NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
25973 | 2kdh | 17243 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 90 HT1 MET 90 12.973 8.313 6.152 2 H2 MET 90 HT2 MET 90 12.429 9.625 5.220 3 H3 MET 90 HT3 MET 90 14.011 9.038 5.023 4 HA MET 90 HA MET 90 12.939 8.102 3.207 5 HB2 MET 90 HB2 MET 90 13.824 6.589 5.370 6 HB3 MET 90 HB1 MET 90 12.278 5.847 4.957 7 HG2 MET 90 HG2 MET 90 13.397 4.753 3.326 8 HG3 MET 90 HG1 MET 90 13.457 6.300 2.481 9 HE1 MET 90 HE1 MET 90 16.524 3.699 3.004 10 HE2 MET 90 HE2 MET 90 16.414 4.759 1.601 11 HE3 MET 90 HE3 MET 90 14.973 3.932 2.186 12 H GLY 91 HN GLY 91 10.986 7.230 2.240 13 HA2 GLY 91 HA2 GLY 91 8.529 7.443 3.920 14 HA3 GLY 91 HA1 GLY 91 8.604 8.282 2.369 15 H LYS 92 HN LYS 92 7.406 5.567 3.746 16 HA LYS 92 HA LYS 92 7.773 3.928 1.260 17 HB2 LYS 92 HB2 LYS 92 7.688 3.385 4.175 18 HB3 LYS 92 HB1 LYS 92 6.854 2.207 3.160 19 HG2 LYS 92 HG2 LYS 92 9.349 2.870 1.916 20 HG3 LYS 92 HG1 LYS 92 9.657 2.454 3.602 21 HD2 LYS 92 HD2 LYS 92 8.612 0.320 3.369 22 HD3 LYS 92 HD1 LYS 92 7.912 0.756 1.809 23 HE2 LYS 92 HE2 LYS 92 9.736 -0.335 0.950 24 HE3 LYS 92 HE1 LYS 92 10.601 1.162 1.352 25 HZ1 LYS 92 HZ1 LYS 92 10.193 -1.123 3.208 26 HZ2 LYS 92 HZ2 LYS 92 11.057 0.300 3.545 27 HZ3 LYS 92 HZ3 LYS 92 11.637 -0.795 2.382 28 H SER 93 HN SER 93 5.365 3.450 3.792 29 HA SER 93 HA SER 93 3.226 3.774 1.732 30 HB2 SER 93 HB2 SER 93 3.565 1.632 3.028 31 HB3 SER 93 HB1 SER 93 3.147 2.517 4.492 32 HG SER 93 HG SER 93 1.516 2.343 2.172 33 H GLU 94 HN GLU 94 1.044 4.474 2.944 34 HA GLU 94 HA GLU 94 1.085 7.185 3.545 35 HB2 GLU 94 HB2 GLU 94 -0.687 5.011 4.706 36 HB3 GLU 94 HB1 GLU 94 -1.097 6.725 4.630 37 HG2 GLU 94 HG2 GLU 94 -1.980 6.300 2.595 38 HG3 GLU 94 HG1 GLU 94 -0.321 6.109 2.025 39 H GLU 95 HN GLU 95 1.885 4.505 5.687 40 HA GLU 95 HA GLU 95 1.702 5.744 8.218 41 HB2 GLU 95 HB2 GLU 95 3.425 3.639 6.941 42 HB3 GLU 95 HB1 GLU 95 3.778 4.149 8.592 43 HG2 GLU 95 HG2 GLU 95 2.265 2.458 9.032 44 HG3 GLU 95 HG1 GLU 95 1.150 3.817 8.875 45 H GLU 96 HN GLU 96 4.514 5.668 5.995 46 HA GLU 96 HA GLU 96 5.848 7.771 7.620 47 HB2 GLU 96 HB2 GLU 96 6.626 5.491 6.157 48 HB3 GLU 96 HB1 GLU 96 7.237 6.868 5.239 49 HG2 GLU 96 HG2 GLU 96 8.560 7.632 7.015 50 HG3 GLU 96 HG1 GLU 96 7.609 6.765 8.222 51 H LEU 97 HN LEU 97 4.317 7.275 4.482 52 HA LEU 97 HA LEU 97 5.212 9.377 2.919 53 HB2 LEU 97 HB2 LEU 97 2.815 7.781 3.265 54 HB3 LEU 97 HB1 LEU 97 2.394 9.411 2.748 55 HG LEU 97 HG LEU 97 2.733 8.152 0.746 56 HD11 LEU 97 HD11 LEU 97 5.417 9.171 0.553 57 HD12 LEU 97 HD12 LEU 97 4.423 10.316 1.454 58 HD13 LEU 97 HD13 LEU 97 3.941 9.813 -0.167 59 HD21 LEU 97 HD21 LEU 97 3.882 6.219 1.089 60 HD22 LEU 97 HD22 LEU 97 4.877 6.924 2.363 61 HD23 LEU 97 HD23 LEU 97 5.295 7.187 0.670 62 H SER 98 HN SER 98 2.616 9.626 5.379 63 HA SER 98 HA SER 98 2.011 12.337 5.233 64 HB2 SER 98 HB2 SER 98 1.382 12.075 7.596 65 HB3 SER 98 HB1 SER 98 0.973 10.615 6.698 66 HG SER 98 HG SER 98 2.568 9.555 7.668 67 H ASP 99 HN ASP 99 4.448 10.990 7.505 68 HA ASP 99 HA ASP 99 5.570 13.473 8.298 69 HB2 ASP 99 HB2 ASP 99 5.841 10.950 9.072 70 HB3 ASP 99 HB1 ASP 99 7.237 10.996 7.994 71 H LEU 100 HN LEU 100 6.603 11.238 5.696 72 HA LEU 100 HA LEU 100 8.846 12.736 4.786 73 HB2 LEU 100 HB2 LEU 100 8.400 10.436 4.136 74 HB3 LEU 100 HB1 LEU 100 6.875 10.905 3.382 75 HG LEU 100 HG LEU 100 8.557 12.567 2.071 76 HD11 LEU 100 HD11 LEU 100 10.714 11.972 2.311 77 HD12 LEU 100 HD12 LEU 100 10.329 10.380 1.658 78 HD13 LEU 100 HD13 LEU 100 10.249 10.662 3.397 79 HD21 LEU 100 HD21 LEU 100 8.040 11.271 0.236 80 HD22 LEU 100 HD22 LEU 100 6.927 10.539 1.392 81 HD23 LEU 100 HD23 LEU 100 8.475 9.766 1.047 82 H PHE 101 HN PHE 101 5.397 13.157 4.257 83 HA PHE 101 HA PHE 101 5.604 14.928 1.972 84 HB2 PHE 101 HB2 PHE 101 3.596 13.623 2.590 85 HB3 PHE 101 HB1 PHE 101 3.454 14.550 4.084 86 HD1 PHE 101 HD1 PHE 101 3.666 15.015 0.370 87 HD2 PHE 101 HD2 PHE 101 2.181 16.515 4.111 88 HE1 PHE 101 HE1 PHE 101 2.400 16.774 -0.836 89 HE2 PHE 101 HE2 PHE 101 0.916 18.273 2.905 90 HZ PHE 101 HZ PHE 101 1.025 18.403 0.431 91 H ARG 102 HN ARG 102 4.468 15.742 5.275 92 HA ARG 102 HA ARG 102 4.776 18.530 5.095 93 HB2 ARG 102 HB2 ARG 102 4.559 18.466 7.468 94 HB3 ARG 102 HB1 ARG 102 3.735 17.012 6.904 95 HG2 ARG 102 HG2 ARG 102 6.145 15.939 7.184 96 HG3 ARG 102 HG1 ARG 102 6.362 17.274 8.316 97 HD2 ARG 102 HD2 ARG 102 4.144 15.195 8.409 98 HD3 ARG 102 HD1 ARG 102 5.495 15.350 9.550 99 HE ARG 102 HE ARG 102 3.124 17.037 9.501 100 HH11 ARG 102 HH21 ARG 102 6.512 16.874 10.154 101 HH12 ARG 102 HH22 ARG 102 6.484 18.171 11.301 102 HH21 ARG 102 HH11 ARG 102 3.077 18.729 10.997 103 HH22 ARG 102 HH12 ARG 102 4.544 19.219 11.779 104 H MET 103 HN MET 103 7.217 16.070 5.381 105 HA MET 103 HA MET 103 9.328 17.763 6.447 106 HB2 MET 103 HB2 MET 103 9.200 15.276 6.610 107 HB3 MET 103 HB1 MET 103 9.415 15.175 4.862 108 HG2 MET 103 HG2 MET 103 11.496 16.827 5.656 109 HG3 MET 103 HG1 MET 103 11.410 15.636 6.953 110 HE1 MET 103 HE1 MET 103 12.208 12.324 5.509 111 HE2 MET 103 HE2 MET 103 10.873 13.097 6.359 112 HE3 MET 103 HE3 MET 103 12.531 13.426 6.855 113 H PHE 104 HN PHE 104 8.093 17.015 3.234 114 HA PHE 104 HA PHE 104 10.409 18.141 1.833 115 HB2 PHE 104 HB2 PHE 104 7.710 17.003 1.165 116 HB3 PHE 104 HB1 PHE 104 8.596 17.892 -0.075 117 HD1 PHE 104 HD2 PHE 104 11.377 17.247 0.439 118 HD2 PHE 104 HD1 PHE 104 7.915 14.716 0.673 119 HE1 PHE 104 HE2 PHE 104 12.802 15.261 0.026 120 HE2 PHE 104 HE1 PHE 104 9.340 12.728 0.260 121 HZ PHE 104 HZ PHE 104 11.783 13.001 -0.064 122 H ASP 105 HN ASP 105 7.096 19.190 2.631 123 HA ASP 105 HA ASP 105 6.948 21.576 1.148 124 HB2 ASP 105 HB2 ASP 105 5.161 20.507 2.520 125 HB3 ASP 105 HB1 ASP 105 5.996 21.036 3.981 126 H LYS 106 HN LYS 106 8.949 22.711 1.088 127 HA LYS 106 HA LYS 106 10.556 23.353 3.371 128 HB2 LYS 106 HB2 LYS 106 10.826 23.495 0.704 129 HB3 LYS 106 HB1 LYS 106 10.390 25.176 1.010 130 HG2 LYS 106 HG2 LYS 106 12.624 25.421 1.398 131 HG3 LYS 106 HG1 LYS 106 12.219 24.770 2.986 132 HD2 LYS 106 HD2 LYS 106 12.778 22.516 2.259 133 HD3 LYS 106 HD1 LYS 106 13.053 23.081 0.611 134 HE2 LYS 106 HE2 LYS 106 14.809 24.684 1.693 135 HE3 LYS 106 HE1 LYS 106 14.732 23.565 3.069 136 HZ1 LYS 106 HZ1 LYS 106 16.306 22.570 1.722 137 HZ2 LYS 106 HZ2 LYS 106 15.525 23.020 0.281 138 HZ3 LYS 106 HZ3 LYS 106 14.889 21.770 1.241 139 H ASN 107 HN ASN 107 7.767 24.951 1.886 140 HA ASN 107 HA ASN 107 7.994 27.456 3.289 141 HB2 ASN 107 HB2 ASN 107 6.669 27.078 1.244 142 HB3 ASN 107 HB1 ASN 107 5.614 25.972 2.125 143 HD21 ASN 107 HD21 ASN 107 3.852 27.578 1.498 144 HD22 ASN 107 HD22 ASN 107 3.639 28.957 2.464 145 H ALA 108 HN ALA 108 6.814 24.301 4.204 146 HA ALA 108 HA ALA 108 5.960 23.506 6.259 147 HB1 ALA 108 HB1 ALA 108 7.897 25.460 6.723 148 HB2 ALA 108 HB2 ALA 108 7.250 24.341 7.924 149 HB3 ALA 108 HB3 ALA 108 6.548 25.950 7.749 150 H ASP 109 HN ASP 109 3.797 23.937 5.103 151 HA ASP 109 HA ASP 109 2.177 25.784 6.794 152 HB2 ASP 109 HB2 ASP 109 1.138 26.699 4.748 153 HB3 ASP 109 HB1 ASP 109 2.882 26.967 4.729 154 H GLY 110 HN GLY 110 2.623 22.721 5.876 155 HA2 GLY 110 HA2 GLY 110 1.078 20.936 6.323 156 HA3 GLY 110 HA1 GLY 110 -0.255 22.076 6.135 157 H TYR 111 HN TYR 111 0.975 23.130 3.595 158 HA TYR 111 HA TYR 111 0.348 20.788 1.824 159 HB2 TYR 111 HB2 TYR 111 -0.435 23.710 1.563 160 HB3 TYR 111 HB1 TYR 111 -0.816 22.452 0.386 161 HD1 TYR 111 HD2 TYR 111 -1.169 23.223 4.039 162 HD2 TYR 111 HD1 TYR 111 -2.811 21.247 0.596 163 HE1 TYR 111 HE2 TYR 111 -3.174 22.595 5.356 164 HE2 TYR 111 HE1 TYR 111 -4.817 20.619 1.913 165 HH TYR 111 HH TYR 111 -5.758 22.012 4.602 166 H ILE 112 HN ILE 112 1.082 21.424 -0.545 167 HA ILE 112 HA ILE 112 3.744 22.802 -0.400 168 HB ILE 112 HB ILE 112 2.884 20.155 -1.571 169 HG12 ILE 112 HG12 ILE 112 5.158 21.073 0.217 170 HG13 ILE 112 HG11 ILE 112 3.757 20.115 0.702 171 HG21 ILE 112 HG21 ILE 112 5.268 20.150 -2.558 172 HG22 ILE 112 HG22 ILE 112 5.216 21.903 -2.368 173 HG23 ILE 112 HG23 ILE 112 4.048 21.093 -3.412 174 HD11 ILE 112 HD11 ILE 112 4.714 18.609 -1.361 175 HD12 ILE 112 HD12 ILE 112 5.145 18.345 0.329 176 HD13 ILE 112 HD13 ILE 112 6.213 19.279 -0.718 177 H ASP 113 HN ASP 113 3.947 24.395 -1.934 178 HA ASP 113 HA ASP 113 1.859 24.603 -4.046 179 HB2 ASP 113 HB2 ASP 113 3.969 26.474 -2.927 180 HB3 ASP 113 HB1 ASP 113 2.874 26.914 -4.239 181 H LEU 114 HN LEU 114 2.812 25.576 -6.190 182 HA LEU 114 HA LEU 114 4.579 23.644 -7.367 183 HB2 LEU 114 HB2 LEU 114 3.294 26.247 -8.100 184 HB3 LEU 114 HB1 LEU 114 4.565 25.623 -9.153 185 HG LEU 114 HG LEU 114 3.028 23.378 -8.665 186 HD11 LEU 114 HD11 LEU 114 1.135 24.324 -7.716 187 HD12 LEU 114 HD12 LEU 114 0.716 24.441 -9.425 188 HD13 LEU 114 HD13 LEU 114 1.342 25.852 -8.571 189 HD21 LEU 114 HD21 LEU 114 2.291 25.113 -10.980 190 HD22 LEU 114 HD22 LEU 114 2.750 23.410 -10.955 191 HD23 LEU 114 HD23 LEU 114 3.988 24.658 -10.820 192 H ASP 115 HN ASP 115 5.104 26.977 -6.204 193 HA ASP 115 HA ASP 115 7.767 27.330 -7.129 194 HB2 ASP 115 HB2 ASP 115 6.114 28.978 -6.082 195 HB3 ASP 115 HB1 ASP 115 6.613 28.335 -4.517 196 H GLU 116 HN GLU 116 6.527 25.322 -4.572 197 HA GLU 116 HA GLU 116 9.205 25.055 -3.305 198 HB2 GLU 116 HB2 GLU 116 6.547 23.763 -2.620 199 HB3 GLU 116 HB1 GLU 116 7.956 23.915 -1.568 200 HG2 GLU 116 HG2 GLU 116 7.739 26.341 -1.552 201 HG3 GLU 116 HG1 GLU 116 6.410 26.259 -2.709 202 H LEU 117 HN LEU 117 6.958 23.299 -5.366 203 HA LEU 117 HA LEU 117 7.916 20.652 -5.077 204 HB2 LEU 117 HB2 LEU 117 6.831 22.224 -7.430 205 HB3 LEU 117 HB1 LEU 117 7.075 20.478 -7.473 206 HG LEU 117 HG LEU 117 5.407 21.877 -5.369 207 HD11 LEU 117 HD11 LEU 117 4.770 21.677 -8.051 208 HD12 LEU 117 HD12 LEU 117 3.602 21.821 -6.737 209 HD13 LEU 117 HD13 LEU 117 4.027 20.230 -7.369 210 HD21 LEU 117 HD21 LEU 117 5.790 19.822 -4.431 211 HD22 LEU 117 HD22 LEU 117 6.211 19.084 -5.976 212 HD23 LEU 117 HD23 LEU 117 4.517 19.317 -5.543 213 H LYS 118 HN LYS 118 8.911 23.030 -7.584 214 HA LYS 118 HA LYS 118 11.004 21.575 -8.748 215 HB2 LYS 118 HB2 LYS 118 11.876 23.839 -9.336 216 HB3 LYS 118 HB1 LYS 118 10.132 23.717 -9.565 217 HG2 LYS 118 HG2 LYS 118 9.999 24.596 -7.108 218 HG3 LYS 118 HG1 LYS 118 11.653 25.137 -7.395 219 HD2 LYS 118 HD2 LYS 118 10.225 25.898 -9.692 220 HD3 LYS 118 HD1 LYS 118 9.167 26.294 -8.337 221 HE2 LYS 118 HE2 LYS 118 10.424 28.171 -8.077 222 HE3 LYS 118 HE1 LYS 118 11.718 27.106 -7.490 223 HZ1 LYS 118 HZ1 LYS 118 11.254 28.119 -10.221 224 HZ2 LYS 118 HZ2 LYS 118 12.100 26.664 -9.984 225 HZ3 LYS 118 HZ3 LYS 118 12.690 28.112 -9.319 226 H ILE 119 HN ILE 119 10.943 23.254 -5.653 227 HA ILE 119 HA ILE 119 13.863 22.963 -5.276 228 HB ILE 119 HB ILE 119 11.564 24.078 -3.646 229 HG12 ILE 119 HG12 ILE 119 13.963 25.435 -4.912 230 HG13 ILE 119 HG11 ILE 119 12.378 25.329 -5.679 231 HG21 ILE 119 HG21 ILE 119 13.120 23.291 -2.018 232 HG22 ILE 119 HG22 ILE 119 13.469 25.008 -2.210 233 HG23 ILE 119 HG23 ILE 119 14.502 23.807 -2.984 234 HD11 ILE 119 HD11 ILE 119 11.676 27.109 -4.500 235 HD12 ILE 119 HD12 ILE 119 13.268 27.234 -3.752 236 HD13 ILE 119 HD13 ILE 119 12.013 26.253 -2.995 237 H MET 120 HN MET 120 10.893 21.326 -4.426 238 HA MET 120 HA MET 120 11.755 19.877 -2.120 239 HB2 MET 120 HB2 MET 120 9.449 19.913 -2.669 240 HB3 MET 120 HB1 MET 120 9.753 19.442 -4.341 241 HG2 MET 120 HG2 MET 120 10.442 17.209 -3.623 242 HG3 MET 120 HG1 MET 120 10.253 17.670 -1.931 243 HE1 MET 120 HE1 MET 120 7.749 15.022 -3.024 244 HE2 MET 120 HE2 MET 120 7.889 15.646 -1.382 245 HE3 MET 120 HE3 MET 120 9.338 15.422 -2.358 246 H LEU 121 HN LEU 121 12.087 19.215 -5.599 247 HA LEU 121 HA LEU 121 13.458 16.644 -5.094 248 HB2 LEU 121 HB2 LEU 121 12.252 18.161 -7.334 249 HB3 LEU 121 HB1 LEU 121 13.652 17.181 -7.772 250 HG LEU 121 HG LEU 121 11.389 16.008 -7.915 251 HD11 LEU 121 HD11 LEU 121 12.341 14.004 -6.483 252 HD12 LEU 121 HD12 LEU 121 13.763 15.040 -6.356 253 HD13 LEU 121 HD13 LEU 121 13.184 14.527 -7.941 254 HD21 LEU 121 HD21 LEU 121 10.669 17.088 -5.678 255 HD22 LEU 121 HD22 LEU 121 11.644 15.835 -4.910 256 HD23 LEU 121 HD23 LEU 121 10.269 15.387 -5.919 257 H GLN 122 HN GLN 122 14.297 19.942 -5.309 258 HA GLN 122 HA GLN 122 16.729 20.040 -6.692 259 HB2 GLN 122 HB2 GLN 122 15.241 21.582 -4.861 260 HB3 GLN 122 HB1 GLN 122 16.857 21.457 -4.164 261 HG2 GLN 122 HG2 GLN 122 17.762 22.094 -6.458 262 HG3 GLN 122 HG1 GLN 122 16.102 22.491 -6.905 263 HE21 GLN 122 HE21 GLN 122 15.818 24.716 -6.745 264 HE22 GLN 122 HE22 GLN 122 16.428 25.690 -5.496 265 H ALA 123 HN ALA 123 16.234 19.112 -3.262 266 HA ALA 123 HA ALA 123 18.878 18.623 -2.486 267 HB1 ALA 123 HB1 ALA 123 17.838 17.653 -0.690 268 HB2 ALA 123 HB2 ALA 123 16.865 16.591 -1.708 269 HB3 ALA 123 HB3 ALA 123 16.374 18.266 -1.457 270 H THR 124 HN THR 124 16.934 16.875 -4.782 271 HA THR 124 HA THR 124 18.673 14.484 -4.752 272 HB THR 124 HB THR 124 16.376 15.296 -6.563 273 HG1 THR 124 HG1 THR 124 15.247 13.837 -5.061 274 HG21 THR 124 HG21 THR 124 17.928 12.777 -6.097 275 HG22 THR 124 HG22 THR 124 17.346 13.467 -7.612 276 HG23 THR 124 HG23 THR 124 16.219 12.662 -6.519 277 H GLY 125 HN GLY 125 18.327 17.483 -6.504 278 HA2 GLY 125 HA2 GLY 125 20.165 18.320 -7.876 279 HA3 GLY 125 HA1 GLY 125 20.580 16.651 -8.269 280 H GLU 126 HN GLU 126 17.309 17.977 -8.309 281 HA GLU 126 HA GLU 