 2.444 -7.652 -4.038 169 HB3 HIS 192 HB1 HIS 192 1.856 -9.177 -4.689 170 HD1 HIS 192 HD1 HIS 192 -0.958 -9.045 -5.097 171 HD2 HIS 192 HD2 HIS 192 1.316 -5.561 -5.274 172 HE1 HIS 192 HE1 HIS 192 -2.354 -7.384 -6.369 173 HE2 HIS 192 HE2 HIS 192 -0.889 -5.338 -6.613 174 H ILE 193 HN ILE 193 3.059 -9.657 -1.406 175 HA ILE 193 HA ILE 193 2.695 -12.376 -2.337 176 HB ILE 193 HB ILE 193 4.790 -12.560 -0.624 177 HG12 ILE 193 HG12 ILE 193 6.164 -10.425 -1.449 178 HG13 ILE 193 HG11 ILE 193 4.562 -9.703 -1.467 179 HG21 ILE 193 HG21 ILE 193 6.210 -12.425 -2.615 180 HG22 ILE 193 HG22 ILE 193 4.876 -11.695 -3.506 181 HG23 ILE 193 HG23 ILE 193 4.738 -13.350 -2.913 182 HD11 ILE 193 HD11 ILE 193 4.282 -10.226 0.890 183 HD12 ILE 193 HD12 ILE 193 5.731 -9.263 0.619 184 HD13 ILE 193 HD13 ILE 193 5.866 -10.995 0.915 185 H ASP 194 HN ASP 194 2.032 -10.478 0.459 186 HA ASP 194 HA ASP 194 1.632 -12.885 2.078 187 HB2 ASP 194 HB2 ASP 194 3.001 -10.941 2.959 188 HB3 ASP 194 HB1 ASP 194 1.496 -10.036 3.047 189 H GLN 195 HN GLN 195 -0.052 -10.570 0.269 190 HA GLN 195 HA GLN 195 -2.238 -10.160 -0.161 191 HB2 GLN 195 HB2 GLN 195 -2.384 -12.652 -0.207 192 HB3 GLN 195 HB1 GLN 195 -2.778 -12.637 1.504 193 HG2 GLN 195 HG2 GLN 195 -4.742 -12.919 0.037 194 HG3 GLN 195 HG1 GLN 195 -4.845 -11.506 1.085 195 HE21 GLN 195 HE21 GLN 195 -4.505 -12.640 -2.182 196 HE22 GLN 195 HE22 GLN 195 -4.803 -11.116 -2.948 197 H THR 196 HN THR 196 -0.937 -8.886 2.020 198 HA THR 196 HA THR 196 -3.263 -8.410 3.772 199 HB THR 196 HB THR 196 -1.289 -9.563 4.913 200 HG1 THR 196 HG1 THR 196 -1.862 -8.561 6.742 201 HG21 THR 196 HG21 THR 196 0.581 -8.180 5.592 202 HG22 THR 196 HG22 THR 196 -0.086 -6.799 4.720 203 HG23 THR 196 HG23 THR 196 0.485 -8.209 3.833 204 H THR 197 HN THR 197 -3.620 -6.258 4.446 205 HA THR 197 HA THR 197 -2.448 -4.275 2.633 206 HB THR 197 HB THR 197 -4.841 -3.830 4.427 207 HG1 THR 197 HG1 THR 197 -5.215 -5.660 3.027 208 HG21 THR 197 HG21 THR 197 -3.785 -1.854 3.432 209 HG22 THR 197 HG22 THR 197 -5.387 -2.135 2.749 210 HG23 THR 197 HG23 THR 197 -3.947 -2.571 1.829 211 H THR 198 HN THR 198 -1.216 -2.614 3.374 212 HA THR 198 HA THR 198 -0.768 -2.538 6.280 213 HB THR 198 HB THR 198 1.334 -2.181 4.140 214 HG1 THR 198 HG1 THR 198 0.206 -4.414 5.244 215 HG21 THR 198 HG21 THR 198 1.573 -2.606 7.122 216 HG22 THR 198 HG22 THR 198 1.838 -1.078 6.280 217 HG23 THR 198 HG23 THR 198 2.912 -2.445 5.983 218 H TRP 199 HN TRP 199 -1.439 -0.575 7.068 219 HA TRP 199 HA TRP 199 -1.377 1.841 5.498 220 HB2 TRP 199 HB2 TRP 199 -1.911 1.297 8.418 221 HB3 TRP 199 HB1 TRP 199 -1.868 2.922 7.757 222 HD1 TRP 199 HD1 TRP 199 -4.150 0.046 8.317 223 HE1 TRP 199 HE1 TRP 199 -6.463 0.550 7.315 224 HE3 TRP 199 HE3 TRP 199 -2.940 4.153 5.500 225 HZ2 TRP 199 HZ2 TRP 199 -7.612 2.424 5.557 226 HZ3 TRP 199 HZ3 TRP 199 -4.724 5.235 4.178 227 HH2 TRP 199 HH2 TRP 199 -7.007 4.379 4.216 228 H GLN 200 HN GLN 200 0.956 0.073 7.023 229 HA GLN 200 HA GLN 200 2.463 2.303 8.116 230 HB2 GLN 200 HB2 GLN 200 2.311 0.153 9.346 231 HB3 GLN 200 HB1 GLN 200 3.133 -0.645 8.014 232 HG2 GLN 200 HG2 GLN 200 4.686 -0.229 9.797 233 HG3 GLN 200 HG1 GLN 200 5.098 0.779 8.410 234 HE21 GLN 200 HE21 GLN 200 3.803 0.725 11.632 235 HE22 GLN 200 HE22 GLN 200 3.925 2.427 11.927 236 H ASP 201 HN ASP 201 3.756 3.425 6.842 237 HA ASP 201 HA ASP 201 4.554 2.441 4.266 238 HB2 ASP 201 HB2 ASP 201 4.007 4.836 4.686 239 HB3 ASP 201 HB1 ASP 201 5.458 4.958 5.680 240 HA PRO 202 HA PRO 202 8.100 0.390 5.946 241 HB2 PRO 202 HB2 PRO 202 9.089 -0.518 3.569 242 HB3 PRO 202 HB1 PRO 202 7.754 -1.279 4.438 243 HG2 PRO 202 HG2 PRO 202 7.695 0.532 2.077 244 HG3 PRO 202 HG1 PRO 202 6.664 -0.855 2.456 245 HD2 PRO 202 HD2 PRO 202 5.893 1.747 2.798 246 HD3 PRO 202 HD1 PRO 202 5.237 0.392 3.737 247 H ARG 203 HN ARG 203 8.209 3.055 3.742 248 HA ARG 203 HA ARG 203 11.130 3.197 3.949 249 HB2 ARG 203 HB2 ARG 203 9.123 4.382 2.131 250 HB3 ARG 203 HB1 ARG 203 10.490 5.409 2.533 251 HG2 ARG 203 HG2 ARG 203 10.864 4.178 0.469 252 HG3 ARG 203 HG1 ARG 203 12.032 3.729 1.708 253 HD2 ARG 203 HD2 ARG 203 9.537 2.135 1.208 254 HD3 ARG 203 HD1 ARG 203 11.009 1.860 0.296 255 HE ARG 203 HE ARG 203 11.106 1.727 3.223 256 HH11 ARG 203 HH11 ARG 203 11.391 0.154 0.124 257 HH12 ARG 203 HH12 ARG 203 11.939 -1.355 0.783 258 HH21 ARG 203 HH21 ARG 203 11.854 -0.227 4.115 259 HH22 ARG 203 HH22 ARG 203 12.218 -1.574 3.074 260 H LYS 204 HN LYS 204 8.205 4.775 5.014 261 HA LYS 204 HA LYS 204 9.381 6.923 6.401 262 HB2 LYS 204 HB2 LYS 204 6.897 6.480 5.989 263 HB3 LYS 204 HB1 LYS 204 6.969 5.342 7.323 264 HG2 LYS 204 HG2 LYS 204 7.774 8.214 7.648 265 HG3 LYS 204 HG1 LYS 204 6.098 7.690 7.792 266 HD2 LYS 204 HD2 LYS 204 8.355 6.538 9.430 267 HD3 LYS 204 HD1 LYS 204 7.364 7.896 9.958 268 HE2 LYS 204 HE2 LYS 204 6.345 6.066 10.966 269 HE3 LYS 204 HE1 LYS 204 5.367 6.331 9.525 270 HZ1 LYS 204 HZ1 LYS 204 7.451 4.253 9.935 271 HZ2 LYS 204 HZ2 LYS 204 6.740 4.585 8.430 272 HZ3 LYS 204 HZ3 LYS 204 5.784 4.020 9.703 273 H ALA 205 HN ALA 205 8.859 3.548 7.170 274 HA ALA 205 HA ALA 205 9.620 2.163 8.798 275 HB1 ALA 205 HB1 ALA 205 12.016 3.986 8.675 276 HB2 ALA 205 HB2 ALA 205 11.695 2.635 7.588 277 HB3 ALA 205 HB3 ALA 205 11.986 2.338 9.302 278 H1 SER 201 HT1 SER 201 -7.057 -5.018 -13.869 279 H2 SER 201 HT2 SER 201 -5.798 -4.610 -12.805 280 H3 SER 201 HT3 SER 201 -5.485 -4.778 -14.461 281 HA SER 201 HA SER 201 -5.553 -2.466 -13.884 282 HB2 SER 201 HB2 SER 201 -8.047 -3.257 -15.410 283 HB3 SER 201 HB1 SER 201 -7.129 -1.759 -15.575 284 HG SER 201 HG SER 201 -6.513 -3.097 -17.237 285 H TPO 202 HN TPO 202 -7.444 -4.277 -11.987 286 HA TPO 202 HA TPO 202 -9.497 -2.312 -11.383 287 HB TPO 202 HB TPO 202 -8.987 -4.942 -9.980 288 HG21 TPO 202 HG21 TPO 202 -10.510 -3.400 -8.837 289 HG22 TPO 202 HG22 TPO 202 -11.379 -4.807 -9.453 290 HG23 TPO 202 HG23 TPO 202 -11.481 -3.265 -10.304 291 H TYR 203 HN TYR 203 -9.501 -1.018 -9.622 292 HA TYR 203 HA TYR 203 -7.046 -0.901 -8.039 293 HB2 TYR 203 HB2 TYR 203 -8.075 1.123 -9.180 294 HB3 TYR 203 HB1 TYR 203 -9.385 1.015 -8.011 295 HD1 TYR 203 HD1 TYR 203 -5.801 1.721 -8.453 296 HD2 TYR 203 HD2 TYR 203 -9.076 1.752 -5.736 297 HE1 TYR 203 HE1 TYR 203 -4.490 3.089 -6.890 298 HE2 TYR 203 HE2 TYR 203 -7.774 3.121 -4.171 299 HH TYR 203 HH TYR 203 -5.605 3.782 -3.663 300 HA PRO 204 HA PRO 204 -9.070 -2.946 -4.633 301 HB2 PRO 204 HB2 PRO 204 -7.285 -2.311 -2.685 302 HB3 PRO 204 HB1 PRO 204 -6.978 -3.549 -3.909 303 HG2 PRO 204 HG2 PRO 204 -6.056 -0.702 -3.825 304 HG3 PRO 204 HG1 PRO 204 -5.140 -2.159 -4.254 305 HD2 PRO 204 HD2 PRO 204 -6.147 -0.490 -6.122 306 HD3 PRO 204 HD1 PRO 204 -6.031 -2.243 -6.387 307 H HIS 205 HN HIS 205 -9.099 -2.164 -2.038 308 HA HIS 205 HA HIS 205 -10.319 0.510 -2.041 309 HB2 HIS 205 HB2 HIS 205 -12.170 -1.002 -2.261 310 HB3 HIS 205 HB1 HIS 205 -11.530 -2.062 -1.012 311 HD1 HIS 205 HD1 HIS 205 -12.214 1.703 -0.907 312 HD2 HIS 205 HD2 HIS 205 -13.224 -1.825 1.057 313 HE1 HIS 205 HE1 HIS 205 -13.681 2.390 1.014 314 HE2 HIS 205 HE2 HIS 205 -14.397 0.231 2.098 315 H SEP 206 HN SEP 206 -10.100 1.668 -0.158 316 HA SEP 206 HA SEP 206 -7.929 1.120 1.489 317 HB2 SEP 206 HB2 SEP 206 -9.079 2.923 2.987 318 HB3 SEP 206 HB1 SEP 206 -8.494 3.367 1.386 319 HA PRO 207 HA PRO 207 -9.267 -1.934 4.306 320 HB2 PRO 207 HB2 PRO 207 -7.539 -0.696 6.324 321 HB3 PRO 207 HB1 PRO 207 -7.415 -2.283 5.554 322 HG2 PRO 207 HG2 PRO 207 -5.739 -0.194 5.038 323 HG3 PRO 207 HG1 PRO 207 -6.066 -1.510 3.901 324 HD2 PRO 207 HD2 PRO 207 -7.011 1.290 3.884 325 HD3 PRO 207 HD1 PRO 207 -6.770 0.169 2.533 326 H THR 208 HN THR 208 -9.694 1.415 4.896 327 HA THR 208 HA THR 208 -11.075 0.995 7.413 328 HB THR 208 HB THR 208 -11.472 3.540 7.162 329 HG1 THR 208 HG1 THR 208 -9.711 4.425 5.765 330 HG21 THR 208 HG21 THR 208 -8.655 2.480 7.420 331 HG22 THR 208 HG22 THR 208 -9.847 2.562 8.717 332 HG23 THR 208 HG23 THR 208 -9.227 4.046 7.993 333 H SER 209 HN SER 209 -12.217 3.327 5.068 334 HA SER 209 HA SER 209 -14.485 1.819 4.199 335 HB2 SER 209 HB2 SER 209 -14.925 3.971 6.289 336 HB3 SER 209 HB1 SER 209 -16.204 3.231 5.329 337 HG SER 209 HG SER 209 -14.604 1.388 6.557 Start of MODEL 5 1 H ASP 170 H ASP 170 16.861 0.159 -6.039 2 HA ASP 170 HA ASP 170 14.493 -0.383 -6.086 3 HB2 ASP 170 HB2 ASP 170 16.258 -2.127 -5.836 4 HB3 ASP 170 HB1 ASP 170 16.061 -2.027 -4.088 5 H VAL 171 HN VAL 171 15.687 0.774 -3.016 6 HA VAL 171 HA VAL 171 13.284 0.081 -1.609 7 HB VAL 171 HB VAL 171 14.180 1.210 0.318 8 HG11 VAL 171 HG11 VAL 171 14.932 -1.047 -0.121 9 HG12 VAL 171 HG12 VAL 171 16.233 -0.106 0.609 10 HG13 VAL 171 HG13 VAL 171 16.250 -0.440 -1.122 11 HG21 VAL 171 HG21 VAL 171 16.469 2.095 -1.436 12 HG22 VAL 171 HG22 VAL 171 16.324 2.345 0.302 13 HG23 VAL 171 HG23 VAL 171 15.202 3.145 -0.796 14 HA PRO 172 HA PRO 172 12.441 4.895 -2.222 15 HB2 PRO 172 HB2 PRO 172 12.675 4.834 -5.180 16 HB3 PRO 172 HB1 PRO 172 13.069 6.129 -4.041 17 HG2 PRO 172 HG2 PRO 172 14.996 4.721 -5.216 18 HG3 PRO 172 HG1 PRO 172 15.134 5.218 -3.519 19 HD2 PRO 172 HD2 PRO 172 14.414 2.547 -4.659 20 HD3 PRO 172 HD1 PRO 172 15.449 2.940 -3.276 21 H LEU 173 HN LEU 173 11.780 2.212 -4.383 22 HA LEU 173 HA LEU 173 8.993 2.390 -3.605 23 HB2 LEU 173 HB2 LEU 173 9.526 3.561 -5.927 24 HB3 LEU 173 HB1 LEU 173 9.495 1.908 -6.507 25 HG LEU 173 HG LEU 173 7.338 3.078 -6.807 26 HD11 LEU 173 HD11 LEU 173 7.352 0.648 -6.596 27 HD12 LEU 173 HD12 LEU 173 5.900 1.340 -5.873 28 HD13 LEU 173 HD13 LEU 173 7.222 0.793 -4.842 29 HD21 LEU 173 HD21 LEU 173 7.372 4.557 -4.921 30 HD22 LEU 173 HD22 LEU 173 7.396 3.198 -3.797 31 HD23 LEU 173 HD23 LEU 173 5.961 3.506 -4.773 32 HA PRO 174 HA PRO 174 10.492 -1.892 -3.210 33 HB2 PRO 174 HB2 PRO 174 7.938 -2.159 -1.732 34 HB3 PRO 174 HB1 PRO 174 9.585 -2.538 -1.222 35 HG2 PRO 174 HG2 PRO 174 8.285 -0.414 -0.251 36 HG3 PRO 174 HG1 PRO 174 10.029 -0.371 -0.567 37 HD2 PRO 174 HD2 PRO 174 7.783 0.762 -2.194 38 HD3 PRO 174 HD1 PRO 174 9.377 1.456 -1.823 39 H ALA 175 HN ALA 175 10.003 -3.697 -4.406 40 HA ALA 175 HA ALA 175 8.010 -3.208 -6.473 41 HB1 ALA 175 HB1 ALA 175 10.149 -5.322 -6.330 42 HB2 ALA 175 HB2 ALA 175 10.314 -3.745 -7.100 43 HB3 ALA 175 HB3 ALA 175 9.166 -4.922 -7.738 44 H GLY 176 HN GLY 176 8.457 -5.401 -3.794 45 HA2 GLY 176 HA2 GLY 176 6.502 -7.301 -4.790 46 HA3 GLY 176 HA1 GLY 176 7.264 -7.335 -3.206 47 H TRP 177 HN TRP 177 6.049 -4.305 -3.977 48 HA TRP 177 HA TRP 177 3.760 -4.761 -2.191 49 HB2 TRP 177 HB2 TRP 177 5.447 -2.262 -2.513 50 HB3 TRP 177 HB1 TRP 177 4.090 -2.445 -1.410 51 HD1 TRP 177 HD1 TRP 177 7.381 -4.454 -1.991 52 HE1 TRP 177 HE1 TRP 177 8.426 -4.937 0.305 53 HE3 TRP 177 HE3 TRP 177 3.880 -2.215 0.979 54 HZ2 TRP 177 HZ2 TRP 177 7.849 -4.433 3.014 55 HZ3 TRP 177 HZ3 TRP 177 4.204 -2.255 3.414 56 HH2 TRP 177 HH2 TRP 177 6.152 -3.343 4.404 57 H GLU 178 HN GLU 178 2.238 -2.684 -2.435 58 HA GLU 178 HA GLU 178 1.730 -2.246 -5.293 59 HB2 GLU 178 HB2 GLU 178 0.278 -4.066 -4.471 60 HB3 GLU 178 HB1 GLU 178 -0.324 -3.021 -3.193 61 HG2 GLU 178 HG2 GLU 178 -1.907 -3.178 -5.025 62 HG3 GLU 178 HG1 GLU 178 -1.294 -1.532 -4.864 63 H MET 179 HN MET 179 1.280 -0.171 -5.780 64 HA MET 179 HA MET 179 1.218 1.718 -3.551 65 HB2 MET 179 HB2 MET 179 1.541 2.216 -6.514 66 HB3 MET 179 HB1 MET 179 1.552 3.459 -5.274 67 HG2 MET 179 HG2 MET 179 3.534 1.211 -5.497 68 HG3 MET 179 HG1 MET 179 3.780 2.870 -6.039 69 HE1 MET 179 HE1 MET 179 3.960 4.913 -2.788 70 HE2 MET 179 HE2 MET 179 2.602 4.712 -3.895 71 HE3 MET 179 HE3 MET 179 4.239 4.895 -4.529 72 H ALA 180 HN ALA 180 -0.915 1.479 -2.851 73 HA ALA 180 HA ALA 180 -2.988 2.298 -4.733 74 HB1 ALA 180 HB1 ALA 180 -3.223 1.450 -1.849 75 HB2 ALA 180 HB2 ALA 180 -3.493 0.423 -3.257 76 HB3 ALA 180 HB3 ALA 180 -4.566 1.788 -2.942 77 H LYS 181 HN LYS 181 -2.482 4.395 -5.097 78 HA LYS 181 HA LYS 181 -2.437 6.231 -2.800 79 HB2 LYS 181 HB2 LYS 181 -1.571 6.791 -5.647 80 HB3 LYS 181 HB1 LYS 181 -1.307 7.808 -4.240 81 HG2 LYS 181 HG2 LYS 181 0.210 6.124 -3.308 82 HG3 LYS 181 HG1 LYS 181 -0.040 5.107 -4.734 83 HD2 LYS 181 HD2 LYS 181 1.093 7.907 -4.754 84 HD3 LYS 181 HD1 LYS 181 2.038 6.422 -4.874 85 HE2 LYS 181 HE2 LYS 181 -0.141 7.184 -6.811 86 HE3 LYS 181 HE1 LYS 181 1.561 7.561 -7.061 87 HZ1 LYS 181 HZ1 LYS 181 0.561 4.802 -6.653 88 HZ2 LYS 181 HZ2 LYS 181 2.099 5.274 -7.183 89 HZ3 LYS 181 HZ3 LYS 181 0.746 5.499 -8.184 90 H THR 182 HN THR 182 -4.437 7.086 -2.435 91 HA THR 182 HA THR 182 -6.054 7.697 -4.814 92 HB THR 182 HB THR 182 -8.041 7.570 -3.461 93 HG1 THR 182 HG1 THR 182 -7.869 6.995 -1.223 94 HG21 THR 182 HG21 THR 182 -7.194 5.448 -4.323 95 HG22 THR 182 HG22 THR 182 -7.983 5.218 -2.761 96 HG23 THR 182 HG23 THR 182 -6.222 5.233 -2.866 97 H SER 183 HN SER 183 -6.915 9.710 -5.110 98 HA SER 183 HA SER 183 -5.457 11.890 -4.047 99 HB2 SER 183 HB2 SER 183 -8.073 12.017 -5.562 100 HB3 SER 183 HB1 SER 183 -6.844 13.276 -5.443 101 HG SER 183 HG SER 183 -7.026 11.303 -7.220 102 H SER 184 HN SER 184 -8.155 10.183 -2.935 103 HA SER 184 HA SER 184 -9.531 12.201 -1.514 104 HB2 SER 184 HB2 SER 184 -10.397 9.888 -2.059 105 HB3 SER 184 HB1 SER 184 -9.345 9.266 -0.790 106 HG SER 184 HG SER 184 -11.422 9.612 0.025 107 H GLY 185 HN GLY 185 -6.490 10.771 -1.057 108 HA2 GLY 185 HA2 GLY 185 -4.940 11.687 0.513 109 HA3 GLY 185 HA1 GLY 185 -6.288 12.042 1.587 110 H GLN 186 HN GLN 186 -5.959 8.992 -0.064 111 HA GLN 186 HA GLN 186 -5.334 7.742 2.525 112 HB2 GLN 186 HB2 GLN 186 -7.349 6.868 0.454 113 HB3 GLN 186 HB1 GLN 186 -6.799 5.831 1.763 114 HG2 GLN 186 HG2 GLN 186 -7.739 7.247 3.407 115 HG3 GLN 186 HG1 GLN 186 -8.027 8.528 2.236 116 HE21 GLN 186 HE21 GLN 186 -8.683 5.202 1.480 117 HE22 GLN 186 HE22 GLN 186 -10.406 5.333 1.481 118 H ARG 187 HN ARG 187 -3.390 6.918 2.402 119 HA ARG 187 HA ARG 187 -2.561 5.633 -0.105 120 HB2 ARG 187 HB2 ARG 187 -0.215 6.061 0.691 121 HB3 ARG 187 HB1 ARG 187 -1.136 7.502 0.291 122 HG2 ARG 187 HG2 ARG 187 -1.539 7.929 2.647 123 HG3 ARG 187 HG1 ARG 187 -0.681 6.449 3.077 124 HD2 ARG 187 HD2 ARG 187 0.540 8.770 1.596 125 HD3 ARG 187 HD1 ARG 187 0.682 8.510 3.333 126 HE ARG 187 HE ARG 187 1.570 6.184 2.176 127 HH11 ARG 187 HH11 ARG 187 2.453 9.568 1.987 128 HH12 ARG 187 HH12 ARG 187 4.140 9.239 1.689 129 HH21 ARG 187 HH21 ARG 187 3.803 5.762 1.796 130 HH22 ARG 187 HH22 ARG 187 4.899 7.088 1.602 131 H TYR 188 HN TYR 188 -2.618 3.432 0.073 132 HA TYR 188 HA TYR 188 -1.554 2.296 2.540 133 HB2 TYR 188 HB2 TYR 188 -3.319 0.521 2.480 134 HB3 TYR 188 HB1 TYR 188 -3.921 2.126 2.867 135 HD1 TYR 188 HD2 TYR 188 -5.220 3.395 1.158 136 HD2 TYR 188 HD1 TYR 188 -4.088 -0.665 0.569 137 HE1 TYR 188 HE2 TYR 188 -6.923 3.180 -0.601 138 HE2 TYR 188 HE1 TYR 188 -5.797 -0.893 -1.186 139 HH TYR 188 HH TYR 188 -7.620 1.872 -2.351 140 H PHE 189 HN PHE 189 -0.418 0.412 2.302 141 HA PHE 189 HA PHE 189 0.254 -0.203 -0.493 142 HB2 PHE 189 HB2 PHE 189 2.022 -0.300 1.963 143 HB3 PHE 189 HB1 PHE 189 2.508 -0.776 0.337 144 HD1 PHE 189 HD2 PHE 189 1.309 1.333 -1.296 145 HD2 PHE 189 HD1 PHE 189 3.316 1.572 2.450 146 HE1 PHE 189 HE2 PHE 189 1.957 3.649 -1.799 147 HE2 PHE 189 HE1 PHE 189 3.962 3.892 1.955 148 HZ PHE 189 HZ PHE 189 3.289 4.932 -0.176 149 H LEU 190 HN LEU 190 -0.154 -2.163 -1.169 150 HA LEU 190 HA LEU 190 -0.790 -4.267 0.732 151 HB2 LEU 190 HB2 LEU 190 -1.194 -3.836 -2.171 152 HB3 LEU 190 HB1 LEU 190 -1.052 -5.490 -1.630 153 HG LEU 190 HG LEU 190 -3.198 -3.490 -1.058 154 HD11 LEU 190 HD11 LEU 190 -3.837 -4.821 -2.806 155 HD12 LEU 190 HD12 LEU 190 -4.443 -5.783 -1.450 156 HD13 LEU 190 HD13 LEU 190 -2.917 -6.211 -2.227 157 HD21 LEU 190 HD21 LEU 190 -2.497 -4.291 1.146 158 HD22 LEU 190 HD22 LEU 190 -2.634 -5.958 0.588 159 HD23 LEU 190 HD23 LEU 190 -4.074 -4.946 0.703 160 H ASN 191 HN ASN 191 0.629 -5.977 1.197 161 HA ASN 191 HA ASN 191 2.951 -6.302 -0.533 162 HB2 ASN 191 HB2 ASN 191 2.060 -7.794 1.949 163 HB3 ASN 191 HB1 ASN 191 3.462 -8.263 0.990 164 HD21 ASN 191 HD21 ASN 191 2.147 -5.927 3.193 165 HD22 ASN 191 HD22 ASN 191 3.634 -5.124 3.542 166 H HIS 192 HN HIS 192 2.608 -7.308 -2.416 167 HA HIS 192 HA HIS 192 0.265 -8.880 -2.900 168 HB2 HIS 192 HB2 HIS 192 2.656 -8.098 -4.506 169 HB3 HIS 192 HB1 HIS 192 1.711 -9.475 -5.057 170 HD1 HIS 192 HD1 HIS 192 -0.740 -8.998 -5.844 171 HD2 HIS 192 HD2 HIS 192 1.498 -5.616 -4.913 172 HE1 HIS 192 HE1 HIS 192 -2.008 -7.056 -6.808 173 HE2 HIS 192 HE2 HIS 192 -0.518 -5.054 -6.440 174 H ILE 193 HN ILE 193 2.986 -9.592 -1.279 175 HA ILE 193 HA ILE 193 3.385 -12.313 -2.210 176 HB ILE 193 HB ILE 193 4.629 -11.299 0.299 177 HG12 ILE 193 HG12 ILE 193 6.012 -10.448 -2.181 178 HG13 ILE 193 HG11 ILE 193 4.565 -9.536 -1.762 179 HG21 ILE 193 HG21 ILE 193 5.180 -13.509 -0.544 180 HG22 ILE 193 HG22 ILE 193 6.592 -12.455 -0.612 181 HG23 ILE 193 HG23 ILE 193 5.688 -12.813 -2.084 182 HD11 ILE 193 HD11 ILE 193 6.546 -8.482 -0.856 183 HD12 ILE 193 HD12 ILE 193 6.956 -9.963 0.003 184 HD13 ILE 193 HD13 ILE 193 5.505 -9.066 0.444 185 H ASP 194 HN ASP 194 2.493 -10.628 0.768 186 HA ASP 194 HA ASP 194 1.528 -13.129 1.939 187 HB2 ASP 194 HB2 ASP 194 3.180 -11.763 3.198 188 HB3 ASP 194 HB1 ASP 194 2.024 -10.442 3.234 189 H GLN 195 HN GLN 195 0.343 -10.364 0.402 190 HA GLN 195 HA GLN 195 -1.717 -9.421 0.122 191 HB2 GLN 195 HB2 GLN 195 -2.504 -11.812 0.012 192 HB3 GLN 195 HB1 GLN 195 -2.787 -11.755 1.743 193 HG2 GLN 195 HG2 GLN 195 -4.877 -11.435 0.728 194 HG3 GLN 195 HG1 GLN 195 -4.375 -9.851 1.308 195 HE21 GLN 195 HE21 GLN 195 -2.477 -9.501 -0.944 196 HE22 GLN 195 HE22 GLN 195 -3.461 -9.136 -2.319 197 H THR 196 HN THR 196 0.006 -8.608 2.096 198 HA THR 196 HA THR 196 -1.481 -8.274 4.581 199 HB THR 196 HB THR 196 1.005 -6.789 4.437 200 HG1 THR 196 HG1 THR 196 1.416 -9.557 4.224 201 HG21 THR 196 HG21 THR 196 0.505 -9.286 6.022 202 HG22 THR 196 HG22 THR 196 -0.296 -7.771 6.444 203 HG23 THR 196 HG23 THR 196 1.466 -7.871 6.461 204 H THR 197 HN THR 197 -2.572 -6.501 5.115 205 HA THR 197 HA THR 197 -2.678 -4.290 3.240 206 HB THR 197 HB THR 197 -4.593 -3.579 4.807 207 HG1 THR 197 HG1 THR 197 -4.643 -4.717 6.592 208 HG21 THR 197 HG21 THR 197 -6.115 -5.334 3.878 209 HG22 THR 197 HG22 THR 197 -4.688 -6.183 3.284 210 HG23 THR 197 HG23 THR 197 -5.073 -4.573 2.675 211 H THR 198 HN THR 198 -1.123 -2.808 3.517 212 HA THR 198 HA THR 198 -0.234 -2.148 6.242 213 HB THR 198 HB THR 198 1.141 -1.477 3.634 214 HG1 THR 198 HG1 THR 198 1.143 -3.665 3.663 215 HG21 THR 198 HG21 THR 198 3.135 -1.285 5.034 216 HG22 THR 198 HG22 THR 198 2.179 -1.680 6.460 217 HG23 THR 198 HG23 THR 198 1.875 -0.182 5.585 218 H TRP 199 HN TRP 199 -0.591 -0.114 7.066 219 HA TRP 199 HA TRP 199 -1.581 1.951 5.216 220 HB2 TRP 199 HB2 TRP 199 -2.127 1.367 8.095 221 HB3 TRP 199 HB1 TRP 199 -2.244 3.029 7.534 222 HD1 TRP 199 HD1 TRP 199 -4.190 -0.153 7.695 223 HE1 TRP 199 HE1 TRP 199 -6.440 0.142 6.485 224 HE3 TRP 199 HE3 TRP 199 -3.252 4.275 5.306 225 HZ2 TRP 199 HZ2 TRP 199 -7.649 1.997 4.728 226 HZ3 TRP 199 HZ3 TRP 199 -5.008 5.237 3.877 227 HH2 TRP 199 HH2 TRP 199 -7.162 4.122 3.593 228 H GLN 200 HN GLN 200 1.218 1.052 6.594 229 HA GLN 200 HA GLN 200 2.069 3.815 7.149 230 HB2 GLN 200 HB2 GLN 200 3.803 2.795 8.640 231 HB3 GLN 200 HB1 GLN 200 2.148 2.571 9.189 232 HG2 GLN 200 HG2 GLN 200 2.190 0.288 8.228 233 HG3 GLN 200 HG1 GLN 200 3.889 0.532 7.827 234 HE21 GLN 200 HE21 GLN 200 4.545 -1.156 9.149 235 HE22 GLN 200 HE22 GLN 200 4.551 -1.034 10.877 236 H ASP 201 HN ASP 201 4.033 4.518 6.348 237 HA ASP 201 HA ASP 201 4.834 3.358 3.862 238 HB2 ASP 201 HB2 ASP 201 4.920 5.784 4.262 239 HB3 ASP 201 HB1 ASP 201 6.144 5.543 5.506 240 HA PRO 202 HA PRO 202 7.397 0.106 5.348 241 HB2 PRO 202 HB2 PRO 202 8.731 0.511 2.729 242 HB3 PRO 202 HB1 PRO 202 8.043 -0.955 3.434 243 HG2 PRO 202 HG2 PRO 202 6.807 0.423 1.478 244 HG3 PRO 202 HG1 PRO 202 5.922 -0.459 2.732 245 HD2 PRO 202 HD2 PRO 202 6.288 2.457 2.382 246 HD3 PRO 202 HD1 PRO 202 4.985 1.565 3.181 247 H ARG 203 HN ARG 203 8.723 3.186 4.305 248 HA ARG 203 HA ARG 203 11.441 2.435 4.873 249 HB2 ARG 203 HB2 ARG 203 10.100 5.015 4.155 250 HB3 ARG 203 HB1 ARG 203 11.738 5.034 4.794 251 HG2 ARG 203 HG2 ARG 203 11.844 5.069 2.407 252 HG3 ARG 203 HG1 ARG 203 12.417 3.502 2.969 253 HD2 ARG 203 HD2 ARG 203 11.019 3.143 1.066 254 HD3 ARG 203 HD1 ARG 203 10.149 2.580 2.493 255 HE ARG 203 HE ARG 203 8.791 4.579 2.375 256 HH11 ARG 203 HH11 ARG 203 10.821 3.931 -0.402 257 HH12 ARG 203 HH12 ARG 203 9.827 4.828 -1.507 258 HH21 ARG 203 HH21 ARG 203 7.458 5.747 0.923 259 HH22 ARG 203 HH22 ARG 203 7.925 5.883 -0.751 260 H LYS 204 HN LYS 204 8.810 3.860 6.641 261 HA LYS 204 HA LYS 204 10.539 4.144 8.990 262 HB2 LYS 204 HB2 LYS 204 9.207 6.075 8.772 263 HB3 LYS 204 HB1 LYS 204 7.774 5.144 8.353 264 HG2 LYS 204 HG2 LYS 204 7.653 6.109 10.607 265 HG3 LYS 204 HG1 LYS 204 7.569 4.348 10.619 266 HD2 LYS 204 HD2 LYS 204 10.048 4.357 11.104 267 HD3 LYS 204 HD1 LYS 204 9.905 6.097 11.364 268 HE2 LYS 204 HE2 LYS 204 9.765 4.977 13.490 269 HE3 LYS 204 HE1 LYS 204 8.187 5.654 13.093 270 HZ1 LYS 204 HZ1 LYS 204 7.910 3.455 13.959 271 HZ2 LYS 204 HZ2 LYS 204 9.011 2.812 12.848 272 HZ3 LYS 204 HZ3 LYS 204 7.527 3.417 12.306 273 H ALA 205 HN ALA 205 7.434 2.701 8.049 274 HA ALA 205 HA ALA 205 6.128 1.109 8.996 275 HB1 ALA 205 HB1 ALA 205 8.797 -0.139 9.650 276 HB2 ALA 205 HB2 ALA 205 7.922 -0.308 8.129 277 HB3 ALA 205 HB3 ALA 205 7.242 -0.972 9.614 278 H1 SER 201 HT1 SER 201 -10.167 -4.728 -13.154 279 H2 SER 201 HT2 SER 201 -9.871 -6.378 -13.410 280 H3 SER 201 HT3 SER 201 -8.572 -5.288 -13.290 281 HA SER 201 HA SER 201 -10.483 -5.825 -11.095 282 HB2 SER 201 HB2 SER 201 -7.697 -6.935 -11.551 283 HB3 SER 201 HB1 SER 201 -8.677 -7.191 -10.107 284 HG SER 201 HG SER 201 -8.672 -8.829 -11.963 285 H TPO 202 HN TPO 202 -9.286 -3.373 -12.331 286 HA TPO 202 HA TPO 202 -7.073 -2.564 -10.722 287 HB TPO 202 HB TPO 202 -8.827 -0.802 -12.436 288 HG21 TPO 202 HG21 TPO 202 -7.194 0.370 -11.042 289 HG22 TPO 202 HG22 TPO 202 -6.755 0.481 -12.746 290 HG23 TPO 202 HG23 TPO 202 -5.902 -0.642 -11.687 291 H TYR 203 HN TYR 203 -7.042 -1.332 -8.945 292 HA TYR 203 HA TYR 203 -7.667 -0.172 -7.113 293 HB2 TYR 203 HB2 TYR 203 -8.734 1.433 -8.630 294 HB3 TYR 203 HB1 TYR 203 -10.197 0.456 -8.651 295 HD1 TYR 203 HD2 TYR 203 -8.098 2.682 -6.602 296 HD2 TYR 203 HD1 TYR 203 -11.763 0.532 -6.822 297 HE1 TYR 203 HE2 TYR 203 -8.932 3.911 -4.642 298 HE2 TYR 203 HE1 TYR 203 -12.607 1.760 -4.867 299 HH TYR 203 HH TYR 203 -11.377 2.996 -2.783 300 HA PRO 204 HA PRO 204 -10.120 -3.430 -5.222 301 HB2 PRO 204 HB2 PRO 204 -8.518 -3.209 -2.890 302 HB3 PRO 204 HB1 PRO 204 -8.398 -4.436 -4.149 303 HG2 PRO 204 HG2 PRO 204 -6.487 -2.484 -3.574 304 HG3 PRO 204 HG1 PRO 204 -6.563 -3.462 -5.049 305 HD2 PRO 204 HD2 PRO 204 -7.461 -0.659 -4.581 306 HD3 PRO 204 HD1 PRO 204 -6.780 -1.403 -6.044 307 H HIS 205 HN HIS 205 -9.471 -2.598 -2.183 308 HA HIS 205 HA HIS 205 -11.041 -0.171 -1.973 309 HB2 HIS 205 HB2 HIS 205 -12.739 -1.997 -1.928 310 HB3 HIS 205 HB1 HIS 205 -11.907 -2.704 -0.546 311 HD1 HIS 205 HD1 HIS 205 -13.734 0.490 -1.494 312 HD2 HIS 205 HD2 HIS 205 -12.716 -1.729 1.874 313 HE1 HIS 205 HE1 HIS 205 -14.905 1.603 0.434 314 HE2 HIS 205 HE2 HIS 205 -14.060 0.400 2.479 315 H SEP 206 HN SEP 206 -10.374 1.046 -0.306 316 HA SEP 206 HA SEP 206 -8.012 0.498 1.053 317 HB2 SEP 206 HB2 SEP 206 -9.140 2.343 2.667 318 HB3 SEP 206 HB1 SEP 206 -8.435 2.738 1.101 319 HA PRO 207 HA PRO 207 -9.197 -2.598 3.966 320 HB2 PRO 207 HB2 PRO 207 -7.118 -2.078 5.759 321 HB3 PRO 207 HB1 PRO 207 -7.066 -3.192 4.391 322 HG2 PRO 207 HG2 PRO 207 -6.022 -0.425 4.626 323 HG3 PRO 207 HG1 PRO 207 -5.396 -1.788 3.684 324 HD2 PRO 207 HD2 PRO 207 -6.719 0.287 2.560 325 HD3 PRO 207 HD1 PRO 207 -6.797 -1.363 1.911 326 H THR 208 HN THR 208 -8.995 0.749 4.773 327 HA THR 208 HA THR 208 -10.706 0.206 7.088 328 HB THR 208 HB THR 208 -8.541 2.318 7.067 329 HG1 THR 208 HG1 THR 208 -8.702 -0.166 8.485 330 HG21 THR 208 HG21 THR 208 -9.110 2.576 9.443 331 HG22 THR 208 HG22 THR 208 -10.408 1.398 9.257 332 HG23 THR 208 HG23 THR 208 -10.491 2.941 8.408 333 H SER 209 HN SER 209 -12.428 0.643 5.670 334 HA SER 209 HA SER 209 -13.325 3.319 5.788 335 HB2 SER 209 HB2 SER 209 -13.637 3.588 3.279 336 HB3 SER 209 HB1 SER 209 -11.980 3.750 3.860 337 HG SER 209 HG SER 209 -11.690 2.357 2.264 Start of MODEL 6 1 H ASP 170 H ASP 170 14.952 3.038 -7.977 2 HA ASP 170 HA ASP 170 13.335 1.313 -7.627 3 HB2 ASP 170 HB2 ASP 170 14.729 -0.584 -8.227 4 HB3 ASP 170 HB1 ASP 170 15.351 0.867 -9.003 5 H VAL 171 HN VAL 171 15.947 1.184 -5.186 6 HA VAL 171 HA VAL 171 14.586 -0.908 -3.779 7 HB VAL 171 HB VAL 171 17.055 -0.780 -3.876 8 HG11 VAL 171 HG11 VAL 171 18.239 0.652 -2.267 9 HG12 VAL 171 HG12 VAL 171 16.726 1.489 -1.931 10 HG13 VAL 171 HG13 VAL 171 17.439 1.567 -3.544 11 HG21 VAL 171 HG21 VAL 171 17.420 -1.504 -1.568 12 HG22 VAL 171 HG22 VAL 171 15.948 -2.190 -2.254 13 HG23 VAL 171 HG23 VAL 171 15.846 -0.844 -1.120 14 HA PRO 172 HA PRO 172 13.606 2.662 -0.617 15 HB2 PRO 172 HB2 PRO 172 12.785 4.995 -1.728 16 HB3 PRO 172 HB1 PRO 172 14.459 4.704 -1.242 17 HG2 PRO 172 HG2 PRO 172 13.215 4.478 -3.958 18 HG3 PRO 172 HG1 PRO 172 14.744 5.251 -3.494 19 HD2 PRO 172 HD2 PRO 172 14.681 2.793 -4.574 20 HD3 PRO 172 HD1 PRO 172 15.853 3.235 -3.319 21 H LEU 173 HN LEU 173 12.177 1.770 -3.567 22 HA LEU 173 HA LEU 173 9.516 1.895 -2.321 23 HB2 LEU 173 HB2 LEU 173 9.947 3.459 -4.332 24 HB3 LEU 173 HB1 LEU 173 9.965 2.001 -5.299 25 HG LEU 173 HG LEU 173 7.795 3.255 -5.308 26 HD11 LEU 173 HD11 LEU 173 7.693 0.440 -4.239 27 HD12 LEU 173 HD12 LEU 173 7.846 0.910 -5.932 28 HD13 LEU 173 HD13 LEU 173 6.370 1.284 -5.044 29 HD21 LEU 173 HD21 LEU 173 7.758 3.993 -3.008 30 HD22 LEU 173 HD22 LEU 173 7.676 2.323 -2.449 31 HD23 LEU 173 HD23 LEU 173 6.327 3.017 -3.348 32 HA PRO 174 HA PRO 174 10.497 -2.523 -2.729 33 HB2 PRO 174 HB2 PRO 174 7.983 -2.700 -1.146 34 HB3 PRO 174 HB1 PRO 174 9.572 -3.405 -0.828 35 HG2 PRO 174 HG2 PRO 174 8.679 -1.330 0.582 36 HG3 PRO 174 HG1 PRO 174 10.389 -1.459 0.123 37 HD2 PRO 174 HD2 PRO 174 8.218 0.210 -1.091 38 HD3 PRO 174 HD1 PRO 174 9.911 0.635 -0.753 39 H ALA 175 HN ALA 175 9.821 -3.905 -4.275 40 HA ALA 175 HA ALA 175 7.691 -2.908 -5.992 41 HB1 ALA 175 HB1 ALA 175 9.881 -3.372 -6.969 42 HB2 ALA 175 HB2 ALA 175 8.629 -4.384 -7.688 43 HB3 ALA 175 HB3 ALA 175 9.739 -5.064 -6.497 44 H GLY 176 HN GLY 176 8.092 -5.315 -3.652 45 HA2 GLY 176 HA2 GLY 176 6.042 -7.073 -4.733 46 HA3 GLY 176 HA1 GLY 176 6.824 -7.220 -3.163 47 H TRP 177 HN TRP 177 5.797 -4.098 -3.757 48 HA TRP 177 HA TRP 177 3.427 -4.495 -2.063 49 HB2 TRP 177 HB2 TRP 177 5.362 -2.162 -2.126 50 HB3 TRP 177 HB1 TRP 177 3.896 -2.228 -1.152 51 HD1 TRP 177 HD1 TRP 177 6.925 -4.630 -1.571 52 HE1 TRP 177 HE1 TRP 177 7.700 -5.353 0.767 53 HE3 TRP 177 HE3 TRP 177 3.569 -1.996 1.226 54 HZ2 TRP 177 HZ2 TRP 177 6.998 -4.858 3.445 55 HZ3 TRP 177 HZ3 TRP 177 3.699 -2.166 3.678 56 HH2 TRP 177 HH2 TRP 177 5.383 -3.571 4.753 57 H GLU 178 HN GLU 178 1.556 -3.618 -2.712 58 HA GLU 178 HA GLU 178 1.475 -2.454 -5.384 59 HB2 GLU 178 HB2 GLU 178 -0.051 -4.333 -4.723 60 HB3 GLU 178 HB1 GLU 178 -0.804 -3.255 -3.560 61 HG2 GLU 178 HG2 GLU 178 -1.688 -1.880 -5.260 62 HG3 GLU 178 HG1 GLU 178 -0.689 -2.649 -6.495 63 H MET 179 HN MET 179 1.169 -0.335 -5.753 64 HA MET 179 HA MET 179 0.837 1.414 -3.452 65 HB2 MET 179 HB2 MET 179 1.273 2.166 -6.348 66 HB3 MET 179 HB1 MET 179 1.326 3.255 -4.971 67 HG2 MET 179 HG2 MET 179 3.218 0.955 -5.341 68 HG3 MET 179 HG1 MET 179 3.521 2.595 -5.912 69 HE1 MET 179 HE1 MET 179 4.055 4.623 -4.436 70 HE2 MET 179 HE2 MET 179 3.861 4.661 -2.683 71 HE3 MET 179 HE3 MET 179 2.446 4.491 -3.723 72 H ALA 180 HN ALA 180 -1.322 1.246 -2.892 73 HA ALA 180 HA ALA 180 -3.274 1.990 -4.929 74 HB1 ALA 180 HB1 ALA 180 -3.848 0.137 -3.448 75 HB2 ALA 180 HB2 ALA 180 -4.959 1.490 -3.233 76 HB3 ALA 180 HB3 ALA 180 -3.685 1.197 -2.050 77 H LYS 181 HN LYS 181 -2.787 4.099 -5.300 78 HA LYS 181 HA LYS 181 -2.722 5.955 -3.036 79 HB2 LYS 181 HB2 LYS 181 -2.089 6.496 -5.943 80 HB3 LYS 181 HB1 LYS 181 -1.787 7.568 -4.587 81 HG2 LYS 181 HG2 LYS 181 -0.170 5.876 -3.706 82 HG3 LYS 181 HG1 LYS 181 -0.376 4.969 -5.211 83 HD2 LYS 181 HD2 LYS 181 0.690 7.774 -4.879 84 HD3 LYS 181 HD1 LYS 181 1.563 6.351 -5.452 85 HE2 LYS 181 HE2 LYS 181 0.369 6.308 -7.482 86 HE3 LYS 181 HE1 LYS 181 -0.856 7.423 -6.880 87 HZ1 LYS 181 HZ1 LYS 181 0.939 9.134 -6.762 88 HZ2 LYS 181 HZ2 LYS 181 0.557 8.625 -8.329 89 HZ3 LYS 181 HZ3 LYS 181 1.961 8.051 -7.584 90 H THR 182 HN THR 182 -4.644 6.843 -2.515 91 HA THR 182 HA THR 182 -6.489 7.455 -4.713 92 HB THR 182 HB THR 182 -8.275 7.576 -3.133 93 HG1 THR 182 HG1 THR 182 -7.722 7.158 -0.836 94 HG21 THR 182 HG21 THR 182 -8.240 5.347 -2.111 95 HG22 THR 182 HG22 THR 182 -6.505 5.237 -2.413 96 HG23 THR 182 HG23 THR 182 -7.634 5.308 -3.767 97 H SER 183 HN SER 183 -6.917 9.553 -5.234 98 HA SER 183 HA SER 183 -5.174 11.570 -4.352 99 HB2 SER 183 HB2 SER 183 -7.806 11.940 -5.795 100 HB3 SER 183 HB1 SER 183 -6.427 13.041 -5.800 101 HG SER 183 HG SER 183 -6.522 11.714 -7.688 102 H SER 184 HN SER 184 -8.079 10.401 -3.010 103 HA SER 184 HA SER 184 -8.934 12.768 -1.689 104 HB2 SER 184 HB2 SER 184 -9.456 9.888 -0.925 105 HB3 SER 184 HB1 SER 184 -10.373 11.294 -0.389 106 HG SER 184 HG SER 184 -10.217 10.165 -2.981 107 H GLY 185 HN GLY 185 -6.325 10.639 -1.179 108 HA2 GLY 185 HA2 GLY 185 -4.590 11.526 0.286 109 HA3 GLY 185 HA1 GLY 185 -5.857 11.948 1.424 110 H GLN 186 HN GLN 186 -5.960 8.828 -0.172 111 HA GLN 186 HA GLN 186 -5.076 7.636 2.378 112 HB2 GLN 186 HB2 GLN 186 -6.920 6.443 0.295 113 HB3 GLN 186 HB1 GLN 186 -6.328 5.593 1.710 114 HG2 GLN 186 HG2 GLN 186 -8.365 6.224 2.473 115 HG3 GLN 186 HG1 GLN 186 -7.429 7.632 2.969 116 HE21 GLN 186 HE21 GLN 186 -9.755 6.368 0.703 117 HE22 GLN 186 HE22 GLN 186 -10.304 7.903 0.121 118 H ARG 187 HN ARG 187 -3.069 6.932 2.257 119 HA ARG 187 HA ARG 187 -2.215 5.636 -0.235 120 HB2 ARG 187 HB2 ARG 187 0.134 6.110 0.543 121 HB3 ARG 187 HB1 ARG 187 -0.810 7.522 0.100 122 HG2 ARG 187 HG2 ARG 187 -1.238 7.965 2.480 123 HG3 ARG 187 HG1 ARG 187 -0.247 6.568 2.900 124 HD2 ARG 187 HD2 ARG 187 0.741 8.937 1.319 125 HD3 ARG 187 HD1 ARG 187 0.935 8.761 3.061 126 HE ARG 187 HE ARG 187 2.082 6.522 2.241 127 HH11 ARG 187 HH11 ARG 187 2.367 9.751 0.919 128 HH12 ARG 187 HH12 ARG 187 4.017 9.542 0.410 129 HH21 ARG 187 HH21 ARG 187 4.289 6.249 1.578 130 HH22 ARG 187 HH22 ARG 187 5.092 7.561 0.777 131 H TYR 188 HN TYR 188 -2.891 3.570 0.209 132 HA TYR 188 HA TYR 188 -1.606 2.297 2.523 133 HB2 TYR 188 HB2 TYR 188 -3.484 0.674 2.553 134 HB3 TYR 188 HB1 TYR 188 -3.992 2.318 2.899 135 HD1 TYR 188 HD2 TYR 188 -5.255 3.601 1.181 136 HD2 TYR 188 HD1 TYR 188 -4.337 -0.522 0.684 137 HE1 TYR 188 HE2 TYR 188 -6.988 3.432 -0.553 138 HE2 TYR 188 HE1 TYR 188 -6.071 -0.708 -1.048 139 HH TYR 188 HH TYR 188 -7.645 2.070 -2.383 140 H PHE 189 HN PHE 189 -0.446 0.508 2.178 141 HA PHE 189 HA PHE 189 -0.008 -0.179 -0.645 142 HB2 PHE 189 HB2 PHE 189 1.856 -0.519 1.718 143 HB3 PHE 189 HB1 PHE 189 2.239 -0.891 0.042 144 HD1 PHE 189 HD2 PHE 189 0.925 1.532 -1.201 145 HD2 PHE 189 HD1 PHE 189 3.507 1.097 2.149 146 HE1 PHE 189 HE2 PHE 189 1.735 3.828 -1.537 147 HE2 PHE 189 HE1 PHE 189 4.319 3.395 1.830 148 HZ PHE 189 HZ PHE 189 3.430 4.766 -0.015 149 H LEU 190 HN LEU 190 -0.255 -2.223 -1.326 150 HA LEU 190 HA LEU 190 -1.133 -4.239 0.570 151 HB2 LEU 190 HB2 LEU 190 -1.067 -4.012 -2.387 152 HB3 LEU 190 HB1 LEU 190 -0.996 -5.616 -1.708 153 HG LEU 190 HG LEU 190 -3.243 -3.690 -1.798 154 HD11 LEU 190 HD11 LEU 190 -4.093 -5.355 -3.003 155 HD12 LEU 190 HD12 LEU 190 -3.851 -6.502 -1.677 156 HD13 LEU 190 HD13 LEU 190 -2.555 -6.203 -2.837 157 HD21 LEU 190 HD21 LEU 190 -2.931 -3.986 0.616 158 HD22 LEU 190 HD22 LEU 190 -2.920 -5.736 0.405 159 HD23 LEU 190 HD23 LEU 190 -4.382 -4.815 0.055 160 H ASN 191 HN ASN 191 0.262 -5.823 1.393 161 HA ASN 191 HA ASN 191 2.826 -6.206 0.068 162 HB2 ASN 191 HB2 ASN 191 1.608 -7.734 2.390 163 HB3 ASN 191 HB1 ASN 191 3.252 -7.908 1.794 164 HD21 ASN 191 HD21 ASN 191 4.178 -7.416 3.720 165 HD22 ASN 191 HD22 ASN 191 4.152 -5.817 4.395 166 H HIS 192 HN HIS 192 2.590 -7.261 -1.855 167 HA HIS 192 HA HIS 192 0.434 -9.108 -2.251 168 HB2 HIS 192 HB2 HIS 192 2.608 -8.017 -3.932 169 HB3 HIS 192 HB1 HIS 192 2.022 -9.615 -4.380 170 HD1 HIS 192 HD1 HIS 192 -0.414 -9.793 -5.247 171 HD2 HIS 192 HD2 HIS 192 0.814 -5.917 -4.378 172 HE1 HIS 192 HE1 HIS 192 -2.145 -8.292 -6.270 173 HE2 HIS 192 HE2 HIS 192 -1.324 -5.947 -5.850 174 H ILE 193 HN ILE 193 3.547 -9.352 -0.955 175 HA ILE 193 HA ILE 193 3.773 -12.195 -1.485 176 HB ILE 193 HB ILE 193 5.736 -11.540 0.386 177 HG12 ILE 193 HG12 ILE 193 6.839 -9.615 -1.036 178 HG13 ILE 193 HG11 ILE 193 5.172 -9.240 -1.455 179 HG21 ILE 193 HG21 ILE 193 7.262 -11.841 -1.504 180 HG22 ILE 193 HG22 ILE 193 5.900 -11.696 -2.616 181 HG23 ILE 193 HG23 ILE 193 5.979 -13.051 -1.489 182 HD11 ILE 193 HD11 ILE 193 4.624 -8.775 0.797 183 HD12 ILE 193 HD12 ILE 193 6.135 -7.940 0.451 184 HD13 ILE 193 HD13 ILE 193 6.147 -9.442 1.376 185 H ASP 194 HN ASP 194 2.720 -10.070 1.034 186 HA ASP 194 HA ASP 194 2.521 -12.305 2.916 187 HB2 ASP 194 HB2 ASP 194 2.103 -9.346 3.354 188 HB3 ASP 194 HB1 ASP 194 1.958 -10.577 4.603 189 H GLN 195 HN GLN 195 0.679 -10.440 0.752 190 HA GLN 195 HA GLN 195 -1.521 -10.268 0.211 191 HB2 GLN 195 HB2 GLN 195 -1.318 -12.807 0.427 192 HB3 GLN 195 HB1 GLN 195 -1.996 -12.639 2.039 193 HG2 GLN 195 HG2 GLN 195 -4.029 -11.705 1.116 194 HG3 GLN 195 HG1 GLN 195 -3.350 -11.776 -0.508 195 HE21 GLN 195 HE21 GLN 195 -4.643 -13.606 2.144 196 HE22 GLN 195 HE22 GLN 195 -4.894 -15.082 1.270 197 H THR 196 HN THR 196 -0.364 -8.889 2.470 198 HA THR 196 HA THR 196 -2.654 -8.721 4.317 199 HB THR 196 HB THR 196 -0.354 -9.445 5.242 200 HG1 THR 196 HG1 THR 196 -0.923 -7.422 6.890 201 HG21 THR 196 HG21 THR 196 1.208 -7.721 5.793 202 HG22 THR 196 HG22 THR 196 0.132 -6.468 5.178 203 HG23 THR 196 HG23 THR 196 0.891 -7.600 4.063 204 H THR 197 HN THR 197 -3.344 -6.695 5.035 205 HA THR 197 HA THR 197 -2.951 -4.556 3.112 206 HB THR 197 HB THR 197 -4.770 -3.528 4.750 207 HG1 THR 197 HG1 THR 197 -5.555 -4.915 6.153 208 HG21 THR 197 HG21 THR 197 -6.521 -4.628 3.423 209 HG22 THR 197 HG22 THR 197 -5.344 -5.816 2.861 210 HG23 THR 197 HG23 THR 197 -5.170 -4.120 2.408 211 H THR 198 HN THR 198 -1.747 -2.789 3.485 212 HA THR 198 HA THR 198 -0.700 -2.340 6.203 213 HB THR 198 HB THR 198 0.753 -2.231 3.554 214 HG1 THR 198 HG1 THR 198 1.580 -4.093 4.156 215 HG21 THR 198 HG21 THR 198 1.427 -0.375 5.097 216 HG22 THR 198 HG22 THR 198 2.721 -1.498 4.686 217 HG23 THR 198 HG23 THR 198 1.935 -1.602 6.256 218 H TRP 199 HN TRP 199 -0.929 -0.256 6.955 219 HA TRP 199 HA TRP 199 -1.609 1.841 5.003 220 HB2 TRP 199 HB2 TRP 199 -1.986 1.648 7.985 221 HB3 TRP 199 HB1 TRP 199 -2.120 3.179 7.134 222 HD1 TRP 199 HD1 TRP 199 -3.993 -0.024 7.834 223 HE1 TRP 199 HE1 TRP 199 -6.389 0.188 6.926 224 HE3 TRP 199 HE3 TRP 199 -3.457 4.306 5.166 225 HZ2 TRP 199 HZ2 TRP 199 -7.850 1.957 5.269 226 HZ3 TRP 199 HZ3 TRP 199 -5.404 5.187 3.948 227 HH2 TRP 199 HH2 TRP 199 -7.554 4.032 4.005 228 H GLN 200 HN GLN 200 0.851 0.773 7.150 229 HA GLN 200 HA GLN 200 2.074 3.401 7.371 230 HB2 GLN 200 HB2 GLN 200 3.083 0.767 8.450 231 HB3 GLN 200 HB1 GLN 200 3.608 2.375 8.925 232 HG2 GLN 200 HG2 GLN 200 0.903 1.158 9.417 233 HG3 GLN 200 HG1 GLN 200 2.174 1.411 10.609 234 HE21 GLN 200 HE21 GLN 200 2.897 4.031 9.529 235 HE22 GLN 200 HE22 GLN 200 1.637 5.112 10.028 236 H ASP 201 HN ASP 201 3.576 4.102 6.029 237 HA ASP 201 HA ASP 201 4.567 2.663 3.845 238 HB2 ASP 201 HB2 ASP 201 4.541 5.158 4.032 239 HB3 ASP 201 HB1 ASP 201 5.855 5.048 5.196 240 HA PRO 202 HA PRO 202 7.239 -0.126 6.047 241 HB2 PRO 202 HB2 PRO 202 8.583 -0.969 3.755 242 HB3 PRO 202 HB1 PRO 202 7.115 -1.684 4.425 243 HG2 PRO 202 HG2 PRO 202 7.434 0.220 2.166 244 HG3 PRO 202 HG1 PRO 202 6.248 -1.074 2.391 245 HD2 PRO 202 HD2 PRO 202 5.617 1.529 2.722 246 HD3 PRO 202 HD1 PRO 202 4.854 0.242 3.679 247 H ARG 203 HN ARG 203 8.343 2.579 4.175 248 HA ARG 203 HA ARG 203 11.107 2.071 5.011 249 HB2 ARG 203 HB2 ARG 203 9.848 3.701 2.900 250 HB3 ARG 203 HB1 ARG 203 11.264 4.416 3.664 251 HG2 ARG 203 HG2 ARG 203 11.791 3.098 1.637 252 HG3 ARG 203 HG1 ARG 203 12.610 2.511 3.087 253 HD2 ARG 203 HD2 ARG 203 10.504 0.964 3.264 254 HD3 ARG 203 HD1 ARG 203 10.372 1.291 1.535 255 HE ARG 203 HE ARG 203 12.798 0.476 1.482 256 HH11 ARG 203 HH11 ARG 203 10.424 -0.636 3.799 257 HH12 ARG 203 HH12 ARG 203 11.147 -2.200 4.010 258 HH21 ARG 203 HH21 ARG 203 13.790 -1.578 1.766 259 HH22 ARG 203 HH22 ARG 203 13.066 -2.736 2.852 260 H LYS 204 HN LYS 204 8.367 3.828 5.953 261 HA LYS 204 HA LYS 204 9.988 5.582 7.659 262 HB2 LYS 204 HB2 LYS 204 7.033 5.610 7.015 263 HB3 LYS 204 HB1 LYS 204 7.760 6.636 8.239 264 HG2 LYS 204 HG2 LYS 204 7.472 7.914 6.236 265 HG3 LYS 204 HG1 LYS 204 9.198 7.642 6.478 266 HD2 LYS 204 HD2 LYS 204 9.231 5.940 4.804 267 HD3 LYS 204 HD1 LYS 204 7.474 5.943 4.685 268 HE2 LYS 204 HE2 LYS 204 7.565 8.249 3.821 269 HE3 LYS 204 HE1 LYS 204 9.327 8.185 3.887 270 HZ1 LYS 204 HZ1 LYS 204 8.384 7.698 1.657 271 HZ2 LYS 204 HZ2 LYS 204 7.653 6.304 2.298 272 HZ3 LYS 204 HZ3 LYS 204 9.345 6.444 2.272 273 H ALA 205 HN ALA 205 8.299 2.675 7.647 274 HA ALA 205 HA ALA 205 8.389 2.536 10.583 275 HB1 ALA 205 HB1 ALA 205 6.278 1.309 8.807 276 HB2 ALA 205 HB2 ALA 205 6.059 2.722 9.839 277 HB3 ALA 205 HB3 ALA 205 6.385 1.147 10.561 278 H1 SER 201 HT1 SER 201 -8.711 -1.984 -14.496 279 H2 SER 201 HT2 SER 201 -8.972 -0.405 -13.923 280 H3 SER 201 HT3 SER 201 -10.071 -1.108 -15.006 281 HA SER 201 HA SER 201 -10.860 -1.052 -12.687 282 HB2 SER 201 HB2 SER 201 -10.450 -3.791 -13.909 283 HB3 SER 201 HB1 SER 201 -11.664 -3.376 -12.701 284 HG SER 201 HG SER 201 -12.721 -3.211 -14.594 285 H TPO 202 HN TPO 202 -7.689 -1.582 -12.863 286 HA TPO 202 HA TPO 202 -7.304 -3.518 -10.777 287 HB TPO 202 HB TPO 202 -5.230 -1.570 -11.767 288 HG21 TPO 202 HG21 TPO 202 -5.065 -4.414 -10.760 289 HG22 TPO 202 HG22 TPO 202 -4.619 -2.968 -9.857 290 HG23 TPO 202 HG23 TPO 202 -3.700 -3.429 -11.290 291 H TYR 203 HN TYR 203 -8.123 -2.919 -8.868 292 HA TYR 203 HA TYR 203 -6.849 -1.010 -7.250 293 HB2 TYR 203 HB2 TYR 203 -8.050 0.639 -8.613 294 HB3 TYR 203 HB1 TYR 203 -9.573 -0.186 -8.298 295 HD1 TYR 203 HD2 TYR 203 -6.777 1.550 -6.538 296 HD2 TYR 203 HD1 TYR 203 -10.898 0.489 -6.509 297 HE1 TYR 203 HE2 TYR 203 -7.118 2.942 -4.541 298 HE2 TYR 203 HE1 TYR 203 -11.248 1.879 -4.513 299 HH TYR 203 HH TYR 203 -9.885 2.774 -2.618 300 HA PRO 204 HA PRO 204 -9.069 -3.914 -4.628 301 HB2 PRO 204 HB2 PRO 204 -7.656 -3.419 -2.381 302 HB3 PRO 204 HB1 PRO 204 -7.010 -4.404 -3.698 303 HG2 PRO 204 HG2 PRO 204 -6.474 -1.533 -3.039 304 HG3 PRO 204 HG1 PRO 204 -5.338 -2.796 -3.550 305 HD2 PRO 204 HD2 PRO 204 -6.353 -0.910 -5.244 306 HD3 PRO 204 HD1 PRO 204 -5.841 -2.526 -5.769 307 H HIS 205 HN HIS 205 -8.806 -2.749 -1.782 308 HA HIS 205 HA HIS 205 -10.408 -0.343 -1.954 309 HB2 HIS 205 HB2 HIS 205 -12.120 -2.113 -1.997 310 HB3 HIS 205 HB1 HIS 205 -11.447 -2.803 -0.523 311 HD1 HIS 205 HD1 HIS 205 -12.816 -2.207 1.446 312 HD2 HIS 205 HD2 HIS 205 -12.741 0.846 -1.374 313 HE1 HIS 205 HE1 HIS 205 -14.173 -0.335 2.430 314 HE2 HIS 205 HE2 HIS 205 -13.827 1.589 0.843 315 H SEP 206 HN SEP 206 -10.030 1.008 -0.313 316 HA SEP 206 HA SEP 206 -7.934 0.714 1.448 317 HB2 SEP 206 HB2 SEP 206 -9.208 2.565 2.749 318 HB3 SEP 206 HB1 SEP 206 -8.699 2.895 1.095 319 HA PRO 207 HA PRO 207 -9.283 -2.348 4.283 320 HB2 PRO 207 HB2 PRO 207 -7.361 -1.142 6.157 321 HB3 PRO 207 HB1 PRO 207 -7.408 -2.772 5.484 322 HG2 PRO 207 HG2 PRO 207 -5.594 -0.924 4.710 323 HG3 PRO 207 HG1 PRO 207 -6.204 -2.176 3.620 324 HD2 PRO 207 HD2 PRO 207 -6.868 0.716 3.745 325 HD3 PRO 207 HD1 PRO 207 -6.802 -0.371 2.345 326 H THR 208 HN THR 208 -9.540 1.028 4.943 327 HA THR 208 HA THR 208 -11.310 0.408 7.213 328 HB THR 208 HB THR 208 -9.691 2.945 6.947 329 HG1 THR 208 HG1 THR 208 -8.946 0.471 7.803 330 HG21 THR 208 HG21 THR 208 -11.245 1.776 9.258 331 HG22 THR 208 HG22 THR 208 -11.744 3.149 8.269 332 HG23 THR 208 HG23 THR 208 -10.312 3.272 9.292 333 H SER 209 HN SER 209 -13.247 0.494 6.157 334 HA SER 209 HA SER 209 -14.243 3.131 5.560 335 HB2 SER 209 HB2 SER 209 -14.221 0.998 3.409 336 HB3 SER 209 HB1 SER 209 -15.190 2.469 3.340 337 HG SER 209 HG SER 209 -12.512 2.876 3.864 Start of MODEL 7 1 H ASP 170 H ASP 170 14.954 0.210 -4.446 2 HA ASP 170 HA ASP 170 14.164 -2.043 -4.038 3 HB2 ASP 170 HB2 ASP 170 15.368 -3.487 -2.490 4 HB3 ASP 170 HB1 ASP 170 16.408 -3.088 -3.853 5 H VAL 171 HN VAL 171 15.842 0.181 -1.850 6 HA VAL 171 HA VAL 171 13.803 -0.027 0.165 7 HB VAL 171 HB VAL 171 16.028 1.995 -0.126 8 HG11 VAL 171 HG11 VAL 171 14.272 1.376 2.248 9 HG12 VAL 171 HG12 VAL 171 14.224 2.847 1.276 10 HG13 VAL 171 HG13 VAL 171 15.652 2.475 2.242 11 HG21 VAL 171 HG21 VAL 171 17.166 0.657 1.582 12 HG22 VAL 171 HG22 VAL 171 16.869 -0.270 0.113 13 HG23 VAL 171 HG23 VAL 171 15.848 -0.517 1.531 14 HA PRO 172 HA PRO 172 12.860 4.553 -1.615 15 HB2 PRO 172 HB2 PRO 172 13.369 3.725 -4.442 16 HB3 PRO 172 HB1 PRO 172 13.519 5.320 -3.693 17 HG2 PRO 172 HG2 PRO 172 15.680 3.860 -4.183 18 HG3 PRO 172 HG1 PRO 172 15.545 4.799 -2.685 19 HD2 PRO 172 HD2 PRO 172 15.287 1.864 -3.113 20 HD3 PRO 172 HD1 PRO 172 15.920 2.751 -1.712 21 H LEU 173 HN LEU 173 12.289 1.700 -3.704 22 HA LEU 173 HA LEU 173 9.456 1.903 -3.072 23 HB2 LEU 173 HB2 LEU 173 10.067 3.211 -5.239 24 HB3 LEU 173 HB1 LEU 173 10.234 1.625 -5.959 25 HG LEU 173 HG LEU 173 8.022 2.758 -6.348 26 HD11 LEU 173 HD11 LEU 173 6.674 0.761 -5.943 27 HD12 LEU 173 HD12 LEU 173 7.943 0.116 -4.902 28 HD13 LEU 173 HD13 LEU 173 8.248 0.354 -6.623 29 HD21 LEU 173 HD21 LEU 173 7.754 3.787 -4.168 30 HD22 LEU 173 HD22 LEU 173 7.662 2.197 -3.410 31 HD23 LEU 173 HD23 LEU 173 6.389 2.724 -4.511 32 HA PRO 174 HA PRO 174 10.618 -2.484 -2.905 33 HB2 PRO 174 HB2 PRO 174 8.054 -2.670 -1.460 34 HB3 PRO 174 HB1 PRO 174 9.677 -3.121 -0.933 35 HG2 PRO 174 HG2 PRO 174 8.362 -0.988 0.066 36 HG3 PRO 174 HG1 PRO 174 10.125 -1.028 -0.095 37 HD2 PRO 174 HD2 PRO 174 8.093 0.326 -1.816 38 HD3 PRO 174 HD1 PRO 174 9.702 0.883 -1.315 39 H ALA 175 HN ALA 175 9.910 -4.158 -4.225 40 HA ALA 175 HA ALA 175 8.110 -3.186 -6.302 41 HB1 ALA 175 HB1 ALA 175 9.084 -4.911 -7.701 42 HB2 ALA 175 HB2 ALA 175 9.944 -5.575 -6.311 43 HB3 ALA 175 HB3 ALA 175 10.345 -3.964 -6.910 44 H GLY 176 HN GLY 176 7.839 -5.285 -3.677 45 HA2 GLY 176 HA2 GLY 176 5.768 -6.898 -4.989 46 HA3 GLY 176 HA1 GLY 176 6.401 -7.162 -3.370 47 H TRP 177 HN TRP 177 5.767 -3.911 -4.043 48 HA TRP 177 HA TRP 177 3.365 -4.064 -2.355 49 HB2 TRP 177 HB2 TRP 177 5.481 -1.898 -2.424 50 HB3 TRP 177 HB1 TRP 177 4.045 -1.891 -1.406 51 HD1 TRP 177 HD1 TRP 177 6.997 -4.352 -1.978 52 HE1 TRP 177 HE1 TRP 177 7.765 -5.241 0.304 53 HE3 TRP 177 HE3 TRP 177 3.666 -1.898 1.004 54 HZ2 TRP 177 HZ2 TRP 177 7.065 -4.933 3.005 55 HZ3 TRP 177 HZ3 TRP 177 3.785 -2.248 3.432 56 HH2 TRP 177 HH2 TRP 177 5.455 -3.733 4.402 57 H GLU 178 HN GLU 178 1.598 -3.039 -2.960 58 HA GLU 178 HA GLU 178 1.496 -1.866 -5.624 59 HB2 GLU 178 HB2 GLU 178 -0.187 -3.563 -5.042 60 HB3 GLU 178 HB1 GLU 178 -0.666 -2.618 -3.636 61 HG2 GLU 178 HG2 GLU 178 -2.296 -2.332 -5.368 62 HG3 GLU 178 HG1 GLU 178 -1.436 -0.811 -5.132 63 H MET 179 HN MET 179 1.126 0.272 -6.031 64 HA MET 179 HA MET 179 1.044 2.083 -3.754 65 HB2 MET 179 HB2 MET 179 1.190 2.730 -6.695 66 HB3 MET 179 HB1 MET 179 1.316 3.886 -5.378 67 HG2 MET 179 HG2 MET 179 3.250 1.638 -5.857 68 HG3 MET 179 HG1 MET 179 3.452 3.294 -6.427 69 HE1 MET 179 HE1 MET 179 3.930 5.353 -4.912 70 HE2 MET 179 HE2 MET 179 3.885 5.316 -3.149 71 HE3 MET 179 HE3 MET 179 2.404 5.070 -4.075 72 H ALA 180 HN ALA 180 -1.085 1.725 -2.991 73 HA ALA 180 HA ALA 180 -3.234 2.457 -4.812 74 HB1 ALA 180 HB1 ALA 180 -4.739 1.934 -2.961 75 HB2 ALA 180 HB2 ALA 180 -3.354 1.677 -1.901 76 HB3 ALA 180 HB3 ALA 180 -3.624 0.602 -3.272 77 H LYS 181 HN LYS 181 -2.824 4.556 -5.245 78 HA LYS 181 HA LYS 181 -2.712 6.444 -2.996 79 HB2 LYS 181 HB2 LYS 181 -2.087 7.004 -5.902 80 HB3 LYS 181 HB1 LYS 181 -1.697 8.005 -4.513 81 HG2 LYS 181 HG2 LYS 181 -0.087 6.349 -3.744 82 HG3 LYS 181 HG1 LYS 181 -0.495 5.291 -5.100 83 HD2 LYS 181 HD2 LYS 181 0.717 8.051 -5.279 84 HD3 LYS 181 HD1 LYS 181 1.548 6.521 -5.553 85 HE2 LYS 181 HE2 LYS 181 -0.737 7.626 -7.185 86 HE3 LYS 181 HE1 LYS 181 0.957 7.585 -7.665 87 HZ1 LYS 181 HZ1 LYS 181 -0.261 5.787 -8.686 88 HZ2 LYS 181 HZ2 LYS 181 -0.776 5.222 -7.177 89 HZ3 LYS 181 HZ3 LYS 181 0.865 5.159 -7.588 90 H THR 182 HN THR 182 -4.719 7.133 -2.497 91 HA THR 182 HA THR 182 -6.630 7.500 -4.698 92 HB THR 182 HB THR 182 -8.401 7.434 -3.009 93 HG1 THR 182 HG1 THR 182 -7.602 6.686 -0.834 94 HG21 THR 182 HG21 THR 182 -8.169 5.087 -2.326 95 HG22 THR 182 HG22 THR 182 -6.457 5.137 -2.748 96 HG23 THR 182 HG23 THR 182 -7.681 5.322 -4.003 97 H SER 183 HN SER 183 -7.732 9.391 -4.995 98 HA SER 183 HA SER 183 -6.439 11.796 -4.331 99 HB2 SER 183 HB2 SER 183 -7.835 11.533 -6.341 100 HB3 SER 183 HB1 SER 183 -9.270 11.381 -5.326 101 HG SER 183 HG SER 183 -8.140 13.579 -4.534 102 H SER 184 HN SER 184 -8.615 9.901 -2.542 103 HA SER 184 HA SER 184 -9.848 11.846 -0.926 104 HB2 SER 184 HB2 SER 184 -9.060 9.089 0.014 105 HB3 SER 184 HB1 SER 184 -10.462 10.047 0.491 106 HG SER 184 HG SER 184 -10.479 8.203 -1.277 107 H GLY 185 HN GLY 185 -6.612 10.872 -1.170 108 HA2 GLY 185 HA2 GLY 185 -4.822 11.912 -0.032 109 HA3 GLY 185 HA1 GLY 185 -5.930 12.352 1.262 110 H GLN 186 HN GLN 186 -5.732 9.163 -0.143 111 HA GLN 186 HA GLN 186 -4.666 8.181 2.422 112 HB2 GLN 186 HB2 GLN 186 -6.903 7.050 0.733 113 HB3 GLN 186 HB1 GLN 186 -6.131 6.159 2.040 114 HG2 GLN 186 HG2 GLN 186 -6.907 7.684 3.667 115 HG3 GLN 186 HG1 GLN 186 -7.397 8.850 2.444 116 HE21 GLN 186 HE21 GLN 186 -8.040 5.435 2.105 117 HE22 GLN 186 HE22 GLN 186 -9.746 5.542 2.346 118 H ARG 187 HN ARG 187 -2.876 7.067 2.248 119 HA ARG 187 HA ARG 187 -2.239 5.786 -0.317 120 HB2 ARG 187 HB2 ARG 187 0.188 6.220 0.336 121 HB3 ARG 187 HB1 ARG 187 -0.757 7.612 -0.177 122 HG2 ARG 187 HG2 ARG 187 -1.144 8.143 2.234 123 HG3 ARG 187 HG1 ARG 187 -0.013 6.852 2.640 124 HD2 ARG 187 HD2 ARG 187 0.707 9.133 0.820 125 HD3 ARG 187 HD1 ARG 187 0.912 9.216 2.567 126 HE ARG 187 HE ARG 187 2.215 6.929 1.851 127 HH11 ARG 187 HH11 ARG 187 2.361 10.243 0.743 128 HH12 ARG 187 HH12 ARG 187 4.078 10.215 0.478 129 HH21 ARG 187 HH21 ARG 187 4.510 6.892 1.512 130 HH22 ARG 187 HH22 ARG 187 5.294 8.332 0.914 131 H TYR 188 HN TYR 188 -2.725 3.672 0.130 132 HA TYR 188 HA TYR 188 -1.272 2.492 2.395 133 HB2 TYR 188 HB2 TYR 188 -3.086 0.761 2.502 134 HB3 TYR 188 HB1 TYR 188 -3.588 2.373 2.982 135 HD1 TYR 188 HD2 TYR 188 -5.091 3.684 1.522 136 HD2 TYR 188 HD1 TYR 188 -4.045 -0.335 0.599 137 HE1 TYR 188 HE2 TYR 188 -6.987 3.556 -0.035 138 HE2 TYR 188 HE1 TYR 188 -5.945 -0.478 -0.952 139 HH TYR 188 HH TYR 188 -7.800 2.309 -1.860 140 H PHE 189 HN PHE 189 -0.176 0.608 2.012 141 HA PHE 189 HA PHE 189 0.223 0.091 -0.851 142 HB2 PHE 189 HB2 PHE 189 2.092 -0.362 1.480 143 HB3 PHE 189 HB1 PHE 189 2.457 -0.707 -0.209 144 HD1 PHE 189 HD2 PHE 189 1.479 1.523 -1.629 145 HD2 PHE 189 HD1 PHE 189 3.405 1.437 2.143 146 HE1 PHE 189 HE2 PHE 189 2.262 3.823 -2.003 147 HE2 PHE 189 HE1 PHE 189 4.198 3.743 1.797 148 HZ PHE 189 HZ PHE 189 3.634 4.934 -0.286 149 H LEU 190 HN LEU 190 -0.008 -1.881 -1.685 150 HA LEU 190 HA LEU 190 -1.058 -3.990 0.022 151 HB2 LEU 190 HB2 LEU 190 -0.684 -3.722 -2.948 152 HB3 LEU 190 HB1 LEU 190 -1.139 -5.233 -2.217 153 HG LEU 190 HG LEU 190 -2.738 -2.732 -2.523 154 HD11 LEU 190 HD11 LEU 190 -4.284 -4.176 -3.569 155 HD12 LEU 190 HD12 LEU 190 -3.524 -5.614 -2.881 156 HD13 LEU 190 HD13 LEU 190 -2.699 -4.706 -4.149 157 HD21 LEU 190 HD21 LEU 190 -3.281 -4.962 -0.582 158 HD22 LEU 190 HD22 LEU 190 -4.398 -3.663 -0.998 159 HD23 LEU 190 HD23 LEU 190 -2.888 -3.295 -0.165 160 H ASN 191 HN ASN 191 0.223 -5.732 0.717 161 HA ASN 191 HA ASN 191 2.686 -6.249 -0.754 162 HB2 ASN 191 HB2 ASN 191 1.427 -7.420 1.705 163 HB3 ASN 191 HB1 ASN 191 2.576 -8.395 0.793 164 HD21 ASN 191 HD21 ASN 191 2.140 -5.564 2.760 165 HD22 ASN 191 HD22 ASN 191 3.816 -5.272 3.054 166 H HIS 192 HN HIS 192 2.171 -6.888 -2.753 167 HA HIS 192 HA HIS 192 -0.268 -8.077 -3.472 168 HB2 HIS 192 HB2 HIS 192 2.337 -7.668 -4.879 169 HB3 HIS 192 HB1 HIS 192 1.126 -8.706 -5.615 170 HD1 HIS 192 HD1 HIS 192 2.033 -6.034 -6.904 171 HD2 HIS 192 HD2 HIS 192 -1.296 -6.435 -4.465 172 HE1 HIS 192 HE1 HIS 192 0.433 -4.208 -7.573 173 HE2 HIS 192 HE2 HIS 192 -1.684 -4.723 -6.346 174 H ILE 193 HN ILE 193 2.792 -9.486 -2.573 175 HA ILE 193 HA ILE 193 1.988 -12.126 -3.465 176 HB ILE 193 HB ILE 193 4.292 -12.717 -2.399 177 HG12 ILE 193 HG12 ILE 193 5.785 -10.560 -2.760 178 HG13 ILE 193 HG11 ILE 193 4.286 -9.721 -2.385 179 HG21 ILE 193 HG21 ILE 193 5.414 -12.070 -4.485 180 HG22 ILE 193 HG22 ILE 193 4.047 -11.028 -4.882 181 HG23 ILE 193 HG23 ILE 193 3.821 -12.773 -4.771 182 HD11 ILE 193 HD11 ILE 193 4.172 -10.899 -0.243 183 HD12 ILE 193 HD12 ILE 193 5.649 -9.950 -0.413 184 HD13 ILE 193 HD13 ILE 193 5.696 -11.703 -0.617 185 H ASP 194 HN ASP 194 1.971 -10.268 -0.587 186 HA ASP 194 HA ASP 194 1.625 -12.660 1.070 187 HB2 ASP 194 HB2 ASP 194 3.221 -10.820 1.746 188 HB3 ASP 194 HB1 ASP 194 1.815 -9.796 2.002 189 H GLN 195 HN GLN 195 -0.120 -10.266 -0.527 190 HA GLN 195 HA GLN 195 -2.308 -9.742 -0.734 191 HB2 GLN 195 HB2 GLN 195 -2.450 -12.285 -0.723 192 HB3 GLN 195 HB1 GLN 195 -2.911 -12.164 0.968 193 HG2 GLN 195 HG2 GLN 195 -4.822 -12.427 -0.579 194 HG3 GLN 195 HG1 GLN 195 -4.905 -10.970 0.411 195 HE21 GLN 195 HE21 GLN 195 -4.752 -8.979 -0.551 196 HE22 GLN 195 HE22 GLN 195 -4.822 -8.751 -2.264 197 H THR 196 HN THR 196 -0.733 -8.698 1.476 198 HA THR 196 HA THR 196 -2.897 -8.232 3.438 199 HB THR 196 HB THR 196 -0.827 -9.421 4.326 200 HG1 THR 196 HG1 THR 196 -1.031 -8.352 6.241 201 HG21 THR 196 HG21 THR 196 0.860 -8.121 3.113 202 HG22 THR 196 HG22 THR 196 1.111 -8.028 4.856 203 HG23 THR 196 HG23 THR 196 0.381 -6.671 3.996 204 H THR 197 HN THR 197 -3.153 -6.085 4.252 205 HA THR 197 HA THR 197 -2.124 -4.071 2.375 206 HB THR 197 HB THR 197 -4.485 -3.666 4.200 207 HG1 THR 197 HG1 THR 197 -5.721 -4.239 2.231 208 HG21 THR 197 HG21 THR 197 -3.533 -1.679 3.167 209 HG22 THR 197 HG22 THR 197 -5.108 -2.035 2.461 210 HG23 THR 197 HG23 THR 197 -3.635 -2.433 1.576 211 H THR 198 HN THR 198 -0.861 -2.495 3.064 212 HA THR 198 HA THR 198 -0.292 -2.317 5.948 213 HB THR 198 HB THR 198 1.483 -1.746 3.563 214 HG1 THR 198 HG1 THR 198 1.146 -3.954 5.280 215 HG21 THR 198 HG21 THR 198 1.983 -0.347 5.567 216 HG22 THR 198 HG22 THR 198 3.289 -1.441 5.113 217 HG23 THR 198 HG23 THR 198 2.253 -1.828 6.479 218 H TRP 199 HN TRP 199 -0.978 -0.426 6.893 219 HA TRP 199 HA TRP 199 -1.622 1.868 5.241 220 HB2 TRP 199 HB2 TRP 199 -2.071 1.125 8.095 221 HB3 TRP 199 HB1 TRP 199 -2.071 2.830 7.676 222 HD1 TRP 199 HD1 TRP 199 -4.353 -0.051 7.918 223 HE1 TRP 199 HE1 TRP 199 -6.603 0.491 6.809 224 HE3 TRP 199 HE3 TRP 199 -3.002 4.155 5.329 225 HZ2 TRP 199 HZ2 TRP 199 -7.669 2.423 5.049 226 HZ3 TRP 199 HZ3 TRP 199 -4.701 5.285 3.950 227 HH2 TRP 199 HH2 TRP 199 -6.986 4.433 3.817 228 H GLN 200 HN GLN 200 0.951 0.820 7.303 229 HA GLN 200 HA GLN 200 2.046 3.511 7.536 230 HB2 GLN 200 HB2 GLN 200 2.979 0.872 8.679 231 HB3 GLN 200 HB1 GLN 200 3.786 2.412 8.948 232 HG2 GLN 200 HG2 GLN 200 0.965 1.742 9.755 233 HG3 GLN 200 HG1 GLN 200 2.364 1.789 10.826 234 HE21 GLN 200 HE21 GLN 200 -0.148 3.313 10.837 235 HE22 GLN 200 HE22 GLN 200 0.325 4.980 10.823 236 H ASP 201 HN ASP 201 3.570 4.278 6.278 237 HA ASP 201 HA ASP 201 4.355 2.981 3.918 238 HB2 ASP 201 HB2 ASP 201 4.219 5.459 4.297 239 HB3 ASP 201 HB1 ASP 201 5.706 5.345 5.233 240 HA PRO 202 HA PRO 202 7.461 0.299 5.735 241 HB2 PRO 202 HB2 PRO 202 8.451 -0.530 3.263 242 HB3 PRO 202 HB1 PRO 202 7.185 -1.317 4.204 243 HG2 PRO 202 HG2 PRO 202 6.961 0.465 1.848 244 HG3 PRO 202 HG1 PRO 202 5.902 -0.846 2.384 245 HD2 PRO 202 HD2 PRO 202 5.254 1.780 2.684 246 HD3 PRO 202 HD1 PRO 202 4.687 0.504 3.786 247 H ARG 203 HN ARG 203 8.113 3.011 3.658 248 HA ARG 203 HA ARG 203 10.983 2.687 3.822 249 HB2 ARG 203 HB2 ARG 203 9.217 4.898 2.810 250 HB3 ARG 203 HB1 ARG 203 10.930 5.178 3.070 251 HG2 ARG 203 HG2 ARG 203 10.781 4.666 0.813 252 HG3 ARG 203 HG1 ARG 203 11.299 3.150 1.549 253 HD2 ARG 203 HD2 ARG 203 9.534 2.856 -0.155 254 HD3 ARG 203 HD1 ARG 203 9.059 2.278 1.441 255 HE ARG 203 HE ARG 203 7.685 4.248 1.685 256 HH11 ARG 203 HH11 ARG 203 8.970 3.774 -1.551 257 HH12 ARG 203 HH12 ARG 203 7.691 4.662 -2.313 258 HH21 ARG 203 HH21 ARG 203 6.023 5.414 0.675 259 HH22 ARG 203 HH22 ARG 203 6.029 5.607 -1.060 260 H LYS 204 HN LYS 204 8.475 4.159 5.691 261 HA LYS 204 HA LYS 204 10.446 5.593 7.322 262 HB2 LYS 204 HB2 LYS 204 7.444 5.823 7.147 263 HB3 LYS 204 HB1 LYS 204 8.380 6.602 8.412 264 HG2 LYS 204 HG2 LYS 204 7.979 8.236 6.755 265 HG3 LYS 204 HG1 LYS 204 9.673 7.772 6.601 266 HD2 LYS 204 HD2 LYS 204 9.069 6.279 4.738 267 HD3 LYS 204 HD1 LYS 204 7.391 6.801 4.879 268 HE2 LYS 204 HE2 LYS 204 8.475 7.999 3.081 269 HE3 LYS 204 HE1 LYS 204 8.093 9.110 4.395 270 HZ1 LYS 204 HZ1 LYS 204 10.318 9.469 3.475 271 HZ2 LYS 204 HZ2 LYS 204 10.766 7.896 3.917 272 HZ3 LYS 204 HZ3 LYS 204 10.382 9.031 5.113 273 H ALA 205 HN ALA 205 8.670 2.728 7.290 274 HA ALA 205 HA ALA 205 8.889 2.468 10.215 275 HB1 ALA 205 HB1 ALA 205 6.567 2.453 9.447 276 HB2 ALA 205 HB2 ALA 205 7.027 0.890 10.124 277 HB3 ALA 205 HB3 ALA 205 6.928 1.099 8.375 278 H1 SER 201 HT1 SER 201 -6.930 -5.557 -13.688 279 H2 SER 201 HT2 SER 201 -6.557 -4.416 -14.885 280 H3 SER 201 HT3 SER 201 -8.102 -4.440 -14.185 281 HA SER 201 HA SER 201 -5.593 -3.844 -12.750 282 HB2 SER 201 HB2 SER 201 -6.779 -1.535 -12.592 283 HB3 SER 201 HB1 SER 201 -5.944 -1.957 -14.087 284 HG SER 201 HG SER 201 -8.078 -1.087 -14.402 285 H TPO 202 HN TPO 202 -5.847 -4.750 -10.841 286 HA TPO 202 HA TPO 202 -8.513 -5.079 -9.732 287 HB TPO 202 HB TPO 202 -5.876 -6.161 -8.718 288 HG21 TPO 202 HG21 TPO 202 -8.727 -6.964 -8.124 289 HG22 TPO 202 HG22 TPO 202 -7.643 -6.111 -7.024 290 HG23 TPO 202 HG23 TPO 202 -7.284 -7.768 -7.509 291 H TYR 203 HN TYR 203 -9.113 -3.145 -8.855 292 HA TYR 203 HA TYR 203 -7.417 -2.051 -6.725 293 HB2 TYR 203 HB2 TYR 203 -8.275 -0.374 -8.276 294 HB3 TYR 203 HB1 TYR 203 -9.923 -0.941 -8.026 295 HD1 TYR 203 HD2 TYR 203 -7.036 0.601 -6.248 296 HD2 TYR 203 HD1 TYR 203 -11.246 -0.012 -6.327 297 HE1 TYR 203 HE2 TYR 203 -7.296 2.174 -4.377 298 HE2 TYR 203 HE1 TYR 203 -11.517 1.561 -4.456 299 HH TYR 203 HH TYR 203 -9.999 2.398 -2.503 300 HA PRO 204 HA PRO 204 -10.161 -4.287 -3.959 301 HB2 PRO 204 HB2 PRO 204 -8.641 -3.988 -1.758 302 HB3 PRO 204 HB1 PRO 204 -8.215 -5.136 -3.032 303 HG2 PRO 204 HG2 PRO 204 -7.114 -2.410 -2.486 304 HG3 PRO 204 HG1 PRO 204 -6.260 -3.888 -2.968 305 HD2 PRO 204 HD2 PRO 204 -6.950 -1.865 -4.697 306 HD3 PRO 204 HD1 PRO 204 -6.691 -3.551 -5.185 307 H HIS 205 HN HIS 205 -9.568 -2.994 -1.195 308 HA HIS 205 HA HIS 205 -10.592 -0.305 -1.567 309 HB2 HIS 205 HB2 HIS 205 -12.586 -1.882 -1.341 310 HB3 HIS 205 HB1 HIS 205 -12.035 -2.189 0.303 311 HD1 HIS 205 HD1 HIS 205 -12.271 -0.227 2.017 312 HD2 HIS 205 HD2 HIS 205 -13.790 0.594 -1.765 313 HE1 HIS 205 HE1 HIS 205 -13.660 1.846 2.282 314 HE2 HIS 205 HE2 HIS 205 -14.357 2.453 -0.054 315 H SEP 206 HN SEP 206 -10.086 1.050 0.121 316 HA SEP 206 HA SEP 206 -7.922 0.561 1.744 317 HB2 SEP 206 HB2 SEP 206 -9.198 2.443 3.184 318 HB3 SEP 206 HB1 SEP 206 -8.386 2.794 1.661 319 HA PRO 207 HA PRO 207 -9.394 -2.530 4.519 320 HB2 PRO 207 HB2 PRO 207 -7.362 -2.212 6.385 321 HB3 PRO 207 HB1 PRO 207 -7.271 -3.203 4.922 322 HG2 PRO 207 HG2 PRO 207 -6.235 -0.463 5.434 323 HG3 PRO 207 HG1 PRO 207 -5.532 -1.771 4.469 324 HD2 PRO 207 HD2 PRO 207 -6.763 0.349 3.351 325 HD3 PRO 207 HD1 PRO 207 -6.814 -1.270 2.625 326 H THR 208 HN THR 208 -9.118 0.771 5.403 327 HA THR 208 HA THR 208 -10.814 0.265 7.734 328 HB THR 208 HB THR 208 -8.496 2.211 7.770 329 HG1 THR 208 HG1 THR 208 -8.707 -0.207 9.269 330 HG21 THR 208 HG21 THR 208 -8.992 2.356 10.172 331 HG22 THR 208 HG22 THR 208 -10.364 1.269 9.955 332 HG23 THR 208 HG23 THR 208 -10.374 2.864 9.201 333 H SER 209 HN SER 209 -12.673 1.202 7.155 334 HA SER 209 HA SER 209 -12.540 3.944 6.083 335 HB2 SER 209 HB2 SER 209 -14.774 1.961 5.618 336 HB3 SER 209 HB1 SER 209 -14.559 3.530 4.842 337 HG SER 209 HG SER 209 -12.430 2.503 4.160 Start of MODEL 8 1 H ASP 170 H ASP 170 11.019 6.160 -6.031 2 HA ASP 170 HA ASP 170 9.050 4.741 -4.338 3 HB2 ASP 170 HB2 ASP 170 8.450 3.562 -6.360 4 HB3 ASP 170 HB1 ASP 170 8.336 5.295 -6.658 5 H VAL 171 HN VAL 171 12.302 4.929 -5.160 6 HA VAL 171 HA VAL 171 12.961 2.235 -5.627 7 HB VAL 171 HB VAL 171 14.798 4.212 -4.297 8 HG11 VAL 171 HG11 VAL 171 16.515 3.021 -5.577 9 HG12 VAL 171 HG12 VAL 171 15.277 1.941 -6.220 10 HG13 VAL 171 HG13 VAL 171 15.637 1.940 -4.493 11 HG21 VAL 171 HG21 VAL 171 13.680 5.317 -6.154 12 HG22 VAL 171 HG22 VAL 171 14.134 3.991 -7.225 13 HG23 VAL 171 HG23 VAL 171 15.380 5.020 -6.518 14 HA PRO 172 HA PRO 172 13.824 1.973 -0.783 15 HB2 PRO 172 HB2 PRO 172 11.893 4.023 0.143 16 HB3 PRO 172 HB1 PRO 172 13.499 3.623 0.760 17 HG2 PRO 172 HG2 PRO 172 13.088 5.847 -0.648 18 HG3 PRO 172 HG1 PRO 172 14.579 4.905 -0.833 19 HD2 PRO 172 HD2 PRO 172 12.180 5.027 -2.616 20 HD3 PRO 172 HD1 PRO 172 13.903 4.950 -3.042 21 H LEU 173 HN LEU 173 11.021 2.206 -2.648 22 HA LEU 173 HA LEU 173 9.222 1.074 -0.652 23 HB2 LEU 173 HB2 LEU 173 8.652 2.915 -2.364 24 HB3 LEU 173 HB1 LEU 173 8.615 1.633 -3.550 25 HG LEU 173 HG LEU 173 6.373 2.268 -2.807 26 HD11 LEU 173 HD11 LEU 173 7.132 -0.500 -1.911 27 HD12 LEU 173 HD12 LEU 173 6.718 -0.008 -3.555 28 HD13 LEU 173 HD13 LEU 173 5.501 0.062 -2.280 29 HD21 LEU 173 HD21 LEU 173 7.336 1.414 -0.088 30 HD22 LEU 173 HD22 LEU 173 5.640 1.649 -0.517 31 HD23 LEU 173 HD23 LEU 173 6.760 3.010 -0.580 32 HA PRO 174 HA PRO 174 10.602 -3.070 -1.695 33 HB2 PRO 174 HB2 PRO 174 7.904 -3.621 -0.517 34 HB3 PRO 174 HB1 PRO 174 9.469 -4.363 -0.162 35 HG2 PRO 174 HG2 PRO 174 8.389 -2.570 1.482 36 HG3 PRO 174 HG1 PRO 174 10.138 -2.611 1.192 37 HD2 PRO 174 HD2 PRO 174 8.098 -0.702 0.189 38 HD3 PRO 174 HD1 PRO 174 9.807 -0.441 0.586 39 H ALA 175 HN ALA 175 10.050 -4.710 -3.179 40 HA ALA 175 HA ALA 175 8.444 -3.619 -5.347 41 HB1 ALA 175 HB1 ALA 175 10.749 -4.329 -5.801 42 HB2 ALA 175 HB2 ALA 175 9.582 -5.241 -6.759 43 HB3 ALA 175 HB3 ALA 175 10.325 -5.977 -5.339 44 H GLY 176 HN GLY 176 8.168 -5.997 -2.920 45 HA2 GLY 176 HA2 GLY 176 6.172 -7.563 -4.339 46 HA3 GLY 176 HA1 GLY 176 6.645 -7.754 -2.655 47 H TRP 177 HN TRP 177 6.069 -4.544 -3.368 48 HA TRP 177 HA TRP 177 3.425 -4.713 -2.088 49 HB2 TRP 177 HB2 TRP 177 5.556 -2.583 -1.797 50 HB3 TRP 177 HB1 TRP 177 3.957 -2.509 -1.068 51 HD1 TRP 177 HD1 TRP 177 6.718 -5.256 -1.058 52 HE1 TRP 177 HE1 TRP 177 7.089 -6.003 1.373 53 HE3 TRP 177 HE3 TRP 177 3.351 -2.189 1.264 54 HZ2 TRP 177 HZ2 TRP 177 6.102 -5.379 3.920 55 HZ3 TRP 177 HZ3 TRP 177 3.119 -2.345 3.711 56 HH2 TRP 177 HH2 TRP 177 4.483 -3.900 5.004 57 H GLU 178 HN GLU 178 1.844 -3.301 -2.723 58 HA GLU 178 HA GLU 178 2.164 -2.204 -5.432 59 HB2 GLU 178 HB2 GLU 178 0.472 -4.003 -5.058 60 HB3 GLU 178 HB1 GLU 178 -0.356 -2.951 -3.923 61 HG2 GLU 178 HG2 GLU 178 -1.518 -2.851 -5.990 62 HG3 GLU 178 HG1 GLU 178 -0.663 -1.321 -5.784 63 H MET 179 HN MET 179 1.769 -0.050 -5.802 64 HA MET 179 HA MET 179 1.377 1.611 -3.450 65 HB2 MET 179 HB2 MET 179 1.967 2.406 -6.300 66 HB3 MET 179 HB1 MET 179 1.819 3.524 -4.948 67 HG2 MET 179 HG2 MET 179 3.885 1.346 -5.099 68 HG3 MET 179 HG1 MET 179 4.128 3.009 -5.632 69 HE1 MET 179 HE1 MET 179 4.123 5.088 -2.440 70 HE2 MET 179 HE2 MET 179 2.856 4.895 -3.652 71 HE3 MET 179 HE3 MET 179 4.544 5.009 -4.151 72 H ALA 180 HN ALA 180 -0.751 1.571 -2.886 73 HA ALA 180 HA ALA 180 -2.655 2.381 -4.959 74 HB1 ALA 180 HB1 ALA 180 -4.404 1.738 -3.391 75 HB2 ALA 180 HB2 ALA 180 -3.184 1.350 -2.179 76 HB3 ALA 180 HB3 ALA 180 -3.280 0.408 -3.667 77 H LYS 181 HN LYS 181 -2.138 4.506 -5.135 78 HA LYS 181 HA LYS 181 -2.410 6.173 -2.734 79 HB2 LYS 181 HB2 LYS 181 -1.282 6.994 -5.418 80 HB3 LYS 181 HB1 LYS 181 -1.190 7.887 -3.909 81 HG2 LYS 181 HG2 LYS 181 0.202 5.996 -2.999 82 HG3 LYS 181 HG1 LYS 181 0.274 5.352 -4.646 83 HD2 LYS 181 HD2 LYS 181 1.275 8.032 -3.683 84 HD3 LYS 181 HD1 LYS 181 2.244 6.672 -4.247 85 HE2 LYS 181 HE2 LYS 181 0.278 8.235 -5.917 86 HE3 LYS 181 HE1 LYS 181 2.025 8.450 -5.941 87 HZ1 LYS 181 HZ1 LYS 181 1.344 7.084 -7.777 88 HZ2 LYS 181 HZ2 LYS 181 0.538 6.007 -6.751 89 HZ3 LYS 181 HZ3 LYS 181 2.226 6.131 -6.690 90 H THR 182 HN THR 182 -4.471 6.850 -2.511 91 HA THR 182 HA THR 182 -6.037 7.334 -4.936 92 HB THR 182 HB THR 182 -7.990 7.442 -3.333 93 HG1 THR 182 HG1 THR 182 -7.047 6.047 -1.347 94 HG21 THR 182 HG21 THR 182 -6.370 4.895 -3.396 95 HG22 THR 182 HG22 THR 182 -7.497 5.440 -4.639 96 HG23 THR 182 HG23 THR 182 -8.092 5.007 -3.035 97 H SER 183 HN SER 183 -7.197 9.219 -5.275 98 HA SER 183 HA SER 183 -5.852 11.604 -4.687 99 HB2 SER 183 HB2 SER 183 -7.942 12.657 -5.706 100 HB3 SER 183 HB1 SER 183 -7.089 11.480 -6.706 101 HG SER 183 HG SER 183 -9.177 10.859 -6.818 102 H SER 184 HN SER 184 -8.146 9.887 -2.861 103 HA SER 184 HA SER 184 -9.369 11.974 -1.427 104 HB2 SER 184 HB2 SER 184 -8.789 9.182 -0.415 105 HB3 SER 184 HB1 SER 184 -10.085 10.263 0.101 106 HG SER 184 HG SER 184 -10.755 8.626 -1.416 107 H GLY 185 HN GLY 185 -6.177 10.858 -1.441 108 HA2 GLY 185 HA2 GLY 185 -4.443 11.982 -0.256 109 HA3 GLY 185 HA1 GLY 185 -5.602 12.374 1.008 110 H GLN 186 HN GLN 186 -5.556 9.190 -0.316 111 HA GLN 186 HA GLN 186 -4.500 8.222 2.256 112 HB2 GLN 186 HB2 GLN 186 -6.573 6.965 0.451 113 HB3 GLN 186 HB1 GLN 186 -5.944 6.240 1.923 114 HG2 GLN 186 HG2 GLN 186 -6.856 8.074 3.234 115 HG3 GLN 186 HG1 GLN 186 -7.467 8.831 1.763 116 HE21 GLN 186 HE21 GLN 186 -8.236 6.259 0.586 117 HE22 GLN 186 HE22 GLN 186 -9.661 5.761 1.424 118 H ARG 187 HN ARG 187 -2.645 7.167 2.125 119 HA ARG 187 HA ARG 187 -2.029 5.779 -0.386 120 HB2 ARG 187 HB2 ARG 187 0.367 6.050 0.208 121 HB3 ARG 187 HB1 ARG 187 -0.465 7.571 -0.069 122 HG2 ARG 187 HG2 ARG 187 -0.692 7.811 2.401 123 HG3 ARG 187 HG1 ARG 187 0.326 6.383 2.580 124 HD2 ARG 187 HD2 ARG 187 1.077 8.986 1.261 125 HD3 ARG 187 HD1 ARG 187 1.666 8.377 2.807 126 HE ARG 187 HE ARG 187 2.483 6.439 1.232 127 HH11 ARG 187 HH11 ARG 187 2.582 9.886 0.736 128 HH12 ARG 187 HH12 ARG 187 3.947 9.838 -0.335 129 HH21 ARG 187 HH21 ARG 187 4.309 6.350 -0.170 130 HH22 ARG 187 HH22 ARG 187 4.935 7.821 -0.856 131 H TYR 188 HN TYR 188 -2.628 3.683 -0.019 132 HA TYR 188 HA TYR 188 -1.538 2.416 2.394 133 HB2 TYR 188 HB2 TYR 188 -3.478 0.806 2.228 134 HB3 TYR 188 HB1 TYR 188 -3.910 2.445 2.697 135 HD1 TYR 188 HD2 TYR 188 -4.937 3.963 0.971 136 HD2 TYR 188 HD1 TYR 188 -4.413 -0.207 0.318 137 HE1 TYR 188 HE2 TYR 188 -6.595 4.047 -0.839 138 HE2 TYR 188 HE1 TYR 188 -6.070 -0.139 -1.491 139 HH TYR 188 HH TYR 188 -7.864 1.195 -2.317 140 H PHE 189 HN PHE 189 -0.408 0.574 2.113 141 HA PHE 189 HA PHE 189 0.193 -0.034 -0.696 142 HB2 PHE 189 HB2 PHE 189 1.919 -0.430 1.760 143 HB3 PHE 189 HB1 PHE 189 2.403 -0.736 0.092 144 HD1 PHE 189 HD2 PHE 189 1.186 1.626 -1.212 145 HD2 PHE 189 HD1 PHE 189 3.400 1.289 2.395 146 HE1 PHE 189 HE2 PHE 189 1.926 3.954 -1.468 147 HE2 PHE 189 HE1 PHE 189 4.135 3.631 2.164 148 HZ PHE 189 HZ PHE 189 3.398 4.966 0.232 149 H LEU 190 HN LEU 190 -0.106 -1.985 -1.476 150 HA LEU 190 HA LEU 190 -1.241 -4.039 0.236 151 HB2 LEU 190 HB2 LEU 190 -1.044 -3.587 -2.695 152 HB3 LEU 190 HB1 LEU 190 -1.168 -5.238 -2.150 153 HG LEU 190 HG LEU 190 -3.196 -3.050 -1.992 154 HD11 LEU 190 HD11 LEU 190 -3.684 -4.269 -3.838 155 HD12 LEU 190 HD12 LEU 190 -4.474 -5.318 -2.654 156 HD13 LEU 190 HD13 LEU 190 -2.855 -5.708 -3.239 157 HD21 LEU 190 HD21 LEU 190 -3.206 -5.581 -0.345 158 HD22 LEU 190 HD22 LEU 190 -4.545 -4.443 -0.503 159 HD23 LEU 190 HD23 LEU 190 -3.047 -3.941 0.281 160 H ASN 191 HN ASN 191 -0.135 -5.925 0.840 161 HA ASN 191 HA ASN 191 2.499 -6.374 -0.363 162 HB2 ASN 191 HB2 ASN 191 1.069 -8.008 1.758 163 HB3 ASN 191 HB1 ASN 191 2.720 -8.250 1.210 164 HD21 ASN 191 HD21 ASN 191 1.200 -5.141 1.931 165 HD22 ASN 191 HD22 ASN 191 2.200 -4.773 3.290 166 H HIS 192 HN HIS 192 2.351 -7.320 -2.334 167 HA HIS 192 HA HIS 192 0.024 -8.777 -3.130 168 HB2 HIS 192 HB2 HIS 192 2.635 -8.120 -4.412 169 HB3 HIS 192 HB1 HIS 192 1.705 -9.457 -5.079 170 HD1 HIS 192 HD1 HIS 192 -1.006 -8.639 -5.449 171 HD2 HIS 192 HD2 HIS 192 2.038 -5.816 -5.670 172 HE1 HIS 192 HE1 HIS 192 -1.965 -6.714 -6.746 173 HE2 HIS 192 HE2 HIS 192 -0.054 -5.089 -7.015 174 H ILE 193 HN ILE 193 2.438 -9.640 -1.135 175 HA ILE 193 HA ILE 193 2.771 -12.379 -2.043 176 HB ILE 193 HB ILE 193 3.755 -11.436 0.619 177 HG12 ILE 193 HG12 ILE 193 5.827 -10.815 -1.154 178 HG13 ILE 193 HG11 ILE 193 4.385 -10.138 -1.906 179 HG21 ILE 193 HG21 ILE 193 4.148 -13.729 -0.065 180 HG22 ILE 193 HG22 ILE 193 5.673 -12.847 0.030 181 HG23 ILE 193 HG23 ILE 193 4.939 -13.175 -1.540 182 HD11 ILE 193 HD11 ILE 193 5.262 -8.421 -0.585 183 HD12 ILE 193 HD12 ILE 193 5.551 -9.501 0.775 184 HD13 ILE 193 HD13 ILE 193 3.899 -9.062 0.338 185 H ASP 194 HN ASP 194 1.453 -10.614 0.729 186 HA ASP 194 HA ASP 194 0.156 -13.053 1.700 187 HB2 ASP 194 HB2 ASP 194 0.519 -10.361 3.021 188 HB3 ASP 194 HB1 ASP 194 -0.280 -11.742 3.761 189 H GLN 195 HN GLN 195 -0.524 -10.281 -0.078 190 HA GLN 195 HA GLN 195 -2.408 -9.272 -0.864 191 HB2 GLN 195 HB2 GLN 195 -3.217 -11.728 -0.946 192 HB3 GLN 195 HB1 GLN 195 -4.093 -11.354 0.531 193 HG2 GLN 195 HG2 GLN 195 -5.546 -11.150 -1.386 194 HG3 GLN 195 HG1 GLN 195 -5.292 -9.570 -0.645 195 HE21 GLN 195 HE21 GLN 195 -5.821 -8.466 -2.517 196 HE22 GLN 195 HE22 GLN 195 -4.775 -8.434 -3.903 197 H THR 196 HN THR 196 -1.153 -8.686 1.635 198 HA THR 196 HA THR 196 -3.310 -7.966 3.483 199 HB THR 196 HB THR 196 -1.148 -7.008 4.718 200 HG1 THR 196 HG1 THR 196 0.631 -8.437 4.217 201 HG21 THR 196 HG21 THR 196 -0.914 -9.156 5.858 202 HG22 THR 196 HG22 THR 196 -1.831 -9.942 4.572 203 HG23 THR 196 HG23 THR 196 -2.610 -8.746 5.608 204 H THR 197 HN THR 197 -3.666 -5.798 4.181 205 HA THR 197 HA THR 197 -2.604 -3.784 2.310 206 HB THR 197 HB THR 197 -5.144 -3.394 3.870 207 HG1 THR 197 HG1 THR 197 -4.729 -5.259 1.981 208 HG21 THR 197 HG21 THR 197 -4.125 -1.461 2.759 209 HG22 THR 197 HG22 THR 197 -5.653 -1.899 1.992 210 HG23 THR 197 HG23 THR 197 -4.124 -2.337 1.229 211 H THR 198 HN THR 198 -1.200 -2.432 3.185 212 HA THR 198 HA THR 198 -1.210 -2.104 6.114 213 HB THR 198 HB THR 198 1.147 -1.797 4.245 214 HG1 THR 198 HG1 THR 198 0.555 -4.044 5.892 215 HG21 THR 198 HG21 THR 198 0.967 -2.148 7.238 216 HG22 THR 198 HG22 THR 198 1.410 -0.669 6.388 217 HG23 THR 198 HG23 THR 198 2.463 -2.081 6.306 218 H TRP 199 HN TRP 199 -1.338 -0.047 6.953 219 HA TRP 199 HA TRP 199 -1.472 2.196 5.076 220 HB2 TRP 199 HB2 TRP 199 -2.263 1.849 7.961 221 HB3 TRP 199 HB1 TRP 199 -2.132 3.448 7.240 222 HD1 TRP 199 HD1 TRP 199 -4.525 0.613 7.642 223 HE1 TRP 199 HE1 TRP 199 -6.655 1.073 6.294 224 HE3 TRP 199 HE3 TRP 199 -2.880 4.552 4.810 225 HZ2 TRP 199 HZ2 TRP 199 -7.527 2.832 4.292 226 HZ3 TRP 199 HZ3 TRP 199 -4.443 5.559 3.191 227 HH2 TRP 199 HH2 TRP 199 -6.717 4.710 2.943 228 H GLN 200 HN GLN 200 0.781 0.650 6.916 229 HA GLN 200 HA GLN 200 2.286 3.015 7.702 230 HB2 GLN 200 HB2 GLN 200 2.204 1.230 9.325 231 HB3 GLN 200 HB1 GLN 200 2.745 0.056 8.133 232 HG2 GLN 200 HG2 GLN 200 4.537 0.628 9.657 233 HG3 GLN 200 HG1 GLN 200 4.915 1.162 8.021 234 HE21 GLN 200 HE21 GLN 200 6.373 2.700 8.697 235 HE22 GLN 200 HE22 GLN 200 5.899 4.152 9.503 236 H ASP 201 HN ASP 201 3.852 3.851 6.499 237 HA ASP 201 HA ASP 201 4.644 2.738 4.002 238 HB2 ASP 201 HB2 ASP 201 4.604 5.151 4.330 239 HB3 ASP 201 HB1 ASP 201 5.787 5.024 5.624 240 HA PRO 202 HA PRO 202 7.552 -0.060 5.917 241 HB2 PRO 202 HB2 PRO 202 8.238 -1.377 3.652 242 HB3 PRO 202 HB1 PRO 202 6.723 -1.668 4.516 243 HG2 PRO 202 HG2 PRO 202 7.228 -0.006 2.087 244 HG3 PRO 202 HG1 PRO 202 5.886 -1.115 2.419 245 HD2 PRO 202 HD2 PRO 202 5.672 1.580 2.679 246 HD3 PRO 202 HD1 PRO 202 4.753 0.443 3.684 247 H ARG 203 HN ARG 203 8.195 2.327 3.506 248 HA ARG 203 HA ARG 203 10.976 1.893 3.167 249 HB2 ARG 203 HB2 ARG 203 9.404 4.473 3.051 250 HB3 ARG 203 HB1 ARG 203 11.069 4.294 2.524 251 HG2 ARG 203 HG2 ARG 203 10.363 2.741 0.784 252 HG3 ARG 203 HG1 ARG 203 8.689 2.882 1.331 253 HD2 ARG 203 HD2 ARG 203 10.408 5.132 0.287 254 HD3 ARG 203 HD1 ARG 203 9.111 4.332 -0.609 255 HE ARG 203 HE ARG 203 7.888 5.172 1.668 256 HH11 ARG 203 HH11 ARG 203 9.797 6.807 -0.782 257 HH12 ARG 203 HH12 ARG 203 9.100 8.365 -0.451 258 HH21 ARG 203 HH21 ARG 203 7.000 7.203 2.111 259 HH22 ARG 203 HH22 ARG 203 7.503 8.590 1.191 260 H LYS 204 HN LYS 204 9.112 3.082 5.778 261 HA LYS 204 HA LYS 204 11.441 4.334 7.031 262 HB2 LYS 204 HB2 LYS 204 8.543 4.391 7.885 263 HB3 LYS 204 HB1 LYS 204 9.857 5.284 8.641 264 HG2 LYS 204 HG2 LYS 204 10.215 6.458 6.470 265 HG3 LYS 204 HG1 LYS 204 8.765 5.660 5.861 266 HD2 LYS 204 HD2 LYS 204 7.444 6.711 7.635 267 HD3 LYS 204 HD1 LYS 204 8.898 7.501 8.249 268 HE2 LYS 204 HE2 LYS 204 7.778 9.123 6.950 269 HE3 LYS 204 HE1 LYS 204 9.131 8.566 5.968 270 HZ1 LYS 204 HZ1 LYS 204 7.529 7.050 4.831 271 HZ2 LYS 204 HZ2 LYS 204 7.211 8.700 4.590 272 HZ3 LYS 204 HZ3 LYS 204 6.272 7.813 5.684 273 H ALA 205 HN ALA 205 9.739 1.423 7.021 274 HA ALA 205 HA ALA 205 10.712 0.750 9.716 275 HB1 ALA 205 HB1 ALA 205 8.308 -0.390 8.295 276 HB2 ALA 205 HB2 ALA 205 8.268 0.788 9.608 277 HB3 ALA 205 HB3 ALA 205 8.873 -0.843 9.903 278 H1 SER 201 HT1 SER 201 -4.049 -4.993 -9.620 279 H2 SER 201 HT2 SER 201 -3.038 -5.379 -10.922 280 H3 SER 201 HT3 SER 201 -4.456 -6.268 -10.656 281 HA SER 201 HA SER 201 -4.379 -3.383 -11.321 282 HB2 SER 201 HB2 SER 201 -5.058 -5.730 -13.112 283 HB3 SER 201 HB1 SER 201 -5.011 -4.027 -13.575 284 HG SER 201 HG SER 201 -3.088 -5.346 -14.086 285 H TPO 202 HN TPO 202 -5.891 -5.353 -9.412 286 HA TPO 202 HA TPO 202 -8.602 -5.232 -10.431 287 HB TPO 202 HB TPO 202 -7.744 -6.161 -7.689 288 HG21 TPO 202 HG21 TPO 202 -10.017 -6.974 -9.507 289 HG22 TPO 202 HG22 TPO 202 -10.150 -5.953 -8.076 290 HG23 TPO 202 HG23 TPO 202 -9.686 -7.646 -7.909 291 H TYR 203 HN TYR 203 -6.563 -3.220 -8.694 292 HA TYR 203 HA TYR 203 -6.775 -1.393 -7.396 293 HB2 TYR 203 HB2 TYR 203 -8.416 -0.561 -8.986 294 HB3 TYR 203 HB1 TYR 203 -9.689 -1.499 -8.210 295 HD1 TYR 203 HD2 TYR 203 -7.379 1.354 -7.759 296 HD2 TYR 203 HD1 TYR 203 -10.822 -0.667 -6.286 297 HE1 TYR 203 HE2 TYR 203 -7.848 3.251 -6.267 298 HE2 TYR 203 HE1 TYR 203 -11.301 1.225 -4.790 299 HH TYR 203 HH TYR 203 -9.855 3.123 -3.681 300 HA PRO 204 HA PRO 204 -7.977 -3.524 -3.626 301 HB2 PRO 204 HB2 PRO 204 -6.198 -2.248 -2.050 302 HB3 PRO 204 HB1 PRO 204 -5.725 -3.581 -3.110 303 HG2 PRO 204 HG2 PRO 204 -5.406 -0.636 -3.510 304 HG3 PRO 204 HG1 PRO 204 -4.270 -1.947 -3.875 305 HD2 PRO 204 HD2 PRO 204 -5.860 -0.741 -5.748 306 HD3 PRO 204 HD1 PRO 204 -5.257 -2.403 -5.887 307 H HIS 205 HN HIS 205 -9.408 -2.876 -2.069 308 HA HIS 205 HA HIS 205 -10.256 -0.097 -2.140 309 HB2 HIS 205 HB2 HIS 205 -12.041 -1.726 -2.211 310 HB3 HIS 205 HB1 HIS 205 -11.438 -2.516 -0.758 311 HD1 HIS 205 HD1 HIS 205 -12.282 1.152 -1.463 312 HD2 HIS 205 HD2 HIS 205 -13.137 -1.901 1.232 313 HE1 HIS 205 HE1 HIS 205 -13.800 2.174 0.260 314 HE2 HIS 205 HE2 HIS 205 -14.043 0.389 2.018 315 H SEP 206 HN SEP 206 -9.939 1.330 -0.608 316 HA SEP 206 HA SEP 206 -7.895 1.107 1.238 317 HB2 SEP 206 HB2 SEP 206 -9.132 3.197 2.238 318 HB3 SEP 206 HB1 SEP 206 -8.440 3.276 0.619 319 HA PRO 207 HA PRO 207 -9.725 -1.673 4.169 320 HB2 PRO 207 HB2 PRO 207 -7.738 -1.232 6.099 321 HB3 PRO 207 HB1 PRO 207 -7.721 -2.458 4.825 322 HG2 PRO 207 HG2 PRO 207 -6.365 0.170 4.955 323 HG3 PRO 207 HG1 PRO 207 -5.867 -1.319 4.138 324 HD2 PRO 207 HD2 PRO 207 -6.845 0.838 2.826 325 HD3 PRO 207 HD1 PRO 207 -7.049 -0.825 2.245 326 H THR 208 HN THR 208 -9.288 1.698 4.797 327 HA THR 208 HA THR 208 -10.532 1.473 7.421 328 HB THR 208 HB THR 208 -10.310 4.030 7.366 329 HG1 THR 208 HG1 THR 208 -9.873 4.510 5.285 330 HG21 THR 208 HG21 THR 208 -7.835 2.298 7.287 331 HG22 THR 208 HG22 THR 208 -8.858 2.588 8.694 332 HG23 THR 208 HG23 THR 208 -7.937 3.915 7.989 333 H SER 209 HN SER 209 -12.552 0.668 6.652 334 HA SER 209 HA SER 209 -14.280 2.830 5.651 335 HB2 SER 209 HB2 SER 209 -14.591 -0.129 5.089 336 HB3 SER 209 HB1 SER 209 -15.645 1.158 4.502 337 HG SER 209 HG SER 209 -13.004 1.580 3.922 Start of MODEL 9 1 H ASP 170 H ASP 170 15.084 3.283 -7.165 2 HA ASP 170 HA ASP 170 13.403 1.590 -6.725 3 HB2 ASP 170 HB2 ASP 170 15.084 -0.361 -6.706 4 HB3 ASP 170 HB1 ASP 170 15.181 0.809 -8.018 5 H VAL 171 HN VAL 171 15.543 2.216 -3.995 6 HA VAL 171 HA VAL 171 14.378 0.075 -2.481 7 HB VAL 171 HB VAL 171 15.668 0.727 -0.600 8 HG11 VAL 171 HG11 VAL 171 17.932 0.690 -1.537 9 HG12 VAL 171 HG12 VAL 171 17.267 1.061 -3.129 10 HG13 VAL 171 HG13 VAL 171 16.855 -0.459 -2.333 11 HG21 VAL 171 HG21 VAL 171 15.321 3.159 -0.715 12 HG22 VAL 171 HG22 VAL 171 16.471 3.237 -2.056 13 HG23 VAL 171 HG23 VAL 171 17.009 2.720 -0.461 14 HA PRO 172 HA PRO 172 11.820 3.614 -0.455 15 HB2 PRO 172 HB2 PRO 172 10.904 5.545 -2.096 16 HB3 PRO 172 HB1 PRO 172 12.415 5.715 -1.192 17 HG2 PRO 172 HG2 PRO 172 12.001 4.914 -4.047 18 HG3 PRO 172 HG1 PRO 172 13.169 6.063 -3.367 19 HD2 PRO 172 HD2 PRO 172 13.848 3.530 -4.016 20 HD3 PRO 172 HD1 PRO 172 14.580 4.400 -2.655 21 H LEU 173 HN LEU 173 11.552 2.045 -3.455 22 HA LEU 173 HA LEU 173 8.660 1.758 -3.018 23 HB2 LEU 173 HB2 LEU 173 9.554 3.155 -5.094 24 HB3 LEU 173 HB1 LEU 173 9.771 1.560 -5.781 25 HG LEU 173 HG LEU 173 7.667 2.493 -6.510 26 HD11 LEU 173 HD11 LEU 173 7.721 0.088 -6.164 27 HD12 LEU 173 HD12 LEU 173 6.124 0.743 -5.809 28 HD13 LEU 173 HD13 LEU 173 7.210 0.306 -4.491 29 HD21 LEU 173 HD21 LEU 173 5.893 3.093 -4.986 30 HD22 LEU 173 HD22 LEU 173 7.340 4.037 -4.624 31 HD23 LEU 173 HD23 LEU 173 6.896 2.670 -3.598 32 HA PRO 174 HA PRO 174 10.525 -2.416 -2.750 33 HB2 PRO 174 HB2 PRO 174 8.041 -2.868 -1.187 34 HB3 PRO 174 HB1 PRO 174 9.726 -3.171 -0.743 35 HG2 PRO 174 HG2 PRO 174 8.334 -1.170 0.350 36 HG3 PRO 174 HG1 PRO 174 10.062 -0.999 -0.023 37 HD2 PRO 174 HD2 PRO 174 7.685 -0.007 -1.561 38 HD3 PRO 174 HD1 PRO 174 9.206 0.831 -1.181 39 H ALA 175 HN ALA 175 10.023 -4.184 -4.027 40 HA ALA 175 HA ALA 175 7.988 -3.551 -6.012 41 HB1 ALA 175 HB1 ALA 175 9.119 -5.172 -7.423 42 HB2 ALA 175 HB2 ALA 175 10.141 -5.659 -6.070 43 HB3 ALA 175 HB3 ALA 175 10.279 -4.032 -6.739 44 H GLY 176 HN GLY 176 8.185 -5.512 -3.301 45 HA2 GLY 176 HA2 GLY 176 6.267 -7.466 -4.339 46 HA3 GLY 176 HA1 GLY 176 6.984 -7.472 -2.729 47 H TRP 177 HN TRP 177 5.937 -4.421 -3.713 48 HA TRP 177 HA TRP 177 3.545 -4.683 -2.020 49 HB2 TRP 177 HB2 TRP 177 5.436 -2.325 -2.258 50 HB3 TRP 177 HB1 TRP 177 3.969 -2.350 -1.288 51 HD1 TRP 177 HD1 TRP 177 7.119 -4.618 -1.497 52 HE1 TRP 177 HE1 TRP 177 7.886 -5.160 0.893 53 HE3 TRP 177 HE3 TRP 177 3.546 -2.063 1.074 54 HZ2 TRP 177 HZ2 TRP 177 7.079 -4.573 3.520 55 HZ3 TRP 177 HZ3 TRP 177 3.613 -2.089 3.532 56 HH2 TRP 177 HH2 TRP 177 5.353 -3.321 4.718 57 H GLU 178 HN GLU 178 2.168 -2.487 -2.417 58 HA GLU 178 HA GLU 178 1.958 -2.006 -5.302 59 HB2 GLU 178 HB2 GLU 178 0.464 -3.928 -4.644 60 HB3 GLU 178 HB1 GLU 178 -0.397 -2.825 -3.585 61 HG2 GLU 178 HG2 GLU 178 -1.561 -3.150 -5.701 62 HG3 GLU 178 HG1 GLU 178 -1.060 -1.473 -5.483 63 H MET 179 HN MET 179 1.394 0.077 -5.768 64 HA MET 179 HA MET 179 0.925 1.867 -3.517 65 HB2 MET 179 HB2 MET 179 1.175 2.607 -6.431 66 HB3 MET 179 HB1 MET 179 1.227 3.695 -5.050 67 HG2 MET 179 HG2 MET 179 3.268 1.564 -5.591 68 HG3 MET 179 HG1 MET 179 3.400 3.250 -6.091 69 HE1 MET 179 HE1 MET 179 3.821 5.202 -2.826 70 HE2 MET 179 HE2 MET 179 2.328 4.972 -3.733 71 HE3 MET 179 HE3 MET 179 3.847 5.230 -4.589 72 H ALA 180 HN ALA 180 -1.163 1.774 -2.859 73 HA ALA 180 HA ALA 180 -3.167 2.362 -4.928 74 HB1 ALA 180 HB1 ALA 180 -3.617 1.314 -2.138 75 HB2 ALA 180 HB2 ALA 180 -3.622 0.342 -3.609 76 HB3 ALA 180 HB3 ALA 180 -4.853 1.583 -3.367 77 H LYS 181 HN LYS 181 -2.979 4.498 -5.133 78 HA LYS 181 HA LYS 181 -3.001 6.156 -2.707 79 HB2 LYS 181 HB2 LYS 181 -2.079 6.981 -5.464 80 HB3 LYS 181 HB1 LYS 181 -1.844 7.853 -3.957 81 HG2 LYS 181 HG2 LYS 181 -0.347 6.064 -3.173 82 HG3 LYS 181 HG1 LYS 181 -0.544 5.224 -4.717 83 HD2 LYS 181 HD2 LYS 181 0.662 7.953 -4.270 84 HD3 LYS 181 HD1 LYS 181 1.505 6.482 -4.759 85 HE2 LYS 181 HE2 LYS 181 0.217 6.439 -6.841 86 HE3 LYS 181 HE1 LYS 181 -0.624 7.910 -6.352 87 HZ1 LYS 181 HZ1 LYS 181 2.163 7.567 -7.227 88 HZ2 LYS 181 HZ2 LYS 181 1.780 8.835 -6.170 89 HZ3 LYS 181 HZ3 LYS 181 1.023 8.741 -7.685 90 H THR 182 HN THR 182 -5.053 6.811 -2.333 91 HA THR 182 HA THR 182 -6.791 7.399 -4.599 92 HB THR 182 HB THR 182 -8.568 7.662 -2.854 93 HG1 THR 182 HG1 THR 182 -7.592 6.455 -0.813 94 HG21 THR 182 HG21 THR 182 -8.738 5.276 -2.332 95 HG22 THR 182 HG22 THR 182 -7.051 5.051 -2.795 96 HG23 THR 182 HG23 THR 182 -8.242 5.526 -4.006 97 H SER 183 HN SER 183 -7.805 9.371 -4.917 98 HA SER 183 HA SER 183 -6.164 11.625 -4.434 99 HB2 SER 183 HB2 SER 183 -8.996 11.543 -5.493 100 HB3 SER 183 HB1 SER 183 -7.844 12.865 -5.682 101 HG SER 183 HG SER 183 -6.573 11.555 -6.968 102 H SER 184 HN SER 184 -8.681 10.203 -2.623 103 HA SER 184 HA SER 184 -9.646 12.518 -1.304 104 HB2 SER 184 HB2 SER 184 -10.322 10.742 0.464 105 HB3 SER 184 HB1 SER 184 -11.054 10.657 -1.139 106 HG SER 184 HG SER 184 -10.125 8.649 -0.174 107 H GLY 185 HN GLY 185 -6.710 10.856 -1.146 108 HA2 GLY 185 HA2 GLY 185 -4.853 11.772 0.038 109 HA3 GLY 185 HA1 GLY 185 -5.969 12.385 1.252 110 H GLN 186 HN GLN 186 -5.962 9.142 -0.109 111 HA GLN 186 HA GLN 186 -5.182 8.139 2.550 112 HB2 GLN 186 HB2 GLN 186 -7.312 7.093 0.683 113 HB3 GLN 186 HB1 GLN 186 -6.673 6.156 2.028 114 HG2 GLN 186 HG2 GLN 186 -7.488 7.715 3.616 115 HG3 GLN 186 HG1 GLN 186 -7.887 8.882 2.359 116 HE21 GLN 186 HE21 GLN 186 -8.574 5.473 2.007 117 HE22 GLN 186 HE22 GLN 186 -10.288 5.614 2.162 118 H ARG 187 HN ARG 187 -3.248 7.314 2.418 119 HA ARG 187 HA ARG 187 -2.449 5.947 -0.048 120 HB2 ARG 187 HB2 ARG 187 -0.106 6.309 0.801 121 HB3 ARG 187 HB1 ARG 187 -0.987 7.768 0.375 122 HG2 ARG 187 HG2 ARG 187 -1.448 8.190 2.731 123 HG3 ARG 187 HG1 ARG 187 -0.597 6.708 3.168 124 HD2 ARG 187 HD2 ARG 187 0.607 9.103 1.786 125 HD3 ARG 187 HD1 ARG 187 0.817 8.675 3.483 126 HE ARG 187 HE ARG 187 1.784 6.496 2.442 127 HH11 ARG 187 HH11 ARG 187 2.154 9.757 1.216 128 HH12 ARG 187 HH12 ARG 187 3.699 9.446 0.482 129 HH21 ARG 187 HH21 ARG 187 3.839 6.087 1.495 130 HH22 ARG 187 HH22 ARG 187 4.647 7.355 0.623 131 H TYR 188 HN TYR 188 -2.791 3.773 0.161 132 HA TYR 188 HA TYR 188 -1.696 2.510 2.570 133 HB2 TYR 188 HB2 TYR 188 -3.538 0.803 2.401 134 HB3 TYR 188 HB1 TYR 188 -4.075 2.408 2.877 135 HD1 TYR 188 HD2 TYR 188 -5.230 3.857 1.187 136 HD2 TYR 188 HD1 TYR 188 -4.371 -0.244 0.447 137 HE1 TYR 188 HE2 TYR 188 -6.875 3.848 -0.636 138 HE2 TYR 188 HE1 TYR 188 -6.013 -0.267 -1.383 139 HH TYR 188 HH TYR 188 -7.878 0.937 -2.222 140 H PHE 189 HN PHE 189 -0.482 0.728 2.234 141 HA PHE 189 HA PHE 189 0.104 0.156 -0.588 142 HB2 PHE 189 HB2 PHE 189 1.820 -0.213 1.872 143 HB3 PHE 189 HB1 PHE 189 2.298 -0.619 0.229 144 HD1 PHE 189 HD2 PHE 189 1.559 1.543 -1.383 145 HD2 PHE 189 HD1 PHE 189 2.973 1.634 2.618 146 HE1 PHE 189 HE2 PHE 189 2.396 3.825 -1.744 147 HE2 PHE 189 HE1 PHE 189 3.817 3.921 2.273 148 HZ PHE 189 HZ PHE 189 3.535 5.015 0.080 149 H LEU 190 HN LEU 190 -0.046 -1.863 -1.383 150 HA LEU 190 HA LEU 190 -1.145 -3.933 0.341 151 HB2 LEU 190 HB2 LEU 190 -0.699 -3.678 -2.605 152 HB3 LEU 190 HB1 LEU 190 -0.983 -5.245 -1.902 153 HG LEU 190 HG LEU 190 -2.855 -3.030 -2.406 154 HD11 LEU 190 HD11 LEU 190 -3.851 -4.648 -3.569 155 HD12 LEU 190 HD12 LEU 190 -3.851 -5.741 -2.180 156 HD13 LEU 190 HD13 LEU 190 -2.433 -5.646 -3.228 157 HD21 LEU 190 HD21 LEU 190 -2.957 -3.133 0.034 158 HD22 LEU 190 HD22 LEU 190 -3.181 -4.880 -0.039 159 HD23 LEU 190 HD23 LEU 190 -4.417 -3.806 -0.686 160 H ASN 191 HN ASN 191 0.052 -5.726 1.057 161 HA ASN 191 HA ASN 191 2.722 -6.111 -0.085 162 HB2 ASN 191 HB2 ASN 191 1.287 -7.620 2.125 163 HB3 ASN 191 HB1 ASN 191 2.910 -7.988 1.550 164 HD21 ASN 191 HD21 ASN 191 1.599 -4.754 2.031 165 HD22 ASN 191 HD22 ASN 191 2.639 -4.338 3.346 166 H HIS 192 HN HIS 192 2.722 -7.180 -1.980 167 HA HIS 192 HA HIS 192 0.457 -8.688 -2.861 168 HB2 HIS 192 HB2 HIS 192 3.131 -8.019 -3.997 169 HB3 HIS 192 HB1 HIS 192 2.276 -9.393 -4.683 170 HD1 HIS 192 HD1 HIS 192 -0.047 -8.872 -5.852 171 HD2 HIS 192 HD2 HIS 192 2.228 -5.541 -4.803 172 HE1 HIS 192 HE1 HIS 192 -1.010 -6.951 -7.150 173 HE2 HIS 192 HE2 HIS 192 0.505 -5.000 -6.673 174 H ILE 193 HN ILE 193 3.046 -9.456 -0.880 175 HA ILE 193 HA ILE 193 3.233 -12.243 -1.681 176 HB ILE 193 HB ILE 193 4.553 -11.568 0.828 177 HG12 ILE 193 HG12 ILE 193 6.355 -10.281 -0.734 178 HG13 ILE 193 HG11 ILE 193 4.858 -9.740 -1.484 179 HG21 ILE 193 HG21 ILE 193 5.045 -13.561 -0.454 180 HG22 ILE 193 HG22 ILE 193 6.481 -12.545 -0.335 181 HG23 ILE 193 HG23 ILE 193 5.547 -12.580 -1.830 182 HD11 ILE 193 HD11 ILE 193 4.086 -8.834 0.602 183 HD12 ILE 193 HD12 ILE 193 5.685 -8.195 0.223 184 HD13 ILE 193 HD13 ILE 193 5.508 -9.463 1.435 185 H ASP 194 HN ASP 194 2.567 -10.485 1.329 186 HA ASP 194 HA ASP 194 1.328 -12.770 2.531 187 HB2 ASP 194 HB2 ASP 194 1.799 -9.935 3.395 188 HB3 ASP 194 HB1 ASP 194 0.741 -10.990 4.326 189 H GLN 195 HN GLN 195 0.286 -10.313 0.453 190 HA GLN 195 HA GLN 195 -1.736 -9.664 -0.371 191 HB2 GLN 195 HB2 GLN 195 -2.035 -12.173 -0.488 192 HB3 GLN 195 HB1 GLN 195 -2.853 -12.087 1.065 193 HG2 GLN 195 HG2 GLN 195 -4.624 -10.774 0.133 194 HG3 GLN 195 HG1 GLN 195 -3.764 -10.618 -1.398 195 HE21 GLN 195 HE21 GLN 195 -2.862 -13.372 -1.408 196 HE22 GLN 195 HE22 GLN 195 -4.245 -14.337 -1.798 197 H THR 196 HN THR 196 -0.792 -8.530 1.964 198 HA THR 196 HA THR 196 -3.257 -8.091 3.530 199 HB THR 196 HB THR 196 -1.482 -9.257 4.847 200 HG1 THR 196 HG1 THR 196 -1.728 -7.882 6.639 201 HG21 THR 196 HG21 THR 196 0.505 -8.050 5.538 202 HG22 THR 196 HG22 THR 196 0.028 -6.656 4.569 203 HG23 THR 196 HG23 THR 196 0.471 -8.169 3.778 204 H THR 197 HN THR 197 -3.632 -5.929 4.272 205 HA THR 197 HA THR 197 -2.351 -3.968 2.500 206 HB THR 197 HB THR 197 -4.939 -3.529 3.969 207 HG1 THR 197 HG1 THR 197 -4.436 -5.299 1.971 208 HG21 THR 197 HG21 THR 197 -4.058 -1.533 3.032 209 HG22 THR 197 HG22 THR 197 -5.296 -2.086 1.902 210 HG23 THR 197 HG23 THR 197 -3.594 -2.354 1.544 211 H THR 198 HN THR 198 -1.155 -2.390 3.315 212 HA THR 198 HA THR 198 -1.013 -2.135 6.246 213 HB THR 198 HB THR 198 1.203 -1.584 4.264 214 HG1 THR 198 HG1 THR 198 0.224 -3.967 5.257 215 HG21 THR 198 HG21 THR 198 1.321 -2.192 7.219 216 HG22 THR 198 HG22 THR 198 1.372 -0.568 6.536 217 HG23 THR 198 HG23 THR 198 2.661 -1.717 6.173 218 H TRP 199 HN TRP 199 -1.401 -0.119 7.098 219 HA TRP 199 HA TRP 199 -1.538 2.188 5.303 220 HB2 TRP 199 HB2 TRP 199 -2.311 1.748 8.183 221 HB3 TRP 199 HB1 TRP 199 -2.209 3.364 7.503 222 HD1 TRP 199 HD1 TRP 199 -4.541 0.464 7.845 223 HE1 TRP 199 HE1 TRP 199 -6.726 0.959 6.597 224 HE3 TRP 199 HE3 TRP 199 -3.052 4.565 5.162 225 HZ2 TRP 199 HZ2 TRP 199 -7.692 2.803 4.704 226 HZ3 TRP 199 HZ3 TRP 199 -4.678 5.627 3.647 227 HH2 TRP 199 HH2 TRP 199 -6.949 4.760 3.427 228 H GLN 200 HN GLN 200 0.752 0.606 7.075 229 HA GLN 200 HA GLN 200 2.148 2.982 8.017 230 HB2 GLN 200 HB2 GLN 200 1.902 0.889 9.423 231 HB3 GLN 200 HB1 GLN 200 3.005 0.099 8.306 232 HG2 GLN 200 HG2 GLN 200 4.046 2.620 9.284 233 HG3 GLN 200 HG1 GLN 200 3.682 1.491 10.586 234 HE21 GLN 200 HE21 GLN 200 5.834 1.230 11.086 235 HE22 GLN 200 HE22 GLN 200 6.934 0.337 10.090 236 H ASP 201 HN ASP 201 3.877 3.820 7.081 237 HA ASP 201 HA ASP 201 4.558 3.089 4.415 238 HB2 ASP 201 HB2 ASP 201 4.572 5.412 5.320 239 HB3 ASP 201 HB1 ASP 201 5.975 4.988 6.295 240 HA PRO 202 HA PRO 202 7.423 -0.073 5.686 241 HB2 PRO 202 HB2 PRO 202 8.321 -0.642 3.118 242 HB3 PRO 202 HB1 PRO 202 6.964 -1.406 3.944 243 HG2 PRO 202 HG2 PRO 202 6.965 0.576 1.789 244 HG3 PRO 202 HG1 PRO 202 5.687 -0.530 2.304 245 HD2 PRO 202 HD2 PRO 202 5.765 2.225 2.790 246 HD3 PRO 202 HD1 PRO 202 4.700 1.050 3.580 247 H ARG 203 HN ARG 203 8.304 2.833 4.037 248 HA ARG 203 HA ARG 203 11.133 2.241 4.019 249 HB2 ARG 203 HB2 ARG 203 9.619 4.807 3.545 250 HB3 ARG 203 HB1 ARG 203 11.373 4.733 3.574 251 HG2 ARG 203 HG2 ARG 203 10.881 4.632 1.323 252 HG3 ARG 203 HG1 ARG 203 11.102 2.935 1.746 253 HD2 ARG 203 HD2 ARG 203 9.138 3.314 0.309 254 HD3 ARG 203 HD1 ARG 203 8.718 2.614 1.870 255 HE ARG 203 HE ARG 203 7.784 4.688 2.531 256 HH11 ARG 203 HH11 ARG 203 8.855 4.685 -0.817 257 HH12 ARG 203 HH12 ARG 203 7.965 6.124 -1.227 258 HH21 ARG 203 HH21 ARG 203 6.593 6.523 1.977 259 HH22 ARG 203 HH22 ARG 203 6.678 7.165 0.353 260 H LYS 204 HN LYS 204 8.864 3.228 6.312 261 HA LYS 204 HA LYS 204 10.782 4.635 7.983 262 HB2 LYS 204 HB2 LYS 204 7.937 3.842 8.626 263 HB3 LYS 204 HB1 LYS 204 8.933 4.994 9.504 264 HG2 LYS 204 HG2 LYS 204 7.938 5.308 6.679 265 HG3 LYS 204 HG1 LYS 204 7.299 6.127 8.106 266 HD2 LYS 204 HD2 LYS 204 9.395 7.287 8.427 267 HD3 LYS 204 HD1 LYS 204 10.133 6.389 7.098 268 HE2 LYS 204 HE2 LYS 204 7.761 8.227 6.812 269 HE3 LYS 204 HE1 LYS 204 9.430 8.696 6.494 270 HZ1 LYS 204 HZ1 LYS 204 8.112 6.424 5.106 271 HZ2 LYS 204 HZ2 LYS 204 9.562 7.203 4.693 272 HZ3 LYS 204 HZ3 LYS 204 8.083 8.011 4.506 273 H ALA 205 HN ALA 205 9.724 1.493 7.413 274 HA ALA 205 HA ALA 205 10.228 -0.526 8.280 275 HB1 ALA 205 HB1 ALA 205 12.284 0.959 9.911 276 HB2 ALA 205 HB2 ALA 205 12.524 0.346 8.276 277 HB3 ALA 205 HB3 ALA 205 12.240 -0.778 9.605 278 H1 SER 201 HT1 SER 201 -7.938 -5.241 -15.069 279 H2 SER 201 HT2 SER 201 -8.774 -5.740 -13.678 280 H3 SER 201 HT3 SER 201 -7.089 -5.527 -13.630 281 HA SER 201 HA SER 201 -7.246 -3.212 -13.832 282 HB2 SER 201 HB2 SER 201 -10.208 -3.672 -14.287 283 HB3 SER 201 HB1 SER 201 -9.426 -2.095 -14.175 284 HG SER 201 HG SER 201 -8.064 -2.961 -15.994 285 H TPO 202 HN TPO 202 -7.854 -5.516 -11.853 286 HA TPO 202 HA TPO 202 -9.716 -4.562 -9.958 287 HB TPO 202 HB TPO 202 -7.504 -6.602 -9.628 288 HG21 TPO 202 HG21 TPO 202 -8.335 -5.793 -7.473 289 HG22 TPO 202 HG22 TPO 202 -8.851 -7.454 -7.765 290 HG23 TPO 202 HG23 TPO 202 -9.991 -6.126 -7.980 291 H TYR 203 HN TYR 203 -9.456 -2.773 -8.834 292 HA TYR 203 HA TYR 203 -6.789 -2.062 -7.824 293 HB2 TYR 203 HB2 TYR 203 -7.877 -0.306 -9.133 294 HB3 TYR 203 HB1 TYR 203 -9.303 -0.388 -8.105 295 HD1 TYR 203 HD1 TYR 203 -5.694 0.486 -8.110 296 HD2 TYR 203 HD2 TYR 203 -9.436 0.884 -6.127 297 HE1 TYR 203 HE1 TYR 203 -4.728 2.202 -6.638 298 HE2 TYR 203 HE2 TYR 203 -8.483 2.599 -4.653 299 HH TYR 203 HH TYR 203 -6.330 3.307 -3.824 300 HA PRO 204 HA PRO 204 -8.034 -3.682 -3.881 301 HB2 PRO 204 HB2 PRO 204 -6.105 -2.344 -2.422 302 HB3 PRO 204 HB1 PRO 204 -5.850 -3.873 -3.266 303 HG2 PRO 204 HG2 PRO 204 -5.173 -1.092 -4.135 304 HG3 PRO 204 HG1 PRO 204 -4.239 -2.588 -4.327 305 HD2 PRO 204 HD2 PRO 204 -5.621 -1.537 -6.367 306 HD3 PRO 204 HD1 PRO 204 -5.506 -3.294 -6.138 307 H HIS 205 HN HIS 205 -9.432 -3.049 -2.370 308 HA HIS 205 HA HIS 205 -10.186 -0.232 -2.249 309 HB2 HIS 205 HB2 HIS 205 -11.909 -2.037 -2.463 310 HB3 HIS 205 HB1 HIS 205 -11.429 -2.637 -0.880 311 HD1 HIS 205 HD1 HIS 205 -12.534 -1.590 1.114 312 HD2 HIS 205 HD2 HIS 205 -13.118 0.596 -2.376 313 HE1 HIS 205 HE1 HIS 205 -14.165 0.224 1.713 314 HE2 HIS 205 HE2 HIS 205 -14.269 1.688 -0.334 315 H SEP 206 HN SEP 206 -10.039 1.030 -0.377 316 HA SEP 206 HA SEP 206 -7.841 0.520 1.282 317 HB2 SEP 206 HB2 SEP 206 -8.834 2.436 2.675 318 HB3 SEP 206 HB1 SEP 206 -8.410 2.780 1.005 319 HA PRO 207 HA PRO 207 -9.274 -2.456 4.167 320 HB2 PRO 207 HB2 PRO 207 -7.588 -1.601 6.245 321 HB3 PRO 207 HB1 PRO 207 -7.200 -2.804 5.010 322 HG2 PRO 207 HG2 PRO 207 -6.487 0.075 5.156 323 HG3 PRO 207 HG1 PRO 207 -5.565 -1.282 4.489 324 HD2 PRO 207 HD2 PRO 207 -6.813 0.498 2.913 325 HD3 PRO 207 HD1 PRO 207 -6.688 -1.218 2.472 326 H THR 208 HN THR 208 -9.148 0.945 4.964 327 HA THR 208 HA THR 208 -11.495 0.591 6.659 328 HB THR 208 HB THR 208 -10.408 2.488 8.118 329 HG1 THR 208 HG1 THR 208 -8.287 2.676 7.971 330 HG21 THR 208 HG21 THR 208 -9.539 0.795 9.657 331 HG22 THR 208 HG22 THR 208 -9.558 -0.401 8.360 332 HG23 THR 208 HG23 THR 208 -11.071 0.282 8.952 333 H SER 209 HN SER 209 -12.910 1.586 5.355 334 HA SER 209 HA SER 209 -12.282 4.281 4.388 335 HB2 SER 209 HB2 SER 209 -14.677 2.574 3.680 336 HB3 SER 209 HB1 SER 209 -14.106 4.017 2.845 337 HG SER 209 HG SER 209 -12.200 2.824 2.295 Start of MODEL 10 1 H ASP 170 H ASP 170 15.979 0.127 -6.430 2 HA ASP 170 HA ASP 170 13.230 -0.850 -6.925 3 HB2 ASP 170 HB2 ASP 170 15.135 -2.371 -7.671 4 HB3 ASP 170 HB1 ASP 170 15.580 -2.487 -5.971 5 H VAL 171 HN VAL 171 15.741 0.138 -4.684 6 HA VAL 171 HA VAL 171 14.276 -0.760 -2.389 7 HB VAL 171 HB VAL 171 15.988 0.291 -1.020 8 HG11 VAL 171 HG11 VAL 171 17.089 -1.301 -3.329 9 HG12 VAL 171 HG12 VAL 171 16.352 -1.952 -1.865 10 HG13 VAL 171 HG13 VAL 171 17.877 -1.073 -1.771 11 HG21 VAL 171 HG21 VAL 171 16.481 2.270 -2.323 12 HG22 VAL 171 HG22 VAL 171 17.139 1.279 -3.626 13 HG23 VAL 171 HG23 VAL 171 17.956 1.339 -2.066 14 HA PRO 172 HA PRO 172 13.315 3.994 -1.902 15 HB2 PRO 172 HB2 PRO 172 12.408 5.164 -4.191 16 HB3 PRO 172 HB1 PRO 172 14.077 5.301 -3.625 17 HG2 PRO 172 HG2 PRO 172 12.922 3.453 -5.681 18 HG3 PRO 172 HG1 PRO 172 14.424 4.396 -5.743 19 HD2 PRO 172 HD2 PRO 172 14.434 1.775 -5.158 20 HD3 PRO 172 HD1 PRO 172 15.560 2.908 -4.385 21 H LEU 173 HN LEU 173 11.877 1.596 -3.886 22 HA LEU 173 HA LEU 173 9.370 1.927 -2.476 23 HB2 LEU 173 HB2 LEU 173 9.360 3.225 -4.743 24 HB3 LEU 173 HB1 LEU 173 9.243 1.634 -5.462 25 HG LEU 173 HG LEU 173 7.063 2.810 -5.226 26 HD11 LEU 173 HD11 LEU 173 7.106 0.388 -5.390 27 HD12 LEU 173 HD12 LEU 173 5.821 0.919 -4.305 28 HD13 LEU 173 HD13 LEU 173 7.317 0.261 -3.643 29 HD21 LEU 173 HD21 LEU 173 7.558 3.946 -3.102 30 HD22 LEU 173 HD22 LEU 173 7.490 2.393 -2.272 31 HD23 LEU 173 HD23 LEU 173 6.045 3.043 -3.042 32 HA PRO 174 HA PRO 174 10.705 -2.389 -2.279 33 HB2 PRO 174 HB2 PRO 174 8.060 -2.463 -0.872 34 HB3 PRO 174 HB1 PRO 174 9.616 -3.159 -0.395 35 HG2 PRO 174 HG2 PRO 174 8.746 -0.937 0.755 36 HG3 PRO 174 HG1 PRO 174 10.458 -1.114 0.324 37 HD2 PRO 174 HD2 PRO 174 8.311 0.457 -1.034 38 HD3 PRO 174 HD1 PRO 174 10.026 0.853 -0.807 39 H ALA 175 HN ALA 175 10.108 -4.281 -3.341 40 HA ALA 175 HA ALA 175 8.494 -3.619 -5.668 41 HB1 ALA 175 HB1 ALA 175 9.651 -5.447 -6.764 42 HB2 ALA 175 HB2 ALA 175 10.396 -5.913 -5.234 43 HB3 ALA 175 HB3 ALA 175 10.796 -4.363 -5.975 44 H GLY 176 HN GLY 176 7.733 -5.044 -2.862 45 HA2 GLY 176 HA2 GLY 176 5.851 -6.898 -4.199 46 HA3 GLY 176 HA1 GLY 176 6.350 -7.049 -2.513 47 H TRP 177 HN TRP 177 5.789 -3.878 -3.699 48 HA TRP 177 HA TRP 177 3.343 -3.775 -2.071 49 HB2 TRP 177 HB2 TRP 177 5.609 -1.770 -2.139 50 HB3 TRP 177 HB1 TRP 177 4.114 -1.581 -1.228 51 HD1 TRP 177 HD1 TRP 177 6.935 -4.265 -1.415 52 HE1 TRP 177 HE1 TRP 177 7.449 -5.041 0.977 53 HE3 TRP 177 HE3 TRP 177 3.506 -1.439 1.115 54 HZ2 TRP 177 HZ2 TRP 177 6.538 -4.529 3.582 55 HZ3 TRP 177 HZ3 TRP 177 3.399 -1.647 3.563 56 HH2 TRP 177 HH2 TRP 177 4.890 -3.161 4.761 57 H GLU 178 HN GLU 178 1.684 -2.745 -2.872 58 HA GLU 178 HA GLU 178 1.872 -1.548 -5.541 59 HB2 GLU 178 HB2 GLU 178 0.281 -3.456 -5.018 60 HB3 GLU 178 HB1 GLU 178 -0.591 -2.355 -3.967 61 HG2 GLU 178 HG2 GLU 178 -1.762 -2.407 -6.003 62 HG3 GLU 178 HG1 GLU 178 -0.894 -0.869 -5.981 63 H MET 179 HN MET 179 1.386 0.602 -5.873 64 HA MET 179 HA MET 179 0.974 2.237 -3.492 65 HB2 MET 179 HB2 MET 179 1.362 3.099 -6.367 66 HB3 MET 179 HB1 MET 179 1.318 4.162 -4.970 67 HG2 MET 179 HG2 MET 179 3.384 2.019 -5.345 68 HG3 MET 179 HG1 MET 179 3.563 3.681 -5.904 69 HE1 MET 179 HE1 MET 179 3.867 5.760 -4.368 70 HE2 MET 179 HE2 MET 179 3.624 5.735 -2.622 71 HE3 MET 179 HE3 MET 179 2.266 5.437 -3.705 72 H ALA 180 HN ALA 180 -1.146 2.201 -2.873 73 HA ALA 180 HA ALA 180 -3.126 2.884 -4.926 74 HB1 ALA 180 HB1 ALA 180 -4.826 2.269 -3.301 75 HB2 ALA 180 HB2 ALA 180 -3.584 1.985 -2.082 76 HB3 ALA 180 HB3 ALA 180 -3.668 0.956 -3.512 77 H LYS 181 HN LYS 181 -2.652 5.019 -5.197 78 HA LYS 181 HA LYS 181 -2.763 6.789 -2.870 79 HB2 LYS 181 HB2 LYS 181 -2.029 7.424 -5.740 80 HB3 LYS 181 HB1 LYS 181 -1.890 8.515 -4.369 81 HG2 LYS 181 HG2 LYS 181 -0.215 6.976 -3.372 82 HG3 LYS 181 HG1 LYS 181 -0.291 5.989 -4.838 83 HD2 LYS 181 HD2 LYS 181 0.542 8.888 -4.666 84 HD3 LYS 181 HD1 LYS 181 1.605 7.506 -4.939 85 HE2 LYS 181 HE2 LYS 181 0.455 7.026 -7.038 86 HE3 LYS 181 HE1 LYS 181 -0.634 8.383 -6.762 87 HZ1 LYS 181 HZ1 LYS 181 1.075 9.044 -8.272 88 HZ2 LYS 181 HZ2 LYS 181 2.300 8.520 -7.219 89 HZ3 LYS 181 HZ3 LYS 181 1.334 9.853 -6.799 90 H THR 182 HN THR 182 -4.720 7.570 -2.369 91 HA THR 182 HA THR 182 -6.705 7.797 -4.535 92 HB THR 182 HB THR 182 -8.423 7.624 -2.750 93 HG1 THR 182 HG1 THR 182 -6.261 6.897 -1.046 94 HG21 THR 182 HG21 THR 182 -8.092 5.235 -2.279 95 HG22 THR 182 HG22 THR 182 -6.415 5.367 -2.811 96 HG23 THR 182 HG23 THR 182 -7.726 5.620 -3.961 97 H SER 183 HN SER 183 -8.058 9.587 -4.669 98 HA SER 183 HA SER 183 -6.826 12.071 -4.062 99 HB2 SER 183 HB2 SER 183 -9.677 11.570 -4.957 100 HB3 SER 183 HB1 SER 183 -8.776 13.078 -5.109 101 HG SER 183 HG SER 183 -7.470 10.939 -6.214 102 H SER 184 HN SER 184 -8.889 10.049 -2.283 103 HA SER 184 HA SER 184 -10.149 11.943 -0.613 104 HB2 SER 184 HB2 SER 184 -10.851 9.557 -0.836 105 HB3 SER 184 HB1 SER 184 -9.393 9.076 0.029 106 HG SER 184 HG SER 184 -11.521 10.686 1.019 107 H GLY 185 HN GLY 185 -6.919 10.996 -0.912 108 HA2 GLY 185 HA2 GLY 185 -5.132 12.017 0.246 109 HA3 GLY 185 HA1 GLY 185 -6.240 12.409 1.557 110 H GLN 186 HN GLN 186 -5.836 9.287 -0.012 111 HA GLN 186 HA GLN 186 -4.820 8.222 2.541 112 HB2 GLN 186 HB2 GLN 186 -6.928 6.954 0.782 113 HB3 GLN 186 HB1 GLN 186 -6.241 6.237 2.232 114 HG2 GLN 186 HG2 GLN 186 -7.175 8.035 3.580 115 HG3 GLN 186 HG1 GLN 186 -7.835 8.789 2.132 116 HE21 GLN 186 HE21 GLN 186 -8.572 6.211 0.948 117 HE22 GLN 186 HE22 GLN 186 -9.973 5.685 1.807 118 H ARG 187 HN ARG 187 -2.942 7.280 2.276 119 HA ARG 187 HA ARG 187 -2.374 5.950 -0.281 120 HB2 ARG 187 HB2 ARG 187 0.058 6.277 0.353 121 HB3 ARG 187 HB1 ARG 187 -0.826 7.731 -0.088 122 HG2 ARG 187 HG2 ARG 187 -1.138 8.204 2.332 123 HG3 ARG 187 HG1 ARG 187 -0.109 6.816 2.689 124 HD2 ARG 187 HD2 ARG 187 0.798 9.072 0.926 125 HD3 ARG 187 HD1 ARG 187 0.979 9.125 2.676 126 HE ARG 187 HE ARG 187 2.144 6.780 2.038 127 HH11 ARG 187 HH11 ARG 187 2.473 9.981 0.673 128 HH12 ARG 187 HH12 ARG 187 4.182 9.830 0.384 129 HH21 ARG 187 HH21 ARG 187 4.426 6.572 1.660 130 HH22 ARG 187 HH22 ARG 187 5.284 7.904 0.934 131 H TYR 188 HN TYR 188 -2.962 3.857 0.143 132 HA TYR 188 HA TYR 188 -1.581 2.582 2.398 133 HB2 TYR 188 HB2 TYR 188 -3.453 0.891 2.388 134 HB3 TYR 188 HB1 TYR 188 -3.918 2.501 2.914 135 HD1 TYR 188 HD1 TYR 188 -4.235 -0.000 0.239 136 HD2 TYR 188 HD2 TYR 188 -5.484 3.825 1.626 137 HE1 TYR 188 HE1 TYR 188 -6.069 -0.011 -1.392 138 HE2 TYR 188 HE2 TYR 188 -7.310 3.827 -0.013 139 HH TYR 188 HH TYR 188 -8.080 2.806 -1.925 140 H PHE 189 HN PHE 189 -0.444 0.737 1.969 141 HA PHE 189 HA PHE 189 -0.039 0.282 -0.902 142 HB2 PHE 189 HB2 PHE 189 1.816 -0.240 1.431 143 HB3 PHE 189 HB1 PHE 189 2.200 -0.551 -0.262 144 HD1 PHE 189 HD2 PHE 189 0.748 2.012 -1.251 145 HD2 PHE 189 HD1 PHE 189 3.662 1.281 1.767 146 HE1 PHE 189 HE2 PHE 189 1.555 4.323 -1.477 147 HE2 PHE 189 HE1 PHE 189 4.466 3.592 1.551 148 HZ PHE 189 HZ PHE 189 3.413 5.118 -0.070 149 H LEU 190 HN LEU 190 -0.226 -1.685 -1.790 150 HA LEU 190 HA LEU 190 -1.333 -3.815 -0.161 151 HB2 LEU 190 HB2 LEU 190 -1.079 -3.294 -3.062 152 HB3 LEU 190 HB1 LEU 190 -1.137 -4.961 -2.562 153 HG LEU 190 HG LEU 190 -3.267 -2.897 -2.544 154 HD11 LEU 190 HD11 LEU 190 -4.035 -4.335 -4.060 155 HD12 LEU 190 HD12 LEU 190 -4.143 -5.587 -2.810 156 HD13 LEU 190 HD13 LEU 190 -2.665 -5.407 -3.756 157 HD21 LEU 190 HD21 LEU 190 -3.183 -5.213 -0.605 158 HD22 LEU 190 HD22 LEU 190 -4.567 -4.159 -0.903 159 HD23 LEU 190 HD23 LEU 190 -3.099 -3.506 -0.174 160 H ASN 191 HN ASN 191 0.022 -5.388 0.735 161 HA ASN 191 HA ASN 191 2.579 -5.867 -0.555 162 HB2 ASN 191 HB2 ASN 191 1.385 -7.425 1.757 163 HB3 ASN 191 HB1 ASN 191 3.078 -7.348 1.274 164 HD21 ASN 191 HD21 ASN 191 3.652 -6.776 3.393 165 HD22 ASN 191 HD22 ASN 191 3.380 -5.173 3.997 166 H HIS 192 HN HIS 192 2.213 -6.837 -2.480 167 HA HIS 192 HA HIS 192 0.008 -8.562 -2.986 168 HB2 HIS 192 HB2 HIS 192 2.481 -7.867 -4.543 169 HB3 HIS 192 HB1 HIS 192 1.410 -9.145 -5.099 170 HD1 HIS 192 HD1 HIS 192 -1.265 -8.222 -5.205 171 HD2 HIS 192 HD2 HIS 192 1.852 -5.497 -5.643 172 HE1 HIS 192 HE1 HIS 192 -2.253 -6.248 -6.402 173 HE2 HIS 192 HE2 HIS 192 -0.303 -4.710 -6.852 174 H ILE 193 HN ILE 193 2.768 -9.112 -1.299 175 HA ILE 193 HA ILE 193 3.108 -11.891 -2.058 176 HB ILE 193 HB ILE 193 4.827 -11.850 -0.187 177 HG12 ILE 193 HG12 ILE 193 4.288 -8.870 -0.325 178 HG13 ILE 193 HG11 ILE 193 3.824 -9.922 1.016 179 HG21 ILE 193 HG21 ILE 193 5.143 -9.900 -2.468 180 HG22 ILE 193 HG22 ILE 193 5.457 -11.636 -2.521 181 HG23 ILE 193 HG23 ILE 193 6.463 -10.587 -1.521 182 HD11 ILE 193 HD11 ILE 193 5.767 -8.880 1.735 183 HD12 ILE 193 HD12 ILE 193 6.542 -9.041 0.164 184 HD13 ILE 193 HD13 ILE 193 6.318 -10.463 1.184 185 H ASP 194 HN ASP 194 1.813 -9.954 0.595 186 HA ASP 194 HA ASP 194 1.072 -12.399 2.026 187 HB2 ASP 194 HB2 ASP 194 2.260 -10.357 3.131 188 HB3 ASP 194 HB1 ASP 194 0.650 -9.631 3.149 189 H GLN 195 HN GLN 195 -0.227 -10.121 -0.077 190 HA GLN 195 HA GLN 195 -2.328 -9.568 -0.799 191 HB2 GLN 195 HB2 GLN 195 -2.602 -12.174 -0.334 192 HB3 GLN 195 HB1 GLN 195 -3.599 -11.608 1.000 193 HG2 GLN 195 HG2 GLN 195 -5.022 -12.055 -0.848 194 HG3 GLN 195 HG1 GLN 195 -4.936 -10.306 -0.639 195 HE21 GLN 195 HE21 GLN 195 -2.365 -12.208 -2.044 196 HE22 GLN 195 HE22 GLN 195 -2.534 -11.599 -3.658 197 H THR 196 HN THR 196 -0.999 -8.666 1.648 198 HA THR 196 HA THR 196 -3.234 -7.954 3.407 199 HB THR 196 HB THR 196 -0.363 -8.546 3.787 200 HG1 THR 196 HG1 THR 196 -1.308 -9.987 4.968 201 HG21 THR 196 HG21 THR 196 0.025 -7.247 5.663 202 HG22 THR 196 HG22 THR 196 -1.669 -6.778 5.830 203 HG23 THR 196 HG23 THR 196 -0.690 -6.109 4.522 204 H THR 197 HN THR 197 -3.716 -5.838 3.820 205 HA THR 197 HA THR 197 -2.386 -3.868 2.115 206 HB THR 197 HB THR 197 -4.932 -3.426 3.667 207 HG1 THR 197 HG1 THR 197 -4.505 -5.139 1.611 208 HG21 THR 197 HG21 THR 197 -3.827 -1.455 2.698 209 HG22 THR 197 HG22 THR 197 -5.354 -1.794 1.883 210 HG23 THR 197 HG23 THR 197 -3.828 -2.234 1.116 211 H THR 198 HN THR 198 -0.993 -2.502 2.973 212 HA THR 198 HA THR 198 -0.892 -2.268 5.902 213 HB THR 198 HB THR 198 1.359 -1.829 3.930 214 HG1 THR 198 HG1 THR 198 1.245 -3.951 3.785 215 HG21 THR 198 HG21 THR 198 1.375 -2.271 6.920 216 HG22 THR 198 HG22 THR 198 1.662 -0.736 6.104 217 HG23 THR 198 HG23 THR 198 2.797 -2.069 5.893 218 H TRP 199 HN TRP 199 -1.643 -0.315 6.630 219 HA TRP 199 HA TRP 199 -1.644 2.047 4.994 220 HB2 TRP 199 HB2 TRP 199 -2.366 1.462 7.851 221 HB3 TRP 199 HB1 TRP 199 -2.244 3.122 7.289 222 HD1 TRP 199 HD1 TRP 199 -4.564 0.136 7.267 223 HE1 TRP 199 HE1 TRP 199 -6.766 0.798 6.125 224 HE3 TRP 199 HE3 TRP 199 -3.149 4.643 5.280 225 HZ2 TRP 199 HZ2 TRP 199 -7.772 2.914 4.573 226 HZ3 TRP 199 HZ3 TRP 199 -4.801 5.915 3.971 227 HH2 TRP 199 HH2 TRP 199 -7.065 5.065 3.628 228 H GLN 200 HN GLN 200 0.743 0.507 6.707 229 HA GLN 200 HA GLN 200 2.098 2.939 7.598 230 HB2 GLN 200 HB2 GLN 200 1.927 1.046 9.166 231 HB3 GLN 200 HB1 GLN 200 2.784 0.022 8.024 232 HG2 GLN 200 HG2 GLN 200 4.767 1.418 8.244 