126 16.835 16.970 -10.991 282 HB2 GLU 126 HB2 GLU 126 14.626 18.011 -10.611 283 HB3 GLU 126 HB1 GLU 126 15.143 17.112 -9.184 284 HG2 GLU 126 HG2 GLU 126 14.894 18.990 -7.971 285 HG3 GLU 126 HG1 GLU 126 16.211 19.712 -8.896 286 H THR 127 HN THR 127 18.333 18.084 -12.386 287 HA THR 127 HA THR 127 18.079 21.055 -12.526 288 HB THR 127 HB THR 127 20.069 20.592 -14.159 289 HG1 THR 127 HG1 THR 127 20.359 18.245 -12.687 290 HG21 THR 127 HG21 THR 127 20.826 19.681 -11.441 291 HG22 THR 127 HG22 THR 127 19.947 21.208 -11.523 292 HG23 THR 127 HG23 THR 127 21.465 21.016 -12.401 293 H ILE 128 HN ILE 128 16.058 21.203 -13.647 294 HA ILE 128 HA ILE 128 16.178 20.312 -16.502 295 HB ILE 128 HB ILE 128 13.951 19.433 -16.310 296 HG12 ILE 128 HG12 ILE 128 13.973 20.824 -13.620 297 HG13 ILE 128 HG11 ILE 128 12.871 21.098 -14.969 298 HG21 ILE 128 HG21 ILE 128 15.747 17.990 -15.397 299 HG22 ILE 128 HG22 ILE 128 14.219 17.731 -14.556 300 HG23 ILE 128 HG23 ILE 128 15.488 18.695 -13.801 301 HD11 ILE 128 HD11 ILE 128 13.063 18.517 -13.390 302 HD12 ILE 128 HD12 ILE 128 11.916 18.862 -14.684 303 HD13 ILE 128 HD13 ILE 128 11.821 19.748 -13.162 304 H THR 129 HN THR 129 14.600 21.564 -17.865 305 HA THR 129 HA THR 129 14.767 24.387 -17.412 306 HB THR 129 HB THR 129 13.256 24.452 -19.381 307 HG1 THR 129 HG1 THR 129 11.847 22.827 -18.954 308 HG21 THR 129 HG21 THR 129 15.256 24.078 -20.367 309 HG22 THR 129 HG22 THR 129 14.696 22.418 -20.574 310 HG23 THR 129 HG23 THR 129 15.699 22.844 -19.188 311 H GLU 130 HN GLU 130 12.608 25.742 -17.474 312 HA GLU 130 HA GLU 130 11.108 25.092 -15.049 313 HB2 GLU 130 HB2 GLU 130 11.661 27.373 -15.440 314 HB3 GLU 130 HB1 GLU 130 11.111 27.299 -17.115 315 HG2 GLU 130 HG2 GLU 130 8.785 26.942 -16.310 316 HG3 GLU 130 HG1 GLU 130 9.355 27.107 -14.649 317 H ASP 131 HN ASP 131 10.677 24.630 -18.471 318 HA ASP 131 HA ASP 131 7.772 24.418 -18.435 319 HB2 ASP 131 HB2 ASP 131 9.248 24.994 -20.397 320 HB3 ASP 131 HB1 ASP 131 9.806 23.321 -20.402 321 H ASP 132 HN ASP 132 10.296 22.384 -17.367 322 HA ASP 132 HA ASP 132 8.797 19.867 -17.843 323 HB2 ASP 132 HB2 ASP 132 11.525 20.745 -17.320 324 HB3 ASP 132 HB1 ASP 132 11.071 19.404 -16.268 325 H ILE 133 HN ILE 133 9.440 22.184 -15.299 326 HA ILE 133 HA ILE 133 9.000 20.652 -12.970 327 HB ILE 133 HB ILE 133 8.191 23.482 -13.713 328 HG12 ILE 133 HG12 ILE 133 10.619 22.895 -13.903 329 HG13 ILE 133 HG11 ILE 133 10.302 24.099 -12.653 330 HG21 ILE 133 HG21 ILE 133 8.528 23.674 -11.095 331 HG22 ILE 133 HG22 ILE 133 8.113 21.960 -11.130 332 HG23 ILE 133 HG23 ILE 133 6.977 23.155 -11.757 333 HD11 ILE 133 HD11 ILE 133 10.070 21.412 -11.581 334 HD12 ILE 133 HD12 ILE 133 11.096 22.740 -11.041 335 HD13 ILE 133 HD13 ILE 133 11.651 21.661 -12.321 336 H GLU 134 HN GLU 134 6.517 22.556 -14.738 337 HA GLU 134 HA GLU 134 4.231 21.701 -13.376 338 HB2 GLU 134 HB2 GLU 134 4.887 22.504 -16.193 339 HB3 GLU 134 HB1 GLU 134 3.253 21.946 -15.832 340 HG2 GLU 134 HG2 GLU 134 3.682 23.660 -13.750 341 HG3 GLU 134 HG1 GLU 134 4.610 24.446 -15.028 342 H GLU 135 HN GLU 135 6.272 19.887 -15.544 343 HA GLU 135 HA GLU 135 4.459 17.829 -16.354 344 HB2 GLU 135 HB2 GLU 135 6.885 18.490 -17.073 345 HB3 GLU 135 HB1 GLU 135 7.386 17.414 -15.768 346 HG2 GLU 135 HG2 GLU 135 5.457 16.572 -17.942 347 HG3 GLU 135 HG1 GLU 135 7.199 16.319 -18.053 348 H LEU 136 HN LEU 136 6.061 18.456 -13.319 349 HA LEU 136 HA LEU 136 5.600 15.703 -12.318 350 HB2 LEU 136 HB2 LEU 136 7.004 18.205 -11.423 351 HB3 LEU 136 HB1 LEU 136 6.619 16.964 -10.231 352 HG LEU 136 HG LEU 136 7.742 15.773 -12.625 353 HD11 LEU 136 HD11 LEU 136 8.836 18.043 -12.734 354 HD12 LEU 136 HD12 LEU 136 9.969 16.709 -12.519 355 HD13 LEU 136 HD13 LEU 136 9.529 17.723 -11.145 356 HD21 LEU 136 HD21 LEU 136 9.423 15.017 -10.806 357 HD22 LEU 136 HD22 LEU 136 7.741 14.526 -10.609 358 HD23 LEU 136 HD23 LEU 136 8.380 15.878 -9.674 359 H MET 137 HN MET 137 4.412 19.013 -11.837 360 HA MET 137 HA MET 137 2.761 18.537 -9.556 361 HB2 MET 137 HB2 MET 137 3.471 20.735 -10.493 362 HB3 MET 137 HB1 MET 137 2.406 20.466 -11.873 363 HG2 MET 137 HG2 MET 137 1.249 21.862 -10.247 364 HG3 MET 137 HG1 MET 137 0.479 20.276 -10.289 365 HE1 MET 137 HE1 MET 137 0.972 22.405 -6.841 366 HE2 MET 137 HE2 MET 137 -0.373 21.374 -7.325 367 HE3 MET 137 HE3 MET 137 0.291 22.537 -8.469 368 H LYS 138 HN LYS 138 2.002 18.402 -13.054 369 HA LYS 138 HA LYS 138 -0.728 17.958 -13.054 370 HB2 LYS 138 HB2 LYS 138 -0.219 16.477 -15.043 371 HB3 LYS 138 HB1 LYS 138 0.611 18.033 -15.069 372 HG2 LYS 138 HG2 LYS 138 2.492 16.805 -15.396 373 HG3 LYS 138 HG1 LYS 138 2.386 16.467 -13.668 374 HD2 LYS 138 HD2 LYS 138 2.520 14.316 -14.586 375 HD3 LYS 138 HD1 LYS 138 0.780 14.539 -14.399 376 HE2 LYS 138 HE2 LYS 138 0.602 15.234 -16.766 377 HE3 LYS 138 HE1 LYS 138 2.352 15.007 -16.960 378 HZ1 LYS 138 HZ1 LYS 138 0.290 12.976 -16.357 379 HZ2 LYS 138 HZ2 LYS 138 1.924 12.707 -15.976 380 HZ3 LYS 138 HZ3 LYS 138 1.456 12.963 -17.589 381 H ASP 139 HN ASP 139 1.790 15.663 -12.065 382 HA ASP 139 HA ASP 139 -0.141 13.465 -11.723 383 HB2 ASP 139 HB2 ASP 139 2.739 13.916 -11.811 384 HB3 ASP 139 HB1 ASP 139 2.292 12.835 -10.490 385 H GLY 140 HN GLY 140 1.606 15.786 -9.682 386 HA2 GLY 140 HA2 GLY 140 0.768 14.547 -7.188 387 HA3 GLY 140 HA1 GLY 140 1.509 16.140 -7.351 388 H ASP 141 HN ASP 141 -0.566 16.937 -9.372 389 HA ASP 141 HA ASP 141 -3.009 17.046 -7.661 390 HB2 ASP 141 HB2 ASP 141 -1.093 19.201 -8.345 391 HB3 ASP 141 HB1 ASP 141 -2.795 19.625 -8.527 392 H LYS 142 HN LYS 142 -3.534 15.533 -9.598 393 HA LYS 142 HA LYS 142 -3.721 16.478 -12.277 394 HB2 LYS 142 HB2 LYS 142 -4.739 14.306 -10.584 395 HB3 LYS 142 HB1 LYS 142 -5.847 14.732 -11.890 396 HG2 LYS 142 HG2 LYS 142 -3.081 14.655 -12.806 397 HG3 LYS 142 HG1 LYS 142 -3.585 13.112 -12.117 398 HD2 LYS 142 HD2 LYS 142 -5.785 13.775 -13.606 399 HD3 LYS 142 HD1 LYS 142 -4.484 14.452 -14.588 400 HE2 LYS 142 HE2 LYS 142 -3.385 12.045 -13.977 401 HE3 LYS 142 HE1 LYS 142 -5.105 11.609 -13.993 402 HZ1 LYS 142 HZ1 LYS 142 -4.083 11.525 -16.224 403 HZ2 LYS 142 HZ2 LYS 142 -3.745 13.186 -16.114 404 HZ3 LYS 142 HZ3 LYS 142 -5.355 12.643 -16.131 405 H ASN 143 HN ASN 143 -5.572 17.272 -9.457 406 HA ASN 143 HA ASN 143 -7.944 18.206 -10.920 407 HB2 ASN 143 HB2 ASN 143 -7.234 18.960 -8.095 408 HB3 ASN 143 HB1 ASN 143 -8.811 18.561 -8.771 409 HD21 ASN 143 HD21 ASN 143 -6.505 17.344 -6.723 410 HD22 ASN 143 HD22 ASN 143 -6.793 15.683 -6.922 411 H ASN 144 HN ASN 144 -4.844 19.452 -10.111 412 HA ASN 144 HA ASN 144 -3.924 21.628 -10.241 413 HB2 ASN 144 HB2 ASN 144 -6.178 21.661 -12.272 414 HB3 ASN 144 HB1 ASN 144 -4.909 22.885 -12.195 415 HD21 ASN 144 HD21 ASN 144 -5.247 21.156 -14.489 416 HD22 ASN 144 HD22 ASN 144 -3.881 20.154 -14.590 417 H ASP 145 HN ASP 145 -5.370 21.548 -7.988 418 HA ASP 145 HA ASP 145 -7.493 23.603 -8.002 419 HB2 ASP 145 HB2 ASP 145 -6.222 22.168 -5.659 420 HB3 ASP 145 HB1 ASP 145 -7.848 22.845 -5.758 421 H GLY 146 HN GLY 146 -4.087 23.466 -7.601 422 HA2 GLY 146 HA2 GLY 146 -2.838 25.580 -7.496 423 HA3 GLY 146 HA1 GLY 146 -4.129 26.236 -6.488 424 H ARG 147 HN ARG 147 -3.798 23.193 -5.365 425 HA ARG 147 HA ARG 147 -1.412 23.682 -3.672 426 HB2 ARG 147 HB2 ARG 147 -4.114 24.311 -2.937 427 HB3 ARG 147 HB1 ARG 147 -3.552 22.977 -1.927 428 HG2 ARG 147 HG2 ARG 147 -1.764 24.220 -1.054 429 HG3 ARG 147 HG1 ARG 147 -1.789 25.371 -2.390 430 HD2 ARG 147 HD2 ARG 147 -4.006 26.208 -1.583 431 HD3 ARG 147 HD1 ARG 147 -3.863 25.128 -0.182 432 HE ARG 147 HE ARG 147 -1.440 26.603 -0.399 433 HH11 ARG 147 HH21 ARG 147 -4.802 27.040 0.262 434 HH12 ARG 147 HH22 ARG 147 -4.552 28.404 1.298 435 HH21 ARG 147 HH11 ARG 147 -1.105 28.382 0.949 436 HH22 ARG 147 HH12 ARG 147 -2.463 29.164 1.686 437 H ILE 148 HN ILE 148 -0.557 21.757 -2.848 438 HA ILE 148 HA ILE 148 -1.854 19.240 -3.803 439 HB ILE 148 HB ILE 148 0.961 19.686 -2.777 440 HG12 ILE 148 HG12 ILE 148 -0.166 20.077 -5.567 441 HG13 ILE 148 HG11 ILE 148 0.642 21.285 -4.567 442 HG21 ILE 148 HG21 ILE 148 -0.303 17.644 -4.630 443 HG22 ILE 148 HG22 ILE 148 0.271 17.352 -2.988 444 HG23 ILE 148 HG23 ILE 148 1.421 17.740 -4.268 445 HD11 ILE 148 HD11 ILE 148 2.489 20.665 -5.753 446 HD12 ILE 148 HD12 ILE 148 1.802 19.102 -6.193 447 HD13 ILE 148 HD13 ILE 148 2.534 19.327 -4.605 448 H ASP 149 HN ASP 149 -2.934 18.099 -2.233 449 HA ASP 149 HA ASP 149 -2.145 18.504 0.624 450 HB2 ASP 149 HB2 ASP 149 -4.439 19.038 0.119 451 HB3 ASP 149 HB1 ASP 149 -4.650 17.533 -0.777 452 H TYR 150 HN TYR 150 -2.028 16.589 2.001 453 HA TYR 150 HA TYR 150 -0.447 14.472 1.176 454 HB2 TYR 150 HB2 TYR 150 -1.026 14.950 3.495 455 HB3 TYR 150 HB1 TYR 150 -2.713 14.532 3.195 456 HD1 TYR 150 HD2 TYR 150 0.013 12.653 1.605 457 HD2 TYR 150 HD1 TYR 150 -2.720 12.777 4.917 458 HE1 TYR 150 HE2 TYR 150 0.511 10.276 2.106 459 HE2 TYR 150 HE1 TYR 150 -2.221 10.400 5.418 460 HH TYR 150 HH TYR 150 0.276 8.829 4.569 461 H ASP 151 HN ASP 151 -4.028 14.522 1.168 462 HA ASP 151 HA ASP 151 -4.574 11.926 0.281 463 HB2 ASP 151 HB2 ASP 151 -5.893 14.377 0.601 464 HB3 ASP 151 HB1 ASP 151 -6.164 13.949 -1.089 465 H GLU 152 HN GLU 152 -3.582 14.746 -1.656 466 HA GLU 152 HA GLU 152 -3.694 13.217 -4.170 467 HB2 GLU 152 HB2 GLU 152 -2.801 16.001 -3.367 468 HB3 GLU 152 HB1 GLU 152 -2.782 15.423 -5.034 469 HG2 GLU 152 HG2 GLU 152 -5.127 15.230 -5.125 470 HG3 GLU 152 HG1 GLU 152 -5.285 15.228 -3.368 471 H PHE 153 HN PHE 153 -1.303 14.130 -1.765 472 HA PHE 153 HA PHE 153 1.111 13.956 -3.178 473 HB2 PHE 153 HB2 PHE 153 0.595 14.427 -0.700 474 HB3 PHE 153 HB1 PHE 153 0.612 12.676 -0.483 475 HD1 PHE 153 HD1 PHE 153 2.694 14.994 -2.572 476 HD2 PHE 153 HD2 PHE 153 2.610 12.040 0.545 477 HE1 PHE 153 HE1 PHE 153 5.171 15.028 -2.473 478 HE2 PHE 153 HE2 PHE 153 5.088 12.074 0.644 479 HZ PHE 153 HZ PHE 153 6.369 13.569 -0.865 480 H LEU 154 HN LEU 154 -1.102 11.375 -2.256 481 HA LEU 154 HA LEU 154 0.660 9.144 -2.662 482 HB2 LEU 154 HB2 LEU 154 -2.133 9.730 -2.158 483 HB3 LEU 154 HB1 LEU 154 -1.985 8.419 -3.328 484 HG LEU 154 HG LEU 154 -0.559 7.160 -1.826 485 HD11 LEU 154 HD11 LEU 154 0.052 9.682 -0.776 486 HD12 LEU 154 HD12 LEU 154 0.638 8.130 -0.178 487 HD13 LEU 154 HD13 LEU 154 -0.806 8.858 0.525 488 HD21 LEU 154 HD21 LEU 154 -3.116 7.236 -1.497 489 HD22 LEU 154 HD22 LEU 154 -2.783 8.256 -0.097 490 HD23 LEU 154 HD23 LEU 154 -2.157 6.608 -0.157 491 H GLU 155 HN GLU 155 -1.780 10.622 -4.840 492 HA GLU 155 HA GLU 155 -1.458 9.050 -7.118 493 HB2 GLU 155 HB2 GLU 155 -2.887 11.185 -6.522 494 HB3 GLU 155 HB1 GLU 155 -1.568 12.049 -7.313 495 HG2 GLU 155 HG2 GLU 155 -2.798 11.639 -9.196 496 HG3 GLU 155 HG1 GLU 155 -1.987 10.074 -9.124 497 H PHE 156 HN PHE 156 0.823 11.299 -5.722 498 HA PHE 156 HA PHE 156 2.489 11.457 -8.150 499 HB2 PHE 156 HB2 PHE 156 2.156 13.318 -6.505 500 HB3 PHE 156 HB1 PHE 156 2.981 12.344 -5.288 501 HD1 PHE 156 HD1 PHE 156 3.531 13.319 -8.879 502 HD2 PHE 156 HD2 PHE 156 5.224 12.850 -4.958 503 HE1 PHE 156 HE1 PHE 156 5.723 14.109 -9.730 504 HE2 PHE 156 HE2 PHE 156 7.414 13.640 -5.810 505 HZ PHE 156 HZ PHE 156 7.664 14.269 -8.195 506 H MET 157 HN MET 157 2.711 9.994 -4.892 507 HA MET 157 HA MET 157 5.221 8.612 -5.576 508 HB2 MET 157 HB2 MET 157 3.421 8.287 -3.160 509 HB3 MET 157 HB1 MET 157 5.154 7.974 -3.259 510 HG2 MET 157 HG2 MET 157 3.811 10.681 -3.514 511 HG3 MET 157 HG1 MET 157 4.769 10.119 -2.144 512 HE1 MET 157 HE1 MET 157 7.975 11.308 -2.651 513 HE2 MET 157 HE2 MET 157 7.751 9.561 -2.604 514 HE3 MET 157 HE3 MET 157 6.660 10.606 -1.699 515 H LYS 158 HN LYS 158 1.936 7.573 -4.564 516 HA LYS 158 HA LYS 158 0.870 5.473 -4.864 517 HB2 LYS 158 HB2 LYS 158 1.250 6.850 -7.174 518 HB3 LYS 158 HB1 LYS 158 2.073 5.343 -7.579 519 HG2 LYS 158 HG2 LYS 158 -0.266 4.502 -6.320 520 HG3 LYS 158 HG1 LYS 158 -0.785 5.871 -7.304 521 HD2 LYS 158 HD2 LYS 158 1.062 4.263 -8.816 522 HD3 LYS 158 HD1 LYS 158 -0.223 3.234 -8.181 523 HE2 LYS 158 HE2 LYS 158 -1.420 3.979 -9.983 524 HE3 LYS 158 HE1 LYS 158 -1.621 5.467 -9.035 525 HZ1 LYS 158 HZ1 LYS 158 -0.573 5.707 -11.325 526 HZ2 LYS 158 HZ2 LYS 158 0.802 4.965 -10.659 527 HZ3 LYS 158 HZ3 LYS 158 0.240 6.441 -10.031 528 H GLY 159 HN GLY 159 3.717 5.392 -3.877 529 HA2 GLY 159 HA2 GLY 159 5.146 3.611 -3.278 530 HA3 GLY 159 HA1 GLY 159 4.129 2.530 -4.232 531 H VAL 160 HN VAL 160 6.461 5.206 -4.711 532 HA VAL 160 HA VAL 160 7.402 3.776 -7.177 533 HB VAL 160 HB VAL 160 6.258 5.988 -7.463 534 HG11 VAL 160 HG11 VAL 160 7.761 6.652 -5.192 535 HG12 VAL 160 HG12 VAL 160 6.778 7.753 -6.157 536 HG13 VAL 160 HG13 VAL 160 8.499 7.575 -6.501 537 HG21 VAL 160 HG21 VAL 160 7.829 6.822 -9.031 538 HG22 VAL 160 HG22 VAL 160 8.209 5.103 -8.916 539 HG23 VAL 160 HG23 VAL 160 9.204 6.285 -8.066 540 H GLU 161 HN GLU 161 9.793 4.457 -7.659 541 HA GLU 161 HA GLU 161 11.512 5.226 -5.466 542 HB2 GLU 161 HB2 GLU 161 10.459 2.678 -5.280 543 HB3 GLU 161 HB1 GLU 161 12.020 2.388 -6.049 544 HG2 GLU 161 HG2 GLU 161 13.081 3.802 -4.252 545 HG3 GLU 161 HG1 GLU 161 11.516 3.841 -3.439 546 HO1 KDH 1 H1 KDH 1 10.218 8.469 -11.205 547 H21 KDH 1 H21 KDH 1 10.051 7.695 -3.729 548 H33 KDH 1 H33 KDH 1 8.768 12.752 -6.598 549 H4 KDH 1 H4 KDH 1 10.124 8.788 -7.888 550 HO7 KDH 1 H7 KDH 1 6.780 8.766 -11.784 551 H01 KDH 1 H01 KDH 1 10.289 13.131 -4.571 552 H01A KDH 1 H02 KDH 1 8.630 12.474 -4.281 553 HO03 KDH 1 H03 KDH 1 12.136 12.726 -1.902 554 HO10 KDH 1 H10 KDH 1 5.401 10.523 -10.678 555 H12 KDH 1 H12 KDH 1 6.811 11.692 -7.884 556 H15 KDH 1 H15 KDH 1 7.732 10.773 -5.919 557 H26 KDH 1 H26 KDH 1 11.838 10.538 -0.904 558 H39 KDH 1 H39 KDH 1 11.756 13.973 -10.176 559 H41 KDH 1 H41 KDH 1 11.986 10.156 -7.999 560 HO02 KDH 1 H42 KDH 1 12.416 7.810 -1.576 561 HO44 KDH 1 H44 KDH 1 13.359 8.450 -9.893 562 HO47 KDH 1 H47 KDH 1 14.534 10.866 -12.499 563 HO50 KDH 1 H50 KDH 1 13.542 12.957 -12.781 Start of MODEL 2 1 H1 MET 90 HT1 MET 90 13.661 3.297 3.082 2 H2 MET 90 HT2 MET 90 14.537 4.108 4.291 3 H3 MET 90 HT3 MET 90 15.144 4.031 2.706 4 HA MET 90 HA MET 90 13.173 5.830 3.844 5 HB2 MET 90 HB2 MET 90 14.258 7.292 2.275 6 HB3 MET 90 HB1 MET 90 15.524 6.261 2.943 7 HG2 MET 90 HG2 MET 90 15.201 4.728 0.961 8 HG3 MET 90 HG1 MET 90 14.132 5.950 0.270 9 HE1 MET 90 HE1 MET 90 17.222 4.921 1.700 10 HE2 MET 90 HE2 MET 90 18.423 6.195 1.508 11 HE3 MET 90 HE3 MET 90 18.154 5.043 0.202 12 H GLY 91 HN GLY 91 11.284 6.499 2.752 13 HA2 GLY 91 HA2 GLY 91 9.502 6.390 1.221 14 HA3 GLY 91 HA1 GLY 91 10.603 5.601 0.090 15 H LYS 92 HN LYS 92 7.820 5.099 1.784 16 HA LYS 92 HA LYS 92 7.919 2.202 1.333 17 HB2 LYS 92 HB2 LYS 92 9.047 2.994 3.624 18 HB3 LYS 92 HB1 LYS 92 7.366 3.019 4.158 19 HG2 LYS 92 HG2 LYS 92 7.260 0.766 4.223 20 HG3 LYS 92 HG1 LYS 92 7.981 0.618 2.620 21 HD2 LYS 92 HD2 LYS 92 10.221 0.923 3.574 22 HD3 LYS 92 HD1 LYS 92 9.521 1.135 5.180 23 HE2 LYS 92 HE2 LYS 92 8.391 -1.251 4.405 24 HE3 LYS 92 HE1 LYS 92 10.006 -1.353 3.676 25 HZ1 LYS 92 HZ1 LYS 92 10.994 -0.753 5.766 26 HZ2 LYS 92 HZ2 LYS 92 9.974 -2.088 6.018 27 HZ3 LYS 92 HZ3 LYS 92 9.472 -0.533 6.482 28 H SER 93 HN SER 93 5.802 1.892 3.468 29 HA SER 93 HA SER 93 3.489 2.455 1.847 30 HB2 SER 93 HB2 SER 93 4.055 1.550 4.660 31 HB3 SER 93 HB1 SER 93 2.399 1.904 4.175 32 HG SER 93 HG SER 93 2.387 0.153 3.003 33 H GLU 94 HN GLU 94 1.618 3.560 3.569 34 HA GLU 94 HA GLU 94 2.072 6.375 3.309 35 HB2 GLU 94 HB2 GLU 94 0.060 4.505 4.341 36 HB3 GLU 94 HB1 GLU 94 0.086 6.040 5.212 37 HG2 GLU 94 HG2 GLU 94 -1.169 6.847 3.509 38 HG3 GLU 94 HG1 GLU 94 0.325 6.830 2.569 39 H GLU 95 HN GLU 95 3.276 4.166 5.605 40 HA GLU 95 HA GLU 95 3.256 5.613 8.040 41 HB2 GLU 95 HB2 GLU 95 4.156 3.229 7.215 42 HB3 GLU 95 HB1 GLU 95 5.690 4.099 7.180 43 HG2 GLU 95 HG2 GLU 95 5.773 4.321 9.454 44 HG3 GLU 95 HG1 GLU 95 4.026 4.520 9.599 45 H GLU 96 HN GLU 96 6.129 5.389 5.913 46 HA GLU 96 HA GLU 96 7.224 7.879 6.971 47 HB2 GLU 96 HB2 GLU 96 8.064 5.571 5.539 48 HB3 GLU 96 HB1 GLU 96 8.440 6.963 4.523 49 HG2 GLU 96 HG2 GLU 96 10.343 6.652 5.937 50 HG3 GLU 96 HG1 GLU 96 9.469 8.036 6.595 51 H LEU 97 HN LEU 97 5.262 6.926 4.249 52 HA LEU 97 HA LEU 97 5.725 9.015 2.404 53 HB2 LEU 97 HB2 LEU 97 3.800 6.951 2.991 54 HB3 LEU 97 HB1 LEU 97 2.950 8.413 2.490 55 HG LEU 97 HG LEU 97 3.635 6.841 0.606 56 HD11 LEU 97 HD11 LEU 97 4.984 9.512 0.301 57 HD12 LEU 97 HD12 LEU 97 3.237 9.429 0.535 58 HD13 LEU 97 HD13 LEU 97 3.980 8.636 -0.855 59 HD21 LEU 97 HD21 LEU 97 6.384 8.015 0.906 60 HD22 LEU 97 HD22 LEU 97 5.884 6.551 0.059 61 HD23 LEU 97 HD23 LEU 97 5.966 6.566 1.820 62 H SER 98 HN SER 98 4.061 9.048 5.489 63 HA SER 98 HA SER 98 2.619 11.539 5.043 64 HB2 SER 98 HB2 SER 98 2.011 9.700 6.644 65 HB3 SER 98 HB1 SER 98 3.422 10.127 7.608 66 HG SER 98 HG SER 98 2.476 12.302 7.643 67 H ASP 99 HN ASP 99 5.667 10.635 6.668 68 HA ASP 99 HA ASP 99 6.264 13.298 7.627 69 HB2 ASP 99 HB2 ASP 99 8.181 11.037 6.999 70 HB3 ASP 99 HB1 ASP 99 8.365 12.292 8.225 71 H LEU 100 HN LEU 100 7.194 11.464 4.708 72 HA LEU 100 HA LEU 100 9.133 13.135 3.589 73 HB2 LEU 100 HB2 LEU 100 6.812 11.597 2.399 74 HB3 LEU 100 HB1 LEU 100 8.047 12.356 1.395 75 HG LEU 100 HG LEU 100 8.517 10.261 3.535 76 HD11 LEU 100 HD11 LEU 100 7.960 8.917 1.786 77 HD12 LEU 100 HD12 LEU 100 9.562 9.332 1.178 78 HD13 LEU 100 HD13 LEU 100 8.147 10.216 0.607 79 HD21 LEU 100 HD21 LEU 100 10.877 10.396 2.382 80 HD22 LEU 100 HD22 LEU 100 10.454 11.572 3.626 81 HD23 LEU 100 HD23 LEU 100 10.352 12.016 1.922 82 H PHE 101 HN PHE 101 5.638 13.372 2.826 83 HA PHE 101 HA PHE 101 5.604 15.784 1.443 84 HB2 PHE 101 HB2 PHE 101 3.649 14.396 1.745 85 HB3 PHE 101 HB1 PHE 101 3.698 14.620 3.494 86 HD1 PHE 101 HD2 PHE 101 3.366 16.970 4.433 87 HD2 PHE 101 HD1 PHE 101 2.515 15.936 0.351 88 HE1 PHE 101 HE2 PHE 101 1.954 18.997 4.213 89 HE2 PHE 101 HE1 PHE 101 1.103 17.963 0.132 90 HZ PHE 101 HZ PHE 101 0.823 19.493 2.063 91 H ARG 102 HN ARG 102 5.960 15.281 4.920 92 HA ARG 102 HA ARG 102 5.601 18.075 5.656 93 HB2 ARG 102 HB2 ARG 102 5.226 16.081 7.121 94 HB3 ARG 102 HB1 ARG 102 6.961 15.771 7.092 95 HG2 ARG 102 HG2 ARG 102 7.293 18.116 7.993 96 HG3 ARG 102 HG1 ARG 102 5.547 18.188 8.239 97 HD2 ARG 102 HD2 ARG 102 6.863 15.750 9.306 98 HD3 ARG 102 HD1 ARG 102 7.264 17.265 10.139 99 HE ARG 102 HE ARG 102 4.526 17.432 9.787 100 HH11 ARG 102 HH21 ARG 102 6.711 15.112 11.125 101 HH12 ARG 102 HH22 ARG 102 5.567 14.511 12.278 102 HH21 ARG 102 HH11 ARG 102 3.029 16.651 11.288 103 HH22 ARG 102 HH12 ARG 102 3.488 15.378 12.369 104 H MET 103 HN MET 103 8.322 16.038 4.709 105 HA MET 103 HA MET 103 10.343 18.022 5.503 106 HB2 MET 103 HB2 MET 103 10.290 15.356 4.084 107 HB3 MET 103 HB1 MET 103 11.775 16.302 4.184 108 HG2 MET 103 HG2 MET 103 12.069 15.814 6.376 109 HG3 MET 103 HG1 MET 103 10.366 16.082 6.750 110 HE1 MET 103 HE1 MET 103 12.990 13.442 6.992 111 HE2 MET 103 HE2 MET 103 11.795 12.454 7.829 112 HE3 MET 103 HE3 MET 103 11.926 14.171 8.202 113 H PHE 104 HN PHE 104 9.332 16.591 2.363 114 HA PHE 104 HA PHE 104 10.762 18.197 0.598 115 HB2 PHE 104 HB2 PHE 104 7.894 17.208 0.474 116 HB3 PHE 104 HB1 PHE 104 8.790 17.803 -0.924 117 HD1 PHE 104 HD2 PHE 104 11.516 16.723 -0.260 118 HD2 PHE 104 HD1 PHE 104 7.629 14.906 -0.056 119 HE1 PHE 104 HE2 PHE 104 12.545 14.486 -0.553 120 HE2 PHE 104 HE1 PHE 104 8.659 12.669 -0.350 121 HZ PHE 104 HZ PHE 104 11.117 12.460 -0.599 122 H ASP 105 HN ASP 105 7.639 18.980 2.146 123 HA ASP 105 HA ASP 105 7.007 21.412 0.946 124 HB2 ASP 105 HB2 ASP 105 6.037 19.945 2.959 125 HB3 ASP 105 HB1 ASP 105 6.855 21.175 3.925 126 H LYS 106 HN LYS 106 8.715 22.830 0.444 127 HA LYS 106 HA LYS 106 10.912 23.443 2.191 128 HB2 LYS 106 HB2 LYS 106 10.714 23.764 -0.314 129 HB3 LYS 106 HB1 LYS 106 9.671 25.149 0.011 130 HG2 LYS 106 HG2 LYS 106 11.959 25.931 -0.317 131 HG3 LYS 106 HG1 LYS 106 11.503 26.160 1.372 132 HD2 LYS 106 HD2 LYS 106 12.566 23.536 1.154 133 HD3 LYS 106 HD1 LYS 106 13.675 24.612 0.303 134 HE2 LYS 106 HE2 LYS 106 12.631 25.141 3.108 135 HE3 LYS 106 HE1 LYS 106 14.213 24.419 2.748 136 HZ1 LYS 106 HZ1 LYS 106 15.008 26.338 1.897 137 HZ2 LYS 106 HZ2 LYS 106 13.836 27.044 2.903 138 HZ3 LYS 106 HZ3 LYS 106 13.513 26.813 1.251 139 H ASN 107 HN ASN 107 8.094 25.491 1.311 140 HA ASN 107 HA ASN 107 8.553 27.409 3.416 141 HB2 ASN 107 HB2 ASN 107 7.325 28.064 1.485 142 HB3 ASN 107 HB1 ASN 107 6.251 26.669 1.600 143 HD21 ASN 107 HD21 ASN 107 4.259 27.814 1.873 144 HD22 ASN 107 HD22 ASN 107 3.941 28.806 3.214 145 H ALA 108 HN ALA 108 7.065 24.283 3.340 146 HA ALA 108 HA ALA 108 5.765 23.111 4.941 147 HB1 ALA 108 HB1 ALA 108 8.180 24.097 5.917 148 HB2 ALA 108 HB2 ALA 108 7.195 22.850 6.682 149 HB3 ALA 108 HB3 ALA 108 7.018 24.535 7.170 150 H ASP 109 HN ASP 109 3.674 24.061 4.605 151 HA ASP 109 HA ASP 109 2.830 25.919 6.781 152 HB2 ASP 109 HB2 ASP 109 1.778 27.396 5.176 153 HB3 ASP 109 HB1 ASP 109 3.447 27.157 4.653 154 H GLY 110 HN GLY 110 2.441 22.996 5.608 155 HA2 GLY 110 HA2 GLY 110 0.566 21.589 6.263 156 HA3 GLY 110 HA1 GLY 110 -0.497 22.986 6.087 157 H TYR 111 HN TYR 111 1.380 23.333 3.499 158 HA TYR 111 HA TYR 111 0.210 21.250 1.762 159 HB2 TYR 111 HB2 TYR 111 -0.483 24.195 1.491 160 HB3 TYR 111 HB1 TYR 111 -1.045 22.898 0.436 161 HD1 TYR 111 HD1 TYR 111 -2.527 21.090 1.366 162 HD2 TYR 111 HD2 TYR 111 -1.521 24.617 3.602 163 HE1 TYR 111 HE1 TYR 111 -4.416 20.649 2.912 164 HE2 TYR 111 HE2 TYR 111 -3.410 24.177 5.146 165 HH TYR 111 HH TYR 111 -5.892 22.107 4.469 166 H ILE 112 HN ILE 112 1.617 20.880 0.075 167 HA ILE 112 HA ILE 112 4.017 22.555 -0.188 168 HB ILE 112 HB ILE 112 2.948 19.994 -1.376 169 HG12 ILE 112 HG12 ILE 112 5.575 20.487 0.026 170 HG13 ILE 112 HG11 ILE 112 4.088 20.243 0.943 171 HG21 ILE 112 HG21 ILE 112 5.566 21.334 -2.119 172 HG22 ILE 112 HG22 ILE 112 4.144 21.288 -3.160 173 HG23 ILE 112 HG23 ILE 112 4.965 19.790 -2.722 174 HD11 ILE 112 HD11 ILE 112 5.666 18.304 -0.644 175 HD12 ILE 112 HD12 ILE 112 3.916 18.183 -0.825 176 HD13 ILE 112 HD13 ILE 112 4.649 18.037 0.772 177 H ASP 113 HN ASP 113 4.349 24.071 -1.807 178 HA ASP 113 HA ASP 113 2.109 24.520 -3.727 179 HB2 ASP 113 HB2 ASP 113 3.201 26.217 -2.034 180 HB3 ASP 113 HB1 ASP 113 4.445 26.355 -3.278 181 H LEU 114 HN LEU 114 2.961 25.480 -5.909 182 HA LEU 114 HA LEU 114 4.540 23.473 -7.246 183 HB2 LEU 114 HB2 LEU 114 3.404 26.189 -7.898 184 HB3 LEU 114 HB1 LEU 114 4.419 25.345 -9.068 185 HG LEU 114 HG LEU 114 2.439 23.552 -7.934 186 HD11 LEU 114 HD11 LEU 114 0.429 24.574 -8.739 187 HD12 LEU 114 HD12 LEU 114 1.325 25.880 -9.515 188 HD13 LEU 114 HD13 LEU 114 1.237 25.795 -7.755 189 HD21 LEU 114 HD21 LEU 114 2.791 24.580 -10.766 190 HD22 LEU 114 HD22 LEU 114 2.047 23.059 -10.271 191 HD23 LEU 114 HD23 LEU 114 3.780 23.302 -10.060 192 H ASP 115 HN ASP 115 5.266 26.693 -5.948 193 HA ASP 115 HA ASP 115 7.897 26.936 -7.109 194 HB2 ASP 115 HB2 ASP 115 6.260 28.210 -4.953 195 HB3 ASP 115 HB1 ASP 115 7.993 28.540 -4.972 196 H GLU 116 HN GLU 116 6.639 25.128 -4.435 197 HA GLU 116 HA GLU 116 9.317 24.809 -3.184 198 HB2 GLU 116 HB2 GLU 116 6.640 23.617 -2.410 199 HB3 GLU 116 HB1 GLU 116 8.054 23.834 -1.378 200 HG2 GLU 116 HG2 GLU 116 7.817 26.213 -1.393 201 HG3 GLU 116 HG1 GLU 116 6.629 26.154 -2.695 202 H LEU 117 HN LEU 117 6.971 23.066 -5.139 203 HA LEU 117 HA LEU 117 7.876 20.395 -4.753 204 HB2 LEU 117 HB2 LEU 117 6.578 21.939 -6.999 205 HB3 LEU 117 HB1 LEU 117 6.939 20.222 -7.174 206 HG LEU 117 HG LEU 117 5.518 21.128 -4.700 207 HD11 LEU 117 HD11 LEU 117 4.536 21.551 -7.392 208 HD12 LEU 117 HD12 LEU 117 3.773 21.966 -5.856 209 HD13 LEU 117 HD13 LEU 117 3.536 20.364 -6.556 210 HD21 LEU 117 HD21 LEU 117 5.987 18.831 -4.682 211 HD22 LEU 117 HD22 LEU 117 5.720 18.664 -6.417 212 HD23 LEU 117 HD23 LEU 117 4.347 18.867 -5.330 213 H LYS 118 HN LYS 118 9.264 23.063 -6.556 214 HA LYS 118 HA LYS 118 11.085 21.346 -8.107 215 HB2 LYS 118 HB2 LYS 118 11.803 23.464 -9.035 216 HB3 LYS 118 HB1 LYS 118 10.048 23.531 -8.863 217 HG2 LYS 118 HG2 LYS 118 10.414 24.637 -6.611 218 HG3 LYS 118 HG1 LYS 118 12.122 24.763 -7.033 219 HD2 LYS 118 HD2 LYS 118 10.609 25.704 -9.262 220 HD3 LYS 118 HD1 LYS 118 9.978 26.488 -7.814 221 HE2 LYS 118 HE2 LYS 118 11.977 27.581 -7.367 222 HE3 LYS 118 HE1 LYS 118 12.956 26.322 -8.146 223 HZ1 LYS 118 HZ1 LYS 118 12.959 27.930 -9.766 224 HZ2 LYS 118 HZ2 LYS 118 11.404 28.495 -9.378 225 HZ3 LYS 118 HZ3 LYS 118 11.595 27.038 -10.232 226 H ILE 119 HN ILE 119 11.080 22.996 -5.042 227 HA ILE 119 HA ILE 119 14.033 22.946 -4.813 228 HB ILE 119 HB ILE 119 11.784 23.812 -2.967 229 HG12 ILE 119 HG12 ILE 119 13.726 25.389 -4.689 230 HG13 ILE 119 HG11 ILE 119 12.009 25.163 -5.023 231 HG21 ILE 119 HG21 ILE 119 13.643 23.305 -1.568 232 HG22 ILE 119 HG22 ILE 119 13.731 25.046 -1.835 233 HG23 ILE 119 HG23 ILE 119 14.794 23.961 -2.732 234 HD11 ILE 119 HD11 ILE 119 11.424 26.792 -3.576 235 HD12 ILE 119 HD12 ILE 119 13.132 27.228 -3.517 236 HD13 ILE 119 HD13 ILE 119 12.460 26.131 -2.311 237 H MET 120 HN MET 120 11.251 21.061 -3.858 238 HA MET 120 HA MET 120 12.553 19.633 -1.677 239 HB2 MET 120 HB2 MET 120 10.514 18.311 -1.747 240 HB3 MET 120 HB1 MET 120 10.079 19.998 -2.025 241 HG2 MET 120 HG2 MET 120 9.918 19.640 -4.406 242 HG3 MET 120 HG1 MET 120 10.584 18.014 -4.257 243 HE1 MET 120 HE1 MET 120 9.302 16.047 -4.224 244 HE2 MET 120 HE2 MET 120 7.887 15.767 -3.212 245 HE3 MET 120 HE3 MET 120 9.411 16.248 -2.470 246 H LEU 121 HN LEU 121 12.239 19.206 -5.159 247 HA LEU 121 HA LEU 121 13.338 16.467 -5.099 248 HB2 LEU 121 HB2 LEU 121 11.837 18.180 -6.848 249 HB3 LEU 121 HB1 LEU 121 13.275 17.626 -7.706 250 HG LEU 121 HG LEU 121 12.646 15.279 -6.754 251 HD11 LEU 121 HD11 LEU 121 10.136 16.902 -6.346 252 HD12 LEU 121 HD12 LEU 121 10.912 15.778 -5.231 253 HD13 LEU 121 HD13 LEU 121 10.055 15.166 -6.645 254 HD21 LEU 121 HD21 LEU 121 11.875 16.753 -9.110 255 HD22 LEU 121 HD22 LEU 121 10.590 15.625 -8.679 256 HD23 LEU 121 HD23 LEU 121 12.228 15.032 -8.956 257 H GLN 122 HN GLN 122 14.527 19.699 -5.247 258 HA GLN 122 HA GLN 122 16.826 19.510 -6.866 259 HB2 GLN 122 HB2 GLN 122 15.726 21.167 -4.767 260 HB3 GLN 122 HB1 GLN 122 17.470 21.013 -4.554 261 HG2 GLN 122 HG2 GLN 122 17.812 21.670 -6.916 262 HG3 GLN 122 HG1 GLN 122 16.067 21.852 -7.109 263 HE21 GLN 122 HE21 GLN 122 15.852 24.120 -7.299 264 HE22 GLN 122 HE22 GLN 122 16.407 25.223 -6.134 265 H ALA 123 HN ALA 123 16.172 18.045 -3.764 266 HA ALA 123 HA ALA 123 18.790 17.619 -2.768 267 HB1 ALA 123 HB1 ALA 123 16.622 15.540 -2.611 268 HB2 ALA 123 HB2 ALA 123 16.366 17.121 -1.870 269 HB3 ALA 123 HB3 ALA 123 17.709 16.107 -1.342 270 H THR 124 HN THR 124 17.235 16.279 -5.555 271 HA THR 124 HA THR 124 19.282 14.098 -5.731 272 HB THR 124 HB THR 124 17.662 13.162 -7.386 273 HG1 THR 124 HG1 THR 124 15.638 