233 HG3 GLN 200 HG1 GLN 200 3.906 2.471 9.366 234 HE21 GLN 200 HE21 GLN 200 5.467 -0.599 8.931 235 HE22 GLN 200 HE22 GLN 200 5.490 -1.040 10.605 236 H ASP 201 HN ASP 201 3.725 3.810 6.469 237 HA ASP 201 HA ASP 201 4.567 2.703 3.983 238 HB2 ASP 201 HB2 ASP 201 4.495 5.177 4.589 239 HB3 ASP 201 HB1 ASP 201 5.968 4.899 5.513 240 HA PRO 202 HA PRO 202 7.359 -0.194 5.804 241 HB2 PRO 202 HB2 PRO 202 8.570 -1.011 3.502 242 HB3 PRO 202 HB1 PRO 202 6.959 -1.538 4.003 243 HG2 PRO 202 HG2 PRO 202 7.732 0.605 2.056 244 HG3 PRO 202 HG1 PRO 202 6.461 -0.626 1.921 245 HD2 PRO 202 HD2 PRO 202 5.912 1.921 2.612 246 HD3 PRO 202 HD1 PRO 202 5.001 0.548 3.281 247 H ARG 203 HN ARG 203 8.325 2.610 4.106 248 HA ARG 203 HA ARG 203 11.164 2.080 4.408 249 HB2 ARG 203 HB2 ARG 203 9.693 4.482 3.306 250 HB3 ARG 203 HB1 ARG 203 11.439 4.261 3.276 251 HG2 ARG 203 HG2 ARG 203 11.311 2.501 1.748 252 HG3 ARG 203 HG1 ARG 203 9.590 2.257 2.038 253 HD2 ARG 203 HD2 ARG 203 10.827 4.662 0.707 254 HD3 ARG 203 HD1 ARG 203 10.016 3.331 -0.117 255 HE ARG 203 HE ARG 203 8.287 4.453 1.826 256 HH11 ARG 203 HH11 ARG 203 9.699 5.144 -1.315 257 HH12 ARG 203 HH12 ARG 203 8.370 6.143 -1.829 258 HH21 ARG 203 HH21 ARG 203 6.535 5.718 1.139 259 HH22 ARG 203 HH22 ARG 203 6.587 6.480 -0.428 260 H LYS 204 HN LYS 204 8.654 3.438 6.206 261 HA LYS 204 HA LYS 204 10.452 5.172 7.724 262 HB2 LYS 204 HB2 LYS 204 7.453 4.839 7.870 263 HB3 LYS 204 HB1 LYS 204 8.390 5.953 8.861 264 HG2 LYS 204 HG2 LYS 204 8.141 6.011 5.860 265 HG3 LYS 204 HG1 LYS 204 7.377 7.121 7.001 266 HD2 LYS 204 HD2 LYS 204 9.475 8.028 7.652 267 HD3 LYS 204 HD1 LYS 204 10.359 6.753 6.814 268 HE2 LYS 204 HE2 LYS 204 9.449 7.598 4.671 269 HE3 LYS 204 HE1 LYS 204 8.698 8.928 5.553 270 HZ1 LYS 204 HZ1 LYS 204 11.612 8.385 5.609 271 HZ2 LYS 204 HZ2 LYS 204 10.807 9.772 6.162 272 HZ3 LYS 204 HZ3 LYS 204 10.887 9.443 4.504 273 H ALA 205 HN ALA 205 9.160 2.053 7.814 274 HA ALA 205 HA ALA 205 10.282 1.647 10.460 275 HB1 ALA 205 HB1 ALA 205 8.317 0.488 11.313 276 HB2 ALA 205 HB2 ALA 205 7.438 0.859 9.830 277 HB3 ALA 205 HB3 ALA 205 7.929 2.161 10.915 278 H1 SER 201 HT1 SER 201 -8.697 -5.653 -13.665 279 H2 SER 201 HT2 SER 201 -7.494 -6.749 -13.189 280 H3 SER 201 HT3 SER 201 -7.101 -5.117 -13.431 281 HA SER 201 HA SER 201 -8.613 -4.523 -11.614 282 HB2 SER 201 HB2 SER 201 -9.019 -6.589 -10.048 283 HB3 SER 201 HB1 SER 201 -10.119 -6.270 -11.389 284 HG SER 201 HG SER 201 -9.626 -8.184 -12.072 285 H TPO 202 HN TPO 202 -6.952 -3.462 -10.825 286 HA TPO 202 HA TPO 202 -4.793 -4.983 -9.513 287 HB TPO 202 HB TPO 202 -4.499 -2.164 -10.533 288 HG21 TPO 202 HG21 TPO 202 -2.787 -3.010 -9.006 289 HG22 TPO 202 HG22 TPO 202 -2.127 -2.776 -10.624 290 HG23 TPO 202 HG23 TPO 202 -2.524 -4.398 -10.060 291 H TYR 203 HN TYR 203 -6.828 -2.106 -9.453 292 HA TYR 203 HA TYR 203 -5.966 -1.268 -6.852 293 HB2 TYR 203 HB2 TYR 203 -6.711 0.373 -8.499 294 HB3 TYR 203 HB1 TYR 203 -8.298 -0.382 -8.563 295 HD1 TYR 203 HD2 TYR 203 -5.977 1.441 -6.310 296 HD2 TYR 203 HD1 TYR 203 -9.990 0.255 -7.069 297 HE1 TYR 203 HE2 TYR 203 -6.749 2.917 -4.501 298 HE2 TYR 203 HE1 TYR 203 -10.773 1.729 -5.267 299 HH TYR 203 HH TYR 203 -9.801 2.746 -3.149 300 HA PRO 204 HA PRO 204 -8.896 -3.941 -4.768 301 HB2 PRO 204 HB2 PRO 204 -7.879 -3.662 -2.314 302 HB3 PRO 204 HB1 PRO 204 -7.010 -4.568 -3.559 303 HG2 PRO 204 HG2 PRO 204 -6.548 -1.786 -2.567 304 HG3 PRO 204 HG1 PRO 204 -5.365 -3.030 -3.003 305 HD2 PRO 204 HD2 PRO 204 -6.160 -0.932 -4.638 306 HD3 PRO 204 HD1 PRO 204 -5.393 -2.432 -5.198 307 H HIS 205 HN HIS 205 -8.902 -2.739 -1.866 308 HA HIS 205 HA HIS 205 -10.411 -0.291 -2.248 309 HB2 HIS 205 HB2 HIS 205 -12.133 -2.036 -2.437 310 HB3 HIS 205 HB1 HIS 205 -11.612 -2.731 -0.909 311 HD1 HIS 205 HD1 HIS 205 -12.188 0.975 -1.527 312 HD2 HIS 205 HD2 HIS 205 -13.833 -2.216 0.585 313 HE1 HIS 205 HE1 HIS 205 -13.995 1.966 -0.088 314 HE2 HIS 205 HE2 HIS 205 -15.075 -0.002 1.057 315 H SEP 206 HN SEP 206 -10.234 1.050 -0.523 316 HA SEP 206 HA SEP 206 -8.182 0.816 1.278 317 HB2 SEP 206 HB2 SEP 206 -9.791 2.538 2.587 318 HB3 SEP 206 HB1 SEP 206 -8.874 2.972 1.148 319 HA PRO 207 HA PRO 207 -9.531 -2.450 3.899 320 HB2 PRO 207 HB2 PRO 207 -7.549 -2.107 5.794 321 HB3 PRO 207 HB1 PRO 207 -7.363 -2.991 4.275 322 HG2 PRO 207 HG2 PRO 207 -6.549 -0.212 4.974 323 HG3 PRO 207 HG1 PRO 207 -5.718 -1.410 3.968 324 HD2 PRO 207 HD2 PRO 207 -7.091 0.664 2.922 325 HD3 PRO 207 HD1 PRO 207 -6.981 -0.911 2.112 326 H THR 208 HN THR 208 -9.478 0.836 4.887 327 HA THR 208 HA THR 208 -10.759 0.101 7.432 328 HB THR 208 HB THR 208 -9.268 2.665 6.842 329 HG1 THR 208 HG1 THR 208 -7.759 1.612 8.425 330 HG21 THR 208 HG21 THR 208 -10.299 1.501 9.434 331 HG22 THR 208 HG22 THR 208 -10.996 2.875 8.575 332 HG23 THR 208 HG23 THR 208 -9.378 2.995 9.267 333 H SER 209 HN SER 209 -12.870 0.386 7.358 334 HA SER 209 HA SER 209 -13.918 2.898 6.297 335 HB2 SER 209 HB2 SER 209 -15.007 0.163 5.578 336 HB3 SER 209 HB1 SER 209 -15.774 1.700 5.176 337 HG SER 209 HG SER 209 -13.178 1.669 4.400 Start of MODEL 11 1 H ASP 170 H ASP 170 16.450 1.453 -7.363 2 HA ASP 170 HA ASP 170 14.084 1.010 -7.150 3 HB2 ASP 170 HB2 ASP 170 14.256 -1.447 -7.132 4 HB3 ASP 170 HB1 ASP 170 15.554 -0.715 -8.073 5 H VAL 171 HN VAL 171 15.687 1.232 -4.177 6 HA VAL 171 HA VAL 171 13.884 -0.438 -2.705 7 HB VAL 171 HB VAL 171 14.992 0.268 -0.690 8 HG11 VAL 171 HG11 VAL 171 16.045 -1.466 -2.006 9 HG12 VAL 171 HG12 VAL 171 17.269 -0.470 -1.219 10 HG13 VAL 171 HG13 VAL 171 16.930 -0.256 -2.936 11 HG21 VAL 171 HG21 VAL 171 15.295 2.650 -1.228 12 HG22 VAL 171 HG22 VAL 171 16.567 2.214 -2.373 13 HG23 VAL 171 HG23 VAL 171 16.780 1.897 -0.654 14 HA PRO 172 HA PRO 172 12.013 3.846 -1.336 15 HB2 PRO 172 HB2 PRO 172 11.722 5.186 -3.943 16 HB3 PRO 172 HB1 PRO 172 12.264 5.843 -2.395 17 HG2 PRO 172 HG2 PRO 172 13.974 5.460 -4.409 18 HG3 PRO 172 HG1 PRO 172 14.451 5.167 -2.724 19 HD2 PRO 172 HD2 PRO 172 13.612 3.192 -4.825 20 HD3 PRO 172 HD1 PRO 172 14.976 3.111 -3.697 21 H LEU 173 HN LEU 173 11.422 1.824 -4.001 22 HA LEU 173 HA LEU 173 8.544 2.012 -3.487 23 HB2 LEU 173 HB2 LEU 173 9.416 3.161 -5.693 24 HB3 LEU 173 HB1 LEU 173 9.509 1.514 -6.279 25 HG LEU 173 HG LEU 173 7.439 2.632 -6.973 26 HD11 LEU 173 HD11 LEU 173 6.952 0.401 -5.011 27 HD12 LEU 173 HD12 LEU 173 7.421 0.215 -6.701 28 HD13 LEU 173 HD13 LEU 173 5.855 0.917 -6.294 29 HD21 LEU 173 HD21 LEU 173 5.777 3.354 -5.462 30 HD22 LEU 173 HD22 LEU 173 7.294 4.064 -4.907 31 HD23 LEU 173 HD23 LEU 173 6.619 2.660 -4.078 32 HA PRO 174 HA PRO 174 9.853 -2.329 -3.007 33 HB2 PRO 174 HB2 PRO 174 7.360 -2.510 -1.435 34 HB3 PRO 174 HB1 PRO 174 9.025 -2.837 -0.950 35 HG2 PRO 174 HG2 PRO 174 7.666 -0.693 -0.059 36 HG3 PRO 174 HG1 PRO 174 9.419 -0.663 -0.331 37 HD2 PRO 174 HD2 PRO 174 7.214 0.397 -2.061 38 HD3 PRO 174 HD1 PRO 174 8.783 1.128 -1.659 39 H ALA 175 HN ALA 175 9.257 -4.039 -4.260 40 HA ALA 175 HA ALA 175 7.172 -3.428 -6.202 41 HB1 ALA 175 HB1 ALA 175 9.419 -4.012 -6.976 42 HB2 ALA 175 HB2 ALA 175 8.203 -5.143 -7.571 43 HB3 ALA 175 HB3 ALA 175 9.257 -5.603 -6.233 44 H GLY 176 HN GLY 176 7.599 -5.516 -3.508 45 HA2 GLY 176 HA2 GLY 176 5.522 -7.374 -4.341 46 HA3 GLY 176 HA1 GLY 176 6.307 -7.315 -2.768 47 H TRP 177 HN TRP 177 5.310 -4.287 -3.799 48 HA TRP 177 HA TRP 177 2.979 -4.405 -2.014 49 HB2 TRP 177 HB2 TRP 177 5.018 -2.171 -2.242 50 HB3 TRP 177 HB1 TRP 177 3.606 -2.175 -1.188 51 HD1 TRP 177 HD1 TRP 177 6.602 -4.608 -1.703 52 HE1 TRP 177 HE1 TRP 177 7.483 -5.295 0.610 53 HE3 TRP 177 HE3 TRP 177 3.357 -1.954 1.219 54 HZ2 TRP 177 HZ2 TRP 177 6.889 -4.775 3.307 55 HZ3 TRP 177 HZ3 TRP 177 3.587 -2.101 3.658 56 HH2 TRP 177 HH2 TRP 177 5.324 -3.482 4.667 57 H GLU 178 HN GLU 178 1.194 -3.362 -2.641 58 HA GLU 178 HA GLU 178 1.092 -2.432 -5.403 59 HB2 GLU 178 HB2 GLU 178 -0.542 -4.104 -4.603 60 HB3 GLU 178 HB1 GLU 178 -1.128 -2.958 -3.409 61 HG2 GLU 178 HG2 GLU 178 -2.622 -3.030 -5.300 62 HG3 GLU 178 HG1 GLU 178 -1.831 -1.456 -5.219 63 H MET 179 HN MET 179 0.574 -0.379 -6.001 64 HA MET 179 HA MET 179 0.682 1.640 -3.904 65 HB2 MET 179 HB2 MET 179 0.611 2.006 -6.902 66 HB3 MET 179 HB1 MET 179 0.881 3.269 -5.710 67 HG2 MET 179 HG2 MET 179 2.699 0.926 -6.192 68 HG3 MET 179 HG1 MET 179 2.915 2.558 -6.824 69 HE1 MET 179 HE1 MET 179 3.676 4.601 -5.490 70 HE2 MET 179 HE2 MET 179 3.717 4.678 -3.728 71 HE3 MET 179 HE3 MET 179 2.177 4.497 -4.566 72 H ALA 180 HN ALA 180 -1.305 1.797 -2.940 73 HA ALA 180 HA ALA 180 -3.507 2.497 -4.757 74 HB1 ALA 180 HB1 ALA 180 -3.628 1.726 -1.843 75 HB2 ALA 180 HB2 ALA 180 -4.022 0.682 -3.211 76 HB3 ALA 180 HB3 ALA 180 -5.008 2.105 -2.874 77 H LYS 181 HN LYS 181 -2.907 4.573 -5.199 78 HA LYS 181 HA LYS 181 -2.639 6.415 -2.927 79 HB2 LYS 181 HB2 LYS 181 -1.931 6.878 -5.835 80 HB3 LYS 181 HB1 LYS 181 -1.591 7.962 -4.497 81 HG2 LYS 181 HG2 LYS 181 -0.125 6.187 -3.528 82 HG3 LYS 181 HG1 LYS 181 -0.364 5.250 -5.009 83 HD2 LYS 181 HD2 LYS 181 0.638 8.081 -5.097 84 HD3 LYS 181 HD1 LYS 181 1.735 6.732 -4.808 85 HE2 LYS 181 HE2 LYS 181 1.809 7.167 -7.130 86 HE3 LYS 181 HE1 LYS 181 0.852 5.704 -6.931 87 HZ1 LYS 181 HZ1 LYS 181 -0.327 8.411 -7.271 88 HZ2 LYS 181 HZ2 LYS 181 -1.143 6.923 -7.316 89 HZ3 LYS 181 HZ3 LYS 181 -0.056 7.331 -8.549 90 H THR 182 HN THR 182 -4.593 7.220 -2.390 91 HA THR 182 HA THR 182 -6.439 7.897 -4.576 92 HB THR 182 HB THR 182 -8.236 7.852 -2.896 93 HG1 THR 182 HG1 THR 182 -6.310 6.829 -1.065 94 HG21 THR 182 HG21 THR 182 -7.698 5.793 -4.107 95 HG22 THR 182 HG22 THR 182 -8.252 5.443 -2.472 96 HG23 THR 182 HG23 THR 182 -6.533 5.358 -2.856 97 H SER 183 HN SER 183 -7.101 9.980 -4.870 98 HA SER 183 HA SER 183 -5.572 12.072 -3.771 99 HB2 SER 183 HB2 SER 183 -6.736 12.096 -6.008 100 HB3 SER 183 HB1 SER 183 -8.249 12.364 -5.143 101 HG SER 183 HG SER 183 -7.006 14.273 -5.963 102 H SER 184 HN SER 184 -8.303 10.458 -2.551 103 HA SER 184 HA SER 184 -9.462 12.433 -0.935 104 HB2 SER 184 HB2 SER 184 -9.199 9.494 -0.268 105 HB3 SER 184 HB1 SER 184 -10.441 10.612 0.298 106 HG SER 184 HG SER 184 -11.187 9.302 -1.431 107 H GLY 185 HN GLY 185 -6.390 10.999 -0.801 108 HA2 GLY 185 HA2 GLY 185 -4.712 11.911 0.647 109 HA3 GLY 185 HA1 GLY 185 -5.951 12.154 1.871 110 H GLN 186 HN GLN 186 -6.118 9.174 0.212 111 HA GLN 186 HA GLN 186 -5.060 7.864 2.626 112 HB2 GLN 186 HB2 GLN 186 -7.076 6.810 0.631 113 HB3 GLN 186 HB1 GLN 186 -6.486 5.942 2.041 114 HG2 GLN 186 HG2 GLN 186 -7.467 7.632 3.502 115 HG3 GLN 186 HG1 GLN 186 -8.050 8.515 2.093 116 HE21 GLN 186 HE21 GLN 186 -8.747 6.057 0.640 117 HE22 GLN 186 HE22 GLN 186 -10.184 5.466 1.394 118 H ARG 187 HN ARG 187 -3.036 7.277 2.269 119 HA ARG 187 HA ARG 187 -2.460 5.873 -0.246 120 HB2 ARG 187 HB2 ARG 187 -0.049 6.342 0.258 121 HB3 ARG 187 HB1 ARG 187 -1.021 7.766 -0.078 122 HG2 ARG 187 HG2 ARG 187 -1.153 8.255 2.303 123 HG3 ARG 187 HG1 ARG 187 -0.210 6.805 2.657 124 HD2 ARG 187 HD2 ARG 187 0.722 9.183 1.056 125 HD3 ARG 187 HD1 ARG 187 1.187 8.803 2.714 126 HE ARG 187 HE ARG 187 1.915 7.206 0.347 127 HH11 ARG 187 HH11 ARG 187 2.516 8.263 3.631 128 HH12 ARG 187 HH12 ARG 187 4.044 7.436 3.737 129 HH21 ARG 187 HH21 ARG 187 3.949 6.141 0.499 130 HH22 ARG 187 HH22 ARG 187 4.849 6.231 1.988 131 H TYR 188 HN TYR 188 -2.775 3.722 0.134 132 HA TYR 188 HA TYR 188 -1.392 2.592 2.456 133 HB2 TYR 188 HB2 TYR 188 -3.213 0.852 2.557 134 HB3 TYR 188 HB1 TYR 188 -3.708 2.469 3.031 135 HD1 TYR 188 HD2 TYR 188 -5.218 3.774 1.605 136 HD2 TYR 188 HD1 TYR 188 -4.137 -0.216 0.603 137 HE1 TYR 188 HE2 TYR 188 -7.087 3.678 0.018 138 HE2 TYR 188 HE1 TYR 188 -6.016 -0.331 -0.980 139 HH TYR 188 HH TYR 188 -8.118 2.482 -1.564 140 H PHE 189 HN PHE 189 -0.204 0.801 2.090 141 HA PHE 189 HA PHE 189 0.014 -0.006 -0.723 142 HB2 PHE 189 HB2 PHE 189 2.065 -0.214 1.499 143 HB3 PHE 189 HB1 PHE 189 2.293 -0.794 -0.147 144 HD1 PHE 189 HD2 PHE 189 1.140 1.398 -1.708 145 HD2 PHE 189 HD1 PHE 189 3.648 1.512 1.732 146 HE1 PHE 189 HE2 PHE 189 1.991 3.598 -2.402 147 HE2 PHE 189 HE1 PHE 189 4.480 3.716 1.055 148 HZ PHE 189 HZ PHE 189 3.652 4.765 -1.011 149 H LEU 190 HN LEU 190 -0.429 -2.020 -1.296 150 HA LEU 190 HA LEU 190 -1.301 -3.936 0.719 151 HB2 LEU 190 HB2 LEU 190 -1.502 -3.692 -2.240 152 HB3 LEU 190 HB1 LEU 190 -1.556 -5.299 -1.565 153 HG LEU 190 HG LEU 190 -3.539 -3.084 -1.343 154 HD11 LEU 190 HD11 LEU 190 -4.414 -4.464 -2.869 155 HD12 LEU 190 HD12 LEU 190 -4.820 -5.499 -1.494 156 HD13 LEU 190 HD13 LEU 190 -3.344 -5.793 -2.414 157 HD21 LEU 190 HD21 LEU 190 -3.319 -5.397 0.583 158 HD22 LEU 190 HD22 LEU 190 -4.661 -4.256 0.482 159 HD23 LEU 190 HD23 LEU 190 -3.064 -3.696 0.978 160 H ASN 191 HN ASN 191 -0.146 -5.837 1.235 161 HA ASN 191 HA ASN 191 2.308 -6.319 -0.277 162 HB2 ASN 191 HB2 ASN 191 1.105 -8.033 1.914 163 HB3 ASN 191 HB1 ASN 191 2.708 -8.212 1.206 164 HD21 ASN 191 HD21 ASN 191 2.801 -5.145 1.199 165 HD22 ASN 191 HD22 ASN 191 3.243 -4.758 2.825 166 H HIS 192 HN HIS 192 2.073 -7.270 -2.215 167 HA HIS 192 HA HIS 192 -0.327 -8.686 -2.897 168 HB2 HIS 192 HB2 HIS 192 2.147 -7.892 -4.322 169 HB3 HIS 192 HB1 HIS 192 1.342 -9.331 -4.935 170 HD1 HIS 192 HD1 HIS 192 -1.178 -8.994 -5.751 171 HD2 HIS 192 HD2 HIS 192 1.006 -5.518 -5.062 172 HE1 HIS 192 HE1 HIS 192 -2.495 -7.138 -6.819 173 HE2 HIS 192 HE2 HIS 192 -1.031 -5.101 -6.614 174 H ILE 193 HN ILE 193 2.424 -9.594 -1.250 175 HA ILE 193 HA ILE 193 2.465 -12.332 -2.209 176 HB ILE 193 HB ILE 193 4.029 -11.770 0.201 177 HG12 ILE 193 HG12 ILE 193 5.717 -10.534 -1.526 178 HG13 ILE 193 HG11 ILE 193 4.171 -9.925 -2.113 179 HG21 ILE 193 HG21 ILE 193 4.315 -13.765 -1.132 180 HG22 ILE 193 HG22 ILE 193 5.795 -12.807 -1.151 181 HG23 ILE 193 HG23 ILE 193 4.719 -12.790 -2.547 182 HD11 ILE 193 HD11 ILE 193 5.084 -8.375 -0.538 183 HD12 ILE 193 HD12 ILE 193 5.265 -9.644 0.667 184 HD13 ILE 193 HD13 ILE 193 3.655 -9.135 0.163 185 H ASP 194 HN ASP 194 1.794 -10.579 0.786 186 HA ASP 194 HA ASP 194 0.682 -12.967 2.015 187 HB2 ASP 194 HB2 ASP 194 1.027 -10.148 3.062 188 HB3 ASP 194 HB1 ASP 194 0.408 -11.494 4.007 189 H GLN 195 HN GLN 195 -0.341 -10.380 0.137 190 HA GLN 195 HA GLN 195 -2.324 -9.485 -0.502 191 HB2 GLN 195 HB2 GLN 195 -2.795 -11.997 -0.766 192 HB3 GLN 195 HB1 GLN 195 -3.678 -11.875 0.748 193 HG2 GLN 195 HG2 GLN 195 -5.221 -10.307 -0.209 194 HG3 GLN 195 HG1 GLN 195 -4.276 -10.221 -1.695 195 HE21 GLN 195 HE21 GLN 195 -5.978 -10.881 -2.989 196 HE22 GLN 195 HE22 GLN 195 -6.565 -12.512 -2.979 197 H THR 196 HN THR 196 -1.220 -8.670 1.919 198 HA THR 196 HA THR 196 -3.563 -8.367 3.684 199 HB THR 196 HB THR 196 -1.580 -9.534 4.692 200 HG1 THR 196 HG1 THR 196 -1.768 -8.377 6.635 201 HG21 THR 196 HG21 THR 196 0.373 -8.276 5.310 202 HG22 THR 196 HG22 THR 196 -0.310 -6.800 4.624 203 HG23 THR 196 HG23 THR 196 0.148 -8.133 3.566 204 H THR 197 HN THR 197 -3.971 -6.365 4.656 205 HA THR 197 HA THR 197 -3.301 -4.114 2.945 206 HB THR 197 HB THR 197 -5.031 -3.000 4.554 207 HG1 THR 197 HG1 THR 197 -5.713 -4.300 6.063 208 HG21 THR 197 HG21 THR 197 -6.894 -3.915 3.236 209 HG22 THR 197 HG22 THR 197 -5.835 -5.199 2.648 210 HG23 THR 197 HG23 THR 197 -5.506 -3.520 2.222 211 H THR 198 HN THR 198 -1.954 -2.476 3.526 212 HA THR 198 HA THR 198 -1.102 -2.327 6.337 213 HB THR 198 HB THR 198 0.759 -2.132 3.958 214 HG1 THR 198 HG1 THR 198 -0.199 -4.282 5.356 215 HG21 THR 198 HG21 THR 198 1.259 -2.180 6.935 216 HG22 THR 198 HG22 THR 198 1.581 -0.847 5.825 217 HG23 THR 198 HG23 THR 198 2.517 -2.335 5.711 218 H TRP 199 HN TRP 199 -1.421 -0.282 7.131 219 HA TRP 199 HA TRP 199 -1.529 1.991 5.287 220 HB2 TRP 199 HB2 TRP 199 -2.223 1.654 8.201 221 HB3 TRP 199 HB1 TRP 199 -2.086 3.244 7.471 222 HD1 TRP 199 HD1 TRP 199 -4.470 0.402 7.925 223 HE1 TRP 199 HE1 TRP 199 -6.692 0.945 6.745 224 HE3 TRP 199 HE3 TRP 199 -2.981 4.482 5.219 225 HZ2 TRP 199 HZ2 TRP 199 -7.678 2.842 4.905 226 HZ3 TRP 199 HZ3 TRP 199 -4.629 5.599 3.771 227 HH2 TRP 199 HH2 TRP 199 -6.928 4.793 3.618 228 H GLN 200 HN GLN 200 0.778 0.368 7.002 229 HA GLN 200 HA GLN 200 2.215 2.709 7.955 230 HB2 GLN 200 HB2 GLN 200 2.799 -0.244 8.179 231 HB3 GLN 200 HB1 GLN 200 3.848 1.015 8.819 232 HG2 GLN 200 HG2 GLN 200 1.010 0.450 9.647 233 HG3 GLN 200 HG1 GLN 200 2.471 0.105 10.572 234 HE21 GLN 200 HE21 GLN 200 0.279 2.562 9.484 235 HE22 GLN 200 HE22 GLN 200 0.856 3.829 10.513 236 H ASP 201 HN ASP 201 3.831 3.635 6.952 237 HA ASP 201 HA ASP 201 4.544 2.904 4.294 238 HB2 ASP 201 HB2 ASP 201 4.457 5.251 5.243 239 HB3 ASP 201 HB1 ASP 201 5.943 4.881 6.109 240 HA PRO 202 HA PRO 202 7.699 0.018 5.747 241 HB2 PRO 202 HB2 PRO 202 8.194 -1.141 3.369 242 HB3 PRO 202 HB1 PRO 202 6.728 -1.490 4.292 243 HG2 PRO 202 HG2 PRO 202 7.101 0.312 1.937 244 HG3 PRO 202 HG1 PRO 202 5.769 -0.796 2.301 245 HD2 PRO 202 HD2 PRO 202 5.672 1.911 2.739 246 HD3 PRO 202 HD1 PRO 202 4.703 0.728 3.634 247 H ARG 203 HN ARG 203 7.903 2.531 3.498 248 HA ARG 203 HA ARG 203 10.725 2.288 2.918 249 HB2 ARG 203 HB2 ARG 203 9.188 3.121 1.229 250 HB3 ARG 203 HB1 ARG 203 8.631 4.382 2.313 251 HG2 ARG 203 HG2 ARG 203 10.906 5.363 2.234 252 HG3 ARG 203 HG1 ARG 203 11.320 4.164 1.000 253 HD2 ARG 203 HD2 ARG 203 10.636 6.186 -0.112 254 HD3 ARG 203 HD1 ARG 203 9.383 4.955 -0.336 255 HE ARG 203 HE ARG 203 8.411 6.209 1.772 256 HH11 ARG 203 HH11 ARG 203 9.941 7.593 -1.053 257 HH12 ARG 203 HH12 ARG 203 8.916 8.997 -1.089 258 HH21 ARG 203 HH21 ARG 203 7.071 8.083 1.753 259 HH22 ARG 203 HH22 ARG 203 7.287 9.272 0.510 260 H LYS 204 HN LYS 204 8.587 3.896 5.099 261 HA LYS 204 HA LYS 204 10.571 5.587 6.313 262 HB2 LYS 204 HB2 LYS 204 8.287 6.270 6.531 263 HB3 LYS 204 HB1 LYS 204 7.802 4.689 7.126 264 HG2 LYS 204 HG2 LYS 204 9.570 5.342 9.025 265 HG3 LYS 204 HG1 LYS 204 9.034 6.957 8.555 266 HD2 LYS 204 HD2 LYS 204 6.732 6.353 8.960 267 HD3 LYS 204 HD1 LYS 204 7.197 4.686 9.298 268 HE2 LYS 204 HE2 LYS 204 7.828 7.146 10.921 269 HE3 LYS 204 HE1 LYS 204 6.820 5.778 11.389 270 HZ1 LYS 204 HZ1 LYS 204 8.954 4.413 11.092 271 HZ2 LYS 204 HZ2 LYS 204 8.819 5.400 12.468 272 HZ3 LYS 204 HZ3 LYS 204 9.759 5.911 11.154 273 H ALA 205 HN ALA 205 8.791 2.705 7.390 274 HA ALA 205 HA ALA 205 9.253 1.033 8.844 275 HB1 ALA 205 HB1 ALA 205 11.537 0.173 8.917 276 HB2 ALA 205 HB2 ALA 205 12.123 1.641 8.135 277 HB3 ALA 205 HB3 ALA 205 11.051 0.544 7.263 278 H1 SER 201 HT1 SER 201 -1.349 -1.981 -10.280 279 H2 SER 201 HT2 SER 201 -0.184 -3.169 -10.008 280 H3 SER 201 HT3 SER 201 -1.485 -3.003 -8.938 281 HA SER 201 HA SER 201 -1.592 -3.895 -11.756 282 HB2 SER 201 HB2 SER 201 -0.811 -5.526 -9.972 283 HB3 SER 201 HB1 SER 201 -2.404 -5.365 -9.234 284 HG SER 201 HG SER 201 -3.179 -6.675 -10.682 285 H TPO 202 HN TPO 202 -3.906 -4.607 -9.214 286 HA TPO 202 HA TPO 202 -5.881 -2.998 -10.693 287 HB TPO 202 HB TPO 202 -6.534 -5.387 -8.964 288 HG21 TPO 202 HG21 TPO 202 -8.385 -3.861 -9.481 289 HG22 TPO 202 HG22 TPO 202 -8.596 -5.407 -10.303 290 HG23 TPO 202 HG23 TPO 202 -8.027 -4.001 -11.203 291 H TYR 203 HN TYR 203 -7.353 -1.750 -9.502 292 HA TYR 203 HA TYR 203 -6.394 -0.700 -7.047 293 HB2 TYR 203 HB2 TYR 203 -7.667 0.643 -8.684 294 HB3 TYR 203 HB1 TYR 203 -9.094 -0.335 -8.369 295 HD1 TYR 203 HD2 TYR 203 -6.756 2.106 -6.865 296 HD2 TYR 203 HD1 TYR 203 -10.506 0.126 -6.507 297 HE1 TYR 203 HE2 TYR 203 -7.384 3.632 -5.044 298 HE2 TYR 203 HE1 TYR 203 -11.144 1.653 -4.687 299 HH TYR 203 HH TYR 203 -9.867 3.086 -2.943 300 HA PRO 204 HA PRO 204 -8.465 -3.744 -4.494 301 HB2 PRO 204 HB2 PRO 204 -7.236 -3.123 -2.195 302 HB3 PRO 204 HB1 PRO 204 -6.381 -3.950 -3.502 303 HG2 PRO 204 HG2 PRO 204 -6.303 -1.074 -2.705 304 HG3 PRO 204 HG1 PRO 204 -4.982 -2.124 -3.247 305 HD2 PRO 204 HD2 PRO 204 -6.321 -0.302 -4.848 306 HD3 PRO 204 HD1 PRO 204 -5.403 -1.698 -5.444 307 H HIS 205 HN HIS 205 -8.465 -2.555 -1.648 308 HA HIS 205 HA HIS 205 -10.361 -0.376 -1.868 309 HB2 HIS 205 HB2 HIS 205 -11.800 -2.388 -1.977 310 HB3 HIS 205 HB1 HIS 205 -11.107 -2.953 -0.459 311 HD1 HIS 205 HD1 HIS 205 -12.143 -2.103 1.658 312 HD2 HIS 205 HD2 HIS 205 -13.386 0.014 -1.695 313 HE1 HIS 205 HE1 HIS 205 -13.984 -0.586 2.458 314 HE2 HIS 205 HE2 HIS 205 -14.532 0.852 0.464 315 H SEP 206 HN SEP 206 -10.224 0.987 -0.169 316 HA SEP 206 HA SEP 206 -8.017 0.852 1.531 317 HB2 SEP 206 HB2 SEP 206 -9.510 2.658 2.818 318 HB3 SEP 206 HB1 SEP 206 -8.707 3.015 1.293 319 HA PRO 207 HA PRO 207 -9.160 -2.159 4.446 320 HB2 PRO 207 HB2 PRO 207 -7.346 -0.822 6.333 321 HB3 PRO 207 HB1 PRO 207 -7.248 -2.435 5.627 322 HG2 PRO 207 HG2 PRO 207 -5.594 -0.427 4.895 323 HG3 PRO 207 HG1 PRO 207 -6.098 -1.702 3.776 324 HD2 PRO 207 HD2 PRO 207 -7.031 1.120 3.992 325 HD3 PRO 207 HD1 PRO 207 -6.821 0.105 2.551 326 H THR 208 HN THR 208 -9.660 1.184 5.087 327 HA THR 208 HA THR 208 -11.226 0.485 7.476 328 HB THR 208 HB THR 208 -10.967 2.912 8.112 329 HG1 THR 208 HG1 THR 208 -10.293 3.603 5.978 330 HG21 THR 208 HG21 THR 208 -8.449 1.255 7.895 331 HG22 THR 208 HG22 THR 208 -9.644 1.167 9.189 332 HG23 THR 208 HG23 THR 208 -8.681 2.630 8.976 333 H SER 209 HN SER 209 -13.203 0.145 6.657 334 HA SER 209 HA SER 209 -14.704 2.480 5.889 335 HB2 SER 209 HB2 SER 209 -14.529 0.094 4.028 336 HB3 SER 209 HB1 SER 209 -15.714 1.390 3.882 337 HG SER 209 HG SER 209 -13.191 2.371 4.067 Start of MODEL 12 1 H ASP 170 H ASP 170 14.164 3.952 -6.492 2 HA ASP 170 HA ASP 170 13.511 2.090 -7.828 3 HB2 ASP 170 HB2 ASP 170 15.670 1.536 -8.790 4 HB3 ASP 170 HB1 ASP 170 16.294 1.085 -7.208 5 H VAL 171 HN VAL 171 15.414 2.105 -4.840 6 HA VAL 171 HA VAL 171 13.936 -0.073 -3.726 7 HB VAL 171 HB VAL 171 15.157 0.306 -1.656 8 HG11 VAL 171 HG11 VAL 171 16.882 0.394 -4.125 9 HG12 VAL 171 HG12 VAL 171 16.156 -1.042 -3.404 10 HG13 VAL 171 HG13 VAL 171 17.399 -0.148 -2.529 11 HG21 VAL 171 HG21 VAL 171 15.278 2.765 -1.729 12 HG22 VAL 171 HG22 VAL 171 16.444 2.651 -3.051 13 HG23 VAL 171 HG23 VAL 171 16.851 2.020 -1.458 14 HA PRO 172 HA PRO 172 11.844 3.490 -1.128 15 HB2 PRO 172 HB2 PRO 172 11.095 5.355 -3.287 16 HB3 PRO 172 HB1 PRO 172 11.728 5.697 -1.672 17 HG2 PRO 172 HG2 PRO 172 13.249 6.041 -3.839 18 HG3 PRO 172 HG1 PRO 172 13.929 5.406 -2.327 19 HD2 PRO 172 HD2 PRO 172 13.092 3.915 -4.796 20 HD3 PRO 172 HD1 PRO 172 14.567 3.740 -3.830 21 H LEU 173 HN LEU 173 11.153 2.100 -4.149 22 HA LEU 173 HA LEU 173 8.304 1.920 -3.425 23 HB2 LEU 173 HB2 LEU 173 9.132 3.109 -5.653 24 HB3 LEU 173 HB1 LEU 173 9.229 1.459 -6.229 25 HG LEU 173 HG LEU 173 7.120 2.543 -6.860 26 HD11 LEU 173 HD11 LEU 173 6.749 0.313 -4.869 27 HD12 LEU 173 HD12 LEU 173 7.142 0.127 -6.577 28 HD13 LEU 173 HD13 LEU 173 5.587 0.808 -6.100 29 HD21 LEU 173 HD21 LEU 173 5.485 3.189 -5.251 30 HD22 LEU 173 HD22 LEU 173 6.995 4.007 -4.851 31 HD23 LEU 173 HD23 LEU 173 6.477 2.601 -3.919 32 HA PRO 174 HA PRO 174 9.832 -2.355 -3.026 33 HB2 PRO 174 HB2 PRO 174 7.325 -2.741 -1.541 34 HB3 PRO 174 HB1 PRO 174 8.992 -2.956 -1.004 35 HG2 PRO 174 HG2 PRO 174 7.428 -0.938 -0.121 36 HG3 PRO 174 HG1 PRO 174 9.185 -0.783 -0.292 37 HD2 PRO 174 HD2 PRO 174 7.011 0.204 -2.098 38 HD3 PRO 174 HD1 PRO 174 8.524 0.997 -1.610 39 H ALA 175 HN ALA 175 9.307 -4.108 -4.286 40 HA ALA 175 HA ALA 175 7.351 -3.448 -6.336 41 HB1 ALA 175 HB1 ALA 175 9.647 -3.999 -6.974 42 HB2 ALA 175 HB2 ALA 175 8.480 -5.111 -7.690 43 HB3 ALA 175 HB3 ALA 175 9.441 -5.615 -6.300 44 H GLY 176 HN GLY 176 7.430 -5.466 -3.620 45 HA2 GLY 176 HA2 GLY 176 5.472 -7.326 -4.769 46 HA3 GLY 176 HA1 GLY 176 6.193 -7.443 -3.167 47 H TRP 177 HN TRP 177 5.207 -4.317 -3.927 48 HA TRP 177 HA TRP 177 2.837 -4.642 -2.216 49 HB2 TRP 177 HB2 TRP 177 4.741 -2.288 -2.326 50 HB3 TRP 177 HB1 TRP 177 3.343 -2.433 -1.269 51 HD1 TRP 177 HD1 TRP 177 6.455 -4.684 -1.914 52 HE1 TRP 177 HE1 TRP 177 7.411 -5.409 0.356 53 HE3 TRP 177 HE3 TRP 177 3.147 -2.295 1.157 54 HZ2 TRP 177 HZ2 TRP 177 6.839 -5.015 3.086 55 HZ3 TRP 177 HZ3 TRP 177 3.426 -2.517 3.581 56 HH2 TRP 177 HH2 TRP 177 5.239 -3.848 4.518 57 H GLU 178 HN GLU 178 0.981 -3.717 -2.867 58 HA GLU 178 HA GLU 178 0.890 -2.573 -5.550 59 HB2 GLU 178 HB2 GLU 178 -0.692 -4.390 -4.791 60 HB3 GLU 178 HB1 GLU 178 -1.404 -3.231 -3.681 61 HG2 GLU 178 HG2 GLU 178 -2.777 -3.356 -5.625 62 HG3 GLU 178 HG1 GLU 178 -1.957 -1.794 -5.634 63 H MET 179 HN MET 179 0.501 -0.457 -5.961 64 HA MET 179 HA MET 179 0.438 1.340 -3.665 65 HB2 MET 179 HB2 MET 179 0.662 2.022 -6.600 66 HB3 MET 179 HB1 MET 179 0.859 3.133 -5.253 67 HG2 MET 179 HG2 MET 179 2.637 0.760 -5.707 68 HG3 MET 179 HG1 MET 179 2.952 2.374 -6.344 69 HE1 MET 179 HE1 MET 179 3.522 4.453 -4.947 70 HE2 MET 179 HE2 MET 179 3.533 4.510 -3.185 71 HE3 MET 179 HE3 MET 179 2.008 4.314 -4.051 72 H ALA 180 HN ALA 180 -1.590 1.557 -2.874 73 HA ALA 180 HA ALA 180 -3.663 2.364 -4.793 74 HB1 ALA 180 HB1 ALA 180 -4.307 0.532 -3.337 75 HB2 ALA 180 HB2 ALA 180 -5.266 1.970 -2.990 76 HB3 ALA 180 HB3 ALA 180 -3.944 1.511 -1.917 77 H LYS 181 HN LYS 181 -3.083 4.435 -5.154 78 HA LYS 181 HA LYS 181 -2.626 6.211 -2.864 79 HB2 LYS 181 HB2 LYS 181 -2.054 6.668 -5.801 80 HB3 LYS 181 HB1 LYS 181 -1.562 7.705 -4.472 81 HG2 LYS 181 HG2 LYS 181 -0.010 6.074 -3.673 82 HG3 LYS 181 HG1 LYS 181 -0.619 4.854 -4.797 83 HD2 LYS 181 HD2 LYS 181 0.740 7.433 -5.583 84 HD3 LYS 181 HD1 LYS 181 1.498 5.837 -5.561 85 HE2 LYS 181 HE2 LYS 181 -0.134 5.050 -7.212 86 HE3 LYS 181 HE1 LYS 181 -0.873 6.650 -7.241 87 HZ1 LYS 181 HZ1 LYS 181 1.912 6.001 -8.050 88 HZ2 LYS 181 HZ2 LYS 181 1.226 7.553 -8.057 89 HZ3 LYS 181 HZ3 LYS 181 0.626 6.354 -9.098 90 H THR 182 HN THR 182 -4.397 7.291 -2.227 91 HA THR 182 HA THR 182 -6.269 8.213 -4.304 92 HB THR 182 HB THR 182 -7.952 8.433 -2.510 93 HG1 THR 182 HG1 THR 182 -6.049 7.096 -0.858 94 HG21 THR 182 HG21 THR 182 -6.700 5.689 -2.655 95 HG22 THR 182 HG22 THR 182 -7.861 6.360 -3.800 96 HG23 THR 182 HG23 THR 182 -8.348 6.043 -2.135 97 H SER 183 HN SER 183 -6.787 10.359 -4.443 98 HA SER 183 HA SER 183 -4.914 12.224 -3.361 99 HB2 SER 183 HB2 SER 183 -6.044 12.409 -5.621 100 HB3 SER 183 HB1 SER 183 -7.516 12.869 -4.767 101 HG SER 183 HG SER 183 -5.241 14.284 -4.055 102 H SER 184 HN SER 184 -7.822 10.878 -2.280 103 HA SER 184 HA SER 184 -8.818 12.913 -0.620 104 HB2 SER 184 HB2 SER 184 -8.976 9.921 -0.195 105 HB3 SER 184 HB1 SER 184 -10.048 11.139 0.500 106 HG SER 184 HG SER 184 -10.841 10.030 -1.443 107 H GLY 185 HN GLY 185 -5.966 11.083 -0.418 108 HA2 GLY 185 HA2 GLY 185 -4.267 11.826 1.118 109 HA3 GLY 185 HA1 GLY 185 -5.531 12.124 2.301 110 H GLN 186 HN GLN 186 -5.440 9.207 0.374 111 HA GLN 186 HA GLN 186 -4.490 7.738 2.738 112 HB2 GLN 186 HB2 GLN 186 -6.780 6.946 0.928 113 HB3 GLN 186 HB1 GLN 186 -6.095 5.926 2.184 114 HG2 GLN 186 HG2 GLN 186 -6.797 7.507 3.883 115 HG3 GLN 186 HG1 GLN 186 -7.428 8.587 2.640 116 HE21 GLN 186 HE21 GLN 186 -8.468 6.392 1.020 117 HE22 GLN 186 HE22 GLN 186 -9.877 5.824 1.836 118 H ARG 187 HN ARG 187 -2.510 7.111 2.089 119 HA ARG 187 HA ARG 187 -2.375 5.629 -0.442 120 HB2 ARG 187 HB2 ARG 187 0.158 5.900 -0.151 121 HB3 ARG 187 HB1 ARG 187 -0.762 7.312 -0.643 122 HG2 ARG 187 HG2 ARG 187 -0.705 8.164 1.638 123 HG3 ARG 187 HG1 ARG 187 0.180 6.729 2.157 124 HD2 ARG 187 HD2 ARG 187 1.208 8.529 -0.018 125 HD3 ARG 187 HD1 ARG 187 1.526 8.856 1.684 126 HE ARG 187 HE ARG 187 2.425 6.397 1.565 127 HH11 ARG 187 HH11 ARG 187 2.740 8.850 -0.919 128 HH12 ARG 187 HH12 ARG 187 4.331 8.338 -1.403 129 HH21 ARG 187 HH21 ARG 187 4.544 5.732 0.946 130 HH22 ARG 187 HH22 ARG 187 5.353 6.568 -0.342 131 H TYR 188 HN TYR 188 -3.140 3.695 0.328 132 HA TYR 188 HA TYR 188 -1.634 2.445 2.507 133 HB2 TYR 188 HB2 TYR 188 -3.594 0.846 2.604 134 HB3 TYR 188 HB1 TYR 188 -3.965 2.505 3.050 135 HD1 TYR 188 HD2 TYR 188 -5.364 3.900 1.604 136 HD2 TYR 188 HD1 TYR 188 -4.524 -0.151 0.610 137 HE1 TYR 188 HE2 TYR 188 -7.173 3.939 -0.051 138 HE2 TYR 188 HE1 TYR 188 -6.344 -0.129 -1.040 139 HH TYR 188 HH TYR 188 -8.196 2.834 -1.695 140 H PHE 189 HN PHE 189 -0.665 0.481 2.205 141 HA PHE 189 HA PHE 189 -0.314 -0.229 -0.625 142 HB2 PHE 189 HB2 PHE 189 1.576 -0.663 1.701 143 HB3 PHE 189 HB1 PHE 189 1.882 -1.093 0.016 144 HD1 PHE 189 HD2 PHE 189 1.035 1.164 -1.495 145 HD2 PHE 189 HD1 PHE 189 2.995 1.071 2.282 146 HE1 PHE 189 HE2 PHE 189 1.952 3.401 -1.929 147 HE2 PHE 189 HE1 PHE 189 3.902 3.317 1.868 148 HZ PHE 189 HZ PHE 189 3.383 4.487 -0.238 149 H LEU 190 HN LEU 190 -0.688 -2.228 -1.317 150 HA LEU 190 HA LEU 190 -1.608 -4.235 0.589 151 HB2 LEU 190 HB2 LEU 190 -1.786 -3.868 -2.350 152 HB3 LEU 190 HB1 LEU 190 -1.783 -5.507 -1.753 153 HG LEU 190 HG LEU 190 -3.858 -3.394 -1.483 154 HD11 LEU 190 HD11 LEU 190 -4.777 -4.803 -2.934 155 HD12 LEU 190 HD12 LEU 190 -4.899 -5.990 -1.622 156 HD13 LEU 190 HD13 LEU 190 -3.489 -5.981 -2.682 157 HD21 LEU 190 HD21 LEU 190 -3.377 -3.993 0.843 158 HD22 LEU 190 HD22 LEU 190 -3.538 -5.703 0.440 159 HD23 LEU 190 HD23 LEU 190 -4.938 -4.637 0.331 160 H ASN 191 HN ASN 191 -0.340 -6.038 1.146 161 HA ASN 191 HA ASN 191 2.083 -6.506 -0.408 162 HB2 ASN 191 HB2 ASN 191 0.923 -7.831 2.044 163 HB3 ASN 191 HB1 ASN 191 2.247 -8.562 1.145 164 HD21 ASN 191 HD21 ASN 191 1.280 -5.949 3.206 165 HD22 ASN 191 HD22 ASN 191 2.870 -5.376 3.567 166 H HIS 192 HN HIS 192 1.871 -7.509 -2.286 167 HA HIS 192 HA HIS 192 -0.520 -8.943 -2.968 168 HB2 HIS 192 HB2 HIS 192 1.885 -8.014 -4.384 169 HB3 HIS 192 HB1 HIS 192 1.225 -9.524 -5.000 170 HD1 HIS 192 HD1 HIS 192 -1.568 -9.301 -5.381 171 HD2 HIS 192 HD2 HIS 192 0.788 -5.875 -5.602 172 HE1 HIS 192 HE1 HIS 192 -2.920 -7.624 -6.686 173 HE2 HIS 192 HE2 HIS 192 -1.432 -5.600 -6.914 174 H ILE 193 HN ILE 193 2.134 -9.824 -1.254 175 HA ILE 193 HA ILE 193 2.353 -12.546 -2.253 176 HB ILE 193 HB ILE 193 3.639 -12.062 0.305 177 HG12 ILE 193 HG12 ILE 193 4.894 -10.412 -1.840 178 HG13 ILE 193 HG11 ILE 193 3.536 -9.718 -0.958 179 HG21 ILE 193 HG21 ILE 193 4.225 -13.875 -1.191 180 HG22 ILE 193 HG22 ILE 193 5.618 -12.826 -0.921 181 HG23 ILE 193 HG23 ILE 193 4.711 -12.720 -2.431 182 HD11 ILE 193 HD11 ILE 193 4.681 -9.667 1.032 183 HD12 ILE 193 HD12 ILE 193 5.962 -9.316 -0.131 184 HD13 ILE 193 HD13 ILE 193 5.798 -10.937 0.548 185 H ASP 194 HN ASP 194 1.946 -11.141 0.960 186 HA ASP 194 HA ASP 194 0.692 -13.543 1.938 187 HB2 ASP 194 HB2 ASP 194 2.390 -12.192 3.222 188 HB3 ASP 194 HB1 ASP 194 1.164 -10.937 3.397 189 H GLN 195 HN GLN 195 -0.353 -10.689 0.506 190 HA GLN 195 HA GLN 195 -2.328 -9.606 0.242 191 HB2 GLN 195 HB2 GLN 195 -3.240 -11.844 -0.263 192 HB3 GLN 195 HB1 GLN 195 -3.543 -12.109 1.447 193 HG2 GLN 195 HG2 GLN 195 -5.613 -11.514 0.559 194 HG3 GLN 195 HG1 GLN 195 -5.029 -10.053 1.349 195 HE21 GLN 195 HE21 GLN 195 -3.116 -9.561 -0.896 196 HE22 GLN 195 HE22 GLN 195 -4.089 -8.936 -2.183 197 H THR 196 HN THR 196 -1.390 -8.201 1.848 198 HA THR 196 HA THR 196 -3.056 -8.163 4.280 199 HB THR 196 HB THR 196 -0.973 -7.026 5.366 200 HG1 THR 196 HG1 THR 196 0.875 -8.444 4.373 201 HG21 THR 196 HG21 THR 196 -1.075 -10.003 4.893 202 HG22 THR 196 HG22 THR 196 -1.955 -9.122 6.141 203 HG23 THR 196 HG23 THR 196 -0.192 -9.194 6.187 204 H THR 197 HN THR 197 -3.745 -6.232 5.006 205 HA THR 197 HA THR 197 -3.586 -3.993 3.165 206 HB THR 197 HB THR 197 -5.292 -3.037 4.835 207 HG1 THR 197 HG1 THR 197 -4.764 -4.462 6.565 208 HG21 THR 197 HG21 THR 197 -7.114 -4.423 3.949 209 HG22 THR 197 HG22 THR 197 -5.936 -5.615 3.401 210 HG23 THR 197 HG23 THR 197 -5.955 -4.002 2.689 211 H THR 198 HN THR 198 -2.027 -2.507 3.429 212 HA THR 198 HA THR 198 -0.832 -2.219 6.105 213 HB THR 198 HB THR 198 0.494 -1.707 3.440 214 HG1 THR 198 HG1 THR 198 0.006 -3.915 3.670 215 HG21 THR 198 HG21 THR 198 2.566 -1.764 4.718 216 HG22 THR 198 HG22 THR 198 1.661 -2.053 6.200 217 HG23 THR 198 HG23 THR 198 1.490 -0.519 5.352 218 H TRP 199 HN TRP 199 -0.947 -0.216 7.051 219 HA TRP 199 HA TRP 199 -1.620 2.082 5.344 220 HB2 TRP 199 HB2 TRP 199 -2.080 1.503 8.253 221 HB3 TRP 199 HB1 TRP 199 -2.061 3.163 7.670 222 HD1 TRP 199 HD1 TRP 199 -4.329 0.251 8.072 223 HE1 TRP 199 HE1 TRP 199 -6.605 0.739 6.970 224 HE3 TRP 199 HE3 TRP 199 -3.044 4.412 5.398 225 HZ2 TRP 199 HZ2 TRP 199 -7.697 2.641 5.181 226 HZ3 TRP 199 HZ3 TRP 199 -4.757 5.504 4.016 227 HH2 TRP 199 HH2 TRP 199 -7.036 4.636 3.908 228 H GLN 200 HN GLN 200 0.881 0.655 7.106 229 HA GLN 200 HA GLN 200 2.285 3.154 7.627 230 HB2 GLN 200 HB2 GLN 200 3.018 0.277 8.199 231 HB3 GLN 200 HB1 GLN 200 4.016 1.659 8.627 232 HG2 GLN 200 HG2 GLN 200 2.243 2.486 10.089 233 HG3 GLN 200 HG1 GLN 200 1.243 1.100 9.655 234 HE21 GLN 200 HE21 GLN 200 4.686 0.856 10.066 235 HE22 GLN 200 HE22 GLN 200 4.654 -0.073 11.524 236 H ASP 201 HN ASP 201 3.794 3.972 6.304 237 HA ASP 201 HA ASP 201 4.441 2.691 3.840 238 HB2 ASP 201 HB2 ASP 201 4.411 5.147 4.062 239 HB3 ASP 201 HB1 ASP 201 5.778 5.061 5.170 240 HA PRO 202 HA PRO 202 7.375 -0.076 5.618 241 HB2 PRO 202 HB2 PRO 202 8.442 -0.947 3.213 242 HB3 PRO 202 HB1 PRO 202 7.018 -1.617 4.010 243 HG2 PRO 202 HG2 PRO 202 7.199 0.227 1.700 244 HG3 PRO 202 HG1 PRO 202 5.958 -0.969 2.095 245 HD2 PRO 202 HD2 PRO 202 5.643 1.737 2.420 246 HD3 PRO 202 HD1 PRO 202 4.749 0.510 3.336 247 H ARG 203 HN ARG 203 8.202 2.661 3.709 248 HA ARG 203 HA ARG 203 11.067 2.142 3.977 249 HB2 ARG 203 HB2 ARG 203 9.903 4.642 2.781 250 HB3 ARG 203 HB1 ARG 203 11.456 3.890 2.458 251 HG2 ARG 203 HG2 ARG 203 8.743 3.061 1.488 252 HG3 ARG 203 HG1 ARG 203 10.157 3.523 0.543 253 HD2 ARG 203 HD2 ARG 203 9.864 1.026 2.209 254 HD3 ARG 203 HD1 ARG 203 9.763 1.113 0.454 255 HE ARG 203 HE ARG 203 12.245 2.131 1.452 256 HH11 ARG 203 HH11 ARG 203 10.526 -0.795 0.613 257 HH12 ARG 203 HH12 ARG 203 11.967 -1.726 0.349 258 HH21 ARG 203 HH21 ARG 203 14.145 0.900 1.151 259 HH22 ARG 203 HH22 ARG 203 14.020 -0.781 0.710 260 H LYS 204 HN LYS 204 8.548 3.698 5.604 261 HA LYS 204 HA LYS 204 10.227 5.702 6.864 262 HB2 LYS 204 HB2 LYS 204 7.914 6.277 6.354 263 HB3 LYS 204 HB1 LYS 204 7.337 4.932 7.329 264 HG2 LYS 204 HG2 LYS 204 7.051 6.962 8.561 265 HG3 LYS 204 HG1 LYS 204 8.332 6.021 9.325 266 HD2 LYS 204 HD2 LYS 204 9.033 8.311 9.250 267 HD3 LYS 204 HD1 LYS 204 9.991 7.409 8.076 268 HE2 LYS 204 HE2 LYS 204 9.254 9.557 7.170 269 HE3 LYS 204 HE1 LYS 204 8.555 8.206 6.275 270 HZ1 LYS 204 HZ1 LYS 204 6.973 10.026 6.788 271 HZ2 LYS 204 HZ2 LYS 204 7.133 9.662 8.439 272 HZ3 LYS 204 HZ3 LYS 204 6.483 8.517 7.375 273 H ALA 205 HN ALA 205 9.101 2.495 7.483 274 HA ALA 205 HA ALA 205 9.727 2.664 10.324 275 HB1 ALA 205 HB1 ALA 205 8.803 0.415 10.471 276 HB2 ALA 205 HB2 ALA 205 8.656 0.344 8.715 277 HB3 ALA 205 HB3 ALA 205 7.684 1.493 9.636 278 H1 SER 201 HT1 SER 201 -1.387 -3.918 -9.404 279 H2 SER 201 HT2 SER 201 -0.202 -4.365 -10.527 280 H3 SER 201 HT3 SER 201 -1.435 -5.454 -10.123 281 HA SER 201 HA SER 201 -1.742 -2.894 -11.571 282 HB2 SER 201 HB2 SER 201 -2.676 -4.668 -13.291 283 HB3 SER 201 HB1 SER 201 -0.945 -4.358 -13.176 284 HG SER 201 HG SER 201 -2.423 -6.533 -12.083 285 H TPO 202 HN TPO 202 -3.107 -4.655 -9.202 286 HA TPO 202 HA TPO 202 -5.843 -4.317 -10.225 287 HB TPO 202 HB TPO 202 -4.912 -6.128 -7.987 288 HG21 TPO 202 HG21 TPO 202 -7.273 -5.466 -7.846 289 HG22 TPO 202 HG22 TPO 202 -7.116 -7.172 -8.260 290 HG23 TPO 202 HG23 TPO 202 -7.524 -5.997 -9.509 291 H TYR 203 HN TYR 203 -7.072 -2.819 -9.279 292 HA TYR 203 HA TYR 203 -5.947 -1.297 -7.095 293 HB2 TYR 203 HB2 TYR 203 -7.154 -0.328 -9.145 294 HB3 TYR 203 HB1 TYR 203 -8.645 -0.853 -8.369 295 HD1 TYR 203 HD2 TYR 203 -5.704 1.347 -8.005 296 HD2 TYR 203 HD1 TYR 203 -9.600 0.399 -6.586 297 HE1 TYR 203 HE2 TYR 203 -5.720 3.418 -6.691 298 HE2 TYR 203 HE1 TYR 203 -9.626 2.474 -5.263 299 HH TYR 203 HH TYR 203 -7.956 4.043 -4.263 300 HA PRO 204 HA PRO 204 -8.376 -3.707 -4.213 301 HB2 PRO 204 HB2 PRO 204 -7.176 -2.851 -1.976 302 HB3 PRO 204 HB1 PRO 204 -6.361 -3.948 -3.098 303 HG2 PRO 204 HG2 PRO 204 -6.028 -1.001 -2.747 304 HG3 PRO 204 HG1 PRO 204 -4.799 -2.242 -3.051 305 HD2 PRO 204 HD2 PRO 204 -5.882 -0.584 -4.982 306 HD3 PRO 204 HD1 PRO 204 -5.099 -2.141 -5.306 307 H HIS 205 HN HIS 205 -8.596 -2.401 -1.588 308 HA HIS 205 HA HIS 205 -10.188 -0.023 -2.061 309 HB2 HIS 205 HB2 HIS 205 -11.799 -1.843 -2.419 310 HB3 HIS 205 HB1 HIS 205 -11.367 -2.547 -0.865 311 HD1 HIS 205 HD1 HIS 205 -12.120 1.125 -1.500 312 HD2 HIS 205 HD2 HIS 205 -13.696 -2.173 0.483 313 HE1 HIS 205 HE1 HIS 205 -14.080 1.991 -0.195 314 HE2 HIS 205 HE2 HIS 205 -14.806 0.039 1.225 315 H SEP 206 HN SEP 206 -10.167 1.319 -0.338 316 HA SEP 206 HA SEP 206 -8.174 1.096 1.550 317 HB2 SEP 206 HB2 SEP 206 -9.717 2.908 2.753 318 HB3 SEP 206 HB1 SEP 206 -8.814 3.266 1.286 319 HA PRO 207 HA PRO 207 -9.594 -2.000 4.252 320 HB2 PRO 207 HB2 PRO 207 -7.652 -0.943 6.188 321 HB3 PRO 207 HB1 PRO 207 -7.689 -2.508 5.373 322 HG2 PRO 207 HG2 PRO 207 -5.883 -0.596 4.760 323 HG3 PRO 207 HG1 PRO 207 -6.504 -1.737 3.556 324 HD2 PRO 207 HD2 PRO 207 -7.221 1.122 4.013 325 HD3 PRO 207 HD1 PRO 207 -7.067 0.224 2.489 326 H THR 208 HN THR 208 -9.795 1.328 5.049 327 HA THR 208 HA THR 208 -11.078 0.757 7.616 328 HB THR 208 HB THR 208 -9.340 2.486 7.641 329 HG1 THR 208 HG1 THR 208 -11.976 3.514 8.023 330 HG21 THR 208 HG21 THR 208 -9.694 4.637 6.508 331 HG22 THR 208 HG22 THR 208 -11.151 3.996 5.749 332 HG23 THR 208 HG23 THR 208 -9.576 3.311 5.349 333 H SER 209 HN SER 209 -12.165 0.577 4.677 334 HA SER 209 HA SER 209 -14.809 1.496 5.421 335 HB2 SER 209 HB2 SER 209 -13.444 2.511 2.914 336 HB3 SER 209 HB1 SER 209 -15.136 2.779 3.337 337 HG SER 209 HG SER 209 -13.748 3.528 5.425 Start of MODEL 13 1 H ASP 170 H ASP 170 14.569 -0.526 -6.847 2 HA ASP 170 HA ASP 170 13.412 -1.812 -5.229 3 HB2 ASP 170 HB2 ASP 170 15.429 -2.787 -4.009 4 HB3 ASP 170 HB1 ASP 170 15.521 -2.735 -5.764 5 H VAL 171 HN VAL 171 15.561 0.514 -3.556 6 HA VAL 171 HA VAL 171 14.159 0.144 -1.070 7 HB VAL 171 HB VAL 171 16.235 2.195 -1.842 8 HG11 VAL 171 HG11 VAL 171 14.856 3.013 -0.004 9 HG12 VAL 171 HG12 VAL 171 16.473 2.598 0.564 10 HG13 VAL 171 HG13 VAL 171 15.122 1.509 0.878 11 HG21 VAL 171 HG21 VAL 171 17.744 0.784 -0.515 12 HG22 VAL 171 HG22 VAL 171 17.066 -0.089 -1.889 13 HG23 VAL 171 HG23 VAL 171 16.431 -0.369 -0.268 14 HA PRO 172 HA PRO 172 12.525 4.644 -2.013 15 HB2 PRO 172 HB2 PRO 172 12.331 5.262 -4.683 16 HB3 PRO 172 HB1 PRO 172 13.653 5.781 -3.633 17 HG2 PRO 172 HG2 PRO 172 13.542 3.490 -5.548 18 HG3 PRO 172 HG1 PRO 172 14.864 4.630 -5.242 19 HD2 PRO 172 HD2 PRO 172 14.883 2.149 -4.223 20 HD3 PRO 172 HD1 PRO 172 15.534 3.531 -3.316 21 H LEU 173 HN LEU 173 11.953 1.874 -4.000 22 HA LEU 173 HA LEU 173 9.130 2.048 -3.408 23 HB2 LEU 173 HB2 LEU 173 9.692 3.151 -5.714 24 HB3 LEU 173 HB1 LEU 173 9.885 1.500 -6.261 25 HG LEU 173 HG LEU 173 7.650 2.498 -6.751 26 HD11 LEU 173 HD11 LEU 173 7.619 0.097 -4.931 27 HD12 LEU 173 HD12 LEU 173 7.920 0.082 -6.669 28 HD13 LEU 173 HD13 LEU 173 6.339 0.563 -6.051 29 HD21 LEU 173 HD21 LEU 173 7.385 3.836 -4.742 30 HD22 LEU 173 HD22 LEU 173 7.328 2.376 -3.754 31 HD23 LEU 173 HD23 LEU 173 6.037 2.710 -4.908 32 HA PRO 174 HA PRO 174 10.512 -2.247 -2.860 33 HB2 PRO 174 HB2 PRO 174 7.978 -2.439 -1.367 34 HB3 PRO 174 HB1 PRO 174 9.628 -2.760 -0.828 35 HG2 PRO 174 HG2 PRO 174 8.236 -0.617 0.016 36 HG3 PRO 174 HG1 PRO 174 9.996 -0.577 -0.210 37 HD2 PRO 174 HD2 PRO 174 7.831 0.477 -1.991 38 HD3 PRO 174 HD1 PRO 174 9.399 1.198 -1.567 39 H ALA 175 HN ALA 175 9.983 -3.955 -4.146 40 HA ALA 175 HA ALA 175 7.979 -3.302 -6.156 41 HB1 ALA 175 HB1 ALA 175 10.092 -5.447 -6.179 42 HB2 ALA 175 HB2 ALA 175 10.265 -3.824 -6.848 43 HB3 ALA 175 HB3 ALA 175 9.096 -4.946 -7.545 44 H GLY 176 HN GLY 176 7.902 -5.129 -3.404 45 HA2 GLY 176 HA2 GLY 176 6.043 -7.095 -4.573 46 HA3 GLY 176 HA1 GLY 176 6.730 -7.183 -2.952 47 H TRP 177 HN TRP 177 5.784 -4.075 -3.804 48 HA TRP 177 HA TRP 177 3.390 -4.329 -2.111 49 HB2 TRP 177 HB2 TRP 177 5.324 -2.000 -2.257 50 HB3 TRP 177 HB1 TRP 177 3.920 -2.121 -1.202 51 HD1 TRP 177 HD1 TRP 177 7.079 -4.317 -1.802 52 HE1 TRP 177 HE1 TRP 177 8.015 -5.015 0.486 53 HE3 TRP 177 HE3 TRP 177 3.611 -2.069 1.204 54 HZ2 TRP 177 HZ2 TRP 177 7.362 -4.666 3.201 55 HZ3 TRP 177 HZ3 TRP 177 3.841 -2.300 3.640 56 HH2 TRP 177 HH2 TRP 177 5.683 -3.573 4.609 57 H GLU 178 HN GLU 178 1.582 -3.310 -2.735 58 HA GLU 178 HA GLU 178 1.523 -2.242 -5.459 59 HB2 GLU 178 HB2 GLU 178 -0.028 -4.054 -4.909 60 HB3 GLU 178 HB1 GLU 178 -0.687 -3.117 -3.575 61 HG2 GLU 178 HG2 GLU 178 -1.631 -1.520 -5.095 62 HG3 GLU 178 HG1 GLU 178 -0.833 -2.292 -6.466 63 H MET 179 HN MET 179 1.025 -0.137 -5.919 64 HA MET 179 HA MET 179 0.738 1.695 -3.668 65 HB2 MET 179 HB2 MET 179 0.832 2.355 -6.615 66 HB3 MET 179 HB1 MET 179 0.909 3.499 -5.287 67 HG2 MET 179 HG2 MET 179 2.988 1.394 -5.782 68 HG3 MET 179 HG1 MET 179 3.038 3.028 -6.440 69 HE1 MET 179 HE1 MET 179 3.529 5.168 -5.120 70 HE2 MET 179 HE2 MET 179 3.512 5.278 -3.360 71 HE3 MET 179 HE3 MET 179 2.024 4.913 -4.238 72 H ALA 180 HN ALA 180 -1.353 1.273 -2.947 73 HA ALA 180 HA ALA 180 -3.504 1.780 -4.851 74 HB1 ALA 180 HB1 ALA 180 -5.003 1.069 -3.063 75 HB2 ALA 180 HB2 ALA 180 -3.631 0.922 -1.966 76 HB3 ALA 180 HB3 ALA 180 -3.752 -0.136 -3.370 77 H LYS 181 HN LYS 181 -3.288 3.916 -5.238 78 HA LYS 181 HA LYS 181 -3.354 5.766 -2.963 79 HB2 LYS 181 HB2 LYS 181 -2.732 6.361 -5.864 80 HB3 LYS 181 HB1 LYS 181 -2.522 7.448 -4.501 81 HG2 LYS 181 HG2 LYS 181 -0.784 5.929 -3.602 82 HG3 LYS 181 HG1 LYS 181 -0.943 4.922 -5.049 83 HD2 LYS 181 HD2 LYS 181 -0.095 7.819 -4.947 84 HD3 LYS 181 HD1 LYS 181 0.929 6.428 -5.311 85 HE2 LYS 181 HE2 LYS 181 -0.463 5.963 -7.294 86 HE3 LYS 181 HE1 LYS 181 -1.409 7.409 -6.944 87 HZ1 LYS 181 HZ1 LYS 181 1.487 7.324 -7.593 88 HZ2 LYS 181 HZ2 LYS 181 0.620 8.727 -7.197 89 HZ3 LYS 181 HZ3 LYS 181 0.247 7.874 -8.612 90 H THR 182 HN THR 182 -5.301 6.597 -2.472 91 HA THR 182 HA THR 182 -7.277 6.844 -4.637 92 HB THR 182 HB THR 182 -8.982 6.992 -2.830 93 HG1 THR 182 HG1 THR 182 -7.918 5.988 -0.752 94 HG21 THR 182 HG21 THR 182 -8.544 4.850 -3.908 95 HG22 THR 182 HG22 THR 182 -8.911 4.617 -2.200 96 HG23 THR 182 HG23 THR 182 -7.243 4.523 -2.763 97 H SER 183 HN SER 183 -8.311 8.758 -5.029 98 HA SER 183 HA SER 183 -6.888 11.128 -4.379 99 HB2 SER 183 HB2 SER 183 -8.810 12.246 -5.611 100 HB3 SER 183 HB1 SER 183 -7.905 11.040 -6.523 101 HG SER 183 HG SER 183 -10.526 11.005 -5.626 102 H SER 184 HN SER 184 -9.382 9.413 -2.829 103 HA SER 184 HA SER 184 -10.641 11.473 -1.393 104 HB2 SER 184 HB2 SER 184 -11.548 9.210 -1.420 105 HB3 SER 184 HB1 SER 184 -10.116 8.597 -0.594 106 HG SER 184 HG SER 184 -10.713 9.679 1.250 107 H GLY 185 HN GLY 185 -7.449 10.288 -1.253 108 HA2 GLY 185 HA2 GLY 185 -5.837 11.707 -0.137 109 HA3 GLY 185 HA1 GLY 185 -7.008 11.931 1.153 110 H GLN 186 HN GLN 186 -6.488 8.747 -0.192 111 HA GLN 186 HA GLN 186 -4.960 8.069 2.224 112 HB2 GLN 186 HB2 GLN 186 -7.195 6.456 0.982 113 HB3 GLN 186 HB1 GLN 186 -6.158 5.892 2.283 114 HG2 GLN 186 HG2 GLN 186 -7.815 6.640 3.584 115 HG3 GLN 186 HG1 GLN 186 -7.026 8.195 3.355 116 HE21 GLN 186 HE21 GLN 186 -8.937 6.422 0.956 117 HE22 GLN 186 HE22 GLN 186 -10.199 7.605 0.858 118 H ARG 187 HN ARG 187 -3.142 6.996 1.892 119 HA ARG 187 HA ARG 187 -2.827 5.554 -0.647 120 HB2 ARG 187 HB2 ARG 187 -0.413 6.112 -0.583 121 HB3 ARG 187 HB1 ARG 187 -1.436 7.529 -0.750 122 HG2 ARG 187 HG2 ARG 187 -1.156 7.998 1.643 123 HG3 ARG 187 HG1 ARG 187 -0.098 6.594 1.783 124 HD2 ARG 187 HD2 ARG 187 0.389 9.032 0.075 125 HD3 ARG 187 HD1 ARG 187 1.197 8.649 1.594 126 HE ARG 187 HE ARG 187 1.574 6.516 -0.183 127 HH11 ARG 187 HH11 ARG 187 2.525 9.849 0.251 128 HH12 ARG 187 HH12 ARG 187 4.017 9.677 -0.623 129 HH21 ARG 187 HH21 ARG 187 3.561 6.277 -1.338 130 HH22 ARG 187 HH22 ARG 187 4.607 7.651 -1.529 131 H TYR 188 HN TYR 188 -2.984 3.418 -0.095 132 HA TYR 188 HA TYR 188 -1.444 2.556 2.255 133 HB2 TYR 188 HB2 TYR 188 -3.087 0.779 2.624 134 HB3 TYR 188 HB1 TYR 188 -3.847 2.362 2.693 135 HD1 TYR 188 HD2 TYR 188 -5.171 3.148 0.670 136 HD2 TYR 188 HD1 TYR 188 -3.856 -0.874 1.141 137 HE1 TYR 188 HE2 TYR 188 -6.851 2.412 -0.964 138 HE2 TYR 188 HE1 TYR 188 -5.535 -1.619 -0.492 139 HH TYR 188 HH TYR 188 -7.270 0.571 -2.467 140 H PHE 189 HN PHE 189 -0.251 0.671 2.070 141 HA PHE 189 HA PHE 189 0.196 -0.120 -0.721 142 HB2 PHE 189 HB2 PHE 189 2.055 -0.366 1.653 143 HB3 PHE 189 HB1 PHE 189 2.428 -0.836 -0.002 144 HD1 PHE 189 HD2 PHE 189 1.286 1.420 -1.497 145 HD2 PHE 189 HD1 PHE 189 3.570 1.359 2.092 146 HE1 PHE 189 HE2 PHE 189 2.092 3.691 -1.989 147 HE2 PHE 189 HE1 PHE 189 4.373 3.639 1.622 148 HZ PHE 189 HZ PHE 189 3.635 4.805 -0.422 149 H LEU 190 HN LEU 190 -0.277 -2.091 -1.354 150 HA LEU 190 HA LEU 190 -1.064 -4.095 0.587 151 HB2 LEU 190 HB2 LEU 190 -1.281 -3.802 -2.353 152 HB3 LEU 190 HB1 LEU 190 -1.221 -5.428 -1.722 153 HG LEU 190 HG LEU 190 -3.340 -3.344 -1.369 154 HD11 LEU 190 HD11 LEU 190 -4.083 -4.658 -3.039 155 HD12 LEU 190 HD12 LEU 190 -4.506 -5.777 -1.733 156 HD13 LEU 190 HD13 LEU 190 -2.993 -5.978 -2.618 157 HD21 LEU 190 HD21 LEU 190 -2.935 -5.780 0.373 158 HD22 LEU 190 HD22 LEU 190 -4.384 -4.777 0.337 159 HD23 LEU 190 HD23 LEU 190 -2.858 -4.099 0.897 160 H ASN 191 HN ASN 191 0.225 -5.865 1.168 161 HA ASN 191 HA ASN 191 2.692 -6.284 -0.316 162 HB2 ASN 191 HB2 ASN 191 1.496 -7.609 2.126 163 HB3 ASN 191 HB1 ASN 191 2.908 -8.266 1.300 164 HD21 ASN 191 HD21 ASN 191 1.677 -5.623 3.213 165 HD22 ASN 191 HD22 ASN 191 3.215 -4.975 3.650 166 H HIS 192 HN HIS 192 2.384 -7.223 -2.248 167 HA HIS 192 HA HIS 192 0.093 -8.829 -2.817 168 HB2 HIS 192 HB2 HIS 192 2.436 -7.863 -4.327 169 HB3 HIS 192 HB1 HIS 192 1.767 -9.393 -4.887 170 HD1 HIS 192 HD1 HIS 192 -0.851 -9.330 -5.521 171 HD2 HIS 192 HD2 HIS 192 1.061 -5.649 -5.157 172 HE1 HIS 192 HE1 HIS 192 -2.365 -7.661 -6.638 173 HE2 HIS 192 HE2 HIS 192 -1.273 -5.420 -6.277 174 H ILE 193 HN ILE 193 2.894 -9.507 -1.203 175 HA ILE 193 HA ILE 193 3.068 -12.286 -2.015 176 HB ILE 193 HB ILE 193 4.556 -11.500 0.389 177 HG12 ILE 193 HG12 ILE 193 6.201 -10.313 -1.464 178 HG13 ILE 193 HG11 ILE 193 4.613 -9.774 -1.997 179 HG21 ILE 193 HG21 ILE 193 6.403 -12.544 -0.830 180 HG22 ILE 193 HG22 ILE 193 5.388 -12.660 -2.266 181 HG23 ILE 193 HG23 ILE 193 4.969 -13.570 -0.814 182 HD11 ILE 193 HD11 ILE 193 4.165 -8.863 0.208 183 HD12 ILE 193 HD12 ILE 193 5.631 -8.175 -0.490 184 HD13 ILE 193 HD13 ILE 193 5.750 -9.412 0.760 185 H ASP 194 HN ASP 194 2.039 -10.332 0.733 186 HA ASP 194 HA ASP 194 1.323 -12.757 2.196 187 HB2 ASP 194 HB2 ASP 194 2.674 -10.611 3.100 188 HB3 ASP 194 HB1 ASP 194 1.035 -10.104 3.522 189 H GLN 195 HN GLN 195 -0.133 -10.386 0.273 190 HA GLN 195 HA GLN 195 -2.299 -9.761 -0.176 191 HB2 GLN 195 HB2 GLN 195 -2.678 -12.266 -0.064 192 HB3 GLN 195 HB1 GLN 195 -3.098 -12.072 1.628 193 HG2 GLN 195 HG2 GLN 195 -4.948 -10.564 0.938 194 HG3 GLN 195 HG1 GLN 195 -4.563 -10.936 -0.742 195 HE21 GLN 195 HE21 GLN 195 -4.991 -12.994 -1.546 196 HE22 GLN 195 HE22 GLN 195 -6.043 -14.102 -0.723 197 H THR 196 HN THR 196 -0.731 -8.788 1.968 198 HA THR 196 HA THR 196 -2.597 -8.415 4.191 199 HB THR 196 HB THR 196 0.385 -8.550 3.968 200 HG1 THR 196 HG1 THR 196 0.102 -10.277 5.276 201 HG21 THR 196 HG21 THR 196 0.687 -7.860 6.213 202 HG22 THR 196 HG22 THR 196 -1.046 -7.625 6.452 203 HG23 THR 196 HG23 THR 196 -0.149 -6.557 5.367 204 H THR 197 HN THR 197 -3.186 -6.467 4.875 205 HA THR 197 HA THR 197 -2.647 -4.202 3.137 206 HB THR 197 HB THR 197 -4.409 -3.207 4.863 207 HG1 THR 197 HG1 THR 197 -4.324 -5.064 6.230 208 HG21 THR 197 HG21 THR 197 -4.910 -3.449 2.533 209 HG22 THR 197 HG22 THR 197 -6.230 -4.183 3.445 210 HG23 THR 197 HG23 THR 197 -5.007 -5.202 2.683 211 H THR 198 HN THR 198 -1.526 -2.393 3.713 212 HA THR 198 HA THR 198 -0.583 -2.155 6.475 213 HB THR 198 HB THR 198 1.263 -2.068 4.080 214 HG1 THR 198 HG1 THR 198 0.370 -4.135 5.665 215 HG21 THR 198 HG21 THR 198 1.839 -2.034 7.047 216 HG22 THR 198 HG22 THR 198 1.985 -0.657 5.952 217 HG23 THR 198 HG23 THR 198 3.047 -2.054 5.760 218 H TRP 199 HN TRP 199 -0.693 -0.052 7.175 219 HA TRP 199 HA TRP 199 -1.008 2.068 5.169 220 HB2 TRP 199 HB2 TRP 199 -1.582 1.990 8.131 221 HB3 TRP 199 HB1 TRP 199 -1.645 3.469 7.184 222 HD1 TRP 199 HD1 TRP 199 -3.667 0.423 8.070 223 HE1 TRP 199 HE1 TRP 199 -5.980 0.579 6.967 224 HE3 TRP 199 HE3 TRP 199 -2.804 4.373 4.924 225 HZ2 TRP 199 HZ2 TRP 199 -7.257 2.141 5.008 226 HZ3 TRP 199 HZ3 TRP 199 -4.647 5.132 3.467 227 HH2 TRP 199 HH2 TRP 199 -6.817 4.029 3.510 228 H GLN 200 HN GLN 200 1.342 0.730 7.180 229 HA GLN 200 HA GLN 200 2.695 3.251 7.698 230 HB2 GLN 200 HB2 GLN 200 4.248 1.960 9.048 231 HB3 GLN 200 HB1 GLN 200 2.597 1.559 9.489 232 HG2 GLN 200 HG2 GLN 200 2.747 -0.497 8.179 233 HG3 GLN 200 HG1 GLN 200 4.402 -0.090 7.735 234 HE21 GLN 200 HE21 GLN 200 4.925 1.016 10.436 235 HE22 GLN 200 HE22 GLN 200 5.153 -0.373 11.444 236 H ASP 201 HN ASP 201 4.360 4.004 6.581 237 HA ASP 201 HA ASP 201 5.155 2.846 4.134 238 HB2 ASP 201 HB2 ASP 201 5.319 5.208 4.332 239 HB3 ASP 201 HB1 ASP 201 6.303 5.091 5.786 240 HA PRO 202 HA PRO 202 7.804 -0.223 5.884 241 HB2 PRO 202 HB2 PRO 202 8.738 -1.215 3.524 242 HB3 PRO 202 HB1 PRO 202 7.146 -1.595 4.185 243 HG2 PRO 202 HG2 PRO 202 7.896 0.376 2.066 244 HG3 PRO 202 HG1 PRO 202 6.507 -0.726 2.132 245 HD2 PRO 202 HD2 PRO 202 6.312 1.905 2.727 246 HD3 PRO 202 HD1 PRO 202 5.301 0.669 3.503 247 H ARG 203 HN ARG 203 8.844 2.457 4.031 248 HA ARG 203 HA ARG 203 11.620 1.638 3.950 249 HB2 ARG 203 HB2 ARG 203 10.349 4.255 3.149 250 HB3 ARG 203 HB1 ARG 203 11.999 3.754 2.796 251 HG2 ARG 203 HG2 ARG 203 11.268 2.052 1.329 252 HG3 ARG 203 HG1 ARG 203 9.594 2.213 1.869 253 HD2 ARG 203 HD2 ARG 203 11.194 4.265 0.351 254 HD3 ARG 203 HD1 ARG 203 9.889 3.267 -0.291 255 HE ARG 203 HE ARG 203 8.504 4.451 1.535 256 HH11 ARG 203 HH11 ARG 203 11.197 5.927 -0.153 257 HH12 ARG 203 HH12 ARG 203 10.520 7.530 -0.092 258 HH21 ARG 203 HH21 ARG 203 7.622 6.526 1.629 259 HH22 ARG 203 HH22 ARG 203 8.459 7.868 0.904 260 H LYS 204 HN LYS 204 9.572 3.547 5.991 261 HA LYS 204 HA LYS 204 11.925 4.576 7.398 262 HB2 LYS 204 HB2 LYS 204 10.305 5.926 8.716 263 HB3 LYS 204 HB1 LYS 204 10.293 6.278 6.996 264 HG2 LYS 204 HG2 LYS 204 8.265 4.961 6.726 265 HG3 LYS 204 HG1 LYS 204 8.291 4.560 8.446 266 HD2 LYS 204 HD2 LYS 204 6.727 6.393 7.933 267 HD3 LYS 204 HD1 LYS 204 8.011 6.893 9.031 268 HE2 LYS 204 HE2 LYS 204 7.657 8.621 7.392 269 HE3 LYS 204 HE1 LYS 204 9.224 7.870 7.106 270 HZ1 LYS 204 HZ1 LYS 204 6.719 7.335 5.603 271 HZ2 LYS 204 HZ2 LYS 204 8.193 6.536 5.342 272 HZ3 LYS 204 HZ3 LYS 204 8.063 8.203 5.037 273 H ALA 205 HN ALA 205 9.688 2.055 7.532 274 HA ALA 205 HA ALA 205 9.769 1.685 10.389 275 HB1 ALA 205 HB1 ALA 205 8.783 -0.177 8.227 276 HB2 ALA 205 HB2 ALA 205 7.801 1.010 9.088 277 HB3 ALA 205 HB3 ALA 205 8.505 -0.354 9.959 278 H1 SER 201 HT1 SER 201 -3.570 -0.303 -13.081 279 H2 SER 201 HT2 SER 201 -5.005 0.045 -12.253 280 H3 SER 201 HT3 SER 201 -4.905 -1.341 -13.229 281 HA SER 201 HA SER 201 -3.292 -2.317 -11.786 282 HB2 SER 201 HB2 SER 201 -3.677 0.151 -10.070 283 HB3 SER 201 HB1 SER 201 -2.625 -1.220 -9.716 284 HG SER 201 HG SER 201 -1.186 -0.022 -10.709 285 H TPO 202 HN TPO 202 -6.367 -0.958 -11.691 286 HA TPO 202 HA TPO 202 -8.352 -1.721 -10.976 287 HB TPO 202 HB TPO 202 -6.791 -4.245 -10.409 288 HG21 TPO 202 HG21 TPO 202 -8.966 -5.387 -10.434 289 HG22 TPO 202 HG22 TPO 202 -9.784 -3.831 -10.577 290 HG23 TPO 202 HG23 TPO 202 -8.878 -4.220 -9.115 291 H TYR 203 HN TYR 203 -8.768 -0.350 -9.352 292 HA TYR 203 HA TYR 203 -7.639 -0.584 -6.738 293 HB2 TYR 203 HB2 TYR 203 -8.288 1.603 -7.357 294 HB3 TYR 203 HB1 TYR 203 -9.870 1.073 -7.913 295 HD1 TYR 203 HD2 TYR 203 -7.839 1.248 -4.762 296 HD2 TYR 203 HD1 TYR 203 -11.698 1.438 -6.549 297 HE1 TYR 203 HE2 TYR 203 -8.816 1.826 -2.581 298 HE2 TYR 203 HE1 TYR 203 -12.683 2.018 -4.373 299 HH TYR 203 HH TYR 203 -10.915 3.050 -1.741 300 HA PRO 204 HA PRO 204 -10.694 -3.543 -5.230 301 HB2 PRO 204 HB2 PRO 204 -9.463 -4.016 -2.877 302 HB3 PRO 204 HB1 PRO 204 -8.895 -4.737 -4.386 303 HG2 PRO 204 HG2 PRO 204 -7.825 -2.386 -2.886 304 HG3 PRO 204 HG1 PRO 204 -6.948 -3.677 -3.727 305 HD2 PRO 204 HD2 PRO 204 -7.394 -1.170 -4.768 306 HD3 PRO 204 HD1 PRO 204 -7.094 -2.620 -5.745 307 H HIS 205 HN HIS 205 -10.052 -2.874 -2.087 308 HA HIS 205 HA HIS 205 -11.128 -0.191 -1.970 309 HB2 HIS 205 HB2 HIS 205 -13.168 -1.577 -1.838 310 HB3 HIS 205 HB1 HIS 205 -12.482 -2.446 -0.468 311 HD1 HIS 205 HD1 HIS 205 -12.580 1.324 -1.063 312 HD2 HIS 205 HD2 HIS 205 -13.950 -1.545 1.628 313 HE1 HIS 205 HE1 HIS 205 -13.644 2.608 0.820 314 HE2 HIS 205 HE2 HIS 205 -14.275 0.859 2.520 315 H SEP 206 HN SEP 206 -10.344 0.938 -0.288 316 HA SEP 206 HA SEP 206 -7.989 0.059 0.912 317 HB2 SEP 206 HB2 SEP 206 -9.146 2.217 2.385 318 HB3 SEP 206 HB1 SEP 206 -7.813 2.257 1.234 319 HA PRO 207 HA PRO 207 -9.162 -1.831 4.757 320 HB2 PRO 207 HB2 PRO 207 -7.127 -0.284 6.175 321 HB3 PRO 207 HB1 PRO 207 -7.194 -2.018 5.855 322 HG2 PRO 207 HG2 PRO 207 -5.438 -0.295 4.655 323 HG3 PRO 207 HG1 PRO 207 -5.946 -1.833 3.950 324 HD2 PRO 207 HD2 PRO 207 -6.761 0.929 3.264 325 HD3 PRO 207 HD1 PRO 207 -6.667 -0.512 2.236 326 H THR 208 HN THR 208 -9.168 1.545 4.232 327 HA THR 208 HA THR 208 -10.397 2.212 6.779 328 HB THR 208 HB THR 208 -10.625 4.487 5.392 329 HG1 THR 208 HG1 THR 208 -9.738 4.120 3.469 330 HG21 THR 208 HG21 THR 208 -9.367 4.231 7.467 331 HG22 THR 208 HG22 THR 208 -8.435 5.154 6.287 332 HG23 THR 208 HG23 THR 208 -8.047 3.460 6.586 333 H SER 209 HN SER 209 -12.517 2.365 7.104 334 HA SER 209 HA SER 209 -14.300 3.093 4.952 335 HB2 SER 209 HB2 SER 209 -14.666 0.481 6.447 336 HB3 SER 209 HB1 SER 209 -15.825 1.184 5.321 337 HG SER 209 HG SER 209 -13.250 0.909 4.347 Start of MODEL 14 1 H ASP 170 H ASP 170 15.910 2.256 -6.047 2 HA ASP 170 HA ASP 170 14.112 1.014 -6.976 3 HB2 ASP 170 HB2 ASP 170 15.872 -1.417 -6.587 4 HB3 ASP 170 HB1 ASP 170 14.227 -1.410 -7.216 5 H VAL 171 HN VAL 171 16.076 0.978 -4.243 6 HA VAL 171 HA VAL 171 14.481 -0.699 -2.591 7 HB VAL 171 HB VAL 171 16.862 -0.377 -2.162 8 HG11 VAL 171 HG11 VAL 171 17.682 1.650 -1.070 9 HG12 VAL 171 HG12 VAL 171 16.109 2.410 -1.306 10 HG13 VAL 171 HG13 VAL 171 17.096 1.974 -2.702 11 HG21 VAL 171 HG21 VAL 171 15.446 -1.173 -0.367 12 HG22 VAL 171 HG22 VAL 171 15.077 0.484 0.108 13 HG23 VAL 171 HG23 VAL 171 16.719 -0.136 0.280 14 HA PRO 172 HA PRO 172 12.955 3.626 -0.810 15 HB2 PRO 172 HB2 PRO 172 12.006 5.300 -2.750 16 HB3 PRO 172 HB1 PRO 172 13.623 5.425 -2.045 17 HG2 PRO 172 HG2 PRO 172 12.769 4.100 -4.595 18 HG3 PRO 172 HG1 PRO 172 14.146 5.184 -4.308 19 HD2 PRO 172 HD2 PRO 172 14.498 2.546 -4.431 20 HD3 PRO 172 HD1 PRO 172 15.387 3.527 -3.249 21 H LEU 173 HN LEU 173 11.740 1.625 -3.306 22 HA LEU 173 HA LEU 173 9.119 1.708 -2.045 23 HB2 LEU 173 HB2 LEU 173 9.354 3.218 -4.224 24 HB3 LEU 173 HB1 LEU 173 9.148 1.677 -5.028 25 HG LEU 173 HG LEU 173 7.187 3.002 -3.152 26 HD11 LEU 173 HD11 LEU 173 7.209 4.014 -5.330 27 HD12 LEU 173 HD12 LEU 173 5.752 3.037 -5.164 28 HD13 LEU 173 HD13 LEU 173 7.115 2.437 -6.109 29 HD21 LEU 173 HD21 LEU 173 7.207 0.532 -2.901 30 HD22 LEU 173 HD22 LEU 173 6.846 0.393 -4.623 31 HD23 LEU 173 HD23 LEU 173 5.692 1.174 -3.537 32 HA PRO 174 HA PRO 174 10.360 -2.642 -2.464 33 HB2 PRO 174 HB2 PRO 174 7.804 -2.910 -0.945 34 HB3 PRO 174 HB1 PRO 174 9.402 -3.586 -0.601 35 HG2 PRO 174 HG2 PRO 174 8.455 -1.545 0.815 36 HG3 PRO 174 HG1 PRO 174 10.171 -1.625 0.366 37 HD2 PRO 174 HD2 PRO 174 7.969 0.009 -0.832 38 HD3 PRO 174 HD1 PRO 174 9.655 0.459 -0.500 39 H ALA 175 HN ALA 175 9.698 -4.191 -3.916 40 HA ALA 175 HA ALA 175 7.753 -3.162 -5.824 41 HB1 ALA 175 HB1 ALA 175 9.718 -5.427 -6.109 42 HB2 ALA 175 HB2 ALA 175 9.997 -3.756 -6.597 43 HB3 ALA 175 HB3 ALA 175 8.752 -4.714 -7.401 44 H GLY 176 HN GLY 176 7.763 -5.420 -3.352 45 HA2 GLY 176 HA2 GLY 176 5.730 -7.113 -4.601 46 HA3 GLY 176 HA1 GLY 176 6.428 -7.331 -2.999 47 H TRP 177 HN TRP 177 5.639 -4.136 -3.530 48 HA TRP 177 HA TRP 177 3.190 -4.437 -1.928 49 HB2 TRP 177 HB2 TRP 177 5.200 -2.169 -1.975 50 HB3 TRP 177 HB1 TRP 177 3.716 -2.177 -1.031 51 HD1 TRP 177 HD1 TRP 177 6.667 -4.694 -1.358 52 HE1 TRP 177 HE1 TRP 177 7.381 -5.409 1.008 53 HE3 TRP 177 HE3 TRP 177 3.371 -1.895 1.348 54 HZ2 TRP 177 HZ2 TRP 177 6.650 -4.843 3.657 55 HZ3 TRP 177 HZ3 TRP 177 3.451 -2.037 3.801 56 HH2 TRP 177 HH2 TRP 177 5.062 -3.480 4.922 57 H GLU 178 HN GLU 178 1.364 -3.544 -2.646 58 HA GLU 178 HA GLU 178 1.387 -2.398 -5.321 59 HB2 GLU 178 HB2 GLU 178 -0.181 -4.225 -4.836 60 HB3 GLU 178 HB1 GLU 178 -0.902 -3.288 -3.537 61 HG2 GLU 178 HG2 GLU 178 -1.955 -1.836 -5.006 62 HG3 GLU 178 HG1 GLU 178 -0.858 -2.219 -6.332 63 H MET 179 HN MET 179 0.982 -0.304 -5.775 64 HA MET 179 HA MET 179 0.745 1.524 -3.527 65 HB2 MET 179 HB2 MET 179 1.140 2.105 -6.463 66 HB3 MET 179 HB1 MET 179 1.109 3.310 -5.188 67 HG2 MET 179 HG2 MET 179 3.140 1.102 -5.380 68 HG3 MET 179 HG1 MET 179 3.347 2.743 -5.994 69 HE1 MET 179 HE1 MET 179 3.801 4.838 -4.565 70 HE2 MET 179 HE2 MET 179 3.502 4.924 -2.831 71 HE3 MET 179 HE3 MET 179 2.158 4.663 -3.942 72 H ALA 180 HN ALA 180 -1.424 1.276 -2.912 73 HA ALA 180 HA ALA 180 -3.438 1.989 -4.889 74 HB1 ALA 180 HB1 ALA 180 -3.943 0.169 -3.347 75 HB2 ALA 180 HB2 ALA 180 -5.060 1.518 -3.128 76 HB3 ALA 180 HB3 ALA 180 -3.744 1.266 -1.981 77 H LYS 181 HN LYS 181 -3.084 4.081 -5.340 78 HA LYS 181 HA LYS 181 -3.023 6.013 -3.128 79 HB2 LYS 181 HB2 LYS 181 -2.287 6.469 -6.030 80 HB3 LYS 181 HB1 LYS 181 -2.002 7.561 -4.686 81 HG2 LYS 181 HG2 LYS 181 -0.415 5.930 -3.727 82 HG3 LYS 181 HG1 LYS 181 -0.653 4.883 -5.132 83 HD2 LYS 181 HD2 LYS 181 0.454 7.695 -5.150 84 HD3 LYS 181 HD1 LYS 181 1.364 6.205 -5.393 85 HE2 LYS 181 HE2 LYS 181 -0.865 7.193 -7.174 86 HE3 LYS 181 HE1 LYS 181 0.856 7.372 -7.509 87 HZ1 LYS 181 HZ1 LYS 181 -0.276 5.461 -8.636 88 HZ2 LYS 181 HZ2 LYS 181 -0.441 4.735 -7.115 89 HZ3 LYS 181 HZ3 LYS 181 1.102 5.045 -7.740 90 H THR 182 HN THR 182 -5.078 6.709 -2.705 91 HA THR 182 HA THR 182 -6.890 7.093 -4.980 92 HB THR 182 HB THR 182 -8.716 7.167 -3.403 93 HG1 THR 182 HG1 THR 182 -8.052 6.703 -1.099 94 HG21 THR 182 HG21 THR 182 -8.570 4.936 -2.414 95 HG22 THR 182 HG22 THR 182 -6.828 4.921 -2.686 96 HG23 THR 182 HG23 THR 182 -7.936 4.940 -4.059 97 H SER 183 HN SER 183 -7.774 9.055 -5.480 98 HA SER 183 HA SER 183 -6.188 11.323 -4.902 99 HB2 SER 183 HB2 SER 183 -8.914 11.277 -6.213 100 HB3 SER 183 HB1 SER 183 -7.660 12.504 -6.398 101 HG SER 183 HG SER 183 -6.503 11.173 -7.644 102 H SER 184 HN SER 184 -8.868 9.955 -3.298 103 HA SER 184 HA SER 184 -9.849 12.364 -2.108 104 HB2 SER 184 HB2 SER 184 -10.235 9.481 -1.277 105 HB3 SER 184 HB1 SER 184 -11.143 10.858 -0.650 106 HG SER 184 HG SER 184 -12.428 10.300 -2.254 107 H GLY 185 HN GLY 185 -7.142 10.373 -1.564 108 HA2 GLY 185 HA2 GLY 185 -5.395 11.411 -0.233 109 HA3 GLY 185 HA1 GLY 185 -6.634 11.886 0.916 110 H GLN 186 HN GLN 186 -6.431 8.670 -0.537 111 HA GLN 186 HA GLN 186 -5.598 7.688 2.125 112 HB2 GLN 186 HB2 GLN 186 -7.378 6.337 0.094 113 HB3 GLN 186 HB1 GLN 186 -6.662 5.493 1.456 114 HG2 GLN 186 HG2 GLN 186 -8.654 5.969 2.382 115 HG3 GLN 186 HG1 GLN 186 -7.829 7.471 2.788 116 HE21 GLN 186 HE21 GLN 186 -10.168 5.956 0.688 117 HE22 GLN 186 HE22 GLN 186 -10.887 7.421 0.116 118 H ARG 187 HN ARG 187 -3.614 6.972 2.170 119 HA ARG 187 HA ARG 187 -2.579 5.624 -0.230 120 HB2 ARG 187 HB2 ARG 187 -0.297 6.124 0.695 121 HB3 ARG 187 HB1 ARG 187 -1.213 7.526 0.170 122 HG2 ARG 187 HG2 ARG 187 -1.644 8.202 2.388 123 HG3 ARG 187 HG1 ARG 187 -1.111 6.652 3.045 124 HD2 ARG 187 HD2 ARG 187 0.630 8.684 1.648 125 HD3 ARG 187 HD1 ARG 187 0.575 8.389 3.387 126 HE ARG 187 HE ARG 187 1.169 6.028 1.890 127 HH11 ARG 187 HH11 ARG 187 2.586 8.921 3.272 128 HH12 ARG 187 HH12 ARG 187 4.188 8.245 3.354 129 HH21 ARG 187 HH21 ARG 187 3.263 5.139 2.023 130 HH22 ARG 187 HH22 ARG 187 4.570 6.086 2.671 131 H TYR 188 HN TYR 188 -3.160 3.521 0.164 132 HA TYR 188 HA TYR 188 -1.938 2.324 2.552 133 HB2 TYR 188 HB2 TYR 188 -3.749 0.670 2.634 134 HB3 TYR 188 HB1 TYR 188 -4.366 2.301 2.837 135 HD1 TYR 188 HD1 TYR 188 -4.235 -0.611 0.616 136 HD2 TYR 188 HD2 TYR 188 -5.856 3.282 1.193 137 HE1 TYR 188 HE1 TYR 188 -5.872 -1.030 -1.167 138 HE2 TYR 188 HE2 TYR 188 -7.487 2.873 -0.591 139 HH TYR 188 HH TYR 188 -8.142 -0.155 -1.829 140 H PHE 189 HN PHE 189 -1.014 0.269 2.271 141 HA PHE 189 HA PHE 189 -0.392 -0.303 -0.552 142 HB2 PHE 189 HB2 PHE 189 1.399 -0.615 1.866 143 HB3 PHE 189 HB1 PHE 189 1.822 -1.058 0.216 144 HD1 PHE 189 HD2 PHE 189 0.790 1.207 -1.298 145 HD2 PHE 189 HD1 PHE 189 2.838 1.112 2.421 146 HE1 PHE 189 HE2 PHE 189 1.639 3.472 -1.725 147 HE2 PHE 189 HE1 PHE 189 3.693 3.383 2.012 148 HZ PHE 189 HZ PHE 189 3.097 4.567 -0.065 149 H LEU 190 HN LEU 190 -0.672 -2.305 -1.262 150 HA LEU 190 HA LEU 190 -1.482 -4.385 0.597 151 HB2 LEU 190 HB2 LEU 190 -1.592 -4.015 -2.336 152 HB3 LEU 190 HB1 LEU 190 -1.471 -5.652 -1.753 153 HG LEU 190 HG LEU 190 -3.717 -3.721 -1.534 154 HD11 LEU 190 HD11 LEU 190 -4.232 -5.236 -3.127 155 HD12 LEU 190 HD12 LEU 190 -4.742 -6.209 -1.730 156 HD13 LEU 190 HD13 LEU 190 -3.160 -6.460 -2.455 157 HD21 LEU 190 HD21 LEU 190 -3.249 -5.967 0.433 158 HD22 LEU 190 HD22 LEU 190 -4.729 -5.020 0.279 159 HD23 LEU 190 HD23 LEU 190 -3.236 -4.244 0.809 160 H ASN 191 HN ASN 191 -0.074 -6.017 1.298 161 HA ASN 191 HA ASN 191 2.420 -6.363 -0.185 162 HB2 ASN 191 HB2 ASN 191 1.352 -7.866 2.221 163 HB3 ASN 191 HB1 ASN 191 2.909 -8.163 1.463 164 HD21 ASN 191 HD21 ASN 191 1.471 -4.994 2.036 165 HD22 ASN 191 HD22 ASN 191 2.637 -4.483 3.200 166 H HIS 192 HN HIS 192 2.088 -7.353 -2.098 167 HA HIS 192 HA HIS 192 -0.222 -9.000 -2.498 168 HB2 HIS 192 HB2 HIS 192 1.880 -7.844 -4.204 169 HB3 HIS 192 HB1 HIS 192 1.222 -9.376 -4.772 170 HD1 HIS 192 HD1 HIS 192 -0.400 -8.786 -6.562 171 HD2 HIS 192 HD2 HIS 192 -0.745 -6.294 -3.250 172 HE1 HIS 192 HE1 HIS 192 -2.382 -7.312 -7.026 173 HE2 HIS 192 HE2 HIS 192 -2.452 -5.680 -5.106 174 H ILE 193 HN ILE 193 2.705 -9.699 -1.160 175 HA ILE 193 HA ILE 193 2.814 -12.420 -2.167 176 HB ILE 193 HB ILE 193 4.481 -12.018 0.148 177 HG12 ILE 193 HG12 ILE 193 6.015 -10.378 -1.326 178 HG13 ILE 193 HG11 ILE 193 4.435 -9.812 -1.854 179 HG21 ILE 193 HG21 ILE 193 6.251 -12.660 -1.424 180 HG22 ILE 193 HG22 ILE 193 5.111 -12.490 -2.759 181 HG23 ILE 193 HG23 ILE 193 4.847 -13.722 -1.525 182 HD11 ILE 193 HD11 ILE 193 3.825 -9.245 0.388 183 HD12 ILE 193 HD12 ILE 193 5.389 -8.521 0.020 184 HD13 ILE 193 HD13 ILE 193 5.301 -9.972 1.019 185 H ASP 194 HN ASP 194 2.048 -10.688 0.804 186 HA ASP 194 HA ASP 194 1.318 -13.197 2.110 187 HB2 ASP 194 HB2 ASP 194 2.927 -11.556 3.191 188 HB3 ASP 194 HB1 ASP 194 1.557 -10.478 3.392 189 H GLN 195 HN GLN 195 -0.095 -10.544 0.551 190 HA GLN 195 HA GLN 195 -2.260 -9.862 0.202 191 HB2 GLN 195 HB2 GLN 195 -2.731 -12.380 0.362 192 HB3 GLN 195 HB1 GLN 195 -3.154 -12.100 2.046 193 HG2 GLN 195 HG2 GLN 195 -5.154 -12.163 0.735 194 HG3 GLN 195 HG1 GLN 195 -4.896 -10.516 1.307 195 HE21 GLN 195 HE21 GLN 195 -3.065 -11.919 -1.301 196 HE22 GLN 195 HE22 GLN 195 -3.761 -10.964 -2.570 197 H THR 196 HN THR 196 -0.521 -9.007 2.378 198 HA THR 196 HA THR 196 -2.286 -8.569 4.652 199 HB THR 196 HB THR 196 0.121 -7.200 5.085 200 HG1 THR 196 HG1 THR 196 1.091 -9.662 4.526 201 HG21 THR 196 HG21 THR 196 0.569 -9.349 6.484 202 HG22 THR 196 HG22 THR 196 -1.067 -9.796 5.985 203 HG23 THR 196 HG23 THR 196 -0.798 -8.309 6.900 204 H THR 197 HN THR 197 -3.114 -6.673 5.281 205 HA THR 197 HA THR 197 -3.065 -4.482 3.377 206 HB THR 197 HB THR 197 -4.825 -3.556 5.012 207 HG1 THR 197 HG1 THR 197 -4.484 -4.801 6.826 208 HG21 THR 197 HG21 THR 197 -6.570 -5.018 4.107 209 HG22 THR 197 HG22 THR 197 -5.339 -6.180 3.613 210 HG23 THR 197 HG23 THR 197 -5.393 -4.583 2.867 211 H THR 198 HN THR 198 -1.871 -2.694 3.633 212 HA THR 198 HA THR 198 -0.636 -2.205 6.266 213 HB THR 198 HB THR 198 0.606 -1.929 3.520 214 HG1 THR 198 HG1 THR 198 0.503 -3.948 5.329 215 HG21 THR 198 HG21 THR 198 1.352 -0.173 5.124 216 HG22 THR 198 HG22 THR 198 2.638 -1.259 4.604 217 HG23 THR 198 HG23 THR 198 1.918 -1.453 6.197 218 H TRP 199 HN TRP 199 -0.858 -0.140 7.063 219 HA TRP 199 HA TRP 199 -1.485 2.009 5.137 220 HB2 TRP 199 HB2 TRP 199 -2.130 1.802 8.083 221 HB3 TRP 199 HB1 TRP 199 -2.310 3.282 7.153 222 HD1 TRP 199 HD1 TRP 199 -3.931 -0.098 7.743 223 HE1 TRP 199 HE1 TRP 199 -6.266 -0.111 6.670 224 HE3 TRP 199 HE3 TRP 199 -3.667 4.324 5.186 225 HZ2 TRP 199 HZ2 TRP 199 -7.803 1.546 4.958 226 HZ3 TRP 199 HZ3 TRP 199 -5.617 5.037 3.858 227 HH2 TRP 199 HH2 TRP 199 -7.638 3.674 3.752 228 H GLN 200 HN GLN 200 0.860 0.705 7.116 229 HA GLN 200 HA GLN 200 2.128 3.217 7.842 230 HB2 GLN 200 HB2 GLN 200 2.083 1.378 9.466 231 HB3 GLN 200 HB1 GLN 200 2.951 0.348 8.336 232 HG2 GLN 200 HG2 GLN 200 4.857 1.923 8.434 233 HG3 GLN 200 HG1 GLN 200 3.988 2.843 9.660 234 HE21 GLN 200 HE21 GLN 200 6.547 1.454 9.798 235 HE22 GLN 200 HE22 GLN 200 6.412 0.347 11.125 236 H ASP 201 HN ASP 201 3.875 4.065 6.862 237 HA ASP 201 HA ASP 201 4.710 3.121 4.317 238 HB2 ASP 201 HB2 ASP 201 4.727 5.513 5.030 239 HB3 ASP 201 HB1 ASP 201 6.070 5.146 6.107 240 HA PRO 202 HA PRO 202 7.325 0.015 6.185 241 HB2 PRO 202 HB2 PRO 202 8.115 -1.195 3.871 242 HB3 PRO 202 HB1 PRO 202 6.564 -1.485 4.666 243 HG2 PRO 202 HG2 PRO 202 7.195 0.218 2.302 244 HG3 PRO 202 HG1 PRO 202 5.775 -0.788 2.619 245 HD2 PRO 202 HD2 PRO 202 5.777 1.925 2.925 246 HD3 PRO 202 HD1 PRO 202 4.725 0.829 3.850 247 H ARG 203 HN ARG 203 8.455 2.452 3.992 248 HA ARG 203 HA ARG 203 11.213 1.541 4.397 249 HB2 ARG 203 HB2 ARG 203 11.894 3.127 2.683 250 HB3 ARG 203 HB1 ARG 203 10.610 2.094 2.078 251 HG2 ARG 203 HG2 ARG 203 9.567 4.521 3.247 252 HG3 ARG 203 HG1 ARG 203 10.725 4.850 1.959 253 HD2 ARG 203 HD2 ARG 203 9.464 3.660 0.374 254 HD3 ARG 203 HD1 ARG 203 8.497 2.866 1.619 255 HE ARG 203 HE ARG 203 7.557 5.130 2.087 256 HH11 ARG 203 HH11 ARG 203 8.900 4.420 -1.082 257 HH12 ARG 203 HH12 ARG 203 7.900 5.593 -1.895 258 HH21 ARG 203 HH21 ARG 203 6.289 6.664 1.031 259 HH22 ARG 203 HH22 ARG 203 6.425 6.891 -0.690 260 H LYS 204 HN LYS 204 8.960 3.723 5.625 261 HA LYS 204 HA LYS 204 10.756 5.777 6.464 262 HB2 LYS 204 HB2 LYS 204 8.323 6.126 6.143 263 HB3 LYS 204 HB1 LYS 204 8.013 5.083 7.521 264 HG2 LYS 204 HG2 LYS 204 7.796 7.333 8.244 265 HG3 LYS 204 HG1 LYS 204 9.278 6.685 8.943 266 HD2 LYS 204 HD2 LYS 204 9.430 8.155 6.348 267 HD3 LYS 204 HD1 LYS 204 9.221 9.077 7.837 268 HE2 LYS 204 HE2 LYS 204 11.448 7.123 7.259 269 HE3 LYS 204 HE1 LYS 204 11.578 8.882 7.214 270 HZ1 LYS 204 HZ1 LYS 204 12.408 8.191 9.303 271 HZ2 LYS 204 HZ2 LYS 204 11.094 7.161 9.582 272 HZ3 LYS 204 HZ3 LYS 204 10.868 8.840 9.610 273 H ALA 205 HN ALA 205 9.821 2.696 7.729 274 HA ALA 205 HA ALA 205 11.092 3.346 10.301 275 HB1 ALA 205 HB1 ALA 205 8.787 2.517 10.440 276 HB2 ALA 205 HB2 ALA 205 