14.237 -7.525 274 HG21 THR 124 HG21 THR 124 16.459 13.965 -4.722 275 HG22 THR 124 HG22 THR 124 17.464 12.547 -5.017 276 HG23 THR 124 HG23 THR 124 15.867 12.665 -5.755 277 H GLY 125 HN GLY 125 19.030 17.209 -6.649 278 HA2 GLY 125 HA2 GLY 125 20.300 18.389 -8.262 279 HA3 GLY 125 HA1 GLY 125 20.811 16.842 -8.939 280 H GLU 126 HN GLU 126 17.446 17.720 -8.399 281 HA GLU 126 HA GLU 126 16.581 16.958 -10.998 282 HB2 GLU 126 HB2 GLU 126 14.502 18.074 -10.306 283 HB3 GLU 126 HB1 GLU 126 15.193 17.195 -8.942 284 HG2 GLU 126 HG2 GLU 126 15.103 19.127 -7.782 285 HG3 GLU 126 HG1 GLU 126 16.397 19.716 -8.825 286 H THR 127 HN THR 127 17.931 17.995 -12.587 287 HA THR 127 HA THR 127 17.660 20.975 -12.765 288 HB THR 127 HB THR 127 19.948 20.275 -12.591 289 HG1 THR 127 HG1 THR 127 19.992 21.706 -14.175 290 HG21 THR 127 HG21 THR 127 19.939 17.963 -12.945 291 HG22 THR 127 HG22 THR 127 20.761 18.556 -14.388 292 HG23 THR 127 HG23 THR 127 19.058 18.101 -14.467 293 H ILE 128 HN ILE 128 15.655 21.010 -13.900 294 HA ILE 128 HA ILE 128 15.801 19.973 -16.706 295 HB ILE 128 HB ILE 128 13.429 19.276 -16.417 296 HG12 ILE 128 HG12 ILE 128 13.146 19.184 -13.635 297 HG13 ILE 128 HG11 ILE 128 13.783 20.797 -13.959 298 HG21 ILE 128 HG21 ILE 128 14.413 17.310 -15.932 299 HG22 ILE 128 HG22 ILE 128 14.261 17.727 -14.225 300 HG23 ILE 128 HG23 ILE 128 15.739 18.123 -15.101 301 HD11 ILE 128 HD11 ILE 128 11.976 20.795 -15.881 302 HD12 ILE 128 HD12 ILE 128 11.501 21.166 -14.224 303 HD13 ILE 128 HD13 ILE 128 11.215 19.556 -14.884 304 H THR 129 HN THR 129 13.968 21.058 -18.039 305 HA THR 129 HA THR 129 14.246 23.872 -18.029 306 HB THR 129 HB THR 129 11.756 23.270 -19.180 307 HG1 THR 129 HG1 THR 129 11.790 21.243 -19.695 308 HG21 THR 129 HG21 THR 129 12.975 23.405 -21.273 309 HG22 THR 129 HG22 THR 129 14.493 23.032 -20.455 310 HG23 THR 129 HG23 THR 129 13.674 24.562 -20.140 311 H GLU 130 HN GLU 130 12.332 25.430 -17.702 312 HA GLU 130 HA GLU 130 11.280 25.068 -14.979 313 HB2 GLU 130 HB2 GLU 130 12.235 27.191 -15.737 314 HB3 GLU 130 HB1 GLU 130 11.067 27.269 -17.057 315 HG2 GLU 130 HG2 GLU 130 9.271 27.702 -15.618 316 HG3 GLU 130 HG1 GLU 130 10.107 27.033 -14.216 317 H ASP 131 HN ASP 131 10.039 25.065 -18.292 318 HA ASP 131 HA ASP 131 7.236 25.207 -17.621 319 HB2 ASP 131 HB2 ASP 131 7.058 24.289 -19.987 320 HB3 ASP 131 HB1 ASP 131 8.040 25.746 -19.828 321 H ASP 132 HN ASP 132 9.549 22.718 -17.217 322 HA ASP 132 HA ASP 132 7.579 20.513 -17.446 323 HB2 ASP 132 HB2 ASP 132 10.538 20.846 -17.072 324 HB3 ASP 132 HB1 ASP 132 9.794 19.310 -16.627 325 H ILE 133 HN ILE 133 8.795 22.655 -15.051 326 HA ILE 133 HA ILE 133 8.699 20.968 -12.727 327 HB ILE 133 HB ILE 133 8.348 23.942 -13.196 328 HG12 ILE 133 HG12 ILE 133 10.529 22.778 -13.819 329 HG13 ILE 133 HG11 ILE 133 10.680 24.089 -12.649 330 HG21 ILE 133 HG21 ILE 133 7.362 23.466 -11.056 331 HG22 ILE 133 HG22 ILE 133 8.980 24.094 -10.743 332 HG23 ILE 133 HG23 ILE 133 8.671 22.361 -10.633 333 HD11 ILE 133 HD11 ILE 133 11.985 22.244 -11.817 334 HD12 ILE 133 HD12 ILE 133 10.657 21.114 -12.077 335 HD13 ILE 133 HD13 ILE 133 10.535 22.344 -10.819 336 H GLU 134 HN GLU 134 6.216 22.714 -14.525 337 HA GLU 134 HA GLU 134 4.181 22.314 -12.427 338 HB2 GLU 134 HB2 GLU 134 4.394 23.608 -15.129 339 HB3 GLU 134 HB1 GLU 134 2.795 23.286 -14.456 340 HG2 GLU 134 HG2 GLU 134 4.031 24.377 -12.291 341 HG3 GLU 134 HG1 GLU 134 4.845 25.241 -13.596 342 H GLU 135 HN GLU 135 5.494 20.453 -14.947 343 HA GLU 135 HA GLU 135 3.099 19.092 -15.854 344 HB2 GLU 135 HB2 GLU 135 6.044 18.920 -16.113 345 HB3 GLU 135 HB1 GLU 135 5.186 17.395 -16.337 346 HG2 GLU 135 HG2 GLU 135 3.767 19.493 -17.705 347 HG3 GLU 135 HG1 GLU 135 5.457 19.506 -18.208 348 H LEU 136 HN LEU 136 5.413 18.581 -13.229 349 HA LEU 136 HA LEU 136 4.548 15.903 -12.545 350 HB2 LEU 136 HB2 LEU 136 6.138 18.126 -11.288 351 HB3 LEU 136 HB1 LEU 136 5.717 16.708 -10.327 352 HG LEU 136 HG LEU 136 6.885 16.293 -13.054 353 HD11 LEU 136 HD11 LEU 136 8.299 17.373 -10.640 354 HD12 LEU 136 HD12 LEU 136 8.566 17.735 -12.345 355 HD13 LEU 136 HD13 LEU 136 9.139 16.210 -11.667 356 HD21 LEU 136 HD21 LEU 136 7.952 14.640 -10.981 357 HD22 LEU 136 HD22 LEU 136 6.864 14.174 -12.288 358 HD23 LEU 136 HD23 LEU 136 6.206 14.733 -10.750 359 H MET 137 HN MET 137 3.651 19.161 -11.424 360 HA MET 137 HA MET 137 2.091 18.551 -9.178 361 HB2 MET 137 HB2 MET 137 2.621 20.715 -10.889 362 HB3 MET 137 HB1 MET 137 0.863 20.564 -10.874 363 HG2 MET 137 HG2 MET 137 1.682 20.184 -8.203 364 HG3 MET 137 HG1 MET 137 2.615 21.557 -8.799 365 HE1 MET 137 HE1 MET 137 -0.071 21.328 -6.544 366 HE2 MET 137 HE2 MET 137 -0.318 23.061 -6.737 367 HE3 MET 137 HE3 MET 137 1.319 22.411 -6.699 368 H LYS 138 HN LYS 138 1.343 17.973 -12.568 369 HA LYS 138 HA LYS 138 -1.448 17.797 -12.576 370 HB2 LYS 138 HB2 LYS 138 -1.132 16.332 -14.450 371 HB3 LYS 138 HB1 LYS 138 0.256 17.420 -14.439 372 HG2 LYS 138 HG2 LYS 138 1.597 15.714 -13.273 373 HG3 LYS 138 HG1 LYS 138 0.210 14.625 -13.262 374 HD2 LYS 138 HD2 LYS 138 0.490 15.471 -15.938 375 HD3 LYS 138 HD1 LYS 138 2.122 15.102 -15.379 376 HE2 LYS 138 HE2 LYS 138 -0.290 13.257 -15.245 377 HE3 LYS 138 HE1 LYS 138 1.162 13.042 -16.243 378 HZ1 LYS 138 HZ1 LYS 138 1.862 11.888 -14.445 379 HZ2 LYS 138 HZ2 LYS 138 0.821 12.693 -13.372 380 HZ3 LYS 138 HZ3 LYS 138 2.269 13.430 -13.867 381 H ASP 139 HN ASP 139 0.884 15.532 -11.168 382 HA ASP 139 HA ASP 139 -1.289 13.630 -10.466 383 HB2 ASP 139 HB2 ASP 139 1.607 13.623 -10.871 384 HB3 ASP 139 HB1 ASP 139 1.140 12.756 -9.407 385 H GLY 140 HN GLY 140 0.334 16.311 -9.106 386 HA2 GLY 140 HA2 GLY 140 -0.249 15.378 -6.330 387 HA3 GLY 140 HA1 GLY 140 0.861 16.688 -6.737 388 H ASP 141 HN ASP 141 -1.286 17.527 -8.809 389 HA ASP 141 HA ASP 141 -3.322 18.664 -6.950 390 HB2 ASP 141 HB2 ASP 141 -1.021 20.001 -7.757 391 HB3 ASP 141 HB1 ASP 141 -2.249 20.593 -8.877 392 H LYS 142 HN LYS 142 -3.949 16.665 -8.730 393 HA LYS 142 HA LYS 142 -4.570 17.301 -11.397 394 HB2 LYS 142 HB2 LYS 142 -5.217 15.342 -9.408 395 HB3 LYS 142 HB1 LYS 142 -6.707 15.794 -10.239 396 HG2 LYS 142 HG2 LYS 142 -4.667 15.567 -12.216 397 HG3 LYS 142 HG1 LYS 142 -4.578 14.131 -11.196 398 HD2 LYS 142 HD2 LYS 142 -7.203 14.147 -11.459 399 HD3 LYS 142 HD1 LYS 142 -6.849 15.103 -12.898 400 HE2 LYS 142 HE2 LYS 142 -5.100 13.200 -13.403 401 HE3 LYS 142 HE1 LYS 142 -6.118 12.246 -12.305 402 HZ1 LYS 142 HZ1 LYS 142 -6.709 12.488 -14.852 403 HZ2 LYS 142 HZ2 LYS 142 -7.452 13.915 -14.304 404 HZ3 LYS 142 HZ3 LYS 142 -7.918 12.411 -13.665 405 H ASN 143 HN ASN 143 -6.017 18.472 -8.454 406 HA ASN 143 HA ASN 143 -8.485 19.433 -9.718 407 HB2 ASN 143 HB2 ASN 143 -7.206 20.095 -7.045 408 HB3 ASN 143 HB1 ASN 143 -8.903 20.305 -7.478 409 HD21 ASN 143 HD21 ASN 143 -6.748 18.160 -5.984 410 HD22 ASN 143 HD22 ASN 143 -7.699 16.756 -6.062 411 H ASN 144 HN ASN 144 -5.271 20.471 -9.682 412 HA ASN 144 HA ASN 144 -4.232 22.550 -10.132 413 HB2 ASN 144 HB2 ASN 144 -6.858 22.902 -11.611 414 HB3 ASN 144 HB1 ASN 144 -5.317 23.661 -12.010 415 HD21 ASN 144 HD21 ASN 144 -4.069 22.561 -13.531 416 HD22 ASN 144 HD22 ASN 144 -4.245 20.920 -13.929 417 H ASP 145 HN ASP 145 -5.583 22.575 -7.620 418 HA ASP 145 HA ASP 145 -7.126 25.108 -7.532 419 HB2 ASP 145 HB2 ASP 145 -7.418 24.408 -5.147 420 HB3 ASP 145 HB1 ASP 145 -7.910 23.153 -6.283 421 H GLY 146 HN GLY 146 -3.897 24.163 -7.398 422 HA2 GLY 146 HA2 GLY 146 -2.019 25.568 -7.020 423 HA3 GLY 146 HA1 GLY 146 -3.100 26.783 -6.337 424 H ARG 147 HN ARG 147 -3.294 23.487 -5.222 425 HA ARG 147 HA ARG 147 -1.556 24.000 -2.885 426 HB2 ARG 147 HB2 ARG 147 -4.352 24.583 -2.935 427 HB3 ARG 147 HB1 ARG 147 -4.120 23.179 -1.893 428 HG2 ARG 147 HG2 ARG 147 -3.005 24.377 -0.315 429 HG3 ARG 147 HG1 ARG 147 -2.123 25.318 -1.519 430 HD2 ARG 147 HD2 ARG 147 -4.259 26.609 -1.957 431 HD3 ARG 147 HD1 ARG 147 -4.964 25.781 -0.554 432 HE ARG 147 HE ARG 147 -2.433 26.795 0.235 433 HH11 ARG 147 HH21 ARG 147 -5.542 27.892 -0.796 434 HH12 ARG 147 HH22 ARG 147 -5.462 29.368 0.105 435 HH21 ARG 147 HH11 ARG 147 -2.320 28.718 1.413 436 HH22 ARG 147 HH12 ARG 147 -3.641 29.836 1.353 437 H ILE 148 HN ILE 148 -0.719 22.059 -2.161 438 HA ILE 148 HA ILE 148 -1.961 19.546 -3.227 439 HB ILE 148 HB ILE 148 0.887 20.224 -2.422 440 HG12 ILE 148 HG12 ILE 148 -0.310 19.698 -5.161 441 HG13 ILE 148 HG11 ILE 148 0.046 21.305 -4.525 442 HG21 ILE 148 HG21 ILE 148 -0.497 17.698 -3.202 443 HG22 ILE 148 HG22 ILE 148 0.866 17.940 -2.110 444 HG23 ILE 148 HG23 ILE 148 1.118 17.970 -3.855 445 HD11 ILE 148 HD11 ILE 148 2.263 21.089 -4.924 446 HD12 ILE 148 HD12 ILE 148 1.817 19.721 -5.945 447 HD13 ILE 148 HD13 ILE 148 2.302 19.451 -4.271 448 H ASP 149 HN ASP 149 -2.616 18.029 -1.726 449 HA ASP 149 HA ASP 149 -2.015 18.605 1.153 450 HB2 ASP 149 HB2 ASP 149 -4.252 16.947 -0.040 451 HB3 ASP 149 HB1 ASP 149 -4.161 17.613 1.591 452 H TYR 150 HN TYR 150 -2.307 16.384 2.451 453 HA TYR 150 HA TYR 150 -0.127 14.665 1.703 454 HB2 TYR 150 HB2 TYR 150 -0.658 14.884 3.999 455 HB3 TYR 150 HB1 TYR 150 -2.377 14.614 3.715 456 HD1 TYR 150 HD1 TYR 150 0.958 12.937 3.557 457 HD2 TYR 150 HD2 TYR 150 -3.300 12.445 3.848 458 HE1 TYR 150 HE1 TYR 150 1.266 10.512 3.971 459 HE2 TYR 150 HE2 TYR 150 -2.991 10.020 4.262 460 HH TYR 150 HH TYR 150 -1.479 8.420 4.764 461 H ASP 151 HN ASP 151 -3.627 14.482 1.208 462 HA ASP 151 HA ASP 151 -3.782 11.725 0.428 463 HB2 ASP 151 HB2 ASP 151 -5.485 13.849 0.854 464 HB3 ASP 151 HB1 ASP 151 -5.589 13.643 -0.895 465 H GLU 152 HN GLU 152 -3.926 14.607 -1.702 466 HA GLU 152 HA GLU 152 -3.576 13.280 -4.162 467 HB2 GLU 152 HB2 GLU 152 -2.940 16.013 -3.073 468 HB3 GLU 152 HB1 GLU 152 -2.523 15.614 -4.740 469 HG2 GLU 152 HG2 GLU 152 -4.851 15.017 -5.210 470 HG3 GLU 152 HG1 GLU 152 -5.289 15.328 -3.530 471 H PHE 153 HN PHE 153 -1.140 14.363 -1.815 472 HA PHE 153 HA PHE 153 1.218 14.106 -3.318 473 HB2 PHE 153 HB2 PHE 153 0.959 14.921 -0.970 474 HB3 PHE 153 HB1 PHE 153 0.715 13.253 -0.449 475 HD1 PHE 153 HD1 PHE 153 3.131 15.378 -2.373 476 HD2 PHE 153 HD2 PHE 153 2.564 11.953 0.157 477 HE1 PHE 153 HE1 PHE 153 5.586 15.048 -2.272 478 HE2 PHE 153 HE2 PHE 153 5.020 11.623 0.259 479 HZ PHE 153 HZ PHE 153 6.531 13.171 -0.955 480 H LEU 154 HN LEU 154 -0.581 11.547 -1.582 481 HA LEU 154 HA LEU 154 1.152 9.373 -2.007 482 HB2 LEU 154 HB2 LEU 154 -1.722 9.862 -1.530 483 HB3 LEU 154 HB1 LEU 154 -1.357 8.294 -2.252 484 HG LEU 154 HG LEU 154 -1.327 8.227 0.244 485 HD11 LEU 154 HD11 LEU 154 1.416 7.661 0.048 486 HD12 LEU 154 HD12 LEU 154 0.781 7.400 -1.577 487 HD13 LEU 154 HD13 LEU 154 0.088 6.529 -0.208 488 HD21 LEU 154 HD21 LEU 154 -0.216 10.679 0.127 489 HD22 LEU 154 HD22 LEU 154 1.255 9.717 0.265 490 HD23 LEU 154 HD23 LEU 154 0.010 9.609 1.510 491 H GLU 155 HN GLU 155 -1.465 10.546 -4.159 492 HA GLU 155 HA GLU 155 -1.022 8.620 -6.240 493 HB2 GLU 155 HB2 GLU 155 -2.737 10.771 -5.625 494 HB3 GLU 155 HB1 GLU 155 -1.982 11.201 -7.161 495 HG2 GLU 155 HG2 GLU 155 -2.560 8.864 -7.974 496 HG3 GLU 155 HG1 GLU 155 -3.532 8.682 -6.513 497 H PHE 156 HN PHE 156 0.886 11.232 -5.185 498 HA PHE 156 HA PHE 156 1.997 12.116 -7.707 499 HB2 PHE 156 HB2 PHE 156 1.991 13.269 -5.433 500 HB3 PHE 156 HB1 PHE 156 3.259 12.142 -4.952 501 HD1 PHE 156 HD1 PHE 156 2.595 13.968 -8.162 502 HD2 PHE 156 HD2 PHE 156 5.304 13.270 -4.902 503 HE1 PHE 156 HE1 PHE 156 4.293 15.399 -9.266 504 HE2 PHE 156 HE2 PHE 156 7.002 14.701 -6.007 505 HZ PHE 156 HZ PHE 156 6.496 15.765 -8.189 506 H MET 157 HN MET 157 3.445 10.086 -5.117 507 HA MET 157 HA MET 157 5.384 9.001 -7.091 508 HB2 MET 157 HB2 MET 157 6.544 8.237 -5.108 509 HB3 MET 157 HB1 MET 157 5.992 9.883 -4.794 510 HG2 MET 157 HG2 MET 157 4.087 9.065 -3.534 511 HG3 MET 157 HG1 MET 157 4.469 7.397 -3.965 512 HE1 MET 157 HE1 MET 157 6.187 10.529 -3.049 513 HE2 MET 157 HE2 MET 157 7.710 9.659 -3.219 514 HE3 MET 157 HE3 MET 157 7.190 10.207 -1.628 515 H LYS 158 HN LYS 158 2.653 7.997 -5.082 516 HA LYS 158 HA LYS 158 1.435 5.973 -5.035 517 HB2 LYS 158 HB2 LYS 158 1.104 6.635 -7.362 518 HB3 LYS 158 HB1 LYS 158 2.658 5.933 -7.813 519 HG2 LYS 158 HG2 LYS 158 1.889 3.748 -7.599 520 HG3 LYS 158 HG1 LYS 158 0.623 4.198 -6.455 521 HD2 LYS 158 HD2 LYS 158 -0.821 4.919 -8.122 522 HD3 LYS 158 HD1 LYS 158 0.492 5.298 -9.238 523 HE2 LYS 158 HE2 LYS 158 0.939 2.793 -9.395 524 HE3 LYS 158 HE1 LYS 158 -0.593 2.555 -8.531 525 HZ1 LYS 158 HZ1 LYS 158 -1.808 3.449 -10.227 526 HZ2 LYS 158 HZ2 LYS 158 -0.544 2.767 -11.135 527 HZ3 LYS 158 HZ3 LYS 158 -0.541 4.429 -10.783 528 H GLY 159 HN GLY 159 3.898 4.678 -7.208 529 HA2 GLY 159 HA2 GLY 159 5.165 3.205 -4.963 530 HA3 GLY 159 HA1 GLY 159 4.432 2.257 -6.257 531 H VAL 160 HN VAL 160 6.793 4.897 -5.765 532 HA VAL 160 HA VAL 160 8.093 4.271 -8.346 533 HB VAL 160 HB VAL 160 8.804 6.235 -6.144 534 HG11 VAL 160 HG11 VAL 160 10.534 6.801 -7.466 535 HG12 VAL 160 HG12 VAL 160 9.431 7.090 -8.812 536 HG13 VAL 160 HG13 VAL 160 10.111 5.482 -8.559 537 HG21 VAL 160 HG21 VAL 160 6.497 6.163 -7.752 538 HG22 VAL 160 HG22 VAL 160 7.553 7.350 -8.516 539 HG23 VAL 160 HG23 VAL 160 7.092 7.540 -6.825 540 H GLU 161 HN GLU 161 9.323 2.396 -8.235 541 HA GLU 161 HA GLU 161 10.586 1.324 -5.925 542 HB2 GLU 161 HB2 GLU 161 10.434 0.895 -8.782 543 HB3 GLU 161 HB1 GLU 161 12.085 0.626 -8.219 544 HG2 GLU 161 HG2 GLU 161 10.569 -0.598 -6.257 545 HG3 GLU 