9.930 1.423 11.219 277 HB3 ALA 205 HB3 ALA 205 9.281 1.030 9.627 278 H1 SER 201 HT1 SER 201 -5.199 -0.677 -15.784 279 H2 SER 201 HT2 SER 201 -6.491 -1.697 -15.391 280 H3 SER 201 HT3 SER 201 -4.957 -1.993 -14.738 281 HA SER 201 HA SER 201 -5.037 0.045 -13.498 282 HB2 SER 201 HB2 SER 201 -7.854 0.322 -14.577 283 HB3 SER 201 HB1 SER 201 -7.012 1.444 -13.504 284 HG SER 201 HG SER 201 -6.906 2.192 -15.638 285 H TPO 202 HN TPO 202 -4.892 -1.153 -11.723 286 HA TPO 202 HA TPO 202 -7.135 -2.880 -10.975 287 HB TPO 202 HB TPO 202 -4.303 -2.881 -9.898 288 HG21 TPO 202 HG21 TPO 202 -5.951 -3.847 -8.360 289 HG22 TPO 202 HG22 TPO 202 -4.897 -5.097 -9.022 290 HG23 TPO 202 HG23 TPO 202 -6.534 -4.904 -9.645 291 H TYR 203 HN TYR 203 -8.394 -2.348 -9.319 292 HA TYR 203 HA TYR 203 -7.322 -0.651 -7.181 293 HB2 TYR 203 HB2 TYR 203 -8.533 0.845 -8.742 294 HB3 TYR 203 HB1 TYR 203 -9.980 -0.138 -8.543 295 HD1 TYR 203 HD2 TYR 203 -7.655 2.154 -6.808 296 HD2 TYR 203 HD1 TYR 203 -11.406 0.149 -6.650 297 HE1 TYR 203 HE2 TYR 203 -8.299 3.521 -4.870 298 HE2 TYR 203 HE1 TYR 203 -12.059 1.514 -4.711 299 HH TYR 203 HH TYR 203 -10.807 2.797 -2.837 300 HA PRO 204 HA PRO 204 -9.591 -3.884 -5.010 301 HB2 PRO 204 HB2 PRO 204 -7.975 -3.281 -2.716 302 HB3 PRO 204 HB1 PRO 204 -7.862 -4.680 -3.782 303 HG2 PRO 204 HG2 PRO 204 -5.944 -2.709 -3.577 304 HG3 PRO 204 HG1 PRO 204 -6.145 -3.779 -4.975 305 HD2 PRO 204 HD2 PRO 204 -7.068 -0.960 -4.594 306 HD3 PRO 204 HD1 PRO 204 -6.400 -1.744 -6.042 307 H HIS 205 HN HIS 205 -9.124 -2.882 -2.035 308 HA HIS 205 HA HIS 205 -10.823 -0.529 -1.980 309 HB2 HIS 205 HB2 HIS 205 -12.426 -2.416 -1.959 310 HB3 HIS 205 HB1 HIS 205 -11.609 -3.084 -0.550 311 HD1 HIS 205 HD1 HIS 205 -12.574 -2.429 1.636 312 HD2 HIS 205 HD2 HIS 205 -13.489 0.310 -1.357 313 HE1 HIS 205 HE1 HIS 205 -14.093 -0.735 2.703 314 HE2 HIS 205 HE2 HIS 205 -14.381 1.050 0.955 315 H SEP 206 HN SEP 206 -10.401 0.747 -0.214 316 HA SEP 206 HA SEP 206 -8.037 0.328 1.229 317 HB2 SEP 206 HB2 SEP 206 -10.126 2.099 2.393 318 HB3 SEP 206 HB1 SEP 206 -8.419 2.399 2.139 319 HA PRO 207 HA PRO 207 -9.010 -2.826 4.123 320 HB2 PRO 207 HB2 PRO 207 -7.346 -1.131 5.933 321 HB3 PRO 207 HB1 PRO 207 -7.238 -2.863 5.598 322 HG2 PRO 207 HG2 PRO 207 -5.531 -1.131 4.493 323 HG3 PRO 207 HG1 PRO 207 -6.118 -2.545 3.604 324 HD2 PRO 207 HD2 PRO 207 -6.806 0.313 3.277 325 HD3 PRO 207 HD1 PRO 207 -6.823 -0.999 2.085 326 H THR 208 HN THR 208 -8.782 0.303 5.859 327 HA THR 208 HA THR 208 -11.551 0.062 6.654 328 HB THR 208 HB THR 208 -10.544 -1.244 8.406 329 HG1 THR 208 HG1 THR 208 -12.181 0.423 8.923 330 HG21 THR 208 HG21 THR 208 -8.838 -0.332 9.919 331 HG22 THR 208 HG22 THR 208 -8.721 1.112 8.912 332 HG23 THR 208 HG23 THR 208 -8.240 -0.456 8.264 333 H SER 209 HN SER 209 -12.454 1.981 6.546 334 HA SER 209 HA SER 209 -11.157 4.345 7.546 335 HB2 SER 209 HB2 SER 209 -11.837 4.123 4.600 336 HB3 SER 209 HB1 SER 209 -11.416 5.623 5.422 337 HG SER 209 HG SER 209 -9.582 3.686 5.905 Start of MODEL 15 1 H ASP 170 H ASP 170 15.667 2.317 -6.206 2 HA ASP 170 HA ASP 170 13.385 0.517 -6.743 3 HB2 ASP 170 HB2 ASP 170 14.929 -1.345 -6.540 4 HB3 ASP 170 HB1 ASP 170 15.470 -0.278 -7.831 5 H VAL 171 HN VAL 171 15.463 2.153 -4.508 6 HA VAL 171 HA VAL 171 14.756 0.512 -2.257 7 HB VAL 171 HB VAL 171 16.143 3.189 -2.390 8 HG11 VAL 171 HG11 VAL 171 15.779 1.339 -0.037 9 HG12 VAL 171 HG12 VAL 171 15.055 2.935 -0.230 10 HG13 VAL 171 HG13 VAL 171 16.804 2.774 -0.064 11 HG21 VAL 171 HG21 VAL 171 18.153 1.882 -1.898 12 HG22 VAL 171 HG22 VAL 171 17.398 1.375 -3.410 13 HG23 VAL 171 HG23 VAL 171 17.197 0.400 -1.953 14 HA PRO 172 HA PRO 172 12.187 4.399 -0.965 15 HB2 PRO 172 HB2 PRO 172 11.537 5.780 -3.475 16 HB3 PRO 172 HB1 PRO 172 12.159 6.436 -1.958 17 HG2 PRO 172 HG2 PRO 172 13.686 6.270 -4.157 18 HG3 PRO 172 HG1 PRO 172 14.356 6.037 -2.532 19 HD2 PRO 172 HD2 PRO 172 13.601 3.986 -4.583 20 HD3 PRO 172 HD1 PRO 172 15.027 4.051 -3.527 21 H LEU 173 HN LEU 173 11.542 2.371 -3.620 22 HA LEU 173 HA LEU 173 8.693 2.402 -2.937 23 HB2 LEU 173 HB2 LEU 173 9.427 3.663 -5.144 24 HB3 LEU 173 HB1 LEU 173 9.491 2.039 -5.796 25 HG LEU 173 HG LEU 173 7.358 3.235 -6.253 26 HD11 LEU 173 HD11 LEU 173 7.400 0.808 -6.279 27 HD12 LEU 173 HD12 LEU 173 5.868 1.398 -5.634 28 HD13 LEU 173 HD13 LEU 173 7.102 0.768 -4.541 29 HD21 LEU 173 HD21 LEU 173 7.194 4.511 -4.203 30 HD22 LEU 173 HD22 LEU 173 6.997 3.028 -3.270 31 HD23 LEU 173 HD23 LEU 173 5.751 3.517 -4.420 32 HA PRO 174 HA PRO 174 9.870 -1.925 -2.761 33 HB2 PRO 174 HB2 PRO 174 7.606 -2.722 -1.421 34 HB3 PRO 174 HB1 PRO 174 9.039 -2.050 -0.642 35 HG2 PRO 174 HG2 PRO 174 6.417 -0.808 -1.157 36 HG3 PRO 174 HG1 PRO 174 7.609 -0.453 0.101 37 HD2 PRO 174 HD2 PRO 174 7.154 1.041 -2.232 38 HD3 PRO 174 HD1 PRO 174 8.533 1.197 -1.132 39 H ALA 175 HN ALA 175 9.531 -3.443 -4.271 40 HA ALA 175 HA ALA 175 7.524 -2.799 -6.285 41 HB1 ALA 175 HB1 ALA 175 9.866 -3.089 -6.947 42 HB2 ALA 175 HB2 ALA 175 8.802 -4.237 -7.759 43 HB3 ALA 175 HB3 ALA 175 9.802 -4.767 -6.406 44 H GLY 176 HN GLY 176 7.856 -5.025 -3.754 45 HA2 GLY 176 HA2 GLY 176 6.097 -7.009 -4.984 46 HA3 GLY 176 HA1 GLY 176 6.797 -7.097 -3.374 47 H TRP 177 HN TRP 177 5.495 -4.093 -4.117 48 HA TRP 177 HA TRP 177 3.156 -4.667 -2.429 49 HB2 TRP 177 HB2 TRP 177 4.943 -2.222 -2.434 50 HB3 TRP 177 HB1 TRP 177 3.471 -2.390 -1.485 51 HD1 TRP 177 HD1 TRP 177 6.654 -4.610 -1.874 52 HE1 TRP 177 HE1 TRP 177 7.435 -5.299 0.479 53 HE3 TRP 177 HE3 TRP 177 3.094 -2.207 0.884 54 HZ2 TRP 177 HZ2 TRP 177 6.647 -4.863 3.139 55 HZ3 TRP 177 HZ3 TRP 177 3.184 -2.387 3.330 56 HH2 TRP 177 HH2 TRP 177 4.931 -3.686 4.424 57 H GLU 178 HN GLU 178 1.270 -3.565 -2.879 58 HA GLU 178 HA GLU 178 1.128 -2.439 -5.577 59 HB2 GLU 178 HB2 GLU 178 -0.415 -4.328 -4.853 60 HB3 GLU 178 HB1 GLU 178 -1.180 -3.179 -3.765 61 HG2 GLU 178 HG2 GLU 178 -2.324 -3.524 -5.972 62 HG3 GLU 178 HG1 GLU 178 -1.946 -1.849 -5.563 63 H MET 179 HN MET 179 0.578 -0.353 -5.950 64 HA MET 179 HA MET 179 0.598 1.404 -3.619 65 HB2 MET 179 HB2 MET 179 0.623 2.127 -6.555 66 HB3 MET 179 HB1 MET 179 0.874 3.230 -5.211 67 HG2 MET 179 HG2 MET 179 2.680 0.902 -5.756 68 HG3 MET 179 HG1 MET 179 2.900 2.494 -6.480 69 HE1 MET 179 HE1 MET 179 3.666 4.617 -5.243 70 HE2 MET 179 HE2 MET 179 3.683 4.780 -3.488 71 HE3 MET 179 HE3 MET 179 2.154 4.545 -4.333 72 H ALA 180 HN ALA 180 -1.506 1.190 -2.780 73 HA ALA 180 HA ALA 180 -3.698 1.871 -4.572 74 HB1 ALA 180 HB1 ALA 180 -3.732 1.234 -1.626 75 HB2 ALA 180 HB2 ALA 180 -4.060 0.098 -2.935 76 HB3 ALA 180 HB3 ALA 180 -5.147 1.458 -2.653 77 H LYS 181 HN LYS 181 -3.292 3.930 -5.125 78 HA LYS 181 HA LYS 181 -2.829 5.919 -3.036 79 HB2 LYS 181 HB2 LYS 181 -2.730 6.200 -6.048 80 HB3 LYS 181 HB1 LYS 181 -2.216 7.406 -4.879 81 HG2 LYS 181 HG2 LYS 181 -0.367 6.055 -4.191 82 HG3 LYS 181 HG1 LYS 181 -0.940 4.678 -5.142 83 HD2 LYS 181 HD2 LYS 181 -0.051 7.340 -6.256 84 HD3 LYS 181 HD1 LYS 181 0.899 5.854 -6.263 85 HE2 LYS 181 HE2 LYS 181 -1.774 6.213 -7.611 86 HE3 LYS 181 HE1 LYS 181 -0.214 6.286 -8.426 87 HZ1 LYS 181 HZ1 LYS 181 0.187 3.999 -7.885 88 HZ2 LYS 181 HZ2 LYS 181 -1.335 4.109 -8.625 89 HZ3 LYS 181 HZ3 LYS 181 -1.225 3.913 -6.948 90 H THR 182 HN THR 182 -4.683 6.606 -2.156 91 HA THR 182 HA THR 182 -7.068 6.888 -3.800 92 HB THR 182 HB THR 182 -6.839 7.598 -0.881 93 HG1 THR 182 HG1 THR 182 -7.621 5.026 -1.765 94 HG21 THR 182 HG21 THR 182 -8.902 8.227 -2.032 95 HG22 THR 182 HG22 THR 182 -9.202 6.943 -0.860 96 HG23 THR 182 HG23 THR 182 -9.111 6.564 -2.581 97 H SER 183 HN SER 183 -8.013 8.810 -4.354 98 HA SER 183 HA SER 183 -6.382 11.100 -4.538 99 HB2 SER 183 HB2 SER 183 -8.640 12.157 -5.261 100 HB3 SER 183 HB1 SER 183 -7.955 10.863 -6.247 101 HG SER 183 HG SER 183 -10.176 10.511 -5.825 102 H SER 184 HN SER 184 -8.570 10.018 -2.119 103 HA SER 184 HA SER 184 -9.152 12.461 -0.845 104 HB2 SER 184 HB2 SER 184 -8.886 9.767 0.504 105 HB3 SER 184 HB1 SER 184 -9.899 11.125 0.997 106 HG SER 184 HG SER 184 -10.834 9.227 -0.286 107 H GLY 185 HN GLY 185 -6.253 10.764 -1.165 108 HA2 GLY 185 HA2 GLY 185 -4.170 11.606 -0.394 109 HA3 GLY 185 HA1 GLY 185 -5.010 12.367 0.954 110 H GLN 186 HN GLN 186 -5.345 9.066 -0.190 111 HA GLN 186 HA GLN 186 -4.368 8.134 2.426 112 HB2 GLN 186 HB2 GLN 186 -6.416 6.822 0.620 113 HB3 GLN 186 HB1 GLN 186 -5.866 6.202 2.170 114 HG2 GLN 186 HG2 GLN 186 -6.772 8.219 3.258 115 HG3 GLN 186 HG1 GLN 186 -7.395 8.746 1.698 116 HE21 GLN 186 HE21 GLN 186 -8.133 5.994 0.892 117 HE22 GLN 186 HE22 GLN 186 -9.555 5.630 1.808 118 H ARG 187 HN ARG 187 -2.462 7.168 2.274 119 HA ARG 187 HA ARG 187 -1.890 5.680 -0.194 120 HB2 ARG 187 HB2 ARG 187 0.537 5.957 0.404 121 HB3 ARG 187 HB1 ARG 187 -0.293 7.445 -0.023 122 HG2 ARG 187 HG2 ARG 187 -0.531 7.952 2.390 123 HG3 ARG 187 HG1 ARG 187 0.420 6.511 2.750 124 HD2 ARG 187 HD2 ARG 187 1.382 8.798 1.040 125 HD3 ARG 187 HD1 ARG 187 1.722 8.640 2.760 126 HE ARG 187 HE ARG 187 2.814 6.446 2.085 127 HH11 ARG 187 HH11 ARG 187 2.617 9.214 -0.053 128 HH12 ARG 187 HH12 ARG 187 4.100 8.837 -0.886 129 HH21 ARG 187 HH21 ARG 187 4.783 5.957 1.026 130 HH22 ARG 187 HH22 ARG 187 5.311 6.976 -0.284 131 H TYR 188 HN TYR 188 -2.780 3.737 0.412 132 HA TYR 188 HA TYR 188 -1.324 2.402 2.584 133 HB2 TYR 188 HB2 TYR 188 -3.210 0.894 2.897 134 HB3 TYR 188 HB1 TYR 188 -3.721 2.560 3.099 135 HD1 TYR 188 HD2 TYR 188 -5.163 3.628 1.368 136 HD2 TYR 188 HD1 TYR 188 -4.121 -0.494 1.200 137 HE1 TYR 188 HE2 TYR 188 -7.002 3.232 -0.214 138 HE2 TYR 188 HE1 TYR 188 -5.964 -0.903 -0.370 139 HH TYR 188 HH TYR 188 -7.855 1.729 -1.721 140 H PHE 189 HN PHE 189 0.007 0.877 1.995 141 HA PHE 189 HA PHE 189 -0.019 0.079 -0.811 142 HB2 PHE 189 HB2 PHE 189 2.120 -0.265 1.305 143 HB3 PHE 189 HB1 PHE 189 2.268 -0.762 -0.377 144 HD1 PHE 189 HD2 PHE 189 0.644 1.828 -1.267 145 HD2 PHE 189 HD1 PHE 189 4.148 1.116 1.050 146 HE1 PHE 189 HE2 PHE 189 1.487 4.059 -1.863 147 HE2 PHE 189 HE1 PHE 189 4.989 3.349 0.464 148 HZ PHE 189 HZ PHE 189 3.660 4.824 -0.992 149 H LEU 190 HN LEU 190 -0.290 -1.961 -1.471 150 HA LEU 190 HA LEU 190 -1.306 -3.863 0.474 151 HB2 LEU 190 HB2 LEU 190 -1.133 -3.842 -2.524 152 HB3 LEU 190 HB1 LEU 190 -1.564 -5.290 -1.654 153 HG LEU 190 HG LEU 190 -3.121 -2.749 -1.959 154 HD11 LEU 190 HD11 LEU 190 -4.576 -4.045 -3.133 155 HD12 LEU 190 HD12 LEU 190 -4.212 -5.499 -2.202 156 HD13 LEU 190 HD13 LEU 190 -3.094 -4.945 -3.450 157 HD21 LEU 190 HD21 LEU 190 -4.733 -3.622 -0.338 158 HD22 LEU 190 HD22 LEU 190 -3.175 -3.299 0.423 159 HD23 LEU 190 HD23 LEU 190 -3.642 -4.955 0.037 160 H ASN 191 HN ASN 191 -0.107 -5.665 1.162 161 HA ASN 191 HA ASN 191 2.386 -6.224 -0.231 162 HB2 ASN 191 HB2 ASN 191 1.078 -7.843 1.981 163 HB3 ASN 191 HB1 ASN 191 2.737 -7.975 1.420 164 HD21 ASN 191 HD21 ASN 191 3.703 -7.571 3.348 165 HD22 ASN 191 HD22 ASN 191 3.621 -6.051 4.163 166 H HIS 192 HN HIS 192 1.771 -6.888 -2.269 167 HA HIS 192 HA HIS 192 -0.657 -8.294 -2.721 168 HB2 HIS 192 HB2 HIS 192 1.196 -6.935 -4.324 169 HB3 HIS 192 HB1 HIS 192 1.209 -8.593 -4.917 170 HD1 HIS 192 HD1 HIS 192 -1.819 -9.239 -4.526 171 HD2 HIS 192 HD2 HIS 192 -0.352 -5.743 -6.248 172 HE1 HIS 192 HE1 HIS 192 -3.688 -8.341 -5.948 173 HE2 HIS 192 HE2 HIS 192 -2.842 -6.149 -6.853 174 H ILE 193 HN ILE 193 2.360 -9.306 -1.700 175 HA ILE 193 HA ILE 193 2.083 -12.050 -2.597 176 HB ILE 193 HB ILE 193 4.084 -12.186 -0.816 177 HG12 ILE 193 HG12 ILE 193 4.773 -9.520 -1.863 178 HG13 ILE 193 HG11 ILE 193 3.490 -9.519 -0.659 179 HG21 ILE 193 HG21 ILE 193 5.631 -11.806 -2.685 180 HG22 ILE 193 HG22 ILE 193 4.317 -11.082 -3.613 181 HG23 ILE 193 HG23 ILE 193 4.245 -12.786 -3.164 182 HD11 ILE 193 HD11 ILE 193 4.876 -10.239 1.010 183 HD12 ILE 193 HD12 ILE 193 5.987 -9.267 0.038 184 HD13 ILE 193 HD13 ILE 193 5.988 -11.024 -0.104 185 H ASP 194 HN ASP 194 1.438 -10.098 0.221 186 HA ASP 194 HA ASP 194 1.012 -12.487 1.867 187 HB2 ASP 194 HB2 ASP 194 2.413 -10.326 2.556 188 HB3 ASP 194 HB1 ASP 194 0.819 -9.722 3.026 189 H GLN 195 HN GLN 195 -0.704 -10.229 0.038 190 HA GLN 195 HA GLN 195 -2.905 -9.681 -0.229 191 HB2 GLN 195 HB2 GLN 195 -3.214 -12.169 -0.023 192 HB3 GLN 195 HB1 GLN 195 -3.485 -11.947 1.697 193 HG2 GLN 195 HG2 GLN 195 -5.441 -10.556 1.202 194 HG3 GLN 195 HG1 GLN 195 -5.175 -10.822 -0.521 195 HE21 GLN 195 HE21 GLN 195 -6.157 -12.270 2.487 196 HE22 GLN 195 HE22 GLN 195 -6.877 -13.690 1.796 197 H THR 196 HN THR 196 -1.148 -8.783 1.940 198 HA THR 196 HA THR 196 -2.969 -8.169 4.145 199 HB THR 196 HB THR 196 -0.050 -8.544 3.798 200 HG1 THR 196 HG1 THR 196 -0.532 -10.099 5.109 201 HG21 THR 196 HG21 THR 196 0.683 -7.299 5.572 202 HG22 THR 196 HG22 THR 196 -0.939 -7.052 6.230 203 HG23 THR 196 HG23 THR 196 -0.432 -6.184 4.777 204 H THR 197 HN THR 197 -3.560 -6.098 4.640 205 HA THR 197 HA THR 197 -2.765 -4.049 2.703 206 HB THR 197 HB THR 197 -4.987 -3.680 4.702 207 HG1 THR 197 HG1 THR 197 -5.759 -5.498 3.805 208 HG21 THR 197 HG21 THR 197 -4.279 -1.785 3.308 209 HG22 THR 197 HG22 THR 197 -5.909 -2.312 2.892 210 HG23 THR 197 HG23 THR 197 -4.550 -2.750 1.858 211 H THR 198 HN THR 198 -1.516 -2.369 3.264 212 HA THR 198 HA THR 198 -0.775 -2.160 6.106 213 HB THR 198 HB THR 198 0.971 -1.978 3.648 214 HG1 THR 198 HG1 THR 198 1.232 -4.034 4.027 215 HG21 THR 198 HG21 THR 198 1.694 -0.395 5.404 216 HG22 THR 198 HG22 THR 198 2.853 -1.693 5.132 217 HG23 THR 198 HG23 THR 198 1.801 -1.736 6.537 218 H TRP 199 HN TRP 199 -1.360 -0.189 6.941 219 HA TRP 199 HA TRP 199 -1.532 2.153 5.234 220 HB2 TRP 199 HB2 TRP 199 -2.176 1.614 8.112 221 HB3 TRP 199 HB1 TRP 199 -2.013 3.268 7.543 222 HD1 TRP 199 HD1 TRP 199 -4.499 0.576 7.908 223 HE1 TRP 199 HE1 TRP 199 -6.681 1.201 6.704 224 HE3 TRP 199 HE3 TRP 199 -2.805 4.528 5.145 225 HZ2 TRP 199 HZ2 TRP 199 -7.567 3.094 4.821 226 HZ3 TRP 199 HZ3 TRP 199 -4.388 5.689 3.662 227 HH2 TRP 199 HH2 TRP 199 -6.721 4.983 3.502 228 H GLN 200 HN GLN 200 0.793 0.661 7.226 229 HA GLN 200 HA GLN 200 2.215 3.132 7.804 230 HB2 GLN 200 HB2 GLN 200 2.112 1.424 9.558 231 HB3 GLN 200 HB1 GLN 200 2.858 0.251 8.482 232 HG2 GLN 200 HG2 GLN 200 4.498 1.062 10.026 233 HG3 GLN 200 HG1 GLN 200 4.885 1.654 8.413 234 HE21 GLN 200 HE21 GLN 200 3.827 2.488 11.597 235 HE22 GLN 200 HE22 GLN 200 3.994 4.205 11.429 236 H ASP 201 HN ASP 201 3.607 3.940 6.401 237 HA ASP 201 HA ASP 201 4.253 2.712 3.972 238 HB2 ASP 201 HB2 ASP 201 4.297 5.176 4.432 239 HB3 ASP 201 HB1 ASP 201 5.803 4.934 5.315 240 HA PRO 202 HA PRO 202 7.128 -0.314 5.538 241 HB2 PRO 202 HB2 PRO 202 8.020 -1.030 3.000 242 HB3 PRO 202 HB1 PRO 202 6.657 -1.745 3.864 243 HG2 PRO 202 HG2 PRO 202 6.672 0.351 1.744 244 HG3 PRO 202 HG1 PRO 202 5.510 -0.957 2.029 245 HD2 PRO 202 HD2 PRO 202 4.956 1.583 2.699 246 HD3 PRO 202 HD1 PRO 202 4.398 0.213 3.695 247 H ARG 203 HN ARG 203 7.962 2.490 3.705 248 HA ARG 203 HA ARG 203 10.774 1.884 3.623 249 HB2 ARG 203 HB2 ARG 203 9.271 4.426 3.023 250 HB3 ARG 203 HB1 ARG 203 11.018 4.270 2.890 251 HG2 ARG 203 HG2 ARG 203 8.906 2.860 1.285 252 HG3 ARG 203 HG1 ARG 203 10.150 3.978 0.715 253 HD2 ARG 203 HD2 ARG 203 10.465 1.141 1.664 254 HD3 ARG 203 HD1 ARG 203 10.909 1.835 0.109 255 HE ARG 203 HE ARG 203 12.421 3.192 1.951 256 HH11 ARG 203 HH11 ARG 203 12.059 -0.152 0.984 257 HH12 ARG 203 HH12 ARG 203 13.632 -0.622 1.552 258 HH21 ARG 203 HH21 ARG 203 14.479 2.586 2.711 259 HH22 ARG 203 HH22 ARG 203 15.019 0.941 2.515 260 H LYS 204 HN LYS 204 8.638 3.098 5.950 261 HA LYS 204 HA LYS 204 10.535 4.608 7.457 262 HB2 LYS 204 HB2 LYS 204 8.183 5.020 7.789 263 HB3 LYS 204 HB1 LYS 204 7.899 3.341 8.215 264 HG2 LYS 204 HG2 LYS 204 7.871 4.818 10.164 265 HG3 LYS 204 HG1 LYS 204 9.154 3.613 10.267 266 HD2 LYS 204 HD2 LYS 204 10.665 5.432 9.260 267 HD3 LYS 204 HD1 LYS 204 9.373 6.552 9.699 268 HE2 LYS 204 HE2 LYS 204 11.068 6.455 11.447 269 HE3 LYS 204 HE1 LYS 204 9.527 5.820 12.027 270 HZ1 LYS 204 HZ1 LYS 204 11.808 4.154 11.079 271 HZ2 LYS 204 HZ2 LYS 204 10.347 3.578 11.714 272 HZ3 LYS 204 HZ3 LYS 204 11.420 4.439 12.705 273 H ALA 205 HN ALA 205 10.106 1.294 6.916 274 HA ALA 205 HA ALA 205 10.994 0.275 9.416 275 HB1 ALA 205 HB1 ALA 205 11.293 -1.835 8.239 276 HB2 ALA 205 HB2 ALA 205 11.116 -1.013 6.690 277 HB3 ALA 205 HB3 ALA 205 9.752 -1.096 7.807 278 H1 SER 201 HT1 SER 201 -0.862 -5.343 -10.440 279 H2 SER 201 HT2 SER 201 -1.876 -5.191 -11.792 280 H3 SER 201 HT3 SER 201 -2.422 -6.003 -10.407 281 HA SER 201 HA SER 201 -2.304 -3.967 -9.133 282 HB2 SER 201 HB2 SER 201 -1.584 -2.728 -11.804 283 HB3 SER 201 HB1 SER 201 -1.908 -1.839 -10.317 284 HG SER 201 HG SER 201 -0.116 -2.975 -9.374 285 H TPO 202 HN TPO 202 -4.401 -4.027 -8.711 286 HA TPO 202 HA TPO 202 -6.242 -3.234 -10.863 287 HB TPO 202 HB TPO 202 -7.998 -4.554 -9.611 288 HG21 TPO 202 HG21 TPO 202 -7.365 -6.688 -10.647 289 HG22 TPO 202 HG22 TPO 202 -5.729 -6.077 -10.891 290 HG23 TPO 202 HG23 TPO 202 -7.086 -5.320 -11.724 291 H TYR 203 HN TYR 203 -7.340 -3.821 -7.642 292 HA TYR 203 HA TYR 203 -6.940 -1.336 -6.432 293 HB2 TYR 203 HB2 TYR 203 -8.433 -0.553 -8.316 294 HB3 TYR 203 HB1 TYR 203 -9.710 -1.565 -7.644 295 HD1 TYR 203 HD2 TYR 203 -7.486 1.304 -6.875 296 HD2 TYR 203 HD1 TYR 203 -11.060 -0.776 -5.872 297 HE1 TYR 203 HE2 TYR 203 -8.116 3.130 -5.356 298 HE2 TYR 203 HE1 TYR 203 -11.698 1.046 -4.348 299 HH TYR 203 HH TYR 203 -10.553 2.846 -3.042 300 HA PRO 204 HA PRO 204 -8.591 -4.107 -3.340 301 HB2 PRO 204 HB2 PRO 204 -7.946 -2.092 -1.361 302 HB3 PRO 204 HB1 PRO 204 -7.138 -3.629 -1.673 303 HG2 PRO 204 HG2 PRO 204 -5.993 -1.202 -2.172 304 HG3 PRO 204 HG1 PRO 204 -5.584 -2.680 -3.061 305 HD2 PRO 204 HD2 PRO 204 -7.411 -0.438 -3.853 306 HD3 PRO 204 HD1 PRO 204 -6.217 -1.320 -4.835 307 H HIS 205 HN HIS 205 -9.299 -2.184 -0.956 308 HA HIS 205 HA HIS 205 -11.810 -1.046 -1.889 309 HB2 HIS 205 HB2 HIS 205 -12.295 -3.440 -1.345 310 HB3 HIS 205 HB1 HIS 205 -11.716 -3.157 0.290 311 HD1 HIS 205 HD1 HIS 205 -13.242 -1.657 1.835 312 HD2 HIS 205 HD2 HIS 205 -14.893 -2.631 -1.852 313 HE1 HIS 205 HE1 HIS 205 -15.699 -1.193 2.054 314 HE2 HIS 205 HE2 HIS 205 -16.702 -1.984 -0.114 315 H SEP 206 HN SEP 206 -9.095 -0.530 -0.416 316 HA SEP 206 HA SEP 206 -8.170 0.234 1.477 317 HB2 SEP 206 HB2 SEP 206 -9.459 2.280 2.470 318 HB3 SEP 206 HB1 SEP 206 -8.718 2.376 0.881 319 HA PRO 207 HA PRO 207 -9.704 -2.084 4.806 320 HB2 PRO 207 HB2 PRO 207 -7.935 -0.913 6.702 321 HB3 PRO 207 HB1 PRO 207 -7.723 -2.429 5.825 322 HG2 PRO 207 HG2 PRO 207 -6.272 -0.028 5.485 323 HG3 PRO 207 HG1 PRO 207 -6.157 -1.499 4.515 324 HD2 PRO 207 HD2 PRO 207 -7.419 1.053 3.878 325 HD3 PRO 207 HD1 PRO 207 -6.998 -0.293 2.804 326 H THR 208 HN THR 208 -9.685 1.327 4.757 327 HA THR 208 HA THR 208 -11.887 1.363 6.694 328 HB THR 208 HB THR 208 -11.105 3.654 7.410 329 HG1 THR 208 HG1 THR 208 -9.630 3.952 5.631 330 HG21 THR 208 HG21 THR 208 -9.410 2.822 8.974 331 HG22 THR 208 HG22 THR 208 -9.245 1.352 8.014 332 HG23 THR 208 HG23 THR 208 -10.764 1.701 8.839 333 H SER 209 HN SER 209 -13.556 1.673 5.316 334 HA SER 209 HA SER 209 -13.267 3.654 3.179 335 HB2 SER 209 HB2 SER 209 -15.535 1.695 3.590 336 HB3 SER 209 HB1 SER 209 -15.155 2.607 2.129 337 HG SER 209 HG SER 209 -13.150 1.409 2.061 Start of MODEL 16 1 H ASP 170 H ASP 170 14.514 0.331 -7.300 2 HA ASP 170 HA ASP 170 12.667 -0.416 -5.929 3 HB2 ASP 170 HB2 ASP 170 13.407 -2.733 -5.693 4 HB3 ASP 170 HB1 ASP 170 14.024 -2.041 -7.190 5 H VAL 171 HN VAL 171 15.385 0.657 -4.162 6 HA VAL 171 HA VAL 171 14.519 -0.458 -1.650 7 HB VAL 171 HB VAL 171 16.458 1.804 -2.162 8 HG11 VAL 171 HG11 VAL 171 17.224 1.383 0.136 9 HG12 VAL 171 HG12 VAL 171 15.925 0.209 0.346 10 HG13 VAL 171 HG13 VAL 171 15.541 1.911 0.090 11 HG21 VAL 171 HG21 VAL 171 18.182 0.109 -1.724 12 HG22 VAL 171 HG22 VAL 171 17.208 -0.288 -3.140 13 HG23 VAL 171 HG23 VAL 171 16.924 -1.123 -1.613 14 HA PRO 172 HA PRO 172 12.715 4.006 -1.023 15 HB2 PRO 172 HB2 PRO 172 12.309 5.469 -3.303 16 HB3 PRO 172 HB1 PRO 172 13.720 5.644 -2.252 17 HG2 PRO 172 HG2 PRO 172 13.441 4.152 -4.823 18 HG3 PRO 172 HG1 PRO 172 14.796 5.133 -4.235 19 HD2 PRO 172 HD2 PRO 172 14.807 2.429 -4.160 20 HD3 PRO 172 HD1 PRO 172 15.637 3.424 -2.947 21 H LEU 173 HN LEU 173 12.055 1.769 -3.495 22 HA LEU 173 HA LEU 173 9.242 1.897 -2.798 23 HB2 LEU 173 HB2 LEU 173 9.841 3.191 -5.028 24 HB3 LEU 173 HB1 LEU 173 9.865 1.574 -5.703 25 HG LEU 173 HG LEU 173 7.702 2.747 -6.018 26 HD11 LEU 173 HD11 LEU 173 7.551 0.304 -4.259 27 HD12 LEU 173 HD12 LEU 173 7.754 0.312 -6.011 28 HD13 LEU 173 HD13 LEU 173 6.260 0.915 -5.293 29 HD21 LEU 173 HD21 LEU 173 7.678 4.040 -3.966 30 HD22 LEU 173 HD22 LEU 173 7.544 2.562 -3.012 31 HD23 LEU 173 HD23 LEU 173 6.225 3.044 -4.079 32 HA PRO 174 HA PRO 174 10.885 -2.346 -2.489 33 HB2 PRO 174 HB2 PRO 174 8.315 -2.593 -0.983 34 HB3 PRO 174 HB1 PRO 174 9.951 -3.084 -0.524 35 HG2 PRO 174 HG2 PRO 174 8.822 -0.941 0.568 36 HG3 PRO 174 HG1 PRO 174 10.547 -0.944 0.150 37 HD2 PRO 174 HD2 PRO 174 8.243 0.297 -1.306 38 HD3 PRO 174 HD1 PRO 174 9.870 0.945 -1.014 39 H ALA 175 HN ALA 175 10.301 -4.234 -3.592 40 HA ALA 175 HA ALA 175 8.561 -3.556 -5.817 41 HB1 ALA 175 HB1 ALA 175 9.692 -5.337 -7.006 42 HB2 ALA 175 HB2 ALA 175 10.507 -5.831 -5.521 43 HB3 ALA 175 HB3 ALA 175 10.859 -4.259 -6.240 44 H GLY 176 HN GLY 176 8.475 -5.675 -3.106 45 HA2 GLY 176 HA2 GLY 176 6.451 -7.398 -4.294 46 HA3 GLY 176 HA1 GLY 176 7.056 -7.492 -2.646 47 H TRP 177 HN TRP 177 6.208 -4.374 -3.729 48 HA TRP 177 HA TRP 177 3.794 -4.483 -2.057 49 HB2 TRP 177 HB2 TRP 177 5.830 -2.256 -2.275 50 HB3 TRP 177 HB1 TRP 177 4.343 -2.182 -1.335 51 HD1 TRP 177 HD1 TRP 177 7.513 -4.426 -1.457 52 HE1 TRP 177 HE1 TRP 177 8.130 -5.065 0.954 53 HE3 TRP 177 HE3 TRP 177 3.636 -2.177 0.982 54 HZ2 TRP 177 HZ2 TRP 177 7.117 -4.664 3.543 55 HZ3 TRP 177 HZ3 TRP 177 3.533 -2.355 3.433 56 HH2 TRP 177 HH2 TRP 177 5.245 -3.570 4.671 57 H GLU 178 HN GLU 178 2.018 -3.478 -2.732 58 HA GLU 178 HA GLU 178 1.977 -2.457 -5.473 59 HB2 GLU 178 HB2 GLU 178 0.361 -4.231 -4.831 60 HB3 GLU 178 HB1 GLU 178 -0.297 -3.174 -3.594 61 HG2 GLU 178 HG2 GLU 178 -1.728 -3.170 -5.525 62 HG3 GLU 178 HG1 GLU 178 -0.970 -1.587 -5.352 63 H MET 179 HN MET 179 1.582 -0.343 -5.934 64 HA MET 179 HA MET 179 1.291 1.506 -3.694 65 HB2 MET 179 HB2 MET 179 1.586 2.095 -6.649 66 HB3 MET 179 HB1 MET 179 1.540 3.295 -5.361 67 HG2 MET 179 HG2 MET 179 3.648 1.172 -5.591 68 HG3 MET 179 HG1 MET 179 3.769 2.797 -6.271 69 HE1 MET 179 HE1 MET 179 3.971 5.111 -3.227 70 HE2 MET 179 HE2 MET 179 2.594 4.762 -4.272 71 HE3 MET 179 HE3 MET 179 4.206 4.945 -4.967 72 H ALA 180 HN ALA 180 -0.764 1.546 -2.997 73 HA ALA 180 HA ALA 180 -2.859 1.869 -5.013 74 HB1 ALA 180 HB1 ALA 180 -3.234 0.144 -3.333 75 HB2 ALA 180 HB2 ALA 180 -4.432 1.431 -3.213 76 HB3 ALA 180 HB3 ALA 180 -3.102 1.352 -2.056 77 H LYS 181 HN LYS 181 -2.458 3.963 -5.600 78 HA LYS 181 HA LYS 181 -2.815 6.001 -3.521 79 HB2 LYS 181 HB2 LYS 181 -1.913 6.450 -6.367 80 HB3 LYS 181 HB1 LYS 181 -1.809 7.572 -5.021 81 HG2 LYS 181 HG2 LYS 181 -0.176 6.010 -3.946 82 HG3 LYS 181 HG1 LYS 181 -0.177 5.056 -5.436 83 HD2 LYS 181 HD2 LYS 181 0.675 7.929 -5.088 84 HD3 LYS 181 HD1 LYS 181 1.687 6.547 -5.498 85 HE2 LYS 181 HE2 LYS 181 -0.512 7.708 -7.207 86 HE3 LYS 181 HE1 LYS 181 1.217 7.915 -7.468 87 HZ1 LYS 181 HZ1 LYS 181 -0.255 5.333 -7.571 88 HZ2 LYS 181 HZ2 LYS 181 1.412 5.531 -7.818 89 HZ3 LYS 181 HZ3 LYS 181 0.306 6.212 -8.908 90 H THR 182 HN THR 182 -4.963 6.332 -3.307 91 HA THR 182 HA THR 182 -6.608 6.388 -5.727 92 HB THR 182 HB THR 182 -8.550 6.392 -4.202 93 HG1 THR 182 HG1 THR 182 -7.329 5.677 -1.936 94 HG21 THR 182 HG21 THR 182 -6.546 4.213 -3.591 95 HG22 THR 182 HG22 THR 182 -7.630 4.255 -4.983 96 HG23 THR 182 HG23 THR 182 -8.290 4.110 -3.353 97 H SER 183 HN SER 183 -7.874 8.133 -6.304 98 HA SER 183 HA SER 183 -6.712 10.670 -5.825 99 HB2 SER 183 HB2 SER 183 -9.329 9.938 -7.151 100 HB3 SER 183 HB1 SER 183 -8.588 11.539 -7.201 101 HG SER 183 HG SER 183 -7.035 9.340 -7.976 102 H SER 184 HN SER 184 -9.048 8.914 -4.089 103 HA SER 184 HA SER 184 -10.522 11.052 -2.963 104 HB2 SER 184 HB2 SER 184 -9.955 8.331 -1.764 105 HB3 SER 184 HB1 SER 184 -11.267 9.423 -1.318 106 HG SER 184 HG SER 184 -11.957 7.783 -2.762 107 H GLY 185 HN GLY 185 -7.309 10.057 -2.550 108 HA2 GLY 185 HA2 GLY 185 -5.757 11.357 -1.294 109 HA3 GLY 185 HA1 GLY 185 -7.057 11.795 -0.192 110 H GLN 186 HN GLN 186 -6.368 8.551 -1.342 111 HA GLN 186 HA GLN 186 -5.517 7.833 1.382 112 HB2 GLN 186 HB2 GLN 186 -7.453 6.409 -0.441 113 HB3 GLN 186 HB1 GLN 186 -6.675 5.603 0.916 114 HG2 GLN 186 HG2 GLN 186 -7.770 6.923 2.487 115 HG3 GLN 186 HG1 GLN 186 -8.182 8.156 1.303 116 HE21 GLN 186 HE21 GLN 186 -8.666 4.760 0.583 117 HE22 GLN 186 HE22 GLN 186 -10.388 4.806 0.685 118 H ARG 187 HN ARG 187 -3.548 7.043 1.425 119 HA ARG 187 HA ARG 187 -2.571 5.578 -0.935 120 HB2 ARG 187 HB2 ARG 187 -0.267 6.256 -0.210 121 HB3 ARG 187 HB1 ARG 187 -1.279 7.576 -0.774 122 HG2 ARG 187 HG2 ARG 187 -1.586 8.411 1.397 123 HG3 ARG 187 HG1 ARG 187 -0.994 6.924 2.137 124 HD2 ARG 187 HD2 ARG 187 0.718 8.703 0.420 125 HD3 ARG 187 HD1 ARG 187 0.599 8.881 2.170 126 HE ARG 187 HE ARG 187 1.298 6.224 1.296 127 HH11 ARG 187 HH11 ARG 187 2.500 9.389 2.153 128 HH12 ARG 187 HH12 ARG 187 4.075 8.815 2.624 129 HH21 ARG 187 HH21 ARG 187 3.384 5.448 1.911 130 HH22 ARG 187 HH22 ARG 187 4.581 6.569 2.470 131 H TYR 188 HN TYR 188 -2.513 3.421 -0.473 132 HA TYR 188 HA TYR 188 -1.342 2.628 2.084 133 HB2 TYR 188 HB2 TYR 188 -3.059 0.718 2.138 134 HB3 TYR 188 HB1 TYR 188 -3.639 2.319 2.577 135 HD1 TYR 188 HD2 TYR 188 -5.016 3.614 0.948 136 HD2 TYR 188 HD1 TYR 188 -3.960 -0.451 0.269 137 HE1 TYR 188 HE2 TYR 188 -6.786 3.446 -0.746 138 HE2 TYR 188 HE1 TYR 188 -5.721 -0.623 -1.437 139 HH TYR 188 HH TYR 188 -8.089 0.837 -1.843 140 H PHE 189 HN PHE 189 0.075 0.972 1.919 141 HA PHE 189 HA PHE 189 0.601 0.069 -0.815 142 HB2 PHE 189 HB2 PHE 189 2.399 0.058 1.621 143 HB3 PHE 189 HB1 PHE 189 2.865 -0.489 0.012 144 HD1 PHE 189 HD2 PHE 189 1.202 1.782 -1.358 145 HD2 PHE 189 HD1 PHE 189 4.184 1.728 1.688 146 HE1 PHE 189 HE2 PHE 189 1.837 4.077 -1.952 147 HE2 PHE 189 HE1 PHE 189 4.813 4.032 1.109 148 HZ PHE 189 HZ PHE 189 3.641 5.213 -0.710 149 H LEU 190 HN LEU 190 0.313 -1.938 -1.403 150 HA LEU 190 HA LEU 190 -0.660 -3.885 0.531 151 HB2 LEU 190 HB2 LEU 190 -0.400 -3.918 -2.467 152 HB3 LEU 190 HB1 LEU 190 -0.976 -5.283 -1.551 153 HG LEU 190 HG LEU 190 -2.320 -2.625 -1.955 154 HD11 LEU 190 HD11 LEU 190 -3.833 -3.790 -3.230 155 HD12 LEU 190 HD12 LEU 190 -3.505 -5.321 -2.415 156 HD13 LEU 190 HD13 LEU 190 -2.349 -4.675 -3.582 157 HD21 LEU 190 HD21 LEU 190 -4.103 -3.419 -0.492 158 HD22 LEU 190 HD22 LEU 190 -2.586 -3.298 0.400 159 HD23 LEU 190 HD23 LEU 190 -3.175 -4.873 -0.126 160 H ASN 191 HN ASN 191 0.479 -5.778 1.100 161 HA ASN 191 HA ASN 191 3.025 -6.246 -0.267 162 HB2 ASN 191 HB2 ASN 191 1.640 -7.726 1.981 163 HB3 ASN 191 HB1 ASN 191 3.094 -8.327 1.194 164 HD21 ASN 191 HD21 ASN 191 1.764 -5.952 3.327 165 HD22 ASN 191 HD22 ASN 191 3.269 -5.346 3.919 166 H HIS 192 HN HIS 192 2.728 -6.961 -2.276 167 HA HIS 192 HA HIS 192 0.265 -7.949 -3.208 168 HB2 HIS 192 HB2 HIS 192 2.735 -7.146 -4.357 169 HB3 HIS 192 HB1 HIS 192 2.357 -8.741 -4.999 170 HD1 HIS 192 HD1 HIS 192 -0.623 -8.618 -5.473 171 HD2 HIS 192 HD2 HIS 192 1.920 -5.407 -6.237 172 HE1 HIS 192 HE1 HIS 192 -1.838 -7.159 -7.123 173 HE2 HIS 192 HE2 HIS 192 -0.366 -5.133 -7.424 174 H ILE 193 HN ILE 193 3.087 -9.582 -2.011 175 HA ILE 193 HA ILE 193 2.242 -12.125 -3.121 176 HB ILE 193 HB ILE 193 4.375 -12.900 -1.814 177 HG12 ILE 193 HG12 ILE 193 5.997 -10.780 -2.041 178 HG13 ILE 193 HG11 ILE 193 4.505 -9.924 -1.680 179 HG21 ILE 193 HG21 ILE 193 4.145 -12.894 -4.226 180 HG22 ILE 193 HG22 ILE 193 5.741 -12.303 -3.762 181 HG23 ILE 193 HG23 ILE 193 4.494 -11.166 -4.275 182 HD11 ILE 193 HD11 ILE 193 4.272 -11.239 0.380 183 HD12 ILE 193 HD12 ILE 193 5.762 -10.294 0.334 184 HD13 ILE 193 HD13 ILE 193 5.806 -12.031 0.026 185 H ASP 194 HN ASP 194 2.141 -10.458 -0.070 186 HA ASP 194 HA ASP 194 1.387 -12.949 1.275 187 HB2 ASP 194 HB2 ASP 194 3.139 -11.267 2.216 188 HB3 ASP 194 HB1 ASP 194 1.725 -10.345 2.718 189 H GLN 195 HN GLN 195 0.064 -10.195 -0.131 190 HA GLN 195 HA GLN 195 -2.065 -9.464 -0.446 191 HB2 GLN 195 HB2 GLN 195 -2.510 -12.024 -0.258 192 HB3 GLN 195 HB1 GLN 195 -3.092 -11.656 1.356 193 HG2 GLN 195 HG2 GLN 195 -4.232 -10.058 -0.851 194 HG3 GLN 195 HG1 GLN 195 -4.661 -11.764 -0.809 195 HE21 GLN 195 HE21 GLN 195 -4.463 -11.806 2.162 196 HE22 GLN 195 HE22 GLN 195 -5.898 -11.015 2.720 197 H THR 196 HN THR 196 -0.302 -8.740 1.850 198 HA THR 196 HA THR 196 -2.262 -8.244 3.970 199 HB THR 196 HB THR 196 -0.090 -7.275 5.116 200 HG1 THR 196 HG1 THR 196 1.747 -8.438 4.403 201 HG21 THR 196 HG21 THR 196 -0.562 -10.232 4.749 202 HG22 THR 196 HG22 THR 196 -1.423 -9.193 5.887 203 HG23 THR 196 HG23 THR 196 0.309 -9.470 6.079 204 H THR 197 HN THR 197 -2.667 -6.259 4.854 205 HA THR 197 HA THR 197 -2.521 -4.100 2.885 206 HB THR 197 HB THR 197 -4.419 -3.203 4.412 207 HG1 THR 197 HG1 THR 197 -3.765 -5.158 5.900 208 HG21 THR 197 HG21 THR 197 -6.078 -4.628 3.255 209 HG22 THR 197 HG22 THR 197 -4.770 -5.696 2.742 210 HG23 THR 197 HG23 THR 197 -4.829 -4.031 2.165 211 H THR 198 HN THR 198 -1.267 -2.360 3.268 212 HA THR 198 HA THR 198 -0.337 -1.909 6.031 213 HB THR 198 HB THR 198 1.297 -1.515 3.523 214 HG1 THR 198 HG1 THR 198 1.411 -3.622 3.554 215 HG21 THR 198 HG21 THR 198 1.969 -0.221 5.542 216 HG22 THR 198 HG22 THR 198 3.185 -1.373 4.994 217 HG23 THR 198 HG23 THR 198 2.189 -1.747 6.393 218 H TRP 199 HN TRP 199 -1.191 0.027 6.721 219 HA TRP 199 HA TRP 199 -1.576 2.230 4.861 220 HB2 TRP 199 HB2 TRP 199 -2.130 1.850 7.789 221 HB3 TRP 199 HB1 TRP 199 -2.144 3.460 7.086 222 HD1 TRP 199 HD1 TRP 199 -4.375 0.638 7.794 223 HE1 TRP 199 HE1 TRP 199 -6.623 0.925 6.570 224 HE3 TRP 199 HE3 TRP 199 -3.063 4.348 4.520 225 HZ2 TRP 199 HZ2 TRP 199 -7.689 2.490 4.493 226 HZ3 TRP 199 HZ3 TRP 199 -4.767 5.180 2.945 227 HH2 TRP 199 HH2 TRP 199 -7.027 4.264 2.935 228 H GLN 200 HN GLN 200 0.830 1.084 6.967 229 HA GLN 200 HA GLN 200 2.075 3.676 7.392 230 HB2 GLN 200 HB2 GLN 200 3.645 2.445 8.813 231 HB3 GLN 200 HB1 GLN 200 1.985 2.057 9.245 232 HG2 GLN 200 HG2 GLN 200 2.138 -0.025 7.978 233 HG3 GLN 200 HG1 GLN 200 3.800 0.366 7.545 234 HE21 GLN 200 HE21 GLN 200 5.400 0.259 9.115 235 HE22 GLN 200 HE22 GLN 200 5.179 -0.614 10.596 236 H ASP 201 HN ASP 201 4.151 4.212 6.635 237 HA ASP 201 HA ASP 201 4.940 2.966 4.164 238 HB2 ASP 201 HB2 ASP 201 5.212 5.432 4.705 239 HB3 ASP 201 HB1 ASP 201 6.513 4.970 5.798 240 HA PRO 202 HA PRO 202 7.113 -0.344 6.258 241 HB2 PRO 202 HB2 PRO 202 8.561 -1.060 3.963 242 HB3 PRO 202 HB1 PRO 202 7.025 -1.742 4.496 243 HG2 PRO 202 HG2 PRO 202 7.567 0.326 2.436 244 HG3 PRO 202 HG1 PRO 202 6.279 -0.888 2.508 245 HD2 PRO 202 HD2 PRO 202 5.817 1.717 3.035 246 HD3 PRO 202 HD1 PRO 202 4.941 0.409 3.870 247 H ARG 203 HN ARG 203 8.602 2.355 4.664 248 HA ARG 203 HA ARG 203 11.280 1.558 5.492 249 HB2 ARG 203 HB2 ARG 203 10.343 4.076 4.111 250 HB3 ARG 203 HB1 ARG 203 12.018 3.592 4.350 251 HG2 ARG 203 HG2 ARG 203 11.856 1.844 2.818 252 HG3 ARG 203 HG1 ARG 203 10.090 1.854 2.860 253 HD2 ARG 203 HD2 ARG 203 11.855 4.010 1.708 254 HD3 ARG 203 HD1 ARG 203 10.926 2.821 0.789 255 HE ARG 203 HE ARG 203 9.060 4.056 2.352 256 HH11 ARG 203 HH11 ARG 203 11.529 5.302 0.209 257 HH12 ARG 203 HH12 ARG 203 10.521 6.563 -0.436 258 HH21 ARG 203 HH21 ARG 203 7.736 5.735 1.568 259 HH22 ARG 203 HH22 ARG 203 8.361 6.825 0.351 260 H LYS 204 HN LYS 204 8.641 3.208 6.734 261 HA LYS 204 HA LYS 204 10.005 5.212 8.256 262 HB2 LYS 204 HB2 LYS 204 7.665 5.442 7.498 263 HB3 LYS 204 HB1 LYS 204 7.203 4.101 8.533 264 HG2 LYS 204 HG2 LYS 204 6.572 6.131 9.600 265 HG3 LYS 204 HG1 LYS 204 7.931 5.446 10.492 266 HD2 LYS 204 HD2 LYS 204 9.451 7.001 9.458 267 HD3 LYS 204 HD1 LYS 204 8.169 7.615 8.409 268 HE2 LYS 204 HE2 LYS 204 8.207 7.790 11.419 269 HE3 LYS 204 HE1 LYS 204 8.606 9.104 10.316 270 HZ1 LYS 204 HZ1 LYS 204 5.972 7.727 10.373 271 HZ2 LYS 204 HZ2 LYS 204 6.373 9.123 9.503 272 HZ3 LYS 204 HZ3 LYS 204 6.302 9.167 11.196 273 H ALA 205 HN ALA 205 9.450 1.875 8.659 274 HA ALA 205 HA ALA 205 9.772 2.031 11.568 275 HB1 ALA 205 HB1 ALA 205 7.907 0.680 10.758 276 HB2 ALA 205 HB2 ALA 205 9.096 -0.317 11.597 277 HB3 ALA 205 HB3 ALA 205 9.026 -0.321 9.834 278 H1 SER 201 HT1 SER 201 -12.655 3.446 -5.048 279 H2 SER 201 HT2 SER 201 -12.802 2.885 -3.451 280 H3 SER 201 HT3 SER 201 -13.882 2.354 -4.640 281 HA SER 201 HA SER 201 -10.983 1.790 -4.563 282 HB2 SER 201 HB2 SER 201 -12.548 0.583 -2.910 283 HB3 SER 201 HB1 SER 201 -13.246 -0.198 -4.330 284 HG SER 201 HG SER 201 -10.677 -0.446 -3.212 285 H TPO 202 HN TPO 202 -10.308 1.905 -6.615 286 HA TPO 202 HA TPO 202 -12.122 0.990 -8.741 287 HB TPO 202 HB TPO 202 -9.719 2.818 -8.952 288 HG21 TPO 202 HG21 TPO 202 -11.874 2.139 -10.963 289 HG22 TPO 202 HG22 TPO 202 -10.185 1.633 -11.039 290 HG23 TPO 202 HG23 TPO 202 -10.601 3.339 -11.186 291 H TYR 203 HN TYR 203 -8.974 0.514 -7.317 292 HA TYR 203 HA TYR 203 -8.377 -1.504 -9.356 293 HB2 TYR 203 HB2 TYR 203 -7.086 0.383 -10.005 294 HB3 TYR 203 HB1 TYR 203 -6.567 0.687 -8.355 295 HD1 TYR 203 HD1 TYR 203 -6.338 -1.958 -10.995 296 HD2 TYR 203 HD2 TYR 203 -4.461 0.017 -7.728 297 HE1 TYR 203 HE1 TYR 203 -4.270 -3.218 -11.423 298 HE2 TYR 203 HE2 TYR 203 -2.395 -1.244 -8.141 299 HH TYR 203 HH TYR 203 -1.644 -3.266 -9.197 300 HA PRO 204 HA PRO 204 -6.179 -3.008 -5.503 301 HB2 PRO 204 HB2 PRO 204 -5.610 -1.294 -3.456 302 HB3 PRO 204 HB1 PRO 204 -4.632 -1.437 -4.917 303 HG2 PRO 204 HG2 PRO 204 -6.260 0.785 -4.054 304 HG3 PRO 204 HG1 PRO 204 -5.185 0.687 -5.456 305 HD2 PRO 204 HD2 PRO 204 -8.107 0.345 -5.303 306 HD3 PRO 204 HD1 PRO 204 -7.087 0.745 -6.702 307 H HIS 205 HN HIS 205 -6.372 -2.285 -2.635 308 HA HIS 205 HA HIS 205 -9.186 -2.545 -1.989 309 HB2 HIS 205 HB2 HIS 205 -8.466 -4.881 -2.427 310 HB3 HIS 205 HB1 HIS 205 -7.189 -4.701 -1.236 311 HD1 HIS 205 HD1 HIS 205 -10.042 -6.514 -1.421 312 HD2 HIS 205 HD2 HIS 205 -8.840 -3.622 1.323 313 HE1 HIS 205 HE1 HIS 205 -11.375 -6.954 0.671 314 HE2 HIS 205 HE2 HIS 205 -10.552 -5.260 2.350 315 H SEP 206 HN SEP 206 -9.244 -0.829 -0.638 316 HA SEP 206 HA SEP 206 -7.118 -0.224 1.172 317 HB2 SEP 206 HB2 SEP 206 -8.996 1.354 2.110 318 HB3 SEP 206 HB1 SEP 206 -8.272 1.673 0.543 319 HA PRO 207 HA PRO 207 -8.016 -3.118 4.281 320 HB2 PRO 207 HB2 PRO 207 -6.660 -1.397 6.208 321 HB3 PRO 207 HB1 PRO 207 -6.148 -2.947 5.541 322 HG2 PRO 207 HG2 PRO 207 -4.939 -0.600 4.916 323 HG3 PRO 207 HG1 PRO 207 -5.020 -1.975 3.802 324 HD2 PRO 207 HD2 PRO 207 -6.641 0.530 3.843 325 HD3 PRO 207 HD1 PRO 207 -6.003 -0.383 2.459 326 H THR 208 HN THR 208 -9.048 0.167 4.644 327 HA THR 208 HA THR 208 -10.992 -0.657 6.660 328 HB THR 208 HB THR 208 -10.481 1.601 7.842 329 HG1 THR 208 HG1 THR 208 -8.870 2.604 6.901 330 HG21 THR 208 HG21 THR 208 -10.149 -0.587 8.887 331 HG22 THR 208 HG22 THR 208 -8.852 0.528 9.317 332 HG23 THR 208 HG23 THR 208 -8.573 -0.723 8.106 333 H SER 209 HN SER 209 -12.937 0.114 6.221 334 HA SER 209 HA SER 209 -13.429 2.761 5.354 335 HB2 SER 209 HB2 SER 209 -12.685 1.700 3.182 336 HB3 SER 209 HB1 SER 209 -14.079 0.630 3.300 337 HG SER 209 HG SER 209 -15.290 2.744 3.515 Start of MODEL 17 1 H ASP 170 H ASP 170 14.989 2.721 -6.816 2 HA ASP 170 HA ASP 170 14.068 0.740 -7.729 3 HB2 ASP 170 HB2 ASP 170 16.807 -0.451 -7.248 4 HB3 ASP 170 HB1 ASP 170 15.384 -1.355 -7.757 5 H VAL 171 HN VAL 171 16.331 0.984 -5.013 6 HA VAL 171 HA VAL 171 14.824 -0.877 -3.434 7 HB VAL 171 HB VAL 171 17.269 -0.688 -3.214 8 HG11 VAL 171 HG11 VAL 171 18.195 1.126 -1.796 9 HG12 VAL 171 HG12 VAL 171 16.654 1.970 -1.944 10 HG13 VAL 171 HG13 VAL 171 17.637 1.664 -3.378 11 HG21 VAL 171 HG21 VAL 171 15.977 -1.733 -1.453 12 HG22 VAL 171 HG22 VAL 171 15.713 -0.167 -0.686 13 HG23 VAL 171 HG23 VAL 171 17.339 -0.848 -0.764 14 HA PRO 172 HA PRO 172 13.698 3.239 -1.041 15 HB2 PRO 172 HB2 PRO 172 12.786 4.951 -3.259 16 HB3 PRO 172 HB1 PRO 172 13.775 5.358 -1.854 17 HG2 PRO 172 HG2 PRO 172 14.841 5.213 -4.300 18 HG3 PRO 172 HG1 PRO 172 15.736 4.668 -2.868 19 HD2 PRO 172 HD2 PRO 172 14.239 3.045 -4.898 20 HD3 PRO 172 HD1 PRO 172 15.836 2.750 -4.185 21 H LEU 173 HN LEU 173 12.153 1.648 -3.641 22 HA LEU 173 HA LEU 173 9.593 1.924 -2.235 23 HB2 LEU 173 HB2 LEU 173 9.925 3.301 -4.487 24 HB3 LEU 173 HB1 LEU 173 9.568 1.749 -5.216 25 HG LEU 173 HG LEU 173 7.759 3.272 -3.331 26 HD11 LEU 173 HD11 LEU 173 7.566 2.775 -6.295 27 HD12 LEU 173 HD12 LEU 173 7.918 4.315 -5.512 28 HD13 LEU 173 HD13 LEU 173 6.339 3.559 -5.300 29 HD21 LEU 173 HD21 LEU 173 7.541 0.803 -3.152 30 HD22 LEU 173 HD22 LEU 173 7.154 0.755 -4.873 31 HD23 LEU 173 HD23 LEU 173 6.091 1.609 -3.749 32 HA PRO 174 HA PRO 174 10.481 -2.511 -2.352 33 HB2 PRO 174 HB2 PRO 174 7.815 -2.598 -1.060 34 HB3 PRO 174 HB1 PRO 174 9.351 -3.286 -0.527 35 HG2 PRO 174 HG2 PRO 174 8.296 -1.121 0.642 36 HG3 PRO 174 HG1 PRO 174 10.046 -1.318 0.449 37 HD2 PRO 174 HD2 PRO 174 8.148 0.401 -1.070 38 HD3 PRO 174 HD1 PRO 174 9.837 0.699 -0.616 39 H ALA 175 HN ALA 175 9.736 -4.251 -3.567 40 HA ALA 175 HA ALA 175 8.020 -3.413 -5.767 41 HB1 ALA 175 HB1 ALA 175 10.228 -4.348 -6.255 42 HB2 ALA 175 HB2 ALA 175 8.936 -5.316 -6.964 43 HB3 ALA 175 HB3 ALA 175 9.748 -5.867 -5.499 44 H GLY 176 HN GLY 176 7.945 -5.632 -3.076 45 HA2 GLY 176 HA2 GLY 176 5.758 -7.202 -4.142 46 HA3 GLY 176 HA1 GLY 176 6.389 -7.293 -2.497 47 H TRP 177 HN TRP 177 5.812 -4.110 -3.270 48 HA TRP 177 HA TRP 177 3.328 -4.191 -1.703 49 HB2 TRP 177 HB2 TRP 177 5.409 -1.995 -1.896 50 HB3 TRP 177 HB1 TRP 177 3.943 -1.923 -0.927 51 HD1 TRP 177 HD1 TRP 177 6.688 -4.669 -1.169 52 HE1 TRP 177 HE1 TRP 177 7.495 -5.216 1.207 53 HE3 TRP 177 HE3 TRP 177 3.864 -1.308 1.451 54 HZ2 TRP 177 HZ2 TRP 177 7.010 -4.342 3.833 55 HZ3 TRP 177 HZ3 TRP 177 4.098 -1.231 3.893 56 HH2 TRP 177 HH2 TRP 177 5.643 -2.716 5.057 57 H GLU 178 HN GLU 178 1.544 -3.453 -2.563 58 HA GLU 178 HA GLU 178 1.569 -2.360 -5.258 59 HB2 GLU 178 HB2 GLU 178 0.049 -4.236 -4.741 60 HB3 GLU 178 HB1 GLU 178 -0.714 -3.287 -3.476 61 HG2 GLU 178 HG2 GLU 178 -1.739 -1.855 -5.024 62 HG3 GLU 178 HG1 GLU 178 -0.681 -2.374 -6.337 63 H MET 179 HN MET 179 1.128 -0.276 -5.738 64 HA MET 179 HA MET 179 0.797 1.559 -3.499 65 HB2 MET 179 HB2 MET 179 1.187 2.174 -6.433 66 HB3 MET 179 HB1 MET 179 1.244 3.333 -5.113 67 HG2 MET 179 HG2 MET 179 3.162 1.040 -5.416 68 HG3 MET 179 HG1 MET 179 3.438 2.668 -6.032 69 HE1 MET 179 HE1 MET 179 4.024 4.726 -4.620 70 HE2 MET 179 HE2 MET 179 3.823 4.820 -2.871 71 HE3 MET 179 HE3 MET 179 2.412 4.628 -3.911 72 H ALA 180 HN ALA 180 -1.259 1.811 -2.859 73 HA ALA 180 HA ALA 180 -3.246 2.418 -4.940 74 HB1 ALA 180 HB1 ALA 180 -4.947 2.002 -3.239 75 HB2 ALA 180 HB2 ALA 180 -3.687 1.686 -2.046 76 HB3 ALA 180 HB3 ALA 180 -3.885 0.606 -3.426 77 H LYS 181 HN LYS 181 -2.809 4.536 -5.349 78 HA LYS 181 HA LYS 181 -2.736 6.369 -3.047 79 HB2 LYS 181 HB2 LYS 181 -1.662 6.836 -5.838 80 HB3 LYS 181 HB1 LYS 181 -1.481 7.909 -4.458 81 HG2 LYS 181 HG2 LYS 181 -0.187 6.101 -3.317 82 HG3 LYS 181 HG1 LYS 181 -0.239 5.180 -4.824 83 HD2 LYS 181 HD2 LYS 181 0.905 7.961 -4.583 84 HD3 LYS 181 HD1 LYS 181 1.863 6.489 -4.455 85 HE2 LYS 181 HE2 LYS 181 2.147 7.094 -6.675 86 HE3 LYS 181 HE1 LYS 181 0.853 5.902 -6.760 87 HZ1 LYS 181 HZ1 LYS 181 -0.753 7.611 -7.017 88 HZ2 LYS 181 HZ2 LYS 181 0.496 7.953 -8.108 89 HZ3 LYS 181 HZ3 LYS 181 0.375 8.830 -6.663 90 H THR 182 HN THR 182 -4.762 7.124 -2.747 91 HA THR 182 HA THR 182 -6.296 7.959 -5.115 92 HB THR 182 HB THR 182 -8.264 7.998 -3.633 93 HG1 THR 182 HG1 THR 182 -7.162 6.616 -1.568 94 HG21 THR 182 HG21 THR 182 -6.713 5.414 -3.453 95 HG22 THR 182 HG22 THR 182 -7.707 5.924 -4.819 96 HG23 THR 182 HG23 THR 182 -8.457 5.592 -3.257 97 H SER 183 HN SER 183 -7.103 10.038 -5.304 98 HA SER 183 HA SER 183 -5.479 12.087 -4.241 99 HB2 SER 183 HB2 SER 183 -8.181 12.411 -5.564 100 HB3 SER 183 HB1 SER 183 -6.893 13.611 -5.465 101 HG SER 183 HG SER 183 -7.146 12.299 -7.486 102 H SER 184 HN SER 184 -8.249 10.529 -3.021 103 HA SER 184 HA SER 184 -9.327 12.578 -1.411 104 HB2 SER 184 HB2 SER 184 -9.379 9.598 -0.879 105 HB3 SER 184 HB1 SER 184 -10.510 10.804 -0.264 106 HG SER 184 HG SER 184 -11.588 10.664 -2.058 107 H GLY 185 HN GLY 185 -6.418 10.858 -1.221 108 HA2 GLY 185 HA2 GLY 185 -4.711 11.548 0.303 109 HA3 GLY 185 HA1 GLY 185 -5.961 11.920 1.483 110 H GLN 186 HN GLN 186 -6.076 8.968 -0.358 111 HA GLN 186 HA GLN 186 -5.391 7.514 2.114 112 HB2 GLN 186 HB2 GLN 186 -7.404 6.806 -0.028 113 HB3 GLN 186 HB1 GLN 186 -6.892 5.693 1.233 114 HG2 GLN 186 HG2 GLN 186 -7.818 7.051 2.935 115 HG3 GLN 186 HG1 GLN 186 -8.096 8.381 1.814 116 HE21 GLN 186 HE21 GLN 186 -8.774 5.066 0.948 117 HE22 GLN 186 HE22 GLN 186 -10.499 5.216 0.950 118 H ARG 187 HN ARG 187 -3.481 6.649 1.951 119 HA ARG 187 HA ARG 187 -2.745 5.328 -0.570 120 HB2 ARG 187 HB2 ARG 187 -0.328 5.917 0.146 121 HB3 ARG 187 HB1 ARG 187 -1.321 7.161 -0.603 122 HG2 ARG 187 HG2 ARG 187 -1.831 8.082 1.603 123 HG3 ARG 187 HG1 ARG 187 -0.830 6.837 2.351 124 HD2 ARG 187 HD2 ARG 187 0.249 8.722 0.280 125 HD3 ARG 187 HD1 ARG 187 0.209 9.141 1.991 126 HE ARG 187 HE ARG 187 1.436 6.650 1.761 127 HH11 ARG 187 HH11 ARG 187 2.017 9.928 0.684 128 HH12 ARG 187 HH12 ARG 187 3.748 9.834 0.895 129 HH21 ARG 187 HH21 ARG 187 3.724 6.504 2.012 130 HH22 ARG 187 HH22 ARG 187 4.716 7.880 1.638 131 H TYR 188 HN TYR 188 -3.128 3.224 0.000 132 HA TYR 188 HA TYR 188 -1.713 2.241 2.383 133 HB2 TYR 188 HB2 TYR 188 -3.399 0.455 2.542 134 HB3 TYR 188 HB1 TYR 188 -4.127 2.048 2.691 135 HD1 TYR 188 HD2 TYR 188 -5.446 2.977 0.803 136 HD2 TYR 188 HD1 TYR 188 -4.004 -1.024 0.782 137 HE1 TYR 188 HE2 TYR 188 -7.047 2.418 -0.971 138 HE2 TYR 188 HE1 TYR 188 -5.606 -1.599 -0.995 139 HH TYR 188 HH TYR 188 -7.420 0.819 -2.670 140 H PHE 189 HN PHE 189 -0.608 0.294 2.190 141 HA PHE 189 HA PHE 189 0.011 -0.406 -0.597 142 HB2 PHE 189 HB2 PHE 189 1.779 -0.664 1.845 143 HB3 PHE 189 HB1 PHE 189 2.220 -1.075 0.189 144 HD1 PHE 189 HD2 PHE 189 1.144 1.197 -1.301 145 HD2 PHE 189 HD1 PHE 189 3.194 1.088 2.422 146 HE1 PHE 189 HE2 PHE 189 1.943 3.491 -1.684 147 HE2 PHE 189 HE1 PHE 189 3.992 3.386 2.056 148 HZ PHE 189 HZ PHE 189 3.372 4.589 -0.003 149 H LEU 190 HN LEU 190 -0.383 -2.376 -1.259 150 HA LEU 190 HA LEU 190 -1.106 -4.476 0.612 151 HB2 LEU 190 HB2 LEU 190 -1.229 -4.094 -2.320 152 HB3 LEU 190 HB1 LEU 190 -1.091 -5.733 -1.748 153 HG LEU 190 HG LEU 190 -3.358 -3.825 -1.524 154 HD11 LEU 190 HD11 LEU 190 -3.999 -5.319 -3.059 155 HD12 LEU 190 HD12 LEU 190 -4.217 -6.450 -1.704 156 HD13 LEU 190 HD13 LEU 190 -2.710 -6.435 -2.617 157 HD21 LEU 190 HD21 LEU 190 -2.874 -4.384 0.821 158 HD22 LEU 190 HD22 LEU 190 -2.880 -6.099 0.411 159 HD23 LEU 190 HD23 LEU 190 -4.363 -5.155 0.271 160 H ASN 191 HN ASN 191 0.446 -5.936 1.398 161 HA ASN 191 HA ASN 191 2.849 -6.287 -0.226 162 HB2 ASN 191 HB2 ASN 191 2.081 -7.703 2.348 163 HB3 ASN 191 HB1 ASN 191 3.622 -7.838 1.513 164 HD21 ASN 191 HD21 ASN 191 1.918 -4.795 1.910 165 HD22 ASN 191 HD22 ASN 191 3.050 -4.107 3.019 166 H HIS 192 HN HIS 192 2.395 -7.430 -2.038 167 HA HIS 192 HA HIS 192 0.180 -9.236 -2.148 168 HB2 HIS 192 HB2 HIS 192 2.242 -8.326 -4.090 169 HB3 HIS 192 HB1 HIS 192 1.380 -9.820 -4.447 170 HD1 HIS 192 HD1 HIS 192 -1.372 -9.525 -4.328 171 HD2 HIS 192 HD2 HIS 192 0.937 -6.111 -4.931 172 HE1 HIS 192 HE1 HIS 192 -2.941 -7.798 -5.262 173 HE2 HIS 192 HE2 HIS 192 -1.491 -5.805 -5.793 174 H ILE 193 HN ILE 193 3.132 -9.664 -0.851 175 HA ILE 193 HA ILE 193 3.455 -12.434 -1.642 176 HB ILE 193 HB ILE 193 5.375 -12.320 0.046 177 HG12 ILE 193 HG12 ILE 193 4.757 -9.358 -0.159 178 HG13 ILE 193 HG11 ILE 193 4.501 -10.364 1.275 179 HG21 ILE 193 HG21 ILE 193 5.401 -10.475 -2.340 180 HG22 ILE 193 HG22 ILE 193 5.720 -12.208 -2.359 181 HG23 ILE 193 HG23 ILE 193 6.829 -11.117 -1.527 182 HD11 ILE 193 HD11 ILE 193 6.477 -9.282 1.728 183 HD12 ILE 193 HD12 ILE 193 7.034 -9.386 0.065 184 HD13 ILE 193 HD13 ILE 193 7.032 -10.828 1.083 185 H ASP 194 HN ASP 194 2.657 -10.543 1.261 186 HA ASP 194 HA ASP 194 1.963 -13.015 2.664 187 HB2 ASP 194 HB2 ASP 194 3.489 -11.434 3.794 188 HB3 ASP 194 HB1 ASP 194 2.233 -10.209 3.749 189 H GLN 195 HN GLN 195 0.435 -10.484 0.980 190 HA GLN 195 HA GLN 195 -1.757 -9.845 0.681 191 HB2 GLN 195 HB2 GLN 195 -2.253 -12.308 0.896 192 HB3 GLN 195 HB1 GLN 195 -2.449 -12.080 2.625 193 HG2 GLN 195 HG2 GLN 195 -4.286 -10.458 2.109 194 HG3 GLN 195 HG1 GLN 195 -4.159 -10.959 0.424 195 HE21 GLN 195 HE21 GLN 195 -6.372 -11.218 2.343 196 HE22 GLN 195 HE22 GLN 195 -6.737 -12.911 2.400 197 H THR 196 HN THR 196 0.023 -8.762 2.650 198 HA THR 196 HA THR 196 -1.573 -8.230 5.021 199 HB THR 196 HB THR 196 0.815 -6.655 4.928 200 HG1 THR 196 HG1 THR 196 1.567 -9.327 4.767 201 HG21 THR 196 HG21 THR 196 0.470 -9.203 6.475 202 HG22 THR 196 HG22 THR 196 -0.471 -7.762 6.880 203 HG23 THR 196 HG23 THR 196 1.292 -7.715 6.957 204 H THR 197 HN THR 197 -2.690 -6.437 5.391 205 HA THR 197 HA THR 197 -2.737 -4.309 3.415 206 HB THR 197 HB THR 197 -4.555 -3.501 5.183 207 HG1 THR 197 HG1 THR 197 -5.499 -5.420 6.147 208 HG21 THR 197 HG21 THR 197 -6.238 -4.815 3.976 209 HG22 THR 197 HG22 THR 197 -4.969 -5.863 3.344 210 HG23 THR 197 HG23 THR 197 -5.029 -4.166 2.868 211 H THR 198 HN THR 198 -1.550 -2.504 3.647 212 HA THR 198 HA THR 198 -0.463 -1.904 6.324 213 HB THR 198 HB THR 198 0.967 -1.636 3.671 214 HG1 THR 198 HG1 THR 198 0.493 -3.825 4.844 215 HG21 THR 198 HG21 THR 198 2.960 -1.252 5.037 216 HG22 THR 198 HG22 THR 198 1.979 -1.337 6.497 217 HG23 THR 198 HG23 THR 198 1.731 -0.026 5.348 218 H TRP 199 HN TRP 199 -0.673 0.205 7.007 219 HA TRP 199 HA TRP 199 -1.200 2.267 4.962 220 HB2 TRP 199 HB2 TRP 199 -2.031 2.119 7.858 221 HB3 TRP 199 HB1 TRP 199 -2.031 3.634 6.969 222 HD1 TRP 199 HD1 TRP 199 -4.049 0.513 7.526 223 HE1 TRP 199 HE1 TRP 199 -6.253 0.674 6.215 224 HE3 TRP 199 HE3 TRP 199 -3.006 4.626 4.656 225 HZ2 TRP 199 HZ2 TRP 199 -7.401 2.315 4.219 226 HZ3 TRP 199 HZ3 TRP 199 -4.720 5.421 3.070 227 HH2 TRP 199 HH2 TRP 199 -6.866 4.287 2.862 228 H GLN 200 HN GLN 200 1.160 1.033 6.903 229 HA GLN 200 HA GLN 200 2.318 3.601 7.665 230 HB2 GLN 200 HB2 GLN 200 3.908 2.251 8.986 231 HB3 GLN 200 HB1 GLN 200 2.234 1.920 9.407 232 HG2 GLN 200 HG2 GLN 200 2.350 -0.092 7.929 233 HG3 GLN 200 HG1 GLN 200 4.078 0.210 7.763 234 HE21 GLN 200 HE21 GLN 200 5.426 -0.086 9.552 235 HE22 GLN 200 HE22 GLN 200 4.921 -0.993 10.931 236 H ASP 201 HN ASP 201 4.341 4.273 7.020 237 HA ASP 201 HA ASP 201 5.036 3.546 4.331 238 HB2 ASP 201 HB2 ASP 201 5.097 5.881 5.266 239 HB3 ASP 201 HB1 ASP 201 6.508 5.407 6.207 240 HA PRO 202 HA PRO 202 7.809 0.226 5.363 241 HB2 PRO 202 HB2 PRO 202 8.845 0.724 2.655 242 HB3 PRO 202 HB1 PRO 202 8.147 -0.743 3.342 243 HG2 PRO 202 HG2 PRO 202 6.853 0.833 1.550 244 HG3 PRO 202 HG1 PRO 202 6.025 -0.162 2.757 245 HD2 PRO 202 HD2 PRO 202 6.385 2.775 2.681 246 HD3 PRO 202 HD1 PRO 202 5.134 1.804 3.467 247 H ARG 203 HN ARG 203 8.775 3.416 4.388 248 HA ARG 203 HA ARG 203 11.605 2.793 4.688 249 HB2 ARG 203 HB2 ARG 203 10.132 5.302 3.906 250 HB3 ARG 203 HB1 ARG 203 11.849 5.317 4.275 251 HG2 ARG 203 HG2 ARG 203 11.626 5.198 1.922 252 HG3 ARG 203 HG1 ARG 203 12.171 3.617 2.474 253 HD2 ARG 203 HD2 ARG 203 10.442 3.437 0.749 254 HD3 ARG 203 HD1 ARG 203 9.910 2.744 2.278 255 HE ARG 203 HE ARG 203 8.623 4.827 2.622 256 HH11 ARG 203 HH11 ARG 203 9.666 4.040 -0.644 257 HH12 ARG 203 HH12 ARG 203 8.337 4.870 -1.391 258 HH21 ARG 203 HH21 ARG 203 6.876 5.888 1.641 259 HH22 ARG 203 HH22 ARG 203 6.756 5.932 -0.096 260 H LYS 204 HN LYS 204 8.988 3.893 6.560 261 HA LYS 204 HA LYS 204 10.767 5.042 8.589 262 HB2 LYS 204 HB2 LYS 204 7.751 5.064 8.391 263 HB3 LYS 204 HB1 LYS 204 8.679 5.803 9.689 264 HG2 LYS 204 HG2 LYS 204 8.836 6.567 6.779 265 HG3 LYS 204 HG1 LYS 204 7.942 7.438 8.024 266 HD2 LYS 204 HD2 LYS 204 10.846 6.912 8.444 267 HD3 LYS 204 HD1 LYS 204 10.369 8.178 7.314 268 HE2 LYS 204 HE2 LYS 204 10.752 9.136 9.495 269 HE3 LYS 204 HE1 LYS 204 9.042 9.240 9.094 270 HZ1 LYS 204 HZ1 LYS 204 10.251 7.176 10.860 271 HZ2 LYS 204 HZ2 LYS 204 8.598 7.374 10.533 272 HZ3 LYS 204 HZ3 LYS 204 9.442 8.564 11.397 273 H ALA 205 HN ALA 205 9.134 2.197 7.807 274 HA ALA 205 HA ALA 205 8.966 1.255 10.557 275 HB1 ALA 205 HB1 ALA 205 7.122 0.738 9.030 276 HB2 ALA 205 HB2 ALA 205 7.912 -0.728 9.607 277 HB3 ALA 205 HB3 ALA 205 8.237 -0.135 7.979 278 H1 SER 201 HT1 SER 201 -9.818 -0.308 -14.231 279 H2 SER 201 HT2 SER 201 -11.487 -0.225 -14.523 280 H3 SER 201 HT3 SER 201 -10.610 -1.599 -14.994 281 HA SER 201 HA SER 201 -11.076 -0.685 -12.221 282 HB2 SER 201 HB2 SER 201 -13.080 -1.654 -13.234 283 HB3 SER 201 HB1 SER 201 -12.161 -3.059 -13.764 284 HG SER 201 HG SER 201 -12.328 -2.340 -11.023 285 H TPO 202 HN TPO 202 -8.999 -0.819 -11.505 286 HA TPO 202 HA TPO 202 -7.858 -3.529 -11.388 287 HB TPO 202 HB TPO 202 -5.831 -1.434 -11.357 288 HG21 TPO 202 HG21 TPO 202 -5.346 -3.817 -11.604 289 HG22 TPO 202 HG22 TPO 202 -4.766 -2.910 -13.001 290 HG23 TPO 202 HG23 TPO 202 -6.253 -3.852 -13.116 291 H TYR 203 HN TYR 203 -9.138 -1.024 -9.776 292 HA TYR 203 HA TYR 203 -7.250 -0.909 -7.563 293 HB2 TYR 203 HB2 TYR 203 -8.251 1.169 -8.507 294 HB3 TYR 203 HB1 TYR 203 -9.837 0.599 -8.006 295 HD1 TYR 203 HD2 TYR 203 -6.463 1.330 -6.593 296 HD2 TYR 203 HD1 TYR 203 -10.670 1.284 -5.950 297 HE1 TYR 203 HE2 TYR 203 -6.136 2.407 -4.411 298 HE2 TYR 203 HE1 TYR 203 -10.351 2.364 -3.763 299 HH TYR 203 HH TYR 203 -8.776 2.842 -2.137 300 HA PRO 204 HA PRO 204 -9.785 -3.863 -5.334 301 HB2 PRO 204 HB2 PRO 204 -8.298 -3.926 -3.081 302 HB3 PRO 204 HB1 PRO 204 -7.784 -4.725 -4.570 303 HG2 PRO 204 HG2 PRO 204 -6.920 -2.095 -3.437 304 HG3 PRO 204 HG1 PRO 204 -5.942 -3.359 -4.203 305 HD2 PRO 204 HD2 PRO 204 -6.769 -1.096 -5.493 306 HD3 PRO 204 HD1 PRO 204 -6.437 -2.631 -6.319 307 H HIS 205 HN HIS 205 -9.139 -3.047 -2.323 308 HA HIS 205 HA HIS 205 -10.771 -0.662 -2.074 309 HB2 HIS 205 HB2 HIS 205 -12.328 -2.701 -2.135 310 HB3 HIS 205 HB1 HIS 205 -11.612 -3.156 -0.592 311 HD1 HIS 205 HD1 HIS 205 -11.942 -1.316 1.391 312 HD2 HIS 205 HD2 HIS 205 -14.364 -0.895 -1.966 313 HE1 HIS 205 HE1 HIS 205 -13.849 0.156 2.107 314 HE2 HIS 205 HE2 HIS 205 -15.343 0.336 0.088 315 H SEP 206 HN SEP 206 -10.254 0.479 -0.285 316 HA SEP 206 HA SEP 206 -7.874 -0.146 1.097 317 HB2 SEP 206 HB2 SEP 206 -8.644 1.830 2.561 318 HB3 SEP 206 HB1 SEP 206 -8.366 2.145 0.849 319 HA PRO 207 HA PRO 207 -9.214 -2.550 4.580 320 HB2 PRO 207 HB2 PRO 207 -7.556 -0.842 6.315 321 HB3 PRO 207 HB1 PRO 207 -7.427 -2.572 5.992 322 HG2 PRO 207 HG2 PRO 207 -5.660 -0.771 5.018 323 HG3 PRO 207 HG1 PRO 207 -6.072 -2.258 4.153 324 HD2 PRO 207 HD2 PRO 207 -6.947 0.541 3.644 325 HD3 PRO 207 HD1 PRO 207 -6.641 -0.775 2.493 326 H THR 208 HN THR 208 -9.544 0.859 4.416 327 HA THR 208 HA THR 208 -11.363 0.968 6.690 328 HB THR 208 HB THR 208 -11.524 3.426 5.971 329 HG1 THR 208 HG1 THR 208 -10.603 2.982 3.828 330 HG21 THR 208 HG21 THR 208 -9.371 3.988 7.014 331 HG22 THR 208 HG22 THR 208 -8.846 2.315 6.820 332 HG23 THR 208 HG23 THR 208 -10.197 2.698 7.887 333 H SER 209 HN SER 209 -13.421 0.393 6.336 334 HA SER 209 HA SER 209 -14.545 0.877 3.658 335 HB2 SER 209 HB2 SER 209 -15.381 -1.205 5.690 336 HB3 SER 209 HB1 SER 209 -16.053 -1.001 4.070 337 HG SER 209 HG SER 209 -13.292 -1.318 4.282 Start of MODEL 18 1 H ASP 170 H ASP 170 13.968 5.556 -5.983 2 HA ASP 170 HA ASP 170 11.674 3.782 -6.540 3 HB2 ASP 170 HB2 ASP 170 13.266 2.888 -8.349 4 HB3 ASP 170 HB1 ASP 170 12.419 4.398 -8.663 5 H VAL 171 HN VAL 171 14.926 4.145 -5.202 6 HA VAL 171 HA VAL 171 15.184 1.307 -4.853 7 HB VAL 171 HB VAL 171 17.244 1.683 -3.687 8 HG11 VAL 171 HG11 VAL 171 16.965 3.466 -6.097 9 HG12 VAL 171 HG12 VAL 171 17.307 1.736 -6.099 10 HG13 VAL 171 HG13 VAL 171 18.488 2.868 -5.440 11 HG21 VAL 171 HG21 VAL 171 16.700 4.643 -3.846 12 HG22 VAL 171 HG22 VAL 171 18.141 3.866 -3.197 13 HG23 VAL 171 HG23 VAL 171 16.592 3.666 -2.377 14 HA PRO 172 HA PRO 172 14.027 2.243 -0.300 15 HB2 PRO 172 HB2 PRO 172 12.248 4.165 0.233 16 HB3 PRO 172 HB1 PRO 172 13.977 4.523 0.111 17 HG2 PRO 172 HG2 PRO 172 11.816 4.907 -1.929 18 HG3 PRO 172 HG1 PRO 172 13.113 6.019 -1.454 19 HD2 PRO 172 HD2 PRO 172 13.238 4.432 -3.667 20 HD3 PRO 172 HD1 PRO 172 14.660 4.962 -2.759 21 H LEU 173 HN LEU 173 12.143 2.108 -3.075 22 HA LEU 173 HA LEU 173 9.628 1.477 -1.754 23 HB2 LEU 173 HB2 LEU 173 9.950 2.927 -3.863 24 HB3 LEU 173 HB1 LEU 173 10.190 1.417 -4.711 25 HG LEU 173 HG LEU 173 7.896 2.393 -4.909 26 HD11 LEU 173 HD11 LEU 173 6.700 0.285 -4.552 27 HD12 LEU 173 HD12 LEU 173 8.078 -0.330 -3.637 28 HD13 LEU 173 HD13 LEU 173 8.254 0.043 -5.351 29 HD21 LEU 173 HD21 LEU 173 7.776 3.221 -2.567 30 HD22 LEU 173 HD22 LEU 173 7.577 1.551 -2.037 31 HD23 LEU 173 HD23 LEU 173 6.363 2.295 -3.075 32 HA PRO 174 HA PRO 174 10.921 -2.886 -1.813 33 HB2 PRO 174 HB2 PRO 174 8.232 -3.122 -0.555 34 HB3 PRO 174 HB1 PRO 174 9.798 -3.734 -0.004 35 HG2 PRO 174 HG2 PRO 174 8.657 -1.657 1.191 36 HG3 PRO 174 HG1 PRO 174 10.412 -1.696 0.920 37 HD2 PRO 174 HD2 PRO 174 8.290 -0.242 -0.614 38 HD3 PRO 174 HD1 PRO 174 9.894 0.319 -0.094 39 H ALA 175 HN ALA 175 10.379 -4.567 -3.164 40 HA ALA 175 HA ALA 175 8.591 -3.772 -5.321 41 HB1 ALA 175 HB1 ALA 175 10.552 -6.057 -5.182 42 HB2 ALA 175 HB2 ALA 175 10.882 -4.456 -5.842 43 HB3 ALA 175 HB3 ALA 175 9.695 -5.503 -6.620 44 H GLY 176 HN GLY 176 8.237 -5.581 -2.571 45 HA2 GLY 176 HA2 GLY 176 6.370 -7.483 -3.803 46 HA3 GLY 176 HA1 GLY 176 6.884 -7.476 -2.122 47 H TRP 177 HN TRP 177 6.156 -4.385 -3.191 48 HA TRP 177 HA TRP 177 3.631 -4.500 -1.688 49 HB2 TRP 177 HB2 TRP 177 5.708 -2.297 -1.768 50 HB3 TRP 177 HB1 TRP 177 4.176 -2.208 -0.905 51 HD1 TRP 177 HD1 TRP 177 7.051 -4.829 -0.932 52 HE1 TRP 177 HE1 TRP 177 7.622 -5.420 1.501 53 HE3 TRP 177 HE3 TRP 177 3.736 -1.770 1.428 54 HZ2 TRP 177 HZ2 TRP 177 6.781 -4.676 4.084 55 HZ3 TRP 177 HZ3 TRP 177 3.677 -1.759 3.886 56 HH2 TRP 177 HH2 TRP 177 5.176 -3.184 5.179 57 H GLU 178 HN GLU 178 1.881 -3.608 -2.509 58 HA GLU 178 HA GLU 178 1.958 -2.519 -5.222 59 HB2 GLU 178 HB2 GLU 178 0.369 -4.339 -4.643 60 HB3 GLU 178 HB1 GLU 178 -0.377 -3.292 -3.448 61 HG2 GLU 178 HG2 GLU 178 -1.768 -3.288 -5.358 62 HG3 GLU 178 HG1 GLU 178 -0.957 -1.726 -5.305 63 H MET 179 HN MET 179 1.540 -0.391 -5.675 64 HA MET 179 HA MET 179 1.199 1.402 -3.402 65 HB2 MET 179 HB2 MET 179 1.576 2.042 -6.332 66 HB3 MET 179 HB1 MET 179 1.544 3.215 -5.025 67 HG2 MET 179 HG2 MET 179 3.591 1.034 -5.302 68 HG3 MET 179 HG1 MET 179 3.787 2.693 -5.865 69 HE1 MET 179 HE1 MET 179 3.989 4.785 -2.663 70 HE2 MET 179 HE2 MET 179 2.635 4.557 -3.771 71 HE3 MET 179 HE3 MET 179 4.273 4.730 -4.402 72 H ALA 180 HN ALA 180 -0.870 1.569 -2.731 73 HA ALA 180 HA ALA 180 -2.871 2.185 -4.796 74 HB1 ALA 180 HB1 ALA 180 -3.319 1.297 -1.948 75 HB2 ALA 180 HB2 ALA 180 -3.463 0.280 -3.382 76 HB3 ALA 180 HB3 ALA 180 -4.574 1.627 -3.142 77 H LYS 181 HN LYS 181 -2.337 4.309 -5.088 78 HA LYS 181 HA LYS 181 -2.507 6.078 -2.749 79 HB2 LYS 181 HB2 LYS 181 -1.477 6.711 -5.525 80 HB3 LYS 181 HB1 LYS 181 -1.362 7.741 -4.107 81 HG2 LYS 181 HG2 LYS 181 0.089 6.008 -3.049 82 HG3 LYS 181 HG1 LYS 181 0.075 5.122 -4.579 83 HD2 LYS 181 HD2 LYS 181 1.029 7.971 -4.269 84 HD3 LYS 181 HD1 LYS 181 2.083 6.558 -4.240 85 HE2 LYS 181 HE2 LYS 181 2.238 7.288 -6.442 86 HE3 LYS 181 HE1 LYS 181 1.035 6.006 -6.534 87 HZ1 LYS 181 HZ1 LYS 181 -0.706 7.673 -6.532 88 HZ2 LYS 181 HZ2 LYS 181 0.380 7.971 -7.794 89 HZ3 LYS 181 HZ3 LYS 181 0.436 8.914 -6.387 90 H THR 182 HN THR 182 -4.569 6.732 -2.450 91 HA THR 182 HA THR 182 -6.237 7.189 -4.803 92 HB THR 182 HB THR 182 -8.126 7.374 -3.259 93 HG1 THR 182 HG1 THR 182 -6.950 6.515 -1.001 94 HG21 THR 182 HG21 THR 182 -7.491 5.145 -4.036 95 HG22 THR 182 HG22 THR 182 -8.116 5.076 -2.389 96 HG23 THR 182 HG23 THR 182 -6.379 4.979 -2.678 97 H SER 183 HN SER 183 -7.041 9.160 -5.376 98 HA SER 183 HA SER 183 -5.410 11.369 -4.821 99 HB2 SER 183 HB2 SER 183 -7.269 12.567 -6.159 100 HB3 SER 183 HB1 SER 183 -6.353 11.288 -6.956 101 HG SER 183 HG SER 183 -8.405 10.737 -7.369 102 H SER 184 HN SER 184 -8.134 10.181 -3.156 103 HA SER 184 HA SER 184 -9.071 12.639 -2.071 104 HB2 SER 184 HB2 SER 184 -9.376 9.854 -0.929 105 HB3 SER 184 HB1 SER 184 -10.381 11.259 -0.574 106 HG SER 184 HG SER 184 -10.484 11.080 -3.141 107 H GLY 185 HN GLY 185 -6.308 10.750 -1.513 108 HA2 GLY 185 HA2 GLY 185 -4.557 11.803 -0.198 109 HA3 GLY 185 HA1 GLY 185 -5.788 12.274 0.959 110 H GLN 186 HN GLN 186 -6.032 9.055 -0.302 111 HA GLN 186 HA GLN 186 -5.024 8.085 2.296 112 HB2 GLN 186 HB2 GLN 186 -7.061 6.845 0.443 113 HB3 GLN 186 HB1 GLN 186 -6.380 6.018 1.834 114 HG2 GLN 186 HG2 GLN 186 -8.280 6.794 2.777 115 HG3 GLN 186 HG1 GLN 186 -7.244 8.186 3.079 116 HE21 GLN 186 HE21 GLN 186 -9.852 6.911 1.161 117 HE22 GLN 186 HE22 GLN 186 -10.393 8.429 0.538 118 H ARG 187 HN ARG 187 -3.241 6.949 2.314 119 HA ARG 187 HA ARG 187 -2.407 5.632 -0.177 120 HB2 ARG 187 HB2 ARG 187 -0.059 6.097 0.504 121 HB3 ARG 187 HB1 ARG 187 -0.994 7.543 0.154 122 HG2 ARG 187 HG2 ARG 187 -1.348 7.827 2.601 123 HG3 ARG 187 HG1 ARG 187 -0.247 6.473 2.865 124 HD2 ARG 187 HD2 ARG 187 0.379 9.119 1.568 125 HD3 ARG 187 HD1 ARG 187 0.977 8.519 3.113 126 HE ARG 187 HE ARG 187 1.843 7.686 0.449 127 HH11 ARG 187 HH11 ARG 187 2.072 7.275 3.927 128 HH12 ARG 187 HH12 ARG 187 3.602 6.461 3.845 129 HH21 ARG 187 HH21 ARG 187 3.847 6.627 0.358 130 HH22 ARG 187 HH22 ARG 187 4.622 6.095 1.824 131 H TYR 188 HN TYR 188 -2.441 3.444 0.087 132 HA TYR 188 HA TYR 188 -1.343 2.332 2.545 133 HB2 TYR 188 HB2 TYR 188 -3.197 0.665 2.669 134 HB3 TYR 188 HB1 TYR 188 -3.718 2.311 2.997 135 HD1 TYR 188 HD2 TYR 188 -5.172 3.489 1.422 136 HD2 TYR 188 HD1 TYR 188 -3.958 -0.525 0.706 137 HE1 TYR 188 HE2 TYR 188 -6.951 3.256 -0.259 138 HE2 TYR 188 HE1 TYR 188 -5.735 -0.769 -0.974 139 HH TYR 188 HH TYR 188 -7.617 1.934 -2.078 140 H PHE 189 HN PHE 189 -0.324 0.353 2.252 141 HA PHE 189 HA PHE 189 0.095 -0.292 -0.590 142 HB2 PHE 189 HB2 PHE 189 2.002 -0.634 1.736 143 HB3 PHE 189 HB1 PHE 189 2.342 -1.039 0.054 144 HD1 PHE 189 HD2 PHE 189 0.986 1.391 -1.159 145 HD2 PHE 189 HD1 PHE 189 3.731 0.969 2.059 146 HE1 PHE 189 HE2 PHE 189 1.797 3.675 -1.561 147 HE2 PHE 189 HE1 PHE 189 4.539 3.258 1.678 148 HZ PHE 189 HZ PHE 189 3.572 4.615 -0.138 149 H LEU 190 HN LEU 190 -0.106 -2.334 -1.294 150 HA LEU 190 HA LEU 190 -1.070 -4.360 0.551 151 HB2 LEU 190 HB2 LEU 190 -0.942 -4.085 -2.399 152 HB3 LEU 190 HB1 LEU 190 -0.919 -5.706 -1.747 153 HG LEU 190 HG LEU 190 -3.122 -3.683 -1.697 154 HD11 LEU 190 HD11 LEU 190 -3.859 -5.069 -3.277 155 HD12 LEU 190 HD12 LEU 190 -3.965 -6.349 -2.061 156 HD13 LEU 190 HD13 LEU 190 -2.492 -6.153 -3.009 157 HD21 LEU 190 HD21 LEU 190 -2.888 -6.080 0.125 158 HD22 LEU 190 HD22 LEU 190 -4.317 -5.065 -0.074 159 HD23 LEU 190 HD23 LEU 190 -2.848 -4.393 0.633 160 H ASN 191 HN ASN 191 0.239 -6.037 1.340 161 HA ASN 191 HA ASN 191 2.806 -6.482 0.045 162 HB2 ASN 191 HB2 ASN 191 1.445 -7.885 2.365 163 HB3 ASN 191 HB1 ASN 191 3.015 -8.350 1.716 164 HD21 ASN 191 HD21 ASN 191 1.241 -5.915 3.462 165 HD22 ASN 191 HD22 ASN 191 2.619 -5.110 4.126 166 H HIS 192 HN HIS 192 2.604 -7.467 -1.905 167 HA HIS 192 HA HIS 192 0.402 -9.172 -2.531 168 HB2 HIS 192 HB2 HIS 192 2.913 -8.387 -3.942 169 HB3 HIS 192 HB1 HIS 192 2.048 -9.809 -4.513 170 HD1 HIS 192 HD1 HIS 192 -0.624 -9.292 -5.034 171 HD2 HIS 192 HD2 HIS 192 2.035 -6.088 -5.050 172 HE1 HIS 192 HE1 HIS 192 -1.766 -7.463 -6.332 173 HE2 HIS 192 HE2 HIS 192 -0.057 -5.615 -6.508 174 H ILE 193 HN ILE 193 3.290 -9.653 -0.883 175 HA ILE 193 HA ILE 193 3.450 -12.503 -1.415 176 HB ILE 193 HB ILE 193 5.122 -11.724 0.771 177 HG12 ILE 193 HG12 ILE 193 6.564 -10.172 -0.850 178 HG13 ILE 193 HG11 ILE 193 4.970 -9.771 -1.481 179 HG21 ILE 193 HG21 ILE 193 5.741 -12.480 -2.075 180 HG22 ILE 193 HG22 ILE 193 5.546 -13.581 -0.712 181 HG23 ILE 193 HG23 ILE 193 6.901 -12.453 -0.748 182 HD11 ILE 193 HD11 ILE 193 5.571 -8.154 0.157 183 HD12 ILE 193 HD12 ILE 193 5.947 -9.410 1.335 184 HD13 ILE 193 HD13 ILE 193 4.280 -9.155 0.820 185 H ASP 194 HN ASP 194 2.250 -10.304 0.987 186 HA ASP 194 HA ASP 194 1.773 -12.489 2.878 187 HB2 ASP 194 HB2 ASP 194 2.584 -9.832 3.237 188 HB3 ASP 194 HB1 ASP 194 0.916 -9.868 3.810 189 H GLN 195 HN GLN 195 0.174 -10.745 0.474 190 HA GLN 195 HA GLN 195 -1.990 -10.264 -0.081 191 HB2 GLN 195 HB2 GLN 195 -2.078 -12.800 0.120 192 HB3 GLN 195 HB1 GLN 195 -2.723 -12.576 1.741 193 HG2 GLN 195 HG2 GLN 195 -4.685 -11.541 0.911 194 HG3 GLN 195 HG1 GLN 195 -4.007 -11.408 -0.710 195 HE21 GLN 195 HE21 GLN 195 -5.465 -13.532 1.627 196 HE22 GLN 195 HE22 GLN 195 -5.777 -14.835 0.526 197 H THR 196 HN THR 196 -0.724 -9.047 2.163 198 HA THR 196 HA THR 196 -2.999 -8.443 3.922 199 HB THR 196 HB THR 196 -0.171 -9.157 4.583 200 HG1 THR 196 HG1 THR 196 -1.458 -10.818 5.011 201 HG21 THR 196 HG21 THR 196 -0.195 -7.140 5.728 202 HG22 THR 196 HG22 THR 196 -0.697 -8.313 6.949 203 HG23 THR 196 HG23 THR 196 -1.899 -7.285 6.163 204 H THR 197 HN THR 197 -3.374 -6.336 4.356 205 HA THR 197 HA THR 197 -1.903 -4.415 2.726 206 HB THR 197 HB THR 197 -4.321 -3.734 4.365 207 HG1 THR 197 HG1 THR 197 -4.360 -5.765 2.798 208 HG21 THR 197 HG21 THR 197 -3.224 -1.923 3.182 209 HG22 THR 197 HG22 THR 197 -4.766 -2.274 2.403 210 HG23 THR 197 HG23 THR 197 -3.261 -2.842 1.678 211 H THR 198 HN THR 198 -0.985 -2.524 3.534 212 HA THR 198 HA THR 198 -0.777 -2.281 6.456 213 HB THR 198 HB THR 198 1.523 -2.028 4.505 214 HG1 THR 198 HG1 THR 198 0.542 -4.126 6.060 215 HG21 THR 198 HG21 THR 198 1.480 -1.901 7.523 216 HG22 THR 198 HG22 THR 198 1.745 -0.540 6.432 217 HG23 THR 198 HG23 THR 198 2.922 -1.852 6.506 218 H TRP 199 HN TRP 199 -1.268 -0.221 7.126 219 HA TRP 199 HA TRP 199 -1.444 1.916 5.152 220 HB2 TRP 199 HB2 TRP 199 -2.258 1.682 8.046 221 HB3 TRP 199 HB1 TRP 199 -2.268 3.227 7.209 222 HD1 TRP 199 HD1 TRP 199 -4.170 -0.094 7.398 223 HE1 TRP 199 HE1 TRP 199 -6.426 0.194 6.210 224 HE3 TRP 199 HE3 TRP 199 -3.421 4.523 5.292 225 HZ2 TRP 199 HZ2 TRP 199 -7.715 2.086 4.587 226 HZ3 TRP 199 HZ3 TRP 199 -5.234 5.493 3.928 227 HH2 TRP 199 HH2 TRP 199 -7.332 4.292 3.587 228 H GLN 200 HN GLN 200 0.938 0.664 7.037 229 HA GLN 200 HA GLN 200 2.180 3.219 7.739 230 HB2 GLN 200 HB2 GLN 200 2.088 1.526 9.495 231 HB3 GLN 200 HB1 GLN 200 2.903 0.368 8.454 232 HG2 GLN 200 HG2 GLN 200 4.447 1.249 10.077 233 HG3 GLN 200 HG1 GLN 200 4.902 1.788 8.462 234 HE21 GLN 200 HE21 GLN 200 6.056 3.537 9.228 235 HE22 GLN 200 HE22 GLN 200 5.297 4.933 9.913 236 H ASP 201 HN ASP 201 3.909 4.010 6.686 237 HA ASP 201 HA ASP 201 4.709 2.857 4.208 238 HB2 ASP 201 HB2 ASP 201 4.678 5.334 4.832 239 HB3 ASP 201 HB1 ASP 201 6.177 5.029 5.705 240 HA PRO 202 HA PRO 202 7.612 0.003 6.023 241 HB2 PRO 202 HB2 PRO 202 8.655 -0.900 3.657 242 HB3 PRO 202 HB1 PRO 202 7.150 -1.486 4.371 243 HG2 PRO 202 HG2 PRO 202 7.566 0.458 2.154 244 HG3 PRO 202 HG1 PRO 202 6.298 -0.759 2.364 245 HD2 PRO 202 HD2 PRO 202 5.911 1.899 2.836 246 HD3 PRO 202 HD1 PRO 202 5.011 0.617 3.669 247 H ARG 203 HN ARG 203 8.397 2.727 4.080 248 HA ARG 203 HA ARG 203 11.255 2.285 4.162 249 HB2 ARG 203 HB2 ARG 203 9.707 4.771 3.422 250 HB3 ARG 203 HB1 ARG 203 11.419 4.490 3.125 251 HG2 ARG 203 HG2 ARG 203 10.950 2.783 1.547 252 HG3 ARG 203 HG1 ARG 203 9.243 2.757 1.992 253 HD2 ARG 203 HD2 ARG 203 10.675 5.087 0.733 254 HD3 ARG 203 HD1 ARG 203 9.664 3.931 -0.134 255 HE ARG 203 HE ARG 203 8.097 4.921 1.916 256 HH11 ARG 203 HH11 ARG 203 9.807 6.261 -0.835 257 HH12 ARG 203 HH12 ARG 203 8.679 7.559 -1.075 258 HH21 ARG 203 HH21 ARG 203 6.628 6.618 1.631 259 HH22 ARG 203 HH22 ARG 203 6.872 7.785 0.353 260 H LYS 204 HN LYS 204 8.854 3.696 6.158 261 HA LYS 204 HA LYS 204 10.850 5.180 7.708 262 HB2 LYS 204 HB2 LYS 204 7.834 5.176 7.929 263 HB3 LYS 204 HB1 LYS 204 8.926 6.194 8.857 264 HG2 LYS 204 HG2 LYS 204 9.632 7.343 6.859 265 HG3 LYS 204 HG1 LYS 204 8.664 6.260 5.857 266 HD2 LYS 204 HD2 LYS 204 7.487 8.347 6.146 267 HD3 LYS 204 HD1 LYS 204 6.632 7.073 7.016 268 HE2 LYS 204 HE2 LYS 204 6.672 8.979 8.434 269 HE3 LYS 204 HE1 LYS 204 7.825 7.822 9.092 270 HZ1 LYS 204 HZ1 LYS 204 8.489 10.201 7.442 271 HZ2 LYS 204 HZ2 LYS 204 9.613 9.075 8.029 272 HZ3 LYS 204 HZ3 LYS 204 8.737 10.039 9.113 273 H ALA 205 HN ALA 205 9.148 2.242 7.707 274 HA ALA 205 HA ALA 205 9.779 1.845 10.553 275 HB1 ALA 205 HB1 ALA 205 7.362 2.096 10.271 276 HB2 ALA 205 HB2 ALA 205 7.784 0.460 10.779 277 HB3 ALA 205 HB3 ALA 205 7.360 0.779 9.098 278 H1 SER 201 HT1 SER 201 -12.554 -3.794 -11.974 279 H2 SER 201 HT2 SER 201 -12.870 -4.932 -13.187 280 H3 SER 201 HT3 SER 201 -12.092 -3.478 -13.576 281 HA SER 201 HA SER 201 -11.005 -5.606 -11.831 282 HB2 SER 201 HB2 SER 201 -10.118 -4.768 -14.600 283 HB3 SER 201 HB1 SER 201 -9.529 -6.139 -13.661 284 HG SER 201 HG SER 201 -10.989 -7.059 -14.955 285 H TPO 202 HN TPO 202 -11.234 -2.367 -12.233 286 HA TPO 202 HA TPO 202 -8.377 -1.832 -11.829 287 HB TPO 202 HB TPO 202 -10.532 0.179 -12.491 288 HG21 TPO 202 HG21 TPO 202 -7.524 0.243 -12.793 289 HG22 TPO 202 HG22 TPO 202 -8.462 1.107 -11.575 290 HG23 TPO 202 HG23 TPO 202 -8.635 1.524 -13.279 291 H TYR 203 HN TYR 203 -7.772 -1.549 -9.799 292 HA TYR 203 HA TYR 203 -7.589 -0.652 -7.723 293 HB2 TYR 203 HB2 TYR 203 -8.391 1.465 -8.578 294 HB3 TYR 203 HB1 TYR 203 -10.059 0.915 -8.490 295 HD1 TYR 203 HD2 TYR 203 -7.084 1.459 -6.300 296 HD2 TYR 203 HD1 TYR 203 -11.325 1.483 -6.631 297 HE1 TYR 203 HE2 TYR 203 -7.252 2.362 -4.022 298 HE2 TYR 203 HE1 TYR 203 -11.504 2.388 -4.351 299 HH TYR 203 HH TYR 203 -10.198 2.492 -2.289 300 HA PRO 204 HA PRO 204 -10.251 -3.533 -5.542 301 HB2 PRO 204 HB2 PRO 204 -8.746 -3.682 -3.315 302 HB3 PRO 204 HB1 PRO 204 -8.267 -4.481 -4.817 303 HG2 PRO 204 HG2 PRO 204 -7.315 -1.887 -3.665 304 HG3 PRO 204 HG1 PRO 204 -6.376 -3.186 -4.425 305 HD2 PRO 204 HD2 PRO 204 -7.118 -0.903 -5.725 306 HD3 PRO 204 HD1 PRO 204 -6.838 -2.450 -6.545 307 H HIS 205 HN HIS 205 -9.637 -2.828 -2.529 308 HA HIS 205 HA HIS 205 -11.051 -0.290 -2.311 309 HB2 HIS 205 HB2 HIS 205 -12.783 -2.121 -2.392 310 HB3 HIS 205 HB1 HIS 205 -12.091 -2.760 -0.904 311 HD1 HIS 205 HD1 HIS 205 -14.032 0.170 -2.235 312 HD2 HIS 205 HD2 HIS 205 -12.778 -1.386 1.406 313 HE1 HIS 205 HE1 HIS 205 -15.261 1.481 -0.478 314 HE2 HIS 205 HE2 HIS 205 -14.262 0.702 1.701 315 H SEP 206 HN SEP 206 -10.675 0.791 -0.413 316 HA SEP 206 HA SEP 206 -8.274 0.324 0.919 317 HB2 SEP 206 HB2 SEP 206 -9.284 2.035 2.580 