161 HG1 GLU 161 9.666 -0.961 -7.728 546 HO1 KDH 1 H1 KDH 1 5.366 11.626 -11.807 547 H21 KDH 1 H21 KDH 1 9.560 7.161 -4.953 548 H33 KDH 1 H33 KDH 1 8.255 12.651 -6.837 549 H4 KDH 1 H4 KDH 1 5.891 11.489 -8.213 550 HO7 KDH 1 H7 KDH 1 6.673 11.013 -12.819 551 H01 KDH 1 H01 KDH 1 10.026 12.650 -4.987 552 H01A KDH 1 H02 KDH 1 8.388 11.988 -4.603 553 HO03 KDH 1 H03 KDH 1 11.250 11.869 -2.075 554 HO10 KDH 1 H10 KDH 1 10.031 8.511 -10.924 555 H12 KDH 1 H12 KDH 1 9.587 9.164 -8.785 556 H15 KDH 1 H15 KDH 1 7.210 10.621 -6.429 557 H26 KDH 1 H26 KDH 1 11.929 9.450 -2.052 558 H39 KDH 1 H39 KDH 1 9.064 13.283 -11.079 559 H41 KDH 1 H41 KDH 1 12.136 11.133 -8.780 560 HO02 KDH 1 H42 KDH 1 10.690 6.239 -3.229 561 HO44 KDH 1 H44 KDH 1 13.706 9.983 -11.808 562 HO47 KDH 1 H47 KDH 1 11.340 10.150 -13.862 563 HO50 KDH 1 H50 KDH 1 9.065 11.833 -13.616 Start of MODEL 3 1 H1 MET 90 HT1 MET 90 12.774 5.119 4.502 2 H2 MET 90 HT2 MET 90 14.234 5.975 4.350 3 H3 MET 90 HT3 MET 90 13.024 6.137 3.168 4 HA MET 90 HA MET 90 12.358 6.841 5.943 5 HB2 MET 90 HB2 MET 90 14.681 7.715 5.119 6 HB3 MET 90 HB1 MET 90 13.727 8.767 4.072 7 HG2 MET 90 HG2 MET 90 12.443 9.091 6.469 8 HG3 MET 90 HG1 MET 90 14.112 8.873 6.996 9 HE1 MET 90 HE1 MET 90 15.721 12.051 6.577 10 HE2 MET 90 HE2 MET 90 15.889 10.314 6.821 11 HE3 MET 90 HE3 MET 90 14.786 11.237 7.839 12 H GLY 91 HN GLY 91 11.090 5.971 3.270 13 HA2 GLY 91 HA2 GLY 91 8.819 7.704 3.362 14 HA3 GLY 91 HA1 GLY 91 9.838 8.172 2.001 15 H LYS 92 HN LYS 92 7.168 6.485 2.572 16 HA LYS 92 HA LYS 92 7.453 4.857 0.157 17 HB2 LYS 92 HB2 LYS 92 8.230 3.809 2.665 18 HB3 LYS 92 HB1 LYS 92 6.672 3.069 2.295 19 HG2 LYS 92 HG2 LYS 92 7.522 1.857 0.573 20 HG3 LYS 92 HG1 LYS 92 8.505 3.202 -0.005 21 HD2 LYS 92 HD2 LYS 92 9.392 2.100 2.577 22 HD3 LYS 92 HD1 LYS 92 9.504 0.961 1.234 23 HE2 LYS 92 HE2 LYS 92 10.447 3.434 0.225 24 HE3 LYS 92 HE1 LYS 92 11.215 3.213 1.810 25 HZ1 LYS 92 HZ1 LYS 92 11.795 0.956 1.186 26 HZ2 LYS 92 HZ2 LYS 92 12.446 2.055 0.065 27 HZ3 LYS 92 HZ3 LYS 92 11.060 1.155 -0.330 28 H SER 93 HN SER 93 5.475 4.333 3.078 29 HA SER 93 HA SER 93 3.064 5.119 1.471 30 HB2 SER 93 HB2 SER 93 1.935 3.341 2.880 31 HB3 SER 93 HB1 SER 93 3.165 2.724 1.781 32 HG SER 93 HG SER 93 3.504 1.852 3.816 33 H GLU 94 HN GLU 94 1.148 5.312 3.290 34 HA GLU 94 HA GLU 94 1.341 7.712 4.618 35 HB2 GLU 94 HB2 GLU 94 -0.064 5.133 5.342 36 HB3 GLU 94 HB1 GLU 94 -0.361 6.637 6.215 37 HG2 GLU 94 HG2 GLU 94 -1.540 7.547 4.498 38 HG3 GLU 94 HG1 GLU 94 -0.441 6.898 3.279 39 H GLU 95 HN GLU 95 2.744 4.654 5.650 40 HA GLU 95 HA GLU 95 3.252 5.054 8.367 41 HB2 GLU 95 HB2 GLU 95 5.159 4.017 6.241 42 HB3 GLU 95 HB1 GLU 95 5.206 3.616 7.958 43 HG2 GLU 95 HG2 GLU 95 2.575 3.065 7.204 44 HG3 GLU 95 HG1 GLU 95 3.543 2.488 5.847 45 H GLU 96 HN GLU 96 5.571 5.941 5.776 46 HA GLU 96 HA GLU 96 6.794 7.941 7.607 47 HB2 GLU 96 HB2 GLU 96 7.569 6.813 4.895 48 HB3 GLU 96 HB1 GLU 96 8.556 7.938 5.829 49 HG2 GLU 96 HG2 GLU 96 8.729 6.333 7.658 50 HG3 GLU 96 HG1 GLU 96 7.646 5.221 6.820 51 H LEU 97 HN LEU 97 5.170 7.712 4.445 52 HA LEU 97 HA LEU 97 5.490 10.272 3.406 53 HB2 LEU 97 HB2 LEU 97 2.989 8.559 3.585 54 HB3 LEU 97 HB1 LEU 97 3.207 9.893 2.453 55 HG LEU 97 HG LEU 97 4.726 7.283 2.567 56 HD11 LEU 97 HD11 LEU 97 2.943 8.701 0.597 57 HD12 LEU 97 HD12 LEU 97 2.828 7.047 1.199 58 HD13 LEU 97 HD13 LEU 97 4.092 7.481 0.049 59 HD21 LEU 97 HD21 LEU 97 6.521 8.698 2.157 60 HD22 LEU 97 HD22 LEU 97 5.507 9.943 1.428 61 HD23 LEU 97 HD23 LEU 97 5.914 8.490 0.514 62 H SER 98 HN SER 98 3.249 9.267 5.989 63 HA SER 98 HA SER 98 1.666 11.484 6.401 64 HB2 SER 98 HB2 SER 98 1.717 10.829 8.767 65 HB3 SER 98 HB1 SER 98 1.752 9.390 7.752 66 HG SER 98 HG SER 98 3.429 9.959 9.613 67 H ASP 99 HN ASP 99 4.927 11.125 7.857 68 HA ASP 99 HA ASP 99 5.000 13.978 8.565 69 HB2 ASP 99 HB2 ASP 99 6.198 11.537 9.365 70 HB3 ASP 99 HB1 ASP 99 7.509 12.570 8.795 71 H LEU 100 HN LEU 100 6.210 11.899 6.003 72 HA LEU 100 HA LEU 100 8.375 13.354 4.980 73 HB2 LEU 100 HB2 LEU 100 7.471 11.174 4.164 74 HB3 LEU 100 HB1 LEU 100 6.111 12.038 3.442 75 HG LEU 100 HG LEU 100 8.228 13.462 2.455 76 HD11 LEU 100 HD11 LEU 100 10.125 12.271 2.700 77 HD12 LEU 100 HD12 LEU 100 9.429 11.070 1.611 78 HD13 LEU 100 HD13 LEU 100 9.241 10.893 3.356 79 HD21 LEU 100 HD21 LEU 100 7.757 12.336 0.351 80 HD22 LEU 100 HD22 LEU 100 6.245 12.506 1.243 81 HD23 LEU 100 HD23 LEU 100 7.074 10.951 1.203 82 H PHE 101 HN PHE 101 5.038 13.678 3.706 83 HA PHE 101 HA PHE 101 5.356 15.986 2.183 84 HB2 PHE 101 HB2 PHE 101 3.316 14.631 2.306 85 HB3 PHE 101 HB1 PHE 101 3.050 15.146 3.971 86 HD1 PHE 101 HD1 PHE 101 2.835 17.692 4.404 87 HD2 PHE 101 HD2 PHE 101 2.441 15.891 0.524 88 HE1 PHE 101 HE1 PHE 101 1.634 19.703 3.593 89 HE2 PHE 101 HE2 PHE 101 1.239 17.903 -0.287 90 HZ PHE 101 HZ PHE 101 0.835 19.809 1.247 91 H ARG 102 HN ARG 102 5.171 15.711 5.688 92 HA ARG 102 HA ARG 102 4.828 18.581 6.148 93 HB2 ARG 102 HB2 ARG 102 3.985 16.867 7.688 94 HB3 ARG 102 HB1 ARG 102 5.619 16.245 7.919 95 HG2 ARG 102 HG2 ARG 102 5.288 19.146 8.414 96 HG3 ARG 102 HG1 ARG 102 4.469 18.084 9.561 97 HD2 ARG 102 HD2 ARG 102 6.726 16.793 9.662 98 HD3 ARG 102 HD1 ARG 102 7.419 18.263 8.948 99 HE ARG 102 HE ARG 102 5.757 19.136 11.038 100 HH11 ARG 102 HH21 ARG 102 8.530 17.122 10.600 101 HH12 ARG 102 HH22 ARG 102 9.180 17.457 12.169 102 HH21 ARG 102 HH11 ARG 102 6.597 19.577 13.088 103 HH22 ARG 102 HH12 ARG 102 8.088 18.843 13.576 104 H MET 103 HN MET 103 7.499 16.434 5.575 105 HA MET 103 HA MET 103 9.497 18.226 6.806 106 HB2 MET 103 HB2 MET 103 9.431 15.563 5.412 107 HB3 MET 103 HB1 MET 103 10.972 16.403 5.593 108 HG2 MET 103 HG2 MET 103 9.584 16.541 8.091 109 HG3 MET 103 HG1 MET 103 9.575 14.863 7.547 110 HE1 MET 103 HE1 MET 103 10.746 13.541 8.307 111 HE2 MET 103 HE2 MET 103 12.183 13.738 9.308 112 HE3 MET 103 HE3 MET 103 12.355 13.346 7.600 113 H PHE 104 HN PHE 104 9.100 16.855 3.508 114 HA PHE 104 HA PHE 104 10.867 18.543 2.133 115 HB2 PHE 104 HB2 PHE 104 8.181 17.400 1.302 116 HB3 PHE 104 HB1 PHE 104 9.391 18.014 0.179 117 HD1 PHE 104 HD1 PHE 104 11.651 16.905 2.264 118 HD2 PHE 104 HD2 PHE 104 8.376 15.210 0.058 119 HE1 PHE 104 HE1 PHE 104 12.781 14.701 2.279 120 HE2 PHE 104 HE2 PHE 104 9.507 13.005 0.077 121 HZ PHE 104 HZ PHE 104 11.710 12.750 1.187 122 H ASP 105 HN ASP 105 7.406 19.116 2.823 123 HA ASP 105 HA ASP 105 6.921 21.485 1.472 124 HB2 ASP 105 HB2 ASP 105 5.452 20.097 3.043 125 HB3 ASP 105 HB1 ASP 105 6.180 21.006 4.368 126 H LYS 106 HN LYS 106 8.862 22.781 1.337 127 HA LYS 106 HA LYS 106 10.152 23.782 3.777 128 HB2 LYS 106 HB2 LYS 106 11.379 23.314 1.689 129 HB3 LYS 106 HB1 LYS 106 10.394 24.503 0.836 130 HG2 LYS 106 HG2 LYS 106 11.222 26.142 2.706 131 HG3 LYS 106 HG1 LYS 106 12.507 24.954 2.927 132 HD2 LYS 106 HD2 LYS 106 13.336 26.541 1.337 133 HD3 LYS 106 HD1 LYS 106 12.905 25.101 0.414 134 HE2 LYS 106 HE2 LYS 106 11.018 26.105 -0.531 135 HE3 LYS 106 HE1 LYS 106 10.852 27.271 0.798 136 HZ1 LYS 106 HZ1 LYS 106 11.870 28.128 -1.356 137 HZ2 LYS 106 HZ2 LYS 106 13.245 27.220 -0.943 138 HZ3 LYS 106 HZ3 LYS 106 12.710 28.468 0.078 139 H ASN 107 HN ASN 107 7.502 24.708 1.765 140 HA ASN 107 HA ASN 107 7.594 27.570 2.354 141 HB2 ASN 107 HB2 ASN 107 6.595 26.721 0.310 142 HB3 ASN 107 HB1 ASN 107 5.511 25.674 1.227 143 HD21 ASN 107 HD21 ASN 107 3.581 26.734 0.380 144 HD22 ASN 107 HD22 ASN 107 3.150 28.303 0.861 145 H ALA 108 HN ALA 108 6.386 24.720 3.931 146 HA ALA 108 HA ALA 108 5.097 24.436 5.895 147 HB1 ALA 108 HB1 ALA 108 6.931 26.704 6.125 148 HB2 ALA 108 HB2 ALA 108 6.600 25.415 7.283 149 HB3 ALA 108 HB3 ALA 108 5.561 26.840 7.228 150 H ASP 109 HN ASP 109 3.387 25.095 3.916 151 HA ASP 109 HA ASP 109 1.681 27.285 5.059 152 HB2 ASP 109 HB2 ASP 109 0.992 27.718 2.767 153 HB3 ASP 109 HB1 ASP 109 2.755 27.672 2.810 154 H GLY 110 HN GLY 110 1.941 23.953 4.513 155 HA2 GLY 110 HA2 GLY 110 0.211 22.469 5.421 156 HA3 GLY 110 HA1 GLY 110 -1.001 23.643 4.905 157 H TYR 111 HN TYR 111 0.291 24.059 2.280 158 HA TYR 111 HA TYR 111 -0.280 21.399 1.014 159 HB2 TYR 111 HB2 TYR 111 -1.078 24.141 -0.011 160 HB3 TYR 111 HB1 TYR 111 -1.583 22.579 -0.656 161 HD1 TYR 111 HD2 TYR 111 -1.677 24.638 2.471 162 HD2 TYR 111 HD1 TYR 111 -3.543 21.555 0.134 163 HE1 TYR 111 HE2 TYR 111 -3.595 24.607 4.043 164 HE2 TYR 111 HE1 TYR 111 -5.460 21.524 1.705 165 HH TYR 111 HH TYR 111 -6.191 22.219 3.726 166 H ILE 112 HN ILE 112 1.225 20.805 -0.530 167 HA ILE 112 HA ILE 112 3.634 22.397 -0.881 168 HB ILE 112 HB ILE 112 2.525 19.865 -2.126 169 HG12 ILE 112 HG12 ILE 112 4.717 20.382 -0.092 170 HG13 ILE 112 HG11 ILE 112 3.118 19.723 0.260 171 HG21 ILE 112 HG21 ILE 112 4.798 21.525 -2.911 172 HG22 ILE 112 HG22 ILE 112 4.070 20.155 -3.749 173 HG23 ILE 112 HG23 ILE 112 5.281 19.880 -2.497 174 HD11 ILE 112 HD11 ILE 112 5.462 18.324 -0.621 175 HD12 ILE 112 HD12 ILE 112 4.218 18.180 -1.864 176 HD13 ILE 112 HD13 ILE 112 3.880 17.661 -0.213 177 H ASP 113 HN ASP 113 4.051 23.855 -2.514 178 HA ASP 113 HA ASP 113 1.956 24.229 -4.606 179 HB2 ASP 113 HB2 ASP 113 3.633 25.893 -2.953 180 HB3 ASP 113 HB1 ASP 113 3.942 26.260 -4.650 181 H LEU 114 HN LEU 114 3.176 25.258 -6.704 182 HA LEU 114 HA LEU 114 4.743 23.071 -7.825 183 HB2 LEU 114 HB2 LEU 114 3.871 25.816 -8.764 184 HB3 LEU 114 HB1 LEU 114 4.763 24.695 -9.793 185 HG LEU 114 HG LEU 114 2.804 23.053 -8.871 186 HD11 LEU 114 HD11 LEU 114 0.756 24.747 -9.395 187 HD12 LEU 114 HD12 LEU 114 1.871 25.860 -8.603 188 HD13 LEU 114 HD13 LEU 114 1.328 24.409 -7.761 189 HD21 LEU 114 HD21 LEU 114 2.230 24.875 -11.200 190 HD22 LEU 114 HD22 LEU 114 1.967 23.136 -11.064 191 HD23 LEU 114 HD23 LEU 114 3.602 23.767 -11.262 192 H ASP 115 HN ASP 115 5.432 26.350 -6.660 193 HA ASP 115 HA ASP 115 8.124 26.542 -7.630 194 HB2 ASP 115 HB2 ASP 115 6.291 28.145 -6.387 195 HB3 ASP 115 HB1 ASP 115 7.421 27.841 -5.067 196 H GLU 116 HN GLU 116 6.747 24.667 -5.079 197 HA GLU 116 HA GLU 116 9.341 24.418 -3.645 198 HB2 GLU 116 HB2 GLU 116 6.681 23.097 -3.053 199 HB3 GLU 116 HB1 GLU 116 8.003 23.413 -1.929 200 HG2 GLU 116 HG2 GLU 116 7.660 25.857 -2.256 201 HG3 GLU 116 HG1 GLU 116 6.282 25.501 -3.299 202 H LEU 117 HN LEU 117 7.088 22.528 -5.624 203 HA LEU 117 HA LEU 117 8.057 19.922 -5.261 204 HB2 LEU 117 HB2 LEU 117 7.019 21.445 -7.659 205 HB3 LEU 117 HB1 LEU 117 7.339 19.711 -7.723 206 HG LEU 117 HG LEU 117 5.539 21.022 -5.668 207 HD11 LEU 117 HD11 LEU 117 5.059 20.472 -8.434 208 HD12 LEU 117 HD12 LEU 117 3.915 21.054 -7.225 209 HD13 LEU 117 HD13 LEU 117 4.128 19.321 -7.476 210 HD21 LEU 117 HD21 LEU 117 4.773 18.583 -5.476 211 HD22 LEU 117 HD22 LEU 117 6.377 18.944 -4.839 212 HD23 LEU 117 HD23 LEU 117 6.208 18.167 -6.413 213 H LYS 118 HN LYS 118 9.417 22.523 -7.281 214 HA LYS 118 HA LYS 118 11.525 20.796 -8.364 215 HB2 LYS 118 HB2 LYS 118 12.256 22.954 -9.373 216 HB3 LYS 118 HB1 LYS 118 10.536 22.658 -9.629 217 HG2 LYS 118 HG2 LYS 118 9.889 24.331 -8.184 218 HG3 LYS 118 HG1 LYS 118 11.317 24.145 -7.165 219 HD2 LYS 118 HD2 LYS 118 12.612 25.520 -8.484 220 HD3 LYS 118 HD1 LYS 118 11.745 25.095 -9.960 221 HE2 LYS 118 HE2 LYS 118 9.754 26.340 -8.571 222 HE3 LYS 118 HE1 LYS 118 11.173 27.244 -8.005 223 HZ1 LYS 118 HZ1 LYS 118 10.711 26.594 -10.861 224 HZ2 LYS 118 HZ2 LYS 118 11.843 27.682 -10.211 225 HZ3 LYS 118 HZ3 LYS 118 10.184 28.045 -10.159 226 H ILE 119 HN ILE 119 11.073 22.675 -5.503 227 HA ILE 119 HA ILE 119 13.966 23.063 -5.023 228 HB ILE 119 HB ILE 119 11.465 23.632 -3.397 229 HG12 ILE 119 HG12 ILE 119 13.261 25.441 -5.049 230 HG13 ILE 119 HG11 ILE 119 11.637 24.922 -5.501 231 HG21 ILE 119 HG21 ILE 119 12.825 24.142 -1.679 232 HG22 ILE 119 HG22 ILE 119 13.721 25.262 -2.705 233 HG23 ILE 119 HG23 ILE 119 14.205 23.569 -2.616 234 HD11 ILE 119 HD11 ILE 119 11.073 26.913 -4.505 235 HD12 ILE 119 HD12 ILE 119 12.490 26.909 -3.455 236 HD13 ILE 119 HD13 ILE 119 11.095 25.906 -3.057 237 H MET 120 HN MET 120 11.350 20.914 -4.059 238 HA MET 120 HA MET 120 12.522 19.761 -1.724 239 HB2 MET 120 HB2 MET 120 10.201 19.434 -2.313 240 HB3 MET 120 HB1 MET 120 10.643 18.717 -3.863 241 HG2 MET 120 HG2 MET 120 12.027 17.171 -2.007 242 HG3 MET 120 HG1 MET 120 10.473 17.466 -1.230 243 HE1 MET 120 HE1 MET 120 8.842 16.450 -1.313 244 HE2 MET 120 HE2 MET 120 8.947 14.772 -1.838 245 HE3 MET 120 HE3 MET 120 7.910 15.897 -2.711 246 H LEU 121 HN LEU 121 12.456 18.401 -5.047 247 HA LEU 121 HA LEU 121 14.341 16.316 -4.530 248 HB2 LEU 121 HB2 LEU 121 12.888 17.535 -6.739 249 HB3 LEU 121 HB1 LEU 121 14.499 17.018 -7.239 250 HG LEU 121 HG LEU 121 12.788 15.216 -7.492 251 HD11 LEU 121 HD11 LEU 121 15.113 14.579 -7.166 252 HD12 LEU 121 HD12 LEU 121 14.094 13.479 -6.238 253 HD13 LEU 121 HD13 LEU 121 14.961 14.779 -5.420 254 HD21 LEU 121 HD21 LEU 121 11.464 15.972 -5.464 255 HD22 LEU 121 HD22 LEU 121 12.721 15.247 -4.461 256 HD23 LEU 121 HD23 LEU 121 11.762 14.235 -5.541 257 H GLN 122 HN GLN 122 14.770 19.719 -5.152 258 HA GLN 122 HA GLN 122 17.275 19.947 -6.329 259 HB2 GLN 122 HB2 GLN 122 15.495 21.523 -4.868 260 HB3 GLN 122 HB1 GLN 122 16.997 21.620 -3.948 261 HG2 GLN 122 HG2 GLN 122 18.028 21.938 -6.395 262 HG3 GLN 122 HG1 GLN 122 16.408 22.556 -6.721 263 HE21 GLN 122 HE21 GLN 122 17.412 24.744 -6.954 264 HE22 GLN 122 HE22 GLN 122 17.818 25.632 -5.566 265 H ALA 123 HN ALA 123 16.524 18.665 -3.155 266 