318 HB3 SEP 206 HB1 SEP 206 -9.036 2.536 0.907 319 HA PRO 207 HA PRO 207 -9.243 -2.789 3.970 320 HB2 PRO 207 HB2 PRO 207 -7.164 -2.133 5.676 321 HB3 PRO 207 HB1 PRO 207 -7.017 -3.185 4.260 322 HG2 PRO 207 HG2 PRO 207 -6.337 -0.296 4.566 323 HG3 PRO 207 HG1 PRO 207 -5.478 -1.565 3.675 324 HD2 PRO 207 HD2 PRO 207 -7.011 0.265 2.435 325 HD3 PRO 207 HD1 PRO 207 -6.878 -1.405 1.849 326 H THR 208 HN THR 208 -9.200 0.594 4.490 327 HA THR 208 HA THR 208 -10.822 0.266 6.897 328 HB THR 208 HB THR 208 -8.532 2.242 6.710 329 HG1 THR 208 HG1 THR 208 -8.633 0.214 8.651 330 HG21 THR 208 HG21 THR 208 -9.046 2.706 9.067 331 HG22 THR 208 HG22 THR 208 -10.420 1.604 8.982 332 HG23 THR 208 HG23 THR 208 -10.418 3.083 8.024 333 H SER 209 HN SER 209 -12.684 0.924 5.928 334 HA SER 209 HA SER 209 -12.683 3.616 4.733 335 HB2 SER 209 HB2 SER 209 -14.767 1.473 4.288 336 HB3 SER 209 HB1 SER 209 -14.535 2.961 3.372 337 HG SER 209 HG SER 209 -12.487 2.094 2.698 Start of MODEL 19 1 H ASP 170 H ASP 170 17.115 1.230 -6.451 2 HA ASP 170 HA ASP 170 14.950 0.954 -7.426 3 HB2 ASP 170 HB2 ASP 170 15.765 -1.950 -7.550 4 HB3 ASP 170 HB1 ASP 170 14.094 -1.412 -7.687 5 H VAL 171 HN VAL 171 16.793 -0.103 -4.853 6 HA VAL 171 HA VAL 171 14.904 -1.424 -3.275 7 HB VAL 171 HB VAL 171 17.306 -1.590 -2.879 8 HG11 VAL 171 HG11 VAL 171 18.467 0.155 -1.574 9 HG12 VAL 171 HG12 VAL 171 17.085 1.221 -1.829 10 HG13 VAL 171 HG13 VAL 171 18.040 0.666 -3.206 11 HG21 VAL 171 HG21 VAL 171 17.232 -1.556 -0.428 12 HG22 VAL 171 HG22 VAL 171 15.779 -2.265 -1.128 13 HG23 VAL 171 HG23 VAL 171 15.738 -0.620 -0.497 14 HA PRO 172 HA PRO 172 14.011 2.917 -1.192 15 HB2 PRO 172 HB2 PRO 172 13.463 4.530 -3.601 16 HB3 PRO 172 HB1 PRO 172 14.303 4.977 -2.114 17 HG2 PRO 172 HG2 PRO 172 15.645 4.605 -4.391 18 HG3 PRO 172 HG1 PRO 172 16.322 4.095 -2.831 19 HD2 PRO 172 HD2 PRO 172 14.980 2.447 -4.944 20 HD3 PRO 172 HD1 PRO 172 16.446 2.095 -4.010 21 H LEU 173 HN LEU 173 12.639 1.379 -3.945 22 HA LEU 173 HA LEU 173 9.982 1.769 -2.759 23 HB2 LEU 173 HB2 LEU 173 10.455 3.122 -4.927 24 HB3 LEU 173 HB1 LEU 173 10.339 1.572 -5.732 25 HG LEU 173 HG LEU 173 8.246 2.946 -5.797 26 HD11 LEU 173 HD11 LEU 173 8.016 0.286 -4.400 27 HD12 LEU 173 HD12 LEU 173 8.145 0.542 -6.141 28 HD13 LEU 173 HD13 LEU 173 6.723 1.113 -5.268 29 HD21 LEU 173 HD21 LEU 173 8.382 3.922 -3.571 30 HD22 LEU 173 HD22 LEU 173 8.161 2.330 -2.845 31 HD23 LEU 173 HD23 LEU 173 6.855 3.062 -3.781 32 HA PRO 174 HA PRO 174 10.686 -2.702 -2.820 33 HB2 PRO 174 HB2 PRO 174 8.140 -2.778 -1.367 34 HB3 PRO 174 HB1 PRO 174 9.736 -3.331 -0.861 35 HG2 PRO 174 HG2 PRO 174 8.504 -1.138 0.172 36 HG3 PRO 174 HG1 PRO 174 10.262 -1.331 0.104 37 HD2 PRO 174 HD2 PRO 174 8.469 0.330 -1.579 38 HD3 PRO 174 HD1 PRO 174 10.152 0.608 -1.086 39 H ALA 175 HN ALA 175 10.041 -4.084 -4.363 40 HA ALA 175 HA ALA 175 7.892 -3.202 -6.114 41 HB1 ALA 175 HB1 ALA 175 10.081 -3.728 -7.064 42 HB2 ALA 175 HB2 ALA 175 8.815 -4.757 -7.731 43 HB3 ALA 175 HB3 ALA 175 9.917 -5.394 -6.510 44 H GLY 176 HN GLY 176 7.964 -5.184 -3.507 45 HA2 GLY 176 HA2 GLY 176 6.040 -7.105 -4.624 46 HA3 GLY 176 HA1 GLY 176 6.793 -7.206 -3.036 47 H TRP 177 HN TRP 177 5.902 -4.083 -3.634 48 HA TRP 177 HA TRP 177 3.524 -4.403 -1.934 49 HB2 TRP 177 HB2 TRP 177 5.481 -2.090 -2.036 50 HB3 TRP 177 HB1 TRP 177 4.084 -2.208 -0.974 51 HD1 TRP 177 HD1 TRP 177 7.008 -4.694 -1.646 52 HE1 TRP 177 HE1 TRP 177 8.022 -5.373 0.616 53 HE3 TRP 177 HE3 TRP 177 4.062 -1.878 1.437 54 HZ2 TRP 177 HZ2 TRP 177 7.619 -4.794 3.345 55 HZ3 TRP 177 HZ3 TRP 177 4.438 -1.999 3.859 56 HH2 TRP 177 HH2 TRP 177 6.183 -3.428 4.792 57 H GLU 178 HN GLU 178 1.722 -3.271 -2.413 58 HA GLU 178 HA GLU 178 1.553 -2.199 -5.125 59 HB2 GLU 178 HB2 GLU 178 -0.021 -3.991 -4.310 60 HB3 GLU 178 HB1 GLU 178 -0.677 -2.827 -3.169 61 HG2 GLU 178 HG2 GLU 178 -2.110 -2.935 -5.079 62 HG3 GLU 178 HG1 GLU 178 -1.282 -1.376 -5.089 63 H MET 179 HN MET 179 1.264 -0.062 -5.515 64 HA MET 179 HA MET 179 1.060 1.736 -3.228 65 HB2 MET 179 HB2 MET 179 1.338 2.391 -6.167 66 HB3 MET 179 HB1 MET 179 1.407 3.544 -4.846 67 HG2 MET 179 HG2 MET 179 3.368 1.302 -5.229 68 HG3 MET 179 HG1 MET 179 3.579 2.948 -5.825 69 HE1 MET 179 HE1 MET 179 3.977 5.064 -2.643 70 HE2 MET 179 HE2 MET 179 2.488 4.806 -3.553 71 HE3 MET 179 HE3 MET 179 4.018 5.018 -4.405 72 H ALA 180 HN ALA 180 -1.004 1.850 -2.512 73 HA ALA 180 HA ALA 180 -3.086 2.401 -4.500 74 HB1 ALA 180 HB1 ALA 180 -3.365 1.761 -1.569 75 HB2 ALA 180 HB2 ALA 180 -3.588 0.625 -2.900 76 HB3 ALA 180 HB3 ALA 180 -4.688 1.991 -2.712 77 H LYS 181 HN LYS 181 -2.615 4.485 -5.002 78 HA LYS 181 HA LYS 181 -2.472 6.444 -2.818 79 HB2 LYS 181 HB2 LYS 181 -1.814 6.783 -5.754 80 HB3 LYS 181 HB1 LYS 181 -1.498 7.945 -4.474 81 HG2 LYS 181 HG2 LYS 181 0.176 6.548 -3.507 82 HG3 LYS 181 HG1 LYS 181 -0.254 5.190 -4.554 83 HD2 LYS 181 HD2 LYS 181 0.869 7.828 -5.490 84 HD3 LYS 181 HD1 LYS 181 1.784 6.330 -5.305 85 HE2 LYS 181 HE2 LYS 181 0.308 5.247 -6.946 86 HE3 LYS 181 HE1 LYS 181 -0.563 6.765 -7.151 87 HZ1 LYS 181 HZ1 LYS 181 1.021 6.516 -8.908 88 HZ2 LYS 181 HZ2 LYS 181 2.283 6.245 -7.808 89 HZ3 LYS 181 HZ3 LYS 181 1.545 7.770 -7.891 90 H THR 182 HN THR 182 -4.484 7.172 -2.306 91 HA THR 182 HA THR 182 -6.360 7.604 -4.533 92 HB THR 182 HB THR 182 -8.185 7.369 -2.908 93 HG1 THR 182 HG1 THR 182 -6.406 6.395 -0.970 94 HG21 THR 182 HG21 THR 182 -7.934 4.973 -2.461 95 HG22 THR 182 HG22 THR 182 -6.209 5.088 -2.812 96 HG23 THR 182 HG23 THR 182 -7.392 5.381 -4.089 97 H SER 183 HN SER 183 -7.355 9.547 -4.801 98 HA SER 183 HA SER 183 -6.218 11.884 -3.758 99 HB2 SER 183 HB2 SER 183 -8.953 11.652 -5.019 100 HB3 SER 183 HB1 SER 183 -7.872 13.047 -5.030 101 HG SER 183 HG SER 183 -7.725 11.975 -7.002 102 H SER 184 HN SER 184 -8.565 9.798 -2.452 103 HA SER 184 HA SER 184 -10.043 11.591 -0.856 104 HB2 SER 184 HB2 SER 184 -9.384 8.711 -0.206 105 HB3 SER 184 HB1 SER 184 -10.788 9.638 0.328 106 HG SER 184 HG SER 184 -11.725 8.884 -1.393 107 H GLY 185 HN GLY 185 -6.817 10.583 -0.715 108 HA2 GLY 185 HA2 GLY 185 -5.247 11.648 0.722 109 HA3 GLY 185 HA1 GLY 185 -6.520 11.840 1.920 110 H GLN 186 HN GLN 186 -6.024 8.841 0.212 111 HA GLN 186 HA GLN 186 -4.977 7.690 2.712 112 HB2 GLN 186 HB2 GLN 186 -7.061 6.478 0.889 113 HB3 GLN 186 HB1 GLN 186 -6.314 5.648 2.245 114 HG2 GLN 186 HG2 GLN 186 -7.240 7.359 3.761 115 HG3 GLN 186 HG1 GLN 186 -8.052 8.102 2.385 116 HE21 GLN 186 HE21 GLN 186 -8.658 5.513 1.149 117 HE22 GLN 186 HE22 GLN 186 -9.949 4.837 2.073 118 H ARG 187 HN ARG 187 -2.957 7.136 2.308 119 HA ARG 187 HA ARG 187 -2.388 5.712 -0.198 120 HB2 ARG 187 HB2 ARG 187 0.045 6.249 0.353 121 HB3 ARG 187 HB1 ARG 187 -0.966 7.588 -0.166 122 HG2 ARG 187 HG2 ARG 187 -1.212 8.315 2.144 123 HG3 ARG 187 HG1 ARG 187 -0.236 6.950 2.684 124 HD2 ARG 187 HD2 ARG 187 0.817 8.918 0.685 125 HD3 ARG 187 HD1 ARG 187 0.891 9.256 2.411 126 HE ARG 187 HE ARG 187 2.039 6.843 2.289 127 HH11 ARG 187 HH11 ARG 187 2.485 9.627 0.230 128 HH12 ARG 187 HH12 ARG 187 4.205 9.411 0.066 129 HH21 ARG 187 HH21 ARG 187 4.336 6.547 2.102 130 HH22 ARG 187 HH22 ARG 187 5.260 7.674 1.156 131 H TYR 188 HN TYR 188 -2.801 3.600 0.326 132 HA TYR 188 HA TYR 188 -1.362 2.557 2.661 133 HB2 TYR 188 HB2 TYR 188 -3.076 0.795 2.831 134 HB3 TYR 188 HB1 TYR 188 -3.753 2.402 3.040 135 HD1 TYR 188 HD2 TYR 188 -5.178 3.384 1.270 136 HD2 TYR 188 HD1 TYR 188 -3.740 -0.613 1.022 137 HE1 TYR 188 HE2 TYR 188 -6.878 2.884 -0.434 138 HE2 TYR 188 HE1 TYR 188 -5.440 -1.127 -0.677 139 HH TYR 188 HH TYR 188 -7.415 1.362 -2.116 140 H PHE 189 HN PHE 189 -0.449 0.483 2.474 141 HA PHE 189 HA PHE 189 0.289 -0.125 -0.306 142 HB2 PHE 189 HB2 PHE 189 1.966 -0.393 2.203 143 HB3 PHE 189 HB1 PHE 189 2.471 -0.838 0.570 144 HD1 PHE 189 HD2 PHE 189 1.640 1.310 -1.091 145 HD2 PHE 189 HD1 PHE 189 3.169 1.460 2.873 146 HE1 PHE 189 HE2 PHE 189 2.434 3.601 -1.498 147 HE2 PHE 189 HE1 PHE 189 3.958 3.763 2.478 148 HZ PHE 189 HZ PHE 189 3.597 4.829 0.290 149 H LEU 190 HN LEU 190 -0.190 -2.054 -1.011 150 HA LEU 190 HA LEU 190 -1.054 -4.138 0.826 151 HB2 LEU 190 HB2 LEU 190 -1.208 -3.665 -2.097 152 HB3 LEU 190 HB1 LEU 190 -1.202 -5.323 -1.567 153 HG LEU 190 HG LEU 190 -3.322 -3.308 -1.457 154 HD11 LEU 190 HD11 LEU 190 -4.105 -4.989 -2.687 155 HD12 LEU 190 HD12 LEU 190 -4.353 -5.861 -1.165 156 HD13 LEU 190 HD13 LEU 190 -2.872 -6.100 -2.092 157 HD21 LEU 190 HD21 LEU 190 -2.648 -3.631 0.986 158 HD22 LEU 190 HD22 LEU 190 -3.225 -5.290 0.809 159 HD23 LEU 190 HD23 LEU 190 -4.331 -3.942 0.565 160 H ASN 191 HN ASN 191 0.299 -5.868 1.414 161 HA ASN 191 HA ASN 191 2.733 -6.238 -0.153 162 HB2 ASN 191 HB2 ASN 191 1.703 -7.531 2.369 163 HB3 ASN 191 HB1 ASN 191 3.034 -8.239 1.452 164 HD21 ASN 191 HD21 ASN 191 2.007 -5.460 3.330 165 HD22 ASN 191 HD22 ASN 191 3.596 -4.870 3.649 166 H HIS 192 HN HIS 192 2.460 -7.224 -2.044 167 HA HIS 192 HA HIS 192 0.219 -8.901 -2.614 168 HB2 HIS 192 HB2 HIS 192 2.701 -8.133 -4.112 169 HB3 HIS 192 HB1 HIS 192 1.730 -9.479 -4.694 170 HD1 HIS 192 HD1 HIS 192 -0.918 -8.807 -5.084 171 HD2 HIS 192 HD2 HIS 192 1.884 -5.725 -5.059 172 HE1 HIS 192 HE1 HIS 192 -2.027 -6.868 -6.237 173 HE2 HIS 192 HE2 HIS 192 -0.256 -5.090 -6.390 174 H ILE 193 HN ILE 193 3.063 -9.449 -0.994 175 HA ILE 193 HA ILE 193 3.389 -12.225 -1.777 176 HB ILE 193 HB ILE 193 4.829 -11.044 0.556 177 HG12 ILE 193 HG12 ILE 193 6.262 -10.467 -1.883 178 HG13 ILE 193 HG11 ILE 193 4.686 -9.676 -1.904 179 HG21 ILE 193 HG21 ILE 193 5.250 -13.347 -0.115 180 HG22 ILE 193 HG22 ILE 193 6.686 -12.355 -0.366 181 HG23 ILE 193 HG23 ILE 193 5.677 -12.807 -1.739 182 HD11 ILE 193 HD11 ILE 193 6.471 -8.261 -0.985 183 HD12 ILE 193 HD12 ILE 193 6.689 -9.427 0.321 184 HD13 ILE 193 HD13 ILE 193 5.163 -8.558 0.160 185 H ASP 194 HN ASP 194 2.292 -10.283 0.919 186 HA ASP 194 HA ASP 194 1.778 -12.670 2.530 187 HB2 ASP 194 HB2 ASP 194 3.098 -10.655 3.385 188 HB3 ASP 194 HB1 ASP 194 1.571 -9.789 3.399 189 H GLN 195 HN GLN 195 0.179 -10.453 0.527 190 HA GLN 195 HA GLN 195 -1.990 -9.852 0.129 191 HB2 GLN 195 HB2 GLN 195 -2.251 -12.379 0.159 192 HB3 GLN 195 HB1 GLN 195 -2.724 -12.244 1.846 193 HG2 GLN 195 HG2 GLN 195 -4.607 -10.792 1.157 194 HG3 GLN 195 HG1 GLN 195 -4.164 -11.079 -0.526 195 HE21 GLN 195 HE21 GLN 195 -5.480 -12.464 2.371 196 HE22 GLN 195 HE22 GLN 195 -6.147 -13.880 1.634 197 H THR 196 HN THR 196 -0.554 -8.709 2.269 198 HA THR 196 HA THR 196 -2.599 -8.436 4.377 199 HB THR 196 HB THR 196 -0.250 -9.261 5.004 200 HG1 THR 196 HG1 THR 196 -0.740 -8.543 6.932 201 HG21 THR 196 HG21 THR 196 1.004 -7.613 3.661 202 HG22 THR 196 HG22 THR 196 1.448 -7.570 5.366 203 HG23 THR 196 HG23 THR 196 0.390 -6.327 4.700 204 H THR 197 HN THR 197 -3.123 -6.390 5.162 205 HA THR 197 HA THR 197 -2.775 -4.273 3.177 206 HB THR 197 HB THR 197 -4.740 -3.265 4.561 207 HG1 THR 197 HG1 THR 197 -5.999 -4.995 5.541 208 HG21 THR 197 HG21 THR 197 -4.967 -4.078 2.282 209 HG22 THR 197 HG22 THR 197 -6.347 -4.604 3.236 210 HG23 THR 197 HG23 THR 197 -5.057 -5.740 2.859 211 H THR 198 HN THR 198 -1.253 -2.839 3.606 212 HA THR 198 HA THR 198 -0.485 -2.369 6.403 213 HB THR 198 HB THR 198 1.111 -2.069 3.850 214 HG1 THR 198 HG1 THR 198 0.827 -4.095 5.771 215 HG21 THR 198 HG21 THR 198 3.055 -1.837 5.391 216 HG22 THR 198 HG22 THR 198 1.919 -1.699 6.728 217 HG23 THR 198 HG23 THR 198 1.930 -0.483 5.457 218 H TRP 199 HN TRP 199 -0.564 -0.309 7.241 219 HA TRP 199 HA TRP 199 -1.153 1.894 5.370 220 HB2 TRP 199 HB2 TRP 199 -1.864 1.486 8.265 221 HB3 TRP 199 HB1 TRP 199 -1.870 3.090 7.541 222 HD1 TRP 199 HD1 TRP 199 -3.921 -0.057 7.802 223 HE1 TRP 199 HE1 TRP 199 -6.134 0.265 6.527 224 HE3 TRP 199 HE3 TRP 199 -2.836 4.312 5.370 225 HZ2 TRP 199 HZ2 TRP 199 -7.264 2.118 4.729 226 HZ3 TRP 199 HZ3 TRP 199 -4.540 5.291 3.887 227 HH2 TRP 199 HH2 TRP 199 -6.709 4.213 3.577 228 H GLN 200 HN GLN 200 1.289 0.564 7.182 229 HA GLN 200 HA GLN 200 2.511 3.144 7.819 230 HB2 GLN 200 HB2 GLN 200 3.385 0.367 8.623 231 HB3 GLN 200 HB1 GLN 200 4.090 1.877 9.184 232 HG2 GLN 200 HG2 GLN 200 1.791 2.450 10.082 233 HG3 GLN 200 HG1 GLN 200 1.368 0.767 9.777 234 HE21 GLN 200 HE21 GLN 200 2.400 -0.866 10.975 235 HE22 GLN 200 HE22 GLN 200 3.169 -0.512 12.492 236 H ASP 201 HN ASP 201 4.197 3.916 6.789 237 HA ASP 201 HA ASP 201 4.869 2.985 4.213 238 HB2 ASP 201 HB2 ASP 201 4.998 5.347 4.995 239 HB3 ASP 201 HB1 ASP 201 6.389 4.918 5.982 240 HA PRO 202 HA PRO 202 7.728 -0.286 5.042 241 HB2 PRO 202 HB2 PRO 202 8.926 0.498 2.470 242 HB3 PRO 202 HB1 PRO 202 8.232 -1.047 2.967 243 HG2 PRO 202 HG2 PRO 202 7.010 0.699 1.263 244 HG3 PRO 202 HG1 PRO 202 6.145 -0.477 2.263 245 HD2 PRO 202 HD2 PRO 202 6.301 2.446 2.541 246 HD3 PRO 202 HD1 PRO 202 5.114 1.307 3.188 247 H ARG 203 HN ARG 203 8.670 2.996 4.395 248 HA ARG 203 HA ARG 203 11.468 2.395 5.029 249 HB2 ARG 203 HB2 ARG 203 10.136 4.848 3.885 250 HB3 ARG 203 HB1 ARG 203 11.804 4.848 4.428 251 HG2 ARG 203 HG2 ARG 203 11.849 4.569 2.087 252 HG3 ARG 203 HG1 ARG 203 12.236 2.998 2.784 253 HD2 ARG 203 HD2 ARG 203 10.679 2.867 0.860 254 HD3 ARG 203 HD1 ARG 203 10.010 2.198 2.348 255 HE ARG 203 HE ARG 203 8.736 4.301 2.577 256 HH11 ARG 203 HH11 ARG 203 10.059 3.537 -0.587 257 HH12 ARG 203 HH12 ARG 203 8.821 4.397 -1.440 258 HH21 ARG 203 HH21 ARG 203 7.106 5.417 1.449 259 HH22 ARG 203 HH22 ARG 203 7.156 5.483 -0.290 260 H LYS 204 HN LYS 204 9.138 4.968 5.859 261 HA LYS 204 HA LYS 204 10.611 5.346 8.366 262 HB2 LYS 204 HB2 LYS 204 9.536 7.545 8.472 263 HB3 LYS 204 HB1 LYS 204 10.419 7.316 6.971 264 HG2 LYS 204 HG2 LYS 204 8.347 6.878 5.790 265 HG3 LYS 204 HG1 LYS 204 7.439 7.033 7.296 266 HD2 LYS 204 HD2 LYS 204 8.257 9.355 7.503 267 HD3 LYS 204 HD1 LYS 204 9.057 9.182 5.938 268 HE2 LYS 204 HE2 LYS 204 6.906 8.794 4.866 269 HE3 LYS 204 HE1 LYS 204 6.094 8.896 6.428 270 HZ1 LYS 204 HZ1 LYS 204 7.567 11.079 5.060 271 HZ2 LYS 204 HZ2 LYS 204 6.901 11.192 6.614 272 HZ3 LYS 204 HZ3 LYS 204 5.887 10.971 5.271 273 H ALA 205 HN ALA 205 7.734 4.011 7.259 274 HA ALA 205 HA ALA 205 5.960 3.048 8.283 275 HB1 ALA 205 HB1 ALA 205 5.797 2.866 10.697 276 HB2 ALA 205 HB2 ALA 205 7.107 4.031 10.891 277 HB3 ALA 205 HB3 ALA 205 7.425 2.462 10.152 278 H1 SER 201 HT1 SER 201 -10.470 -1.083 -15.123 279 H2 SER 201 HT2 SER 201 -9.644 -2.557 -15.266 280 H3 SER 201 HT3 SER 201 -8.901 -1.244 -14.488 281 HA SER 201 HA SER 201 -10.509 -1.310 -12.728 282 HB2 SER 201 HB2 SER 201 -12.359 -2.242 -14.160 283 HB3 SER 201 HB1 SER 201 -11.569 -3.815 -14.059 284 HG SER 201 HG SER 201 -12.678 -2.272 -11.947 285 H TPO 202 HN TPO 202 -8.748 -1.609 -11.542 286 HA TPO 202 HA TPO 202 -7.746 -4.338 -11.179 287 HB TPO 202 HB TPO 202 -5.413 -3.437 -11.110 288 HG21 TPO 202 HG21 TPO 202 -6.193 -4.641 -13.071 289 HG22 TPO 202 HG22 TPO 202 -5.098 -3.340 -13.543 290 HG23 TPO 202 HG23 TPO 202 -6.839 -3.148 -13.752 291 H TYR 203 HN TYR 203 -8.044 -1.044 -10.055 292 HA TYR 203 HA TYR 203 -6.887 -1.220 -7.536 293 HB2 TYR 203 HB2 TYR 203 -7.586 0.888 -8.559 294 HB3 TYR 203 HB1 TYR 203 -9.276 0.408 -8.442 295 HD1 TYR 203 HD2 TYR 203 -6.269 1.081 -6.358 296 HD2 TYR 203 HD1 TYR 203 -10.519 0.985 -6.552 297 HE1 TYR 203 HE2 TYR 203 -6.389 2.101 -4.127 298 HE2 TYR 203 HE1 TYR 203 -10.651 2.002 -4.318 299 HH TYR 203 HH TYR 203 -9.363 2.318 -2.360 300 HA PRO 204 HA PRO 204 -9.838 -3.912 -5.493 301 HB2 PRO 204 HB2 PRO 204 -8.505 -4.158 -3.176 302 HB3 PRO 204 HB1 PRO 204 -7.938 -4.939 -4.657 303 HG2 PRO 204 HG2 PRO 204 -6.976 -2.431 -3.343 304 HG3 PRO 204 HG1 PRO 204 -6.038 -3.714 -4.127 305 HD2 PRO 204 HD2 PRO 204 -6.709 -1.304 -5.296 306 HD3 PRO 204 HD1 PRO 204 -6.286 -2.776 -6.190 307 H HIS 205 HN HIS 205 -9.253 -3.153 -2.432 308 HA HIS 205 HA HIS 205 -10.835 -0.717 -2.282 309 HB2 HIS 205 HB2 HIS 205 -12.539 -2.462 -2.278 310 HB3 HIS 205 HB1 HIS 205 -11.702 -3.311 -0.983 311 HD1 HIS 205 HD1 HIS 205 -12.991 0.271 -1.389 312 HD2 HIS 205 HD2 HIS 205 -12.992 -2.867 1.342 313 HE1 HIS 205 HE1 HIS 205 -14.239 1.121 0.617 314 HE2 HIS 205 HE2 HIS 205 -14.116 -0.743 2.306 315 H SEP 206 HN SEP 206 -10.337 0.524 -0.633 316 HA SEP 206 HA SEP 206 -8.050 0.218 0.887 317 HB2 SEP 206 HB2 SEP 206 -9.347 2.042 2.326 318 HB3 SEP 206 HB1 SEP 206 -8.735 2.408 0.712 319 HA PRO 207 HA PRO 207 -9.113 -2.501 4.168 320 HB2 PRO 207 HB2 PRO 207 -7.208 -1.141 5.898 321 HB3 PRO 207 HB1 PRO 207 -7.107 -2.746 5.175 322 HG2 PRO 207 HG2 PRO 207 -5.535 -0.652 4.421 323 HG3 PRO 207 HG1 PRO 207 -5.965 -1.990 3.346 324 HD2 PRO 207 HD2 PRO 207 -7.060 0.778 3.466 325 HD3 PRO 207 HD1 PRO 207 -6.787 -0.271 2.060 326 H THR 208 HN THR 208 -9.426 0.899 4.467 327 HA THR 208 HA THR 208 -11.138 0.537 6.831 328 HB THR 208 HB THR 208 -10.517 2.885 7.488 329 HG1 THR 208 HG1 THR 208 -9.624 3.426 5.389 330 HG21 THR 208 HG21 THR 208 -8.251 0.889 7.427 331 HG22 THR 208 HG22 THR 208 -9.539 0.954 8.631 332 HG23 THR 208 HG23 THR 208 -8.378 2.276 8.510 333 H SER 209 HN SER 209 -13.175 0.920 6.285 334 HA SER 209 HA SER 209 -13.768 3.261 4.647 335 HB2 SER 209 HB2 SER 209 -15.531 1.862 3.430 336 HB3 SER 209 HB1 SER 209 -13.852 1.586 2.970 337 HG SER 209 HG SER 209 -15.237 0.018 4.889 Start of MODEL 20 1 H ASP 170 H ASP 170 15.913 -0.141 -5.440 2 HA ASP 170 HA ASP 170 13.051 -0.490 -6.067 3 HB2 ASP 170 HB2 ASP 170 15.153 -2.638 -5.752 4 HB3 ASP 170 HB1 ASP 170 13.423 -2.910 -5.936 5 H VAL 171 HN VAL 171 15.514 0.021 -3.789 6 HA VAL 171 HA VAL 171 14.178 -1.225 -1.582 7 HB VAL 171 HB VAL 171 16.441 0.767 -1.668 8 HG11 VAL 171 HG11 VAL 171 15.241 -0.596 0.742 9 HG12 VAL 171 HG12 VAL 171 15.184 1.130 0.388 10 HG13 VAL 171 HG13 VAL 171 16.729 0.352 0.733 11 HG21 VAL 171 HG21 VAL 171 16.960 -1.484 -2.442 12 HG22 VAL 171 HG22 VAL 171 16.312 -2.154 -0.944 13 HG23 VAL 171 HG23 VAL 171 17.761 -1.147 -0.908 14 HA PRO 172 HA PRO 172 12.977 3.471 -0.584 15 HB2 PRO 172 HB2 PRO 172 12.390 4.800 -2.966 16 HB3 PRO 172 HB1 PRO 172 13.806 5.073 -1.949 17 HG2 PRO 172 HG2 PRO 172 13.532 3.407 -4.411 18 HG3 PRO 172 HG1 PRO 172 14.886 4.429 -3.890 19 HD2 PRO 172 HD2 PRO 172 15.005 1.775 -3.650 20 HD3 PRO 172 HD1 PRO 172 15.668 2.830 -2.384 21 H LEU 173 HN LEU 173 11.817 1.499 -3.212 22 HA LEU 173 HA LEU 173 9.163 1.580 -2.044 23 HB2 LEU 173 HB2 LEU 173 9.252 3.314 -3.888 24 HB3 LEU 173 HB1 LEU 173 9.543 2.005 -5.011 25 HG LEU 173 HG LEU 173 7.168 2.909 -4.868 26 HD11 LEU 173 HD11 LEU 173 6.146 0.705 -5.119 27 HD12 LEU 173 HD12 LEU 173 7.592 -0.043 -4.442 28 HD13 LEU 173 HD13 LEU 173 7.680 0.813 -5.982 29 HD21 LEU 173 HD21 LEU 173 7.358 1.533 -2.208 30 HD22 LEU 173 HD22 LEU 173 5.823 1.724 -3.047 31 HD23 LEU 173 HD23 LEU 173 6.747 3.150 -2.581 32 HA PRO 174 HA PRO 174 10.330 -2.752 -2.722 33 HB2 PRO 174 HB2 PRO 174 7.797 -3.048 -1.189 34 HB3 PRO 174 HB1 PRO 174 9.380 -3.784 -0.907 35 HG2 PRO 174 HG2 PRO 174 8.514 -1.817 0.649 36 HG3 PRO 174 HG1 PRO 174 10.215 -1.886 0.144 37 HD2 PRO 174 HD2 PRO 174 7.992 -0.176 -0.911 38 HD3 PRO 174 HD1 PRO 174 9.683 0.254 -0.572 39 H ALA 175 HN ALA 175 9.592 -4.270 -4.163 40 HA ALA 175 HA ALA 175 7.616 -3.209 -6.021 41 HB1 ALA 175 HB1 ALA 175 8.525 -4.800 -7.608 42 HB2 ALA 175 HB2 ALA 175 9.492 -5.547 -6.336 43 HB3 ALA 175 HB3 ALA 175 9.825 -3.890 -6.838 44 H GLY 176 HN GLY 176 7.573 -5.409 -3.494 45 HA2 GLY 176 HA2 GLY 176 5.466 -7.055 -4.690 46 HA3 GLY 176 HA1 GLY 176 6.150 -7.258 -3.079 47 H TRP 177 HN TRP 177 5.525 -4.039 -3.665 48 HA TRP 177 HA TRP 177 3.093 -4.219 -2.027 49 HB2 TRP 177 HB2 TRP 177 5.201 -2.044 -2.127 50 HB3 TRP 177 HB1 TRP 177 3.739 -1.980 -1.148 51 HD1 TRP 177 HD1 TRP 177 6.484 -4.709 -1.549 52 HE1 TRP 177 HE1 TRP 177 7.240 -5.447 0.789 53 HE3 TRP 177 HE3 TRP 177 3.575 -1.601 1.264 54 HZ2 TRP 177 HZ2 TRP 177 6.680 -4.805 3.469 55 HZ3 TRP 177 HZ3 TRP 177 3.740 -1.726 3.708 56 HH2 TRP 177 HH2 TRP 177 5.266 -3.295 4.787 57 H GLU 178 HN GLU 178 1.286 -3.280 -2.694 58 HA GLU 178 HA GLU 178 1.199 -2.226 -5.408 59 HB2 GLU 178 HB2 GLU 178 -0.390 -3.992 -4.796 60 HB3 GLU 178 HB1 GLU 178 -0.987 -3.030 -3.455 61 HG2 GLU 178 HG2 GLU 178 -1.938 -1.422 -4.971 62 HG3 GLU 178 HG1 GLU 178 -1.208 -2.232 -6.356 63 H MET 179 HN MET 179 0.722 -0.137 -5.913 64 HA MET 179 HA MET 179 0.695 1.762 -3.710 65 HB2 MET 179 HB2 MET 179 0.755 2.299 -6.682 66 HB3 MET 179 HB1 MET 179 0.986 3.487 -5.411 67 HG2 MET 179 HG2 MET 179 2.808 1.183 -6.048 68 HG3 MET 179 HG1 MET 179 3.065 2.882 -6.438 69 HE1 MET 179 HE1 MET 179 3.998 4.638 -4.879 70 HE2 MET 179 HE2 MET 179 3.922 4.543 -3.120 71 HE3 MET 179 HE3 MET 179 2.434 4.598 -4.066 72 H ALA 180 HN ALA 180 -1.335 1.789 -2.850 73 HA ALA 180 HA ALA 180 -3.506 2.553 -4.670 74 HB1 ALA 180 HB1 ALA 180 -3.631 1.673 -1.793 75 HB2 ALA 180 HB2 ALA 180 -3.992 0.671 -3.199 76 HB3 ALA 180 HB3 ALA 180 -5.013 2.057 -2.817 77 H LYS 181 HN LYS 181 -2.984 4.660 -5.015 78 HA LYS 181 HA LYS 181 -2.805 6.403 -2.657 79 HB2 LYS 181 HB2 LYS 181 -1.715 6.862 -5.445 80 HB3 LYS 181 HB1 LYS 181 -1.559 7.971 -4.091 81 HG2 LYS 181 HG2 LYS 181 -0.265 6.213 -2.882 82 HG3 LYS 181 HG1 LYS 181 -0.319 5.227 -4.350 83 HD2 LYS 181 HD2 LYS 181 0.782 8.028 -4.302 84 HD3 LYS 181 HD1 LYS 181 1.776 6.601 -3.995 85 HE2 LYS 181 HE2 LYS 181 1.142 5.706 -6.193 86 HE3 LYS 181 HE1 LYS 181 0.178 7.150 -6.496 87 HZ1 LYS 181 HZ1 LYS 181 2.513 7.074 -7.461 88 HZ2 LYS 181 HZ2 LYS 181 3.064 7.328 -5.876 89 HZ3 LYS 181 HZ3 LYS 181 2.069 8.477 -6.622 90 H THR 182 HN THR 182 -4.755 7.278 -2.302 91 HA THR 182 HA THR 182 -6.392 8.054 -4.608 92 HB THR 182 HB THR 182 -8.246 8.299 -3.026 93 HG1 THR 182 HG1 THR 182 -7.505 7.231 -0.832 94 HG21 THR 182 HG21 THR 182 -7.872 6.095 -3.995 95 HG22 THR 182 HG22 THR 182 -8.481 5.954 -2.345 96 HG23 THR 182 HG23 THR 182 -6.769 5.690 -2.680 97 H SER 183 HN SER 183 -6.982 10.145 -4.988 98 HA SER 183 HA SER 183 -5.251 12.168 -4.047 99 HB2 SER 183 HB2 SER 183 -6.937 13.659 -5.332 100 HB3 SER 183 HB1 SER 183 -6.014 12.459 -6.238 101 HG SER 183 HG SER 183 -8.496 12.672 -6.423 102 H SER 184 HN SER 184 -8.143 10.906 -2.773 103 HA SER 184 HA SER 184 -9.012 13.250 -1.399 104 HB2 SER 184 HB2 SER 184 -10.315 11.509 -0.023 105 HB3 SER 184 HB1 SER 184 -10.683 11.621 -1.745 106 HG SER 184 HG SER 184 -9.148 9.673 -0.376 107 H GLY 185 HN GLY 185 -6.483 11.023 -0.927 108 HA2 GLY 185 HA2 GLY 185 -4.737 11.888 0.556 109 HA3 GLY 185 HA1 GLY 185 -6.002 12.241 1.718 110 H GLN 186 HN GLN 186 -5.985 9.182 -0.046 111 HA GLN 186 HA GLN 186 -5.047 7.910 2.452 112 HB2 GLN 186 HB2 GLN 186 -6.865 6.676 0.362 113 HB3 GLN 186 HB1 GLN 186 -6.262 5.872 1.800 114 HG2 GLN 186 HG2 GLN 186 -8.330 6.444 2.522 115 HG3 GLN 186 HG1 GLN 186 -7.443 7.882 3.018 116 HE21 GLN 186 HE21 GLN 186 -9.643 6.522 0.675 117 HE22 GLN 186 HE22 GLN 186 -10.251 8.044 0.091 118 H ARG 187 HN ARG 187 -3.299 6.651 2.358 119 HA ARG 187 HA ARG 187 -2.462 5.637 -0.249 120 HB2 ARG 187 HB2 ARG 187 -0.078 6.146 0.334 121 HB3 ARG 187 HB1 ARG 187 -1.067 7.559 0.006 122 HG2 ARG 187 HG2 ARG 187 -1.268 8.002 2.384 123 HG3 ARG 187 HG1 ARG 187 -0.339 6.547 2.749 124 HD2 ARG 187 HD2 ARG 187 0.673 8.911 1.172 125 HD3 ARG 187 HD1 ARG 187 1.014 8.606 2.873 126 HE ARG 187 HE ARG 187 2.084 6.474 2.042 127 HH11 ARG 187 HH11 ARG 187 1.838 9.326 0.018 128 HH12 ARG 187 HH12 ARG 187 3.289 8.968 -0.881 129 HH21 ARG 187 HH21 ARG 187 4.027 6.023 0.886 130 HH22 ARG 187 HH22 ARG 187 4.542 7.107 -0.369 131 H TYR 188 HN TYR 188 -3.024 3.544 0.230 132 HA TYR 188 HA TYR 188 -1.583 2.352 2.496 133 HB2 TYR 188 HB2 TYR 188 -3.340 0.709 2.738 134 HB3 TYR 188 HB1 TYR 188 -4.059 2.311 2.782 135 HD1 TYR 188 HD1 TYR 188 -3.628 -0.729 0.735 136 HD2 TYR 188 HD2 TYR 188 -5.712 2.963 1.161 137 HE1 TYR 188 HE1 TYR 188 -5.235 -1.429 -0.983 138 HE2 TYR 188 HE2 TYR 188 -7.287 2.284 -0.576 139 HH TYR 188 HH TYR 188 -7.320 -0.979 -1.846 140 H PHE 189 HN PHE 189 -0.583 0.350 2.159 141 HA PHE 189 HA PHE 189 -0.161 -0.248 -0.693 142 HB2 PHE 189 HB2 PHE 189 1.805 -0.530 1.585 143 HB3 PHE 189 HB1 PHE 189 2.098 -1.005 -0.085 144 HD1 PHE 189 HD2 PHE 189 0.917 1.317 -1.505 145 HD2 PHE 189 HD1 PHE 189 3.395 1.126 1.947 146 HE1 PHE 189 HE2 PHE 189 1.790 3.561 -2.009 147 HE2 PHE 189 HE1 PHE 189 4.261 3.377 1.447 148 HZ PHE 189 HZ PHE 189 3.456 4.594 -0.528 149 H LEU 190 HN LEU 190 -0.519 -2.227 -1.359 150 HA LEU 190 HA LEU 190 -1.268 -4.306 0.524 151 HB2 LEU 190 HB2 LEU 190 -1.441 -3.903 -2.408 152 HB3 LEU 190 HB1 LEU 190 -1.360 -5.548 -1.842 153 HG LEU 190 HG LEU 190 -3.534 -3.538 -1.523 154 HD11 LEU 190 HD11 LEU 190 -4.425 -4.929 -3.005 155 HD12 LEU 190 HD12 LEU 190 -4.405 -6.212 -1.778 156 HD13 LEU 190 HD13 LEU 190 -3.038 -6.006 -2.872 157 HD21 LEU 190 HD21 LEU 190 -3.031 -4.220 0.780 158 HD22 LEU 190 HD22 LEU 190 -3.125 -5.913 0.300 159 HD23 LEU 190 HD23 LEU 190 -4.564 -4.898 0.232 160 H ASN 191 HN ASN 191 0.149 -5.970 1.147 161 HA ASN 191 HA ASN 191 2.609 -6.250 -0.403 162 HB2 ASN 191 HB2 ASN 191 1.649 -7.891 1.967 163 HB3 ASN 191 HB1 ASN 191 3.225 -8.017 1.200 164 HD21 ASN 191 HD21 ASN 191 1.608 -4.964 1.881 165 HD22 ASN 191 HD22 ASN 191 2.715 -4.454 3.103 166 H HIS 192 HN HIS 192 2.048 -7.101 -2.371 167 HA HIS 192 HA HIS 192 -0.106 -8.971 -2.637 168 HB2 HIS 192 HB2 HIS 192 1.781 -7.641 -4.481 169 HB3 HIS 192 HB1 HIS 192 1.150 -9.198 -5.015 170 HD1 HIS 192 HD1 HIS 192 -1.458 -9.375 -5.319 171 HD2 HIS 192 HD2 HIS 192 -0.006 -5.541 -4.623 172 HE1 HIS 192 HE1 HIS 192 -3.338 -7.817 -5.923 173 HE2 HIS 192 HE2 HIS 192 -2.363 -5.500 -5.703 174 H ILE 193 HN ILE 193 2.944 -9.359 -1.535 175 HA ILE 193 HA ILE 193 3.321 -12.063 -2.518 176 HB ILE 193 HB ILE 193 5.312 -12.022 -0.974 177 HG12 ILE 193 HG12 ILE 193 4.478 -9.129 -0.624 178 HG13 ILE 193 HG11 ILE 193 4.407 -10.372 0.624 179 HG21 ILE 193 HG21 ILE 193 5.113 -9.799 -3.003 180 HG22 ILE 193 HG22 ILE 193 5.542 -11.479 -3.329 181 HG23 ILE 193 HG23 ILE 193 6.614 -10.466 -2.363 182 HD11 ILE 193 HD11 ILE 193 6.327 -9.260 1.170 183 HD12 ILE 193 HD12 ILE 193 6.739 -8.936 -0.509 184 HD13 ILE 193 HD13 ILE 193 6.969 -10.555 0.155 185 H ASP 194 HN ASP 194 2.368 -10.357 0.410 186 HA ASP 194 HA ASP 194 2.014 -12.894 1.817 187 HB2 ASP 194 HB2 ASP 194 3.301 -10.808 2.753 188 HB3 ASP 194 HB1 ASP 194 1.688 -10.219 3.165 189 H GLN 195 HN GLN 195 0.224 -10.643 0.086 190 HA GLN 195 HA GLN 195 -1.962 -10.015 -0.108 191 HB2 GLN 195 HB2 GLN 195 -2.249 -12.551 -0.180 192 HB3 GLN 195 HB1 GLN 195 -2.653 -12.471 1.531 193 HG2 GLN 195 HG2 GLN 195 -4.554 -11.057 1.054 194 HG3 GLN 195 HG1 GLN 195 -4.131 -11.021 -0.656 195 HE21 GLN 195 HE21 GLN 195 -5.412 -12.937 1.945 196 HE22 GLN 195 HE22 GLN 195 -6.082 -14.194 0.954 197 H THR 196 HN THR 196 -0.246 -9.330 2.105 198 HA THR 196 HA THR 196 -2.051 -8.928 4.357 199 HB THR 196 HB THR 196 0.866 -9.139 3.972 200 HG1 THR 196 HG1 THR 196 0.542 -10.606 5.443 201 HG21 THR 196 HG21 THR 196 1.574 -7.839 5.758 202 HG22 THR 196 HG22 THR 196 -0.069 -7.547 6.336 203 HG23 THR 196 HG23 THR 196 0.498 -6.768 4.856 204 H THR 197 HN THR 197 -2.601 -6.919 5.104 205 HA THR 197 HA THR 197 -2.348 -4.788 3.120 206 HB THR 197 HB THR 197 -4.317 -3.822 4.331 207 HG1 THR 197 HG1 THR 197 -3.859 -4.966 6.344 208 HG21 THR 197 HG21 THR 197 -5.928 -5.555 3.548 209 HG22 THR 197 HG22 THR 197 -4.568 -6.645 3.285 210 HG23 THR 197 HG23 THR 197 -4.697 -5.155 2.351 211 H THR 198 HN THR 198 -1.365 -2.877 3.562 212 HA THR 198 HA THR 198 -0.617 -2.294 6.350 213 HB THR 198 HB THR 198 1.225 -1.893 3.982 214 HG1 THR 198 HG1 THR 198 0.963 -4.029 5.822 215 HG21 THR 198 HG21 THR 198 1.701 -1.757 6.961 216 HG22 THR 198 HG22 THR 198 1.659 -0.389 5.847 217 HG23 THR 198 HG23 THR 198 2.942 -1.592 5.718 218 H TRP 199 HN TRP 199 -0.807 -0.154 6.943 219 HA TRP 199 HA TRP 199 -1.708 1.737 4.874 220 HB2 TRP 199 HB2 TRP 199 -2.129 1.562 7.832 221 HB3 TRP 199 HB1 TRP 199 -2.232 3.129 7.041 222 HD1 TRP 199 HD1 TRP 199 -4.170 -0.043 7.619 223 HE1 TRP 199 HE1 TRP 199 -6.501 0.175 6.545 224 HE3 TRP 199 HE3 TRP 199 -3.415 4.236 4.931 225 HZ2 TRP 199 HZ2 TRP 199 -7.833 1.939 4.758 226 HZ3 TRP 199 HZ3 TRP 199 -5.264 5.121 3.569 227 HH2 TRP 199 HH2 TRP 199 -7.423 3.987 3.492 228 H GLN 200 HN GLN 200 0.933 1.019 6.920 229 HA GLN 200 HA GLN 200 1.925 3.770 6.802 230 HB2 GLN 200 HB2 GLN 200 1.864 2.529 8.992 231 HB3 GLN 200 HB1 GLN 200 3.091 1.450 8.343 232 HG2 GLN 200 HG2 GLN 200 4.085 3.152 9.755 233 HG3 GLN 200 HG1 GLN 200 4.622 3.325 8.085 234 HE21 GLN 200 HE21 GLN 200 1.463 4.311 9.201 235 HE22 GLN 200 HE22 GLN 200 1.715 6.011 9.026 236 H ASP 201 HN ASP 201 3.501 4.351 5.503 237 HA ASP 201 HA ASP 201 4.505 2.762 3.445 238 HB2 ASP 201 HB2 ASP 201 4.450 5.253 3.460 239 HB3 ASP 201 HB1 ASP 201 5.761 5.251 4.633 240 HA PRO 202 HA PRO 202 7.306 0.278 5.754 241 HB2 PRO 202 HB2 PRO 202 8.582 -0.907 3.650 242 HB3 PRO 202 HB1 PRO 202 6.988 -1.383 4.238 243 HG2 PRO 202 HG2 PRO 202 7.724 0.246 1.862 244 HG3 PRO 202 HG1 PRO 202 6.381 -0.885 2.083 245 HD2 PRO 202 HD2 PRO 202 6.126 1.849 2.178 246 HD3 PRO 202 HD1 PRO 202 5.017 0.709 2.963 247 H ARG 203 HN ARG 203 8.394 2.674 3.487 248 HA ARG 203 HA ARG 203 11.119 2.438 4.548 249 HB2 ARG 203 HB2 ARG 203 9.988 3.630 2.073 250 HB3 ARG 203 HB1 ARG 203 11.435 4.371 2.747 251 HG2 ARG 203 HG2 ARG 203 11.930 2.652 1.039 252 HG3 ARG 203 HG1 ARG 203 12.634 2.284 2.615 253 HD2 ARG 203 HD2 ARG 203 10.542 0.891 3.026 254 HD3 ARG 203 HD1 ARG 203 10.238 1.039 1.298 255 HE ARG 203 HE ARG 203 12.357 -0.116 0.940 256 HH11 ARG 203 HH11 ARG 203 10.970 -0.250 4.154 257 HH12 ARG 203 HH12 ARG 203 11.743 -1.744 4.577 258 HH21 ARG 203 HH21 ARG 203 13.400 -2.096 1.495 259 HH22 ARG 203 HH22 ARG 203 13.146 -2.777 3.080 260 H LYS 204 HN LYS 204 8.274 4.237 4.918 261 HA LYS 204 HA LYS 204 9.552 6.518 6.145 262 HB2 LYS 204 HB2 LYS 204 7.450 6.836 4.972 263 HB3 LYS 204 HB1 LYS 204 6.666 5.630 5.977 264 HG2 LYS 204 HG2 LYS 204 6.970 7.093 7.929 265 HG3 LYS 204 HG1 LYS 204 7.691 8.315 6.876 266 HD2 LYS 204 HD2 LYS 204 5.645 8.518 5.626 267 HD3 LYS 204 HD1 LYS 204 4.927 7.168 6.503 268 HE2 LYS 204 HE2 LYS 204 5.718 9.834 7.670 269 HE3 LYS 204 HE1 LYS 204 4.076 9.295 7.326 270 HZ1 LYS 204 HZ1 LYS 204 4.667 7.362 8.897 271 HZ2 LYS 204 HZ2 LYS 204 4.307 8.874 9.569 272 HZ3 LYS 204 HZ3 LYS 204 5.918 8.376 9.435 273 H ALA 205 HN ALA 205 7.940 3.549 7.084 274 HA ALA 205 HA ALA 205 9.202 3.711 9.700 275 HB1 ALA 205 HB1 ALA 205 6.988 4.697 10.057 276 HB2 ALA 205 HB2 ALA 205 7.147 3.153 10.895 277 HB3 ALA 205 HB3 ALA 205 6.233 3.250 9.389 278 H1 SER 201 HT1 SER 201 -3.632 -5.019 -11.789 279 H2 SER 201 HT2 SER 201 -5.312 -5.169 -11.634 280 H3 SER 201 HT3 SER 201 -4.405 -4.435 -10.401 281 HA SER 201 HA SER 201 -3.840 -2.605 -11.777 282 HB2 SER 201 HB2 SER 201 -5.367 -4.114 -13.906 283 HB3 SER 201 HB1 SER 201 -4.876 -2.427 -14.057 284 HG SER 201 HG SER 201 -2.759 -3.019 -14.055 285 H TPO 202 HN TPO 202 -6.614 -4.265 -10.797 286 HA TPO 202 HA TPO 202 -8.328 -1.921 -11.056 287 HB TPO 202 HB TPO 202 -9.371 -4.129 -9.445 288 HG21 TPO 202 HG21 TPO 202 -10.293 -2.822 -12.012 289 HG22 TPO 202 HG22 TPO 202 -10.754 -2.333 -10.381 290 HG23 TPO 202 HG23 TPO 202 -11.252 -3.906 -11.003 291 H TYR 203 HN TYR 203 -9.526 -1.222 -9.074 292 HA TYR 203 HA TYR 203 -7.599 -1.041 -6.868 293 HB2 TYR 203 HB2 TYR 203 -8.081 1.081 -8.024 294 HB3 TYR 203 HB1 TYR 203 -9.795 0.880 -7.672 295 HD1 TYR 203 HD2 TYR 203 -6.497 1.116 -5.961 296 HD2 TYR 203 HD1 TYR 203 -10.678 1.855 -5.758 297 HE1 TYR 203 HE2 TYR 203 -6.182 2.278 -3.821 298 HE2 TYR 203 HE1 TYR 203 -10.373 3.021 -3.615 299 HH TYR 203 HH TYR 203 -8.819 3.137 -1.790 300 HA PRO 204 HA PRO 204 -10.708 -3.090 -4.320 301 HB2 PRO 204 HB2 PRO 204 -8.878 -2.464 -2.119 302 HB3 PRO 204 HB1 PRO 204 -9.366 -4.040 -2.745 303 HG2 PRO 204 HG2 PRO 204 -6.869 -3.070 -3.065 304 HG3 PRO 204 HG1 PRO 204 -7.644 -4.116 -4.270 305 HD2 PRO 204 HD2 PRO 204 -7.322 -1.135 -4.273 306 HD3 PRO 204 HD1 PRO 204 -7.110 -2.290 -5.608 307 H HIS 205 HN HIS 205 -10.490 -2.059 -1.471 308 HA HIS 205 HA HIS 205 -11.022 0.780 -1.753 309 HB2 HIS 205 HB2 HIS 205 -13.243 -0.361 -2.096 310 HB3 HIS 205 HB1 HIS 205 -13.119 -0.954 -0.441 311 HD1 HIS 205 HD1 HIS 205 -14.655 0.411 0.947 312 HD2 HIS 205 HD2 HIS 205 -12.590 2.716 -1.825 313 HE1 HIS 205 HE1 HIS 205 -15.305 2.792 1.423 314 HE2 HIS 205 HE2 HIS 205 -13.796 4.159 -0.059 315 H SEP 206 HN SEP 206 -8.876 0.005 -0.650 316 HA SEP 206 HA SEP 206 -7.526 0.192 1.132 317 HB2 SEP 206 HB2 SEP 206 -9.891 1.533 2.436 318 HB3 SEP 206 HB1 SEP 206 -8.223 1.687 2.935 319 HA PRO 207 HA PRO 207 -8.070 -3.277 3.805 320 HB2 PRO 207 HB2 PRO 207 -6.225 -2.024 5.707 321 HB3 PRO 207 HB1 PRO 207 -6.005 -3.478 4.734 322 HG2 PRO 207 HG2 PRO 207 -4.651 -1.213 4.226 323 HG3 PRO 207 HG1 PRO 207 -5.169 -2.308 2.931 324 HD2 PRO 207 HD2 PRO 207 -6.411 0.261 3.848 325 HD3 PRO 207 HD1 PRO 207 -6.141 -0.331 2.195 326 H THR 208 HN THR 208 -8.728 -0.086 4.854 327 HA THR 208 HA THR 208 -10.280 -1.108 7.106 328 HB THR 208 HB THR 208 -8.441 1.271 7.418 329 HG1 THR 208 HG1 THR 208 -8.083 -1.338 8.529 330 HG21 THR 208 HG21 THR 208 -10.404 1.284 8.882 331 HG22 THR 208 HG22 THR 208 -8.935 0.987 9.810 332 HG23 THR 208 HG23 THR 208 -10.018 -0.349 9.425 333 H SER 209 HN SER 209 -11.916 -0.640 5.451 334 HA SER 209 HA SER 209 -12.987 2.013 5.925 335 HB2 SER 209 HB2 SER 209 -12.557 0.889 3.143 336 HB3 SER 209 HB1 SER 209 -13.590 2.272 3.501 337 HG SER 209 HG SER 209 -11.345 2.725 2.832
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