HA ALA 123 HA ALA 123 19.087 18.896 -1.913 267 HB1 ALA 123 HB1 ALA 123 18.149 17.399 -0.338 268 HB2 ALA 123 HB2 ALA 123 17.179 16.584 -1.565 269 HB3 ALA 123 HB3 ALA 123 16.741 18.206 -1.028 270 H THR 124 HN THR 124 18.079 17.016 -4.595 271 HA THR 124 HA THR 124 20.411 15.160 -4.253 272 HB THR 124 HB THR 124 19.112 13.644 -5.676 273 HG1 THR 124 HG1 THR 124 16.825 14.594 -5.988 274 HG21 THR 124 HG21 THR 124 17.277 14.856 -3.595 275 HG22 THR 124 HG22 THR 124 18.628 13.792 -3.205 276 HG23 THR 124 HG23 THR 124 17.282 13.189 -4.172 277 H GLY 125 HN GLY 125 19.617 17.969 -5.770 278 HA2 GLY 125 HA2 GLY 125 20.846 19.084 -7.473 279 HA3 GLY 125 HA1 GLY 125 21.649 17.559 -7.850 280 H GLU 126 HN GLU 126 18.149 17.997 -7.648 281 HA GLU 126 HA GLU 126 17.664 16.679 -10.147 282 HB2 GLU 126 HB2 GLU 126 15.364 17.325 -9.702 283 HB3 GLU 126 HB1 GLU 126 16.127 16.926 -8.162 284 HG2 GLU 126 HG2 GLU 126 15.526 18.965 -7.417 285 HG3 GLU 126 HG1 GLU 126 16.662 19.660 -8.575 286 H THR 127 HN THR 127 19.379 18.189 -11.303 287 HA THR 127 HA THR 127 18.562 20.889 -11.993 288 HB THR 127 HB THR 127 20.432 20.654 -13.612 289 HG1 THR 127 HG1 THR 127 19.952 18.480 -14.178 290 HG21 THR 127 HG21 THR 127 20.982 21.124 -11.274 291 HG22 THR 127 HG22 THR 127 22.198 20.055 -11.972 292 HG23 THR 127 HG23 THR 127 20.958 19.400 -10.903 293 H ILE 128 HN ILE 128 16.410 20.748 -12.841 294 HA ILE 128 HA ILE 128 16.247 19.514 -15.564 295 HB ILE 128 HB ILE 128 15.228 17.980 -13.989 296 HG12 ILE 128 HG12 ILE 128 12.813 19.450 -14.978 297 HG13 ILE 128 HG11 ILE 128 13.968 18.851 -16.168 298 HG21 ILE 128 HG21 ILE 128 14.586 18.889 -12.020 299 HG22 ILE 128 HG22 ILE 128 13.084 19.318 -12.839 300 HG23 ILE 128 HG23 ILE 128 14.397 20.490 -12.734 301 HD11 ILE 128 HD11 ILE 128 13.268 16.924 -14.040 302 HD12 ILE 128 HD12 ILE 128 13.441 16.671 -15.777 303 HD13 ILE 128 HD13 ILE 128 11.945 17.345 -15.129 304 H THR 129 HN THR 129 14.478 20.492 -16.872 305 HA THR 129 HA THR 129 14.392 23.367 -16.658 306 HB THR 129 HB THR 129 12.599 22.938 -18.496 307 HG1 THR 129 HG1 THR 129 12.128 20.931 -18.895 308 HG21 THR 129 HG21 THR 129 14.331 22.328 -20.109 309 HG22 THR 129 HG22 THR 129 15.359 21.723 -18.809 310 HG23 THR 129 HG23 THR 129 14.997 23.446 -18.919 311 H GLU 130 HN GLU 130 12.688 24.700 -15.927 312 HA GLU 130 HA GLU 130 10.981 23.712 -13.843 313 HB2 GLU 130 HB2 GLU 130 10.240 25.976 -13.760 314 HB3 GLU 130 HB1 GLU 130 11.907 26.068 -14.326 315 HG2 GLU 130 HG2 GLU 130 10.768 25.881 -16.710 316 HG3 GLU 130 HG1 GLU 130 9.364 26.508 -15.847 317 H ASP 131 HN ASP 131 10.601 23.910 -17.303 318 HA ASP 131 HA ASP 131 7.714 23.849 -17.409 319 HB2 ASP 131 HB2 ASP 131 10.053 23.413 -19.208 320 HB3 ASP 131 HB1 ASP 131 8.504 22.761 -19.744 321 H ASP 132 HN ASP 132 10.125 21.453 -16.711 322 HA ASP 132 HA ASP 132 8.440 19.154 -17.441 323 HB2 ASP 132 HB2 ASP 132 11.123 19.631 -17.180 324 HB3 ASP 132 HB1 ASP 132 10.774 18.822 -15.651 325 H ILE 133 HN ILE 133 9.191 21.050 -14.570 326 HA ILE 133 HA ILE 133 8.408 19.312 -12.498 327 HB ILE 133 HB ILE 133 7.925 22.287 -12.864 328 HG12 ILE 133 HG12 ILE 133 10.275 21.659 -13.165 329 HG13 ILE 133 HG11 ILE 133 10.074 22.484 -11.619 330 HG21 ILE 133 HG21 ILE 133 8.474 21.476 -10.162 331 HG22 ILE 133 HG22 ILE 133 7.120 20.532 -10.781 332 HG23 ILE 133 HG23 ILE 133 7.046 22.293 -10.795 333 HD11 ILE 133 HD11 ILE 133 11.461 20.518 -11.274 334 HD12 ILE 133 HD12 ILE 133 10.262 19.491 -12.059 335 HD13 ILE 133 HD13 ILE 133 9.896 20.247 -10.508 336 H GLU 134 HN GLU 134 6.359 21.457 -14.493 337 HA GLU 134 HA GLU 134 3.862 21.098 -13.308 338 HB2 GLU 134 HB2 GLU 134 4.726 21.246 -16.209 339 HB3 GLU 134 HB1 GLU 134 3.042 21.382 -15.701 340 HG2 GLU 134 HG2 GLU 134 3.692 23.284 -14.212 341 HG3 GLU 134 HG1 GLU 134 5.328 23.189 -14.864 342 H GLU 135 HN GLU 135 5.557 18.863 -15.510 343 HA GLU 135 HA GLU 135 3.439 17.008 -15.924 344 HB2 GLU 135 HB2 GLU 135 6.397 17.106 -16.102 345 HB3 GLU 135 HB1 GLU 135 5.700 15.490 -15.997 346 HG2 GLU 135 HG2 GLU 135 4.572 15.693 -18.009 347 HG3 GLU 135 HG1 GLU 135 4.447 17.448 -17.880 348 H LEU 136 HN LEU 136 5.732 17.356 -13.242 349 HA LEU 136 HA LEU 136 4.931 14.841 -11.966 350 HB2 LEU 136 HB2 LEU 136 6.613 17.243 -11.214 351 HB3 LEU 136 HB1 LEU 136 6.355 15.895 -10.106 352 HG LEU 136 HG LEU 136 7.086 14.933 -12.743 353 HD11 LEU 136 HD11 LEU 136 8.791 17.050 -11.447 354 HD12 LEU 136 HD12 LEU 136 8.386 16.847 -13.151 355 HD13 LEU 136 HD13 LEU 136 9.539 15.756 -12.382 356 HD21 LEU 136 HD21 LEU 136 7.775 14.564 -9.891 357 HD22 LEU 136 HD22 LEU 136 9.089 14.225 -11.018 358 HD23 LEU 136 HD23 LEU 136 7.559 13.359 -11.160 359 H MET 137 HN MET 137 3.629 17.995 -12.143 360 HA MET 137 HA MET 137 2.495 18.214 -9.492 361 HB2 MET 137 HB2 MET 137 2.749 19.728 -11.843 362 HB3 MET 137 HB1 MET 137 1.010 19.526 -11.621 363 HG2 MET 137 HG2 MET 137 2.511 20.162 -9.155 364 HG3 MET 137 HG1 MET 137 2.490 21.446 -10.364 365 HE1 MET 137 HE1 MET 137 1.540 21.001 -7.502 366 HE2 MET 137 HE2 MET 137 -0.186 21.203 -7.209 367 HE3 MET 137 HE3 MET 137 0.761 22.559 -7.817 368 H LYS 138 HN LYS 138 1.452 16.686 -12.497 369 HA LYS 138 HA LYS 138 -1.316 16.311 -11.783 370 HB2 LYS 138 HB2 LYS 138 0.659 15.307 -13.779 371 HB3 LYS 138 HB1 LYS 138 -0.800 14.342 -13.550 372 HG2 LYS 138 HG2 LYS 138 -1.962 15.804 -14.802 373 HG3 LYS 138 HG1 LYS 138 -1.581 17.085 -13.651 374 HD2 LYS 138 HD2 LYS 138 -0.005 17.984 -15.006 375 HD3 LYS 138 HD1 LYS 138 0.675 16.404 -15.398 376 HE2 LYS 138 HE2 LYS 138 -0.488 16.287 -17.350 377 HE3 LYS 138 HE1 LYS 138 -1.989 16.830 -16.573 378 HZ1 LYS 138 HZ1 LYS 138 -1.507 19.000 -16.927 379 HZ2 LYS 138 HZ2 LYS 138 -0.614 18.371 -18.229 380 HZ3 LYS 138 HZ3 LYS 138 0.167 18.779 -16.777 381 H ASP 139 HN ASP 139 1.598 14.296 -11.387 382 HA ASP 139 HA ASP 139 0.344 11.929 -10.427 383 HB2 ASP 139 HB2 ASP 139 3.021 13.192 -9.749 384 HB3 ASP 139 HB1 ASP 139 2.606 11.496 -9.498 385 H GLY 140 HN GLY 140 1.311 14.902 -8.738 386 HA2 GLY 140 HA2 GLY 140 0.298 13.760 -6.182 387 HA3 GLY 140 HA1 GLY 140 1.290 15.211 -6.326 388 H ASP 141 HN ASP 141 -0.416 16.145 -8.633 389 HA ASP 141 HA ASP 141 -2.854 16.933 -7.069 390 HB2 ASP 141 HB2 ASP 141 -0.688 18.512 -7.628 391 HB3 ASP 141 HB1 ASP 141 -1.721 18.850 -9.018 392 H LYS 142 HN LYS 142 -3.871 15.146 -8.386 393 HA LYS 142 HA LYS 142 -3.981 15.224 -11.256 394 HB2 LYS 142 HB2 LYS 142 -5.053 13.749 -9.033 395 HB3 LYS 142 HB1 LYS 142 -6.367 14.126 -10.147 396 HG2 LYS 142 HG2 LYS 142 -4.164 13.371 -11.754 397 HG3 LYS 142 HG1 LYS 142 -4.252 12.189 -10.448 398 HD2 LYS 142 HD2 LYS 142 -5.944 11.197 -11.551 399 HD3 LYS 142 HD1 LYS 142 -6.917 12.632 -11.233 400 HE2 LYS 142 HE2 LYS 142 -7.017 12.701 -13.537 401 HE3 LYS 142 HE1 LYS 142 -5.451 13.516 -13.352 402 HZ1 LYS 142 HZ1 LYS 142 -4.319 11.694 -13.991 403 HZ2 LYS 142 HZ2 LYS 142 -5.777 11.259 -14.745 404 HZ3 LYS 142 HZ3 LYS 142 -5.380 10.618 -13.222 405 H ASN 143 HN ASN 143 -5.420 17.214 -8.851 406 HA ASN 143 HA ASN 143 -7.731 18.020 -10.499 407 HB2 ASN 143 HB2 ASN 143 -6.562 18.984 -7.866 408 HB3 ASN 143 HB1 ASN 143 -8.098 19.534 -8.537 409 HD21 ASN 143 HD21 ASN 143 -7.350 17.775 -6.069 410 HD22 ASN 143 HD22 ASN 143 -8.373 16.430 -6.226 411 H ASN 144 HN ASN 144 -4.434 18.816 -10.323 412 HA ASN 144 HA ASN 144 -3.182 20.668 -11.111 413 HB2 ASN 144 HB2 ASN 144 -5.113 19.742 -12.956 414 HB3 ASN 144 HB1 ASN 144 -5.157 21.503 -13.057 415 HD21 ASN 144 HD21 ASN 144 -3.576 22.423 -14.377 416 HD22 ASN 144 HD22 ASN 144 -2.128 21.663 -14.835 417 H ASP 145 HN ASP 145 -4.929 21.271 -8.867 418 HA ASP 145 HA ASP 145 -6.219 23.855 -9.473 419 HB2 ASP 145 HB2 ASP 145 -6.878 23.695 -7.111 420 HB3 ASP 145 HB1 ASP 145 -7.157 22.149 -7.912 421 H GLY 146 HN GLY 146 -3.106 22.744 -8.587 422 HA2 GLY 146 HA2 GLY 146 -1.203 24.239 -8.489 423 HA3 GLY 146 HA1 GLY 146 -2.287 25.538 -7.990 424 H ARG 147 HN ARG 147 -3.301 22.971 -6.236 425 HA ARG 147 HA ARG 147 -1.379 23.542 -4.000 426 HB2 ARG 147 HB2 ARG 147 -3.753 24.568 -3.983 427 HB3 ARG 147 HB1 ARG 147 -4.322 22.922 -3.702 428 HG2 ARG 147 HG2 ARG 147 -3.215 22.762 -1.628 429 HG3 ARG 147 HG1 ARG 147 -2.143 24.114 -1.994 430 HD2 ARG 147 HD2 ARG 147 -5.045 24.754 -2.009 431 HD3 ARG 147 HD1 ARG 147 -4.339 24.382 -0.423 432 HE ARG 147 HE ARG 147 -2.514 26.078 -1.762 433 HH11 ARG 147 HH21 ARG 147 -5.738 26.109 -0.523 434 HH12 ARG 147 HH22 ARG 147 -5.728 27.806 -0.182 435 HH21 ARG 147 HH11 ARG 147 -2.490 28.291 -1.321 436 HH22 ARG 147 HH12 ARG 147 -3.893 29.041 -0.637 437 H ILE 148 HN ILE 148 -0.518 21.722 -3.057 438 HA ILE 148 HA ILE 148 -1.779 19.077 -3.719 439 HB ILE 148 HB ILE 148 1.129 19.859 -3.332 440 HG12 ILE 148 HG12 ILE 148 -0.440 19.057 -5.803 441 HG13 ILE 148 HG11 ILE 148 0.195 20.666 -5.456 442 HG21 ILE 148 HG21 ILE 148 -0.228 17.220 -3.917 443 HG22 ILE 148 HG22 ILE 148 0.876 17.599 -2.594 444 HG23 ILE 148 HG23 ILE 148 1.481 17.502 -4.248 445 HD11 ILE 148 HD11 ILE 148 2.427 19.984 -5.727 446 HD12 ILE 148 HD12 ILE 148 1.590 19.089 -6.995 447 HD13 ILE 148 HD13 ILE 148 2.033 18.281 -5.491 448 H ASP 149 HN ASP 149 -2.595 18.141 -1.882 449 HA ASP 149 HA ASP 149 -1.392 18.879 0.756 450 HB2 ASP 149 HB2 ASP 149 -3.595 18.047 1.604 451 HB3 ASP 149 HB1 ASP 149 -3.771 19.357 0.436 452 H TYR 150 HN TYR 150 -1.957 16.833 2.352 453 HA TYR 150 HA TYR 150 -0.109 14.762 1.667 454 HB2 TYR 150 HB2 TYR 150 -0.698 15.381 3.956 455 HB3 TYR 150 HB1 TYR 150 -2.376 14.920 3.680 456 HD1 TYR 150 HD2 TYR 150 -0.095 12.774 1.949 457 HD2 TYR 150 HD1 TYR 150 -1.883 13.476 5.793 458 HE1 TYR 150 HE2 TYR 150 0.432 10.445 2.620 459 HE2 TYR 150 HE1 TYR 150 -1.354 11.147 6.462 460 HH TYR 150 HH TYR 150 -0.639 9.146 5.746 461 H ASP 151 HN ASP 151 -3.649 14.404 2.127 462 HA ASP 151 HA ASP 151 -4.070 11.875 1.112 463 HB2 ASP 151 HB2 ASP 151 -5.537 14.331 1.481 464 HB3 ASP 151 HB1 ASP 151 -6.082 13.541 0.001 465 H GLU 152 HN GLU 152 -3.456 14.820 -0.777 466 HA GLU 152 HA GLU 152 -3.810 13.410 -3.340 467 HB2 GLU 152 HB2 GLU 152 -3.247 16.179 -2.346 468 HB3 GLU 152 HB1 GLU 152 -2.844 15.799 -4.021 469 HG2 GLU 152 HG2 GLU 152 -5.233 14.811 -4.162 470 HG3 GLU 152 HG1 GLU 152 -5.542 15.710 -2.676 471 H PHE 153 HN PHE 153 -1.226 14.166 -1.133 472 HA PHE 153 HA PHE 153 0.996 14.150 -2.942 473 HB2 PHE 153 HB2 PHE 153 0.908 14.877 -0.523 474 HB3 PHE 153 HB1 PHE 153 0.862 13.172 -0.074 475 HD1 PHE 153 HD1 PHE 153 2.880 15.734 -1.879 476 HD2 PHE 153 HD2 PHE 153 2.839 11.860 -0.024 477 HE1 PHE 153 HE1 PHE 153 5.349 15.612 -2.079 478 HE2 PHE 153 HE2 PHE 153 5.308 11.738 -0.223 479 HZ PHE 153 HZ PHE 153 6.563 13.614 -1.252 480 H LEU 154 HN LEU 154 -0.675 11.532 -1.191 481 HA LEU 154 HA LEU 154 1.018 9.362 -1.704 482 HB2 LEU 154 HB2 LEU 154 -2.004 9.623 -1.713 483 HB3 LEU 154 HB1 LEU 154 -1.166 8.070 -1.682 484 HG LEU 154 HG LEU 154 -1.007 10.276 0.389 485 HD11 LEU 154 HD11 LEU 154 -1.533 7.676 1.441 486 HD12 LEU 154 HD12 LEU 154 -2.623 7.931 0.078 487 HD13 LEU 154 HD13 LEU 154 -2.606 9.076 1.420 488 HD21 LEU 154 HD21 LEU 154 0.658 7.789 -0.036 489 HD22 LEU 154 HD22 LEU 154 0.487 8.525 1.557 490 HD23 LEU 154 HD23 LEU 154 1.211 9.442 0.236 491 H GLU 155 HN GLU 155 -1.628 10.549 -3.820 492 HA GLU 155 HA GLU 155 -1.416 8.792 -5.966 493 HB2 GLU 155 HB2 GLU 155 -2.877 10.917 -5.496 494 HB3 GLU 155 HB1 GLU 155 -1.614 11.771 -6.384 495 HG2 GLU 155 HG2 GLU 155 -1.962 10.412 -8.341 496 HG3 GLU 155 HG1 GLU 155 -3.037 9.324 -7.462 497 H PHE 156 HN PHE 156 0.828 11.320 -5.011 498 HA PHE 156 HA PHE 156 2.328 11.563 -7.431 499 HB2 PHE 156 HB2 PHE 156 2.383 13.032 -5.392 500 HB3 PHE 156 HB1 PHE 156 3.262 11.756 -4.549 501 HD1 PHE 156 HD1 PHE 156 3.391 13.815 -7.678 502 HD2 PHE 156 HD2 PHE 156 5.597 11.678 -4.675 503 HE1 PHE 156 HE1 PHE 156 5.516 14.628 -8.662 504 HE2 PHE 156 HE2 PHE 156 7.723 12.491 -5.659 505 HZ PHE 156 HZ PHE 156 7.683 13.967 -7.653 506 H MET 157 HN MET 157 2.555 9.279 -4.714 507 HA MET 157 HA MET 157 4.969 7.983 -5.743 508 HB2 MET 157 HB2 MET 157 2.955 7.045 -3.677 509 HB3 MET 157 HB1 MET 157 4.643 6.550 -3.814 510 HG2 MET 157 HG2 MET 157 4.712 9.356 -3.689 511 HG3 MET 157 HG1 MET 157 3.524 8.871 -2.480 512 HE1 MET 157 HE1 MET 157 6.641 9.646 -3.459 513 HE2 MET 157 HE2 MET 157 7.896 8.776 -2.580 514 HE3 MET 157 HE3 MET 157 6.979 10.044 -1.768 515 H LYS 158 HN LYS 158 1.503 7.574 -6.087 516 HA LYS 158 HA LYS 158 1.744 4.860 -7.224 517 HB2 LYS 158 HB2 LYS 158 -0.334 6.740 -6.295 518 HB3 LYS 158 HB1 LYS 158 -0.813 5.770 -7.689 519 HG2 LYS 158 HG2 LYS 158 0.423 4.586 -5.190 520 HG3 LYS 158 HG1 LYS 158 -1.318 4.711 -5.444 521 HD2 LYS 158 HD2 LYS 158 -0.208 3.591 -7.811 522 HD3 LYS 158 HD1 LYS 158 0.486 2.717 -6.445 523 HE2 LYS 158 HE2 LYS 158 -2.275 3.088 -5.857 524 HE3 LYS 158 HE1 LYS 158 -2.167 2.484 -7.523 525 HZ1 LYS 158 HZ1 LYS 158 -1.128 1.277 -5.045 526 HZ2 LYS 158 HZ2 LYS 158 -0.357 0.952 -6.524 527 HZ3 LYS 158 HZ3 LYS 158 -1.993 0.546 -6.308 528 H GLY 159 HN GLY 159 2.863 7.519 -8.470 529 HA2 GLY 159 HA2 GLY 159 1.810 6.941 -11.202 530 HA3 GLY 159 HA1 GLY 159 1.952 8.611 -10.650 531 H VAL 160 HN VAL 160 4.377 6.551 -9.418 532 HA VAL 160 HA VAL 160 6.336 7.708 -11.366 533 HB VAL 160 HB VAL 160 7.919 7.491 -9.511 534 HG11 VAL 160 HG11 VAL 160 6.623 8.869 -7.770 535 HG12 VAL 160 HG12 VAL 160 5.232 8.704 -8.841 536 HG13 VAL 160 HG13 VAL 160 6.687 9.525 -9.406 537 HG21 VAL 160 HG21 VAL 160 7.605 5.880 -7.969 538 HG22 VAL 160 HG22 VAL 160 6.012 5.532 -8.641 539 HG23 VAL 160 HG23 VAL 160 6.188 6.745 -7.372 540 H GLU 161 HN GLU 161 5.545 5.745 -12.737 541 HA GLU 161 HA GLU 161 6.141 3.661 -13.687 542 HB2 GLU 161 HB2 GLU 161 8.403 4.740 -12.860 543 HB3 GLU 161 HB1 GLU 161 8.328 3.475 -11.632 544 HG2 GLU 161 HG2 GLU 161 8.861 1.855 -13.118 545 HG3 GLU 161 HG1 GLU 161 7.733 2.480 -14.322 546 HO1 KDH 1 H1 KDH 1 7.604 9.140 -10.952 547 H21 KDH 1 H21 KDH 1 12.452 7.709 -3.597 548 H33 KDH 1 H33 KDH 1 9.111 11.781 -6.384 549 H4 KDH 1 H4 KDH 1 8.185 10.427 -8.179 550 HO7 KDH 1 H7 KDH 1 11.318 8.992 -12.126 551 H01 KDH 1 H01 KDH 1 10.067 12.637 -4.174 552 H01A KDH 1 H02 KDH 1 8.927 11.235 -4.114 553 HO03 KDH 1 H03 KDH 1 11.484 12.792 -1.092 554 HO10 KDH 1 H10 KDH 1 13.305 8.022 -9.359 555 H12 KDH 1 H12 KDH 1 12.168 8.684 -7.455 556 H15 KDH 1 H15 KDH 1 9.096 9.494 -5.926 557 H26 KDH 1 H26 KDH 1 12.422 10.806 -0.489 558 H39 KDH 1 H39 KDH 1 10.010 12.009 -9.904 559 H41 KDH 1 H41 KDH 1 13.608 13.338 -7.755 560 HO02 KDH 1 H42 KDH 1 13.854 8.978 -0.534 561 HO44 KDH 1 H44 KDH 1 15.573 13.230 -10.583 562 HO47 KDH 1 H47 KDH 1 15.015 11.425 -11.732 563 HO50 KDH 1 H50 KDH 1 11.743 11.650 -12.919 Start of MODEL 4 1 H1 MET 90 HT1 MET 90 14.211 8.151 3.726 2 H2 MET 90 HT2 MET 90 12.633 8.623 3.307 3 H3 MET 90 HT3 MET 90 13.860 8.612 2.132 4 HA MET 90 HA MET 90 13.973 6.250 2.118 5 HB2 MET 90 HB2 MET 90 13.076 6.751 4.786 6 HB3 MET 90 HB1 MET 90 11.937 5.632 4.036 7 HG2 MET 90 HG2 MET 90 13.922 4.262 3.279 8 HG3 MET 90 HG1 MET 90 14.940 5.305 4.272 9 HE1 MET 90 HE1 MET 90 14.254 1.679 5.165 10 HE2 MET 90 HE2 MET 90 15.340 2.502 6.281 11 HE3 MET 90 HE3 MET 90 15.406 2.877 4.561 12 H GLY 91 HN GLY 91 10.776 7.389 3.283 13 HA2 GLY 91 HA2 GLY 91 8.687 7.394 2.216 14 HA3 GLY 91 HA1 GLY 91 9.579 7.660 0.718 15 H LYS 92 HN LYS 92 8.014 5.282 2.720 16 HA LYS 92 HA LYS 92 8.525 3.227 0.593 17 HB2 LYS 92 HB2 LYS 92 8.638 3.187 3.577 18 HB3 LYS 92 HB1 LYS 92 8.047 1.733 2.771 19 HG2 LYS 92 HG2 LYS 92 10.194 2.212 1.228 20 HG3 LYS 92 HG1 LYS 92 10.764 2.955 2.722 21 HD2 LYS 92 HD2 LYS 92 9.673 0.609 3.647 22 HD3 LYS 92 HD1 LYS 92 10.332 0.111 2.088 23 HE2 LYS 92 HE2 LYS 92 12.471 1.423 2.848 24 HE3 LYS 92 HE1 LYS 92 11.787 1.236 4.475 25 HZ1 LYS 92 HZ1 LYS 92 11.624 -1.108 4.169 26 HZ2 LYS 92 HZ2 LYS 92 13.210 -0.659 3.758 27 HZ3 LYS 92 HZ3 LYS 92 12.077 -0.996 2.539 28 H SER 93 HN SER 93 6.385 3.016 3.404 29 HA SER 93 HA SER 93 4.066 2.784 1.517 30 HB2 SER 93 HB2 SER 93 4.685 1.635 4.251 31 HB3 SER 93 HB1 SER 93 3.104 1.490 3.489 32 HG SER 93 HG SER 93 3.923 -0.128 2.445 33 H GLU 94 HN GLU 94 1.944 3.203 3.088 34 HA GLU 94 HA GLU 94 1.776 6.015 3.460 35 HB2 GLU 94 HB2 GLU 94 0.204 3.648 4.505 36 HB3 GLU 94 HB1 GLU 94 -0.317 5.316 4.753 37 HG2 GLU 94 HG2 GLU 94 -0.851 5.624 2.542 38 HG3 GLU 94 HG1 GLU 94 0.432 4.554 1.976 39 H GLU 95 HN GLU 95 3.170 3.594 5.478 40 HA GLU 95 HA GLU 95 2.771 4.778 8.065 41 HB2 GLU 95 HB2 GLU 95 3.831 2.483 7.039 42 HB3 GLU 95 HB1 GLU 95 5.303 3.349 7.482 43 HG2 GLU 95 HG2 GLU 95 2.960 2.726 9.304 44 HG3 GLU 95 HG1 GLU 95 4.573 2.016 9.385 45 H GLU 96 HN GLU 96 5.488 5.022 5.743 46 HA GLU 96 HA GLU 96 6.659 7.236 7.343 47 HB2 GLU 96 HB2 GLU 96 7.660 5.075 5.919 48 HB3 GLU 96 HB1 GLU 96 7.950 6.433 4.831 49 HG2 GLU 96 HG2 GLU 96 9.788 6.848 6.080 50 HG3 GLU 96 HG1 GLU 96 8.672 7.449 7.307 51 H LEU 97 HN LEU 97 5.030 6.613 4.286 52 HA LEU 97 HA LEU 97 5.597 8.808 2.702 53 HB2 LEU 97 HB2 LEU 97 3.312 7.044 3.253 54 HB3 LEU 97 HB1 LEU 97 2.839 8.599 2.566 55 HG LEU 97 HG LEU 97 3.261 7.047 0.745 56 HD11 LEU 97 HD11 LEU 97 4.675 8.412 -0.524 57 HD12 LEU 97 HD12 LEU 97 5.759 8.718 0.833 58 HD13 LEU 97 HD13 LEU 97 4.182 9.505 0.770 59 HD21 LEU 97 HD21 LEU 97 4.675 5.355 1.343 60 HD22 LEU 97 HD22 LEU 97 5.598 6.383 2.440 61 HD23 LEU 97 HD23 LEU 97 5.918 6.431 0.707 62 H SER 98 HN SER 98 3.338 8.760 5.474 63 HA SER 98 HA SER 98 2.470 11.470 5.291 64 HB2 SER 98 HB2 SER 98 1.840 9.316 6.769 65 HB3 SER 98 HB1 SER 98 2.852 10.150 7.943 66 HG SER 98 HG SER 98 1.386 12.027 7.009 67 H ASP 99 HN ASP 99 5.074 10.037 7.305 68 HA ASP 99 HA ASP 99 6.003 12.453 8.475 69 HB2 ASP 99 HB2 ASP 99 7.652 10.045 7.651 70 HB3 ASP 99 HB1 ASP 99 7.946 11.125 9.015 71 H LEU 100 HN LEU 100 6.206 11.372 5.213 72 HA LEU 100 HA LEU 100 8.617 12.952 4.566 73 HB2 LEU 100 HB2 LEU 100 7.345 10.699 3.564 74 HB3 LEU 100 HB1 LEU 100 6.937 11.942 2.380 75 HG LEU 100 HG LEU 100 9.744 12.027 3.247 76 HD11 LEU 100 HD11 LEU 100 9.521 9.620 3.337 77 HD12 LEU 100 HD12 LEU 100 10.343 10.028 1.831 78 HD13 LEU 100 HD13 LEU 100 8.633 9.599 1.814 79 HD21 LEU 100 HD21 LEU 100 9.294 11.570 0.438 80 HD22 LEU 100 HD22 LEU 100 9.845 13.043 1.236 81 HD23 LEU 100 HD23 LEU 100 8.119 12.744 1.030 82 H PHE 101 HN PHE 101 5.142 13.310 4.526 83 HA PHE 101 HA PHE 101 4.982 15.436 2.574 84 HB2 PHE 101 HB2 PHE 101 3.174 13.865 3.530 85 HB3 PHE 101 HB1 PHE 101 3.127 14.959 4.913 86 HD1 PHE 101 HD2 PHE 101 2.713 17.449 4.475 87 HD2 PHE 101 HD1 PHE 101 2.033 14.399 1.528 88 HE1 PHE 101 HE2 PHE 101 1.261 19.004 3.200 89 HE2 PHE 101 HE1 PHE 101 0.581 15.954 0.253 90 HZ PHE 101 HZ PHE 101 0.195 18.256 1.089 91 H ARG 102 HN ARG 102 5.588 15.354 6.065 92 HA ARG 102 HA ARG 102 5.167 18.137 6.609 93 HB2 ARG 102 HB2 ARG 102 6.254 17.623 8.669 94 HB3 ARG 102 HB1 ARG 102 5.466 16.122 8.183 95 HG2 ARG 102 HG2 ARG 102 7.720 15.572 7.013 96 HG3 ARG 102 HG1 ARG 102 8.389 16.843 8.035 97 HD2 ARG 102 HD2 ARG 102 6.695 15.056 9.592 98 HD3 ARG 102 HD1 ARG 102 8.001 14.170 8.784 99 HE ARG 102 HE ARG 102 9.586 15.408 10.046 100 HH11 ARG 102 HH21 ARG 102 6.398 16.726 10.288 101 HH12 ARG 102 HH22 ARG 102 6.817 17.833 11.549 102 HH21 ARG 102 HH11 ARG 102 10.134 16.847 11.690 103 HH22 ARG 102 HH12 ARG 102 8.925 17.902 12.342 104 H MET 103 HN MET 103 7.932 16.348 5.320 105 HA MET 103 HA MET 103 9.680 18.732 5.406 106 HB2 MET 103 HB2 MET 103 9.913 15.874 5.266 107 HB3 MET 103 HB1 MET 103 10.752 16.570 3.878 108 HG2 MET 103 HG2 MET 103 12.452 16.736 5.421 109 HG3 MET 103 HG1 MET 103 11.634 18.260 5.764 110 HE1 MET 103 HE1 MET 103 10.721 18.662 8.641 111 HE2 MET 103 HE2 MET 103 12.144 18.832 7.616 112 HE3 MET 103 HE3 MET 103 12.268 17.971 9.149 113 H PHE 104 HN PHE 104 7.904 16.769 3.039 114 HA PHE 104 HA PHE 104 8.905 17.844 0.626 115 HB2 PHE 104 HB2 PHE 104 6.749 16.241 1.578 116 HB3 PHE 104 HB1 PHE 104 6.059 17.454 0.500 117 HD1 PHE 104 HD2 PHE 104 8.603 14.759 0.763 118 HD2 PHE 104 HD1 PHE 104 6.463 17.406 -1.857 119 HE1 PHE 104 HE2 PHE 104 9.445 13.498 -1.199 120 HE2 PHE 104 HE1 PHE 104 7.306 16.144 -3.820 121 HZ PHE 104 HZ PHE 104 8.797 14.190 -3.490 122 H ASP 105 HN ASP 105 6.297 19.056 2.741 123 HA ASP 105 HA ASP 105 5.396 21.226 1.172 124 HB2 ASP 105 HB2 ASP 105 4.637 20.182 3.453 125 HB3 ASP 105 HB1 ASP 105 5.731 21.371 4.162 126 H LYS 106 HN LYS 106 7.006 22.480 0.177 127 HA LYS 106 HA LYS 106 9.472 23.301 1.342 128 HB2 LYS 106 HB2 LYS 106 8.819 23.339 -1.070 129 HB3 LYS 106 HB1 LYS 106 7.741 24.692 -0.727 130 HG2 LYS 106 HG2 LYS 106 9.649 25.828 -1.411 131 HG3 LYS 106 HG1 LYS 106 9.920 25.752 0.331 132 HD2 LYS 106 HD2 LYS 106 10.895 23.479 -1.356 133 HD3 LYS 106 HD1 LYS 106 11.811 24.986 -1.371 134 HE2 LYS 106 HE2 LYS 106 11.204 24.497 1.348 135 HE3 LYS 106 HE1 LYS 106 11.753 22.948 0.677 136 HZ1 LYS 106 HZ1 LYS 106 13.177 25.493 0.873 137 HZ2 LYS 106 HZ2 LYS 106 13.446 24.565 -0.525 138 HZ3 LYS 106 HZ3 LYS 106 13.771 23.910 1.009 139 H ASN 107 HN ASN 107 6.474 25.232 0.924 140 HA ASN 107 HA ASN 107 7.434 27.340 2.700 141 HB2 ASN 107 HB2 ASN 107 5.987 27.903 0.875 142 HB3 ASN 107 HB1 ASN 107 4.821 26.660 1.330 143 HD21 ASN 107 HD21 ASN 107 3.009 27.586 2.285 144 HD22 ASN 107 HD22 ASN 107 3.027 28.939 3.311 145 H ALA 108 HN ALA 108 5.738 24.347 3.097 146 HA ALA 108 HA ALA 108 4.937 23.287 5.053 147 HB1 ALA 108 HB1 ALA 108 6.510 23.705 6.615 148 HB2 ALA 108 HB2 ALA 108 5.690 25.213 7.018 149 HB3 ALA 108 HB3 ALA 108 6.950 25.197 5.784 150 H ASP 109 HN ASP 109 2.765 23.976 4.150 151 HA ASP 109 HA ASP 109 1.386 25.760 6.105 152 HB2 ASP 109 HB2 ASP 109 0.324 26.966 4.269 153 HB3 ASP 109 HB1 ASP 109 2.073 27.020 4.040 154 H GLY 110 HN GLY 110 1.552 22.765 4.888 155 HA2 GLY 110 HA2 GLY 110 -0.075 21.042 5.254 156 HA3 GLY 110 HA1 GLY 110 -1.332 22.277 5.334 157 H TYR 111 HN TYR 111 0.656 22.927 2.719 158 HA TYR 111 HA TYR 111 -0.710 21.128 0.811 159 HB2 TYR 111 HB2 TYR 111 -1.082 24.142 0.827 160 HB3 TYR 111 HB1 TYR 111 -1.750 23.030 -0.369 161 HD1 TYR 111 HD1 TYR 111 -3.380 21.240 0.388 162 HD2 TYR 111 HD2 TYR 111 -2.156 24.489 2.918 163 HE1 TYR 111 HE1 TYR 111 -5.331 20.826 1.863 164 HE2 TYR 111 HE2 TYR 111 -4.107 24.075 4.392 165 HH TYR 111 HH TYR 111 -6.307 23.043 4.282 166 H ILE 112 HN ILE 112 0.520 20.905 -1.073 167 HA ILE 112 HA ILE 112 3.059 22.482 -1.175 168 HB ILE 112 HB ILE 112 2.175 19.798 -2.274 169 HG12 ILE 112 HG12 ILE 112 4.223 20.638 -0.196 170 HG13 ILE 112 HG11 ILE 112 2.694 19.817 0.120 171 HG21 ILE 112 HG21 ILE 112 4.964 20.096 -2.536 172 HG22 ILE 112 HG22 ILE 112 4.268 21.583 -3.179 173 HG23 ILE 112 HG23 ILE 112 3.778 20.022 -3.840 174 HD11 ILE 112 HD11 ILE 112 3.926 17.913 -0.010 175 HD12 ILE 112 HD12 ILE 112 5.247 18.717 -0.859 176 HD13 ILE 112 HD13 ILE 112 3.830 18.164 -1.753 177 H ASP 113 HN ASP 113 3.473 23.777 -2.945 178 HA ASP 113 HA ASP 113 1.386 23.872 -5.087 179 HB2 ASP 113 HB2 ASP 113 2.468 25.793 -3.426 180 HB3 ASP 113 HB1 ASP 113 3.406 26.008 -4.904 181 H LEU 114 HN LEU 114 2.479 24.746 -7.249 182 HA LEU 114 HA LEU 114 4.150 22.730 -8.323 183 HB2 LEU 114 HB2 LEU 114 3.802 25.638 -9.128 184 HB3 LEU 114 HB1 LEU 114 4.409 24.356 -10.177 185 HG LEU 114 HG LEU 114 1.934 23.518 -8.964 186 HD11 LEU 114 HD11 LEU 114 0.413 25.172 -9.692 187 HD12 LEU 114 HD12 LEU 114 1.626 25.972 -10.692 188 HD13 LEU 114 HD13 LEU 114 1.707 26.099 -8.934 189 HD21 LEU 114 HD21 LEU 114 2.536 24.239 -11.846 190 HD22 LEU 114 HD22 LEU 114 1.335 23.088 -11.262 191 HD23 LEU 114 HD23 LEU 114 3.054 22.728 -11.097 192 H ASP 115 HN ASP 115 5.141 26.106 -7.611 193 HA ASP 115 HA ASP 115 7.908 25.825 -7.936 194 HB2 ASP 115 HB2 ASP 115 6.112 27.737 -7.087 195 HB3 ASP 115 HB1 ASP 115 7.062 27.451 -5.629 196 H GLU 116 HN GLU 116 6.101 25.484 -4.860 197 HA GLU 116 HA GLU 116 8.128 24.794 -3.101 198 HB2 GLU 116 HB2 GLU 116 5.455 23.379 -3.343 199 HB3 GLU 116 HB1 GLU 116 6.385 23.643 -1.868 200 HG2 GLU 116 HG2 GLU 116 6.186 26.186 -2.588 201 HG3 GLU 116 HG1 GLU 116 4.773 25.597 -3.464 202 H LEU 117 HN LEU 117 6.481 22.574 -5.373 203 HA LEU 117 HA LEU 117 7.892 20.199 -4.614 204 HB2 LEU 117 HB2 LEU 117 6.581 21.131 -7.187 205 HB3 LEU 117 HB1 LEU 117 7.120 19.474 -6.914 206 HG LEU 117 HG LEU 117 5.318 20.791 -4.906 207 HD11 LEU 117 HD11 LEU 117 4.662 20.273 -7.680 208 HD12 LEU 117 HD12 LEU 117 3.661 20.993 -6.420 209 HD13 LEU 117 HD13 LEU 117 3.705 19.241 -6.617 210 HD21 LEU 117 HD21 LEU 117 5.576 17.936 -5.902 211 HD22 LEU 117 HD22 LEU 117 4.650 18.479 -4.502 212 HD23 LEU 117 HD23 LEU 117 6.412 18.575 -4.486 213 H LYS 118 HN LYS 118 8.897 22.992 -6.377 214 HA LYS 118 HA LYS 118 11.091 21.574 -7.777 215 HB2 LYS 118 HB2 LYS 118 9.877 23.261 -8.993 216 HB3 LYS 118 HB1 LYS 118 10.063 24.422 -7.679 217 HG2 LYS 118 HG2 LYS 118 12.605 24.140 -8.043 218 HG3 LYS 118 HG1 LYS 118 12.169 23.393 -9.580 219 HD2 LYS 118 HD2 LYS 118 11.952 25.446 -10.472 220 HD3 LYS 118 HD1 LYS 118 10.612 25.750 -9.365 221 HE2 LYS 118 HE2 LYS 118 12.839 26.081 -7.739 222 HE3 LYS 118 HE1 LYS 118 13.347 26.798 -9.281 223 HZ1 LYS 118 HZ1 LYS 118 10.913 27.413 -7.704 224 HZ2 LYS 118 HZ2 LYS 118 11.088 27.873 -9.330 225 HZ3 LYS 118 HZ3 LYS 118 12.155 28.477 -8.154 226 H ILE 119 HN ILE 119 10.946 24.521 -5.735 227 HA ILE 119 HA ILE 119 13.698 24.631 -5.099 228 HB ILE 119 HB ILE 119 11.355 25.435 -3.351 229 HG12 ILE 119 HG12 ILE 119 12.275 27.587 -4.963 230 HG13 ILE 119 HG11 ILE 119 12.017 26.216 -6.042 231 HG21 ILE 119 HG21 ILE 119 14.076 26.712 -3.754 232 HG22 ILE 119 HG22 ILE 119 13.677 25.642 -2.410 233 HG23 ILE 119 HG23 ILE 119 12.847 27.189 -2.582 234 HD11 ILE 119 HD11 ILE 119 10.046 27.701 -4.359 235 HD12 ILE 119 HD12 ILE 119 9.784 25.974 -4.602 236 HD13 ILE 119 HD13 ILE 119 9.867 27.056 -5.991 237 H MET 120 HN MET 120 11.158 22.615 -3.731 238 HA MET 120 HA MET 120 12.376 21.924 -1.248 239 HB2 MET 120 HB2 MET 120 10.037 21.439 -2.074 240 HB3 MET 120 HB1 MET 120 10.722 20.165 -3.084 241 HG2 MET 120 HG2 MET 120 11.434 20.182 -0.181 242 HG3 MET 120 HG1 MET 120 9.818 19.640 -0.633 243 HE1 MET 120 HE1 MET 120 9.222 17.482 -1.295 244 HE2 MET 120 HE2 MET 120 10.130 16.424 -2.372 245 HE3 MET 120 HE3 MET 120 9.615 18.011 -2.937 246 H LEU 121 HN LEU 121 12.537 20.208 -4.396 247 HA LEU 121 HA LEU 121 14.537 18.318 -3.457 248 HB2 LEU 121 HB2 LEU 121 12.826 18.782 -5.706 249 HB3 LEU 121 HB1 LEU 121 14.471 18.564 -6.305 250 HG LEU 121 HG LEU 121 13.373 16.388 -6.152 251 HD11 LEU 121 HD11 LEU 121 15.818 17.059 -5.016 252 HD12 LEU 121 HD12 LEU 121 15.269 15.424 -5.385 253 HD13 LEU 121 HD13 LEU 121 15.040 16.087 -3.767 254 HD21 LEU 121 HD21 LEU 121 12.459 15.546 -4.088 255 HD22 LEU 121 HD22 LEU 121 11.760 17.145 -4.344 256 HD23 LEU 121 HD23 LEU 121 13.072 16.931 -3.186 257 H GLN 122 HN GLN 122 14.629 21.525 -4.807 258 HA GLN 122 HA GLN 122 17.025 21.748 -6.158 259 HB2 GLN 122 HB2 GLN 122 15.357 23.533 -5.469 260 HB3 GLN 122 HB1 GLN 122 16.155 23.569 -3.896 261 HG2 GLN 122 HG2 GLN 122 18.336 23.978 -5.161 262 HG3 GLN 122 HG1 GLN 122 17.341 24.264 -6.590 263 HE21 GLN 122 HE21 GLN 122 18.522 25.693 -3.660 264 HE22 GLN 122 HE22 GLN 122 17.658 27.150 -3.773 265 H ALA 123 HN ALA 123 16.604 21.048 -2.736 266 HA ALA 123 HA ALA 123 19.157 21.666 -1.708 267 HB1 ALA 123 HB1 ALA 123 16.944 19.755 -1.145 268 HB2 ALA 123 HB2 ALA 123 17.674 20.966 -0.091 269 HB3 ALA 123 HB3 ALA 123 18.486 19.423 -0.357 270 H THR 124 HN THR 124 18.265 19.252 -4.029 271 HA THR 124 HA THR 124 20.823 17.768 -3.608 272 HB THR 124 HB THR 124 18.474 16.706 -3.742 273 HG1 THR 124 HG1 THR 124 20.565 15.915 -5.480 274 HG21 THR 124 HG21 THR 124 18.870 16.963 -6.715 275 HG22 THR 124 HG22 THR 124 17.969 18.189 -5.823 276 HG23 THR 124 HG23 THR 124 17.413 16.515 -5.828 277 H GLY 125 HN GLY 125 19.454 20.197 -5.568 278 HA2 GLY 125 HA2 GLY 125 20.775 21.394 -7.211 279 HA3 GLY 125 HA1 GLY 125 21.711 19.924 -7.486 280 H GLU 126 HN GLU 126 18.200 19.945 -7.319 281 HA GLU 126 HA GLU 126 17.907 18.537 -9.801 282 HB2 GLU 126 HB2 GLU 126 15.502 19.025 -9.401 283 HB3 GLU 126 HB1 GLU 126 16.306 18.480 -7.928 284 HG2 GLU 126 HG2 GLU 126 15.766 20.398 -6.889 285 HG3 GLU 126 HG1 GLU 126 16.588 21.331 -8.140 286 H THR 127 HN THR 127 18.940 19.743 -11.486 287 HA THR 127 HA THR 127 17.923 22.494 -12.023 288 HB THR 127 HB THR 127 19.823 22.047 -13.883 289 HG1 THR 127 HG1 THR 127 21.158 20.483 -13.329 290 HG21 THR 127 HG21 THR 127 21.035 22.414 -11.231 291 HG22 THR 127 HG22 THR 127 19.635 23.448 -11.521 292 HG23 THR 127 HG23 THR 127 21.014 23.502 -12.619 293 H ILE 128 HN ILE 128 15.851 21.989 -12.898 294 HA ILE 128 HA ILE 128 15.937 20.650 -15.573 295 HB ILE 128 HB ILE 128 13.970 19.386 -14.948 296 HG12 ILE 128 HG12 ILE 128 14.063 20.764 -12.253 297 HG13 ILE 128 HG11 ILE 128 13.013 21.304 -13.564 298 HG21 ILE 128 HG21 ILE 128 16.442 19.005 -13.836 299 HG22 ILE 128 HG22 ILE 128 15.096 17.876 -13.675 300 HG23 ILE 128 HG23 ILE 128 15.418 19.052 -12.401 301 HD11 ILE 128 HD11 ILE 128 12.297 19.434 -11.702 302 HD12 ILE 128 HD12 ILE 128 12.896 18.406 -13.005 303 HD13 ILE 128 HD13 ILE 128 11.587 19.548 -13.312 304 H THR 129 HN THR 129 14.257 21.408 -17.028 305 HA THR 129 HA THR 129 13.606 24.206 -16.770 306 HB THR 129 HB THR 129 13.990 22.920 -18.882 307 HG1 THR 129 HG1 THR 129 11.866 23.728 -19.832 308 HG21 THR 129 HG21 THR 129 12.873 21.006 -19.244 309 HG22 THR 129 HG22 THR 129 11.342 21.881 -19.215 310 HG23 THR 129 HG23 THR 129 12.015 21.230 -17.720 311 H GLU 130 HN GLU 130 11.141 24.797 -17.254 312 HA GLU 130 HA GLU 130 9.618 24.157 -14.904 313 HB2 GLU 130 HB2 GLU 130 9.312 26.248 -16.032 314 HB3 GLU 130 HB1 GLU 130 9.019 25.449 -17.576 315 HG2 GLU 130 HG2 GLU 130 6.978 24.373 -16.480 316 HG3 GLU 130 HG1 GLU 130 7.214 25.507 -15.151 317 H ASP 131 HN ASP 131 9.214 23.164 -18.326 318 HA ASP 131 HA ASP 131 6.935 21.582 -18.176 319 HB2 ASP 131 HB2 ASP 131 8.323 22.078 -20.183 320 HB3 ASP 131 HB1 ASP 131 9.542 20.946 -19.596 321 H ASP 132 HN ASP 132 10.220 20.734 -17.116 322 HA ASP 132 HA ASP 132 9.673 17.969 -16.516 323 HB2 ASP 132 HB2 ASP 132 11.729 20.018 -15.670 324 HB3 ASP 132 HB1 ASP 132 11.785 18.356 -15.083 325 H ILE 133 HN ILE 133 8.837 20.913 -14.916 326 HA ILE 133 HA ILE 133 8.662 19.799 -12.215 327 HB ILE 133 HB ILE 133 7.478 22.306 -13.452 328 HG12 ILE 133 HG12 ILE 133 9.954 22.071 -13.775 329 HG13 ILE 133 HG11 ILE 133 9.520 23.425 -12.732 330 HG21 ILE 133 HG21 ILE 133 7.265 21.157 -10.855 331 HG22 ILE 133 HG22 ILE 133 6.690 22.736 -11.391 332 HG23 ILE 133 HG23 ILE 133 8.314 22.568 -10.722 333 HD11 ILE 133 HD11 ILE 133 9.786 21.057 -11.126 334 HD12 ILE 133 HD12 ILE 133 10.720 22.550 -11.044 335 HD13 ILE 133 HD13 ILE 133 11.233 21.247 -12.116 336 H GLU 134 HN GLU 134 6.254 20.835 -14.666 337 HA GLU 134 HA GLU 134 3.902 20.109 -13.304 338 HB2 GLU 134 HB2 GLU 134 4.595 19.887 -16.253 339 HB3 GLU 134 HB1 GLU 134 2.961 19.971 -15.594 340 HG2 GLU 134 HG2 GLU 134 4.073 22.148 -14.406 341 HG3 GLU 134 HG1 GLU 134 4.975 22.119 -15.921 342 H GLU 135 HN GLU 135 6.160 18.064 -15.125 343 HA GLU 135 HA GLU 135 4.751 15.702 -15.488 344 HB2 GLU 135 HB2 GLU 135 7.551 15.970 -14.345 345 HB3 GLU 135 HB1 GLU 135 6.934 14.624 -15.305 346 HG2 GLU 135 HG2 GLU 135 6.413 16.457 -17.090 347 HG3 GLU 135 HG1 GLU 135 7.572 17.430 -16.183 348 H LEU 136 HN LEU 136 6.364 16.730 -12.459 349 HA LEU 136 HA LEU 136 5.404 14.412 -10.966 350 HB2 LEU 136 HB2 LEU 136 6.680 17.059 -10.205 351 HB3 LEU 136 HB1 LEU 136 6.407 15.736 -9.071 352 HG LEU 136 HG LEU 136 7.739 14.881 -11.541 353 HD11 LEU 136 HD11 LEU 136 8.822 17.137 -9.910 354 HD12 LEU 136 HD12 LEU 136 9.020 16.800 -11.629 355 HD13 LEU 136 HD13 LEU 136 9.952 15.891 -10.439 356 HD21 LEU 136 HD21 LEU 136 8.508 14.680 -8.612 357 HD22 LEU 136 HD22 LEU 136 9.150 13.703 -9.932 358 HD23 LEU 136 HD23 LEU 136 7.462 13.535 -9.451 359 H MET 137 HN MET 137 4.487 17.853 -11.193 360 HA MET 137 HA MET 137 2.477 17.801 -9.144 361 HB2 MET 137 HB2 MET 137 3.660 19.597 -10.976 362 HB3 MET 137 HB1 MET 137 1.927 19.651 -11.301 363 HG2 MET 137 HG2 MET 137 2.468 19.603 -8.442 364 HG3 MET 137 HG1 MET 137 3.264 20.968 -9.225 365 HE1 MET 137 HE1 MET 137 0.114 20.763 -7.178 366 HE2 MET 137 HE2 MET 137 0.244 22.477 -7.564 367 HE3 MET 137 HE3 MET 137 1.699 21.548 -7.215 368 H LYS 138 HN LYS 138 2.519 16.521 -12.358 369 HA LYS 138 HA LYS 138 -0.240 16.711 -13.067 370 HB2 LYS 138 HB2 LYS 138 2.175 15.211 -13.818 371 HB3 LYS 138 HB1 LYS 138 0.680 14.322 -14.114 372 HG2 LYS 138 HG2 LYS 138 0.016 16.824 -15.019 373 HG3 LYS 138 HG1 LYS 138 1.724 16.734 -15.450 374 HD2 LYS 138 HD2 LYS 138 1.286 14.522 -16.534 375 HD3 LYS 138 HD1 LYS 138 -0.433 14.740 -16.202 376 HE2 LYS 138 HE2 LYS 138 1.120 16.862 -17.690 377 HE3 LYS 138 HE1 LYS 138 0.422 15.471 -18.543 378 HZ1 LYS 138 HZ1 LYS 138 -1.007 17.607 -18.090 379 HZ2 LYS 138 HZ2 LYS 138 -1.230 16.878 -16.571 380 HZ3 LYS 138 HZ3 LYS 138 -1.698 16.061 -17.987 381 H ASP 139 HN ASP 139 1.532 14.265 -11.163 382 HA ASP 139 HA ASP 139 -0.899 12.664 -10.735 383 HB2 ASP 139 HB2 ASP 139 2.010 12.575 -10.008 384 HB3 ASP 139 HB1 ASP 139 0.882 11.574 -9.093 385 H GLY 140 HN GLY 140 1.206 14.808 -8.800 386 HA2 GLY 140 HA2 GLY 140 -0.290 14.487 -6.357 387 HA3 GLY 140 HA1 GLY 140 0.839 15.800 -6.699 388 H ASP 141 HN ASP 141 -0.853 16.252 -9.257 389 HA ASP 141 HA ASP 141 -3.204 17.581 -7.964 390 HB2 ASP 141 HB2 ASP 141 -0.824 18.720 -9.234 391 HB3 ASP 141 HB1 ASP 141 -2.320 19.311 -9.960 392 H LYS 142 HN LYS 142 -3.224 15.137 -9.477 393 HA LYS 142 HA LYS 142 -3.664 15.258 -12.229 394 HB2 LYS 142 HB2 LYS 142 -4.566 13.657 -9.923 395 HB3 LYS 142 HB1 LYS 142 -5.643 13.571 -11.317 396 HG2 LYS 142 HG2 LYS 142 -3.130 13.374 -12.465 397 HG3 LYS 142 HG1 LYS 142 -2.955 12.456 -10.970 398 HD2 LYS 142 HD2 LYS 142 -3.808 10.796 -12.333 399 HD3 LYS 142 HD1 LYS 142 -5.317 11.474 -11.719 400 HE2 LYS 142 HE2 LYS 142 -5.490 12.918 -13.725 401 HE3 LYS 142 HE1 LYS 142 -3.987 12.212 -14.352 402 HZ1 LYS 142 HZ1 LYS 142 -5.485 10.772 -15.259 403 HZ2 LYS 142 HZ2 LYS 142 -6.619 10.972 -14.010 404 HZ3 LYS 142 HZ3 LYS 142 -5.248 9.999 -13.768 405 H ASN 143 HN ASN 143 -5.793 16.360 -9.625 406 HA ASN 143 HA ASN 143 -8.101 16.842 -11.321 407 HB2 ASN 143 HB2 ASN 143 -7.331 18.042 -8.642 408 HB3 ASN 143 HB1 ASN 143 -8.960 17.896 -9.301 409 HD21 ASN 143 HD21 ASN 143 -6.817 16.400 -7.188 410 HD22 ASN 143 HD22 ASN 143 -7.479 14.837 -7.204 411 H ASN 144 HN ASN 144 -5.135 18.507 -10.787 412 HA ASN 144 HA ASN 144 -4.339 20.538 -11.710 413 HB2 ASN 144 HB2 ASN 144 -6.176 19.523 -13.452 414 HB3 ASN 144 HB1 ASN 144 -6.917 21.078 -13.071 415 HD21 ASN 144 HD21 ASN 144 -3.576 19.862 -13.761 416 HD22 ASN 144 HD22 ASN 144 -3.172 21.146 -14.794 417 H ASP 145 HN ASP 145 -5.713 20.506 -9.134 418 HA ASP 145 HA ASP 145 -7.374 22.965 -9.122 419 HB2 ASP 145 HB2 ASP 145 -7.747 22.297 -6.775 420 HB3 ASP 145 HB1 ASP 145 -8.012 20.928 -7.855 421 H GLY 146 HN GLY 146 -4.115 22.277 -9.047 422 HA2 GLY 146 HA2 GLY 146 -2.291 23.693 -8.574 423 HA3 GLY 146 HA1 GLY 146 -3.442 24.926 -8.057 424 H ARG 147 HN ARG 147 -4.167 22.063 -6.484 425 HA ARG 147 HA ARG 147 -2.414 22.766 -4.154 426 HB2 ARG 147 HB2 ARG 147 -5.365 22.051 -4.190 427 HB3 ARG 147 HB1 ARG 147 -4.414 22.373 -2.740 428 HG2 ARG 147 HG2 ARG 147 -4.098 24.501 -4.695 429 HG3 ARG 147 HG1 ARG 147 -5.795 24.266 -4.274 430 HD2 ARG 147 HD2 ARG 147 -5.246 24.443 -1.877 431 HD3 ARG 147 HD1 ARG 147 -3.531 24.654 -2.282 432 HE ARG 147 HE ARG 147 -5.293 26.519 -3.684 433 HH11 ARG 147 HH21 ARG 147 -3.456 25.841 -0.838 434 HH12 ARG 147 HH22 ARG 147 -3.264 27.508 -0.410 435 HH21 ARG 147 HH11 ARG 147 -5.051 28.694 -3.132 436 HH22 ARG 147 HH12 ARG 147 -4.164 29.120 -1.706 437 H ILE 148 HN ILE 148 -1.380 20.994 -3.302 438 HA ILE 148 HA ILE 148 -2.273 18.287 -4.227 439 HB ILE 148 HB ILE 148 0.422 19.272 -3.236 440 HG12 ILE 148 HG12 ILE 148 -0.413 18.646 -6.079 441 HG13 ILE 148 HG11 ILE 148 -0.447 20.279 -5.415 442 HG21 ILE 148 HG21 ILE 148 -0.337 16.744 -3.157 443 HG22 ILE 148 HG22 ILE 148 1.265 17.167 -3.762 444 HG23 ILE 148 HG23 ILE 148 -0.041 16.815 -4.894 445 HD11 ILE 148 HD11 ILE 148 1.847 20.445 -5.336 446 HD12 ILE 148 HD12 ILE 148 1.713 19.302 -6.673 447 HD13 ILE 148 HD13 ILE 148 2.067 18.719 -5.046 448 H ASP 149 HN ASP 149 -3.717 17.791 -2.505 449 HA ASP 149 HA ASP 149 -2.964 18.189 0.293 450 HB2 ASP 149 HB2 ASP 149 -5.111 16.966 0.645 451 HB3 ASP 149 HB1 ASP 149 -5.283 18.292 -0.506 452 H TYR 150 HN TYR 150 -2.792 16.323 1.816 453 HA TYR 150 HA TYR 150 -0.797 14.452 1.148 454 HB2 TYR 150 HB2 TYR 150 -1.336 14.945 3.429 455 HB3 TYR 150 HB1 TYR 150 -3.021 14.477 3.202 456 HD1 TYR 150 HD2 TYR 150 0.468 13.154 3.202 457 HD2 TYR 150 HD1 TYR 150 -3.717 12.231 3.493 458 HE1 TYR 150 HE2 TYR 150 1.027 10.823 3.838 459 HE2 TYR 150 HE1 TYR 150 -3.158 9.899 4.128 460 HH TYR 150 HH TYR 150 -0.051 8.593 3.765 461 H ASP 151 HN ASP 151 -4.331 14.151 0.912 462 HA ASP 151 HA ASP 151 -4.604 11.400 0.409 463 HB2 ASP 151 HB2 ASP 151 -6.310 13.352 0.597 464 HB3 ASP 151 HB1 ASP 151 -6.070 13.536 -1.141 465 H GLU 152 HN GLU 152 -3.662 13.999 -1.841 466 HA GLU 152 HA GLU 152 -3.453 12.128 -4.108 467 HB2 GLU 152 HB2 GLU 152 -2.672 15.041 -3.758 468 HB3 GLU 152 HB1 GLU 152 -2.801 14.189 -5.297 469 HG2 GLU 152 HG2 GLU 152 -5.131 14.039 -5.172 470 HG3 GLU 152 HG1 GLU 152 -5.146 14.234 -3.419 471 H PHE 153 HN PHE 153 -1.397 13.394 -1.610 472 HA PHE 153 HA PHE 153 1.152 13.238 -2.889 473 HB2 PHE 153 HB2 PHE 153 0.392 14.207 -0.609 474 HB3 PHE 153 HB1 PHE 153 0.585 12.563 0.001 475 HD1 PHE 153 HD1 PHE 153 2.435 15.106 -2.053 476 HD2 PHE 153 HD2 PHE 153 2.671 11.907 0.805 477 HE1 PHE 153 HE1 PHE 153 4.883 15.458 -1.860 478 HE2 PHE 153 HE2 PHE 153 5.118 12.259 0.997 479 HZ PHE 153 HZ PHE 153 6.223 14.034 -0.335 480 H LEU 154 HN LEU 154 -0.996 10.762 -1.654 481 HA LEU 154 HA LEU 154 0.960 8.652 -1.373 482 HB2 LEU 154 HB2 LEU 154 -1.993 9.001 -1.466 483 HB3 LEU 154 HB1 LEU 154 -1.392 7.384 -1.836 484 HG LEU 154 HG LEU 154 -1.850 7.708 0.599 485 HD11 LEU 154 HD11 LEU 154 0.180 6.670 1.346 486 HD12 LEU 154 HD12 LEU 154 1.115 7.422 0.053 487 HD13 LEU 154 HD13 LEU 154 -0.055 6.158 -0.325 488 HD21 LEU 154 HD21 LEU 154 -1.345 10.004 0.959 489 HD22 LEU 154 HD22 LEU 154 0.242 9.855 0.205 490 HD23 LEU 154 HD23 LEU 154 -0.054 9.132 1.786 491 H GLU 155 HN GLU 155 -1.593 9.022 -3.868 492 HA GLU 155 HA GLU 155 -0.485 7.158 -5.713 493 HB2 GLU 155 HB2 GLU 155 -2.044 8.220 -7.270 494 HB3 GLU 155 HB1 GLU 155 -2.799 8.137 -5.678 495 HG2 GLU 155 HG2 GLU 155 -2.358 10.447 -5.243 496 HG3 GLU 155 HG1 GLU 155 -1.275 10.570 -6.630 497 H PHE 156 HN PHE 156 0.432 10.403 -4.908 498 HA PHE 156 HA PHE 156 1.760 11.117 -7.374 499 HB2 PHE 156 HB2 PHE 156 1.102 12.808 -5.805 500 HB3 PHE 156 HB1 PHE 156 1.942 11.998 -4.483 501 HD1 PHE 156 HD2 PHE 156 4.436 11.942 -4.425 502 HD2 PHE 156 HD1 PHE 156 2.275 14.224 -7.353 503 HE1 PHE 156 HE2 PHE 156 6.494 13.223 -4.946 504 HE2 PHE 156 HE1 PHE 156 4.332 15.506 -7.872 505 HZ PHE 156 HZ PHE 156 6.442 15.006 -6.669 506 H MET 157 HN MET 157 3.129 10.136 -4.200 507 HA MET 157 HA MET 157 5.807 9.802 -5.053 508 HB2 MET 157 HB2 MET 157 4.157 8.370 -2.945 509 HB3 MET 157 HB1 MET 157 5.919 8.330 -3.022 510 HG2 MET 157 HG2 MET 157 4.222 10.827 -2.724 511 HG3 MET 157 HG1 MET 157 5.154 10.059 -1.438 512 HE1 MET 157 HE1 MET 157 7.317 9.368 -1.617 513 HE2 MET 157 HE2 MET 157 8.548 10.620 -1.772 514 HE3 MET 157 HE3 MET 157 8.286 9.484 -3.093 515 H LYS 158 HN LYS 158 3.023 7.656 -5.363 516 HA LYS 158 HA LYS 158 4.702 5.425 -6.355 517 HB2 LYS 158 HB2 LYS 158 2.077 5.853 -5.193 518 HB3 LYS 158 HB1 LYS 158 1.950 4.886 -6.662 519 HG2 LYS 158 HG2 LYS 158 3.951 3.542 -5.677 520 HG3 LYS 158 HG1 LYS 158 3.497 4.292 -4.147 521 HD2 LYS 158 HD2 LYS 158 1.252 3.143 -5.696 522 HD3 LYS 158 HD1 LYS 158 2.410 1.969 -5.068 523 HE2 LYS 158 HE2 LYS 158 1.615 4.085 -3.147 524 HE3 LYS 158 HE1 LYS 158 0.337 2.935 -3.590 525 HZ1 LYS 158 HZ1 LYS 158 1.980 1.133 -3.225 526 HZ2 LYS 158 HZ2 LYS 158 1.594 1.987 -1.808 527 HZ3 LYS 158 HZ3 LYS 158 3.064 2.283 -2.608 528 H GLY 159 HN GLY 159 4.655 7.901 -7.922 529 HA2 GLY 159 HA2 GLY 159 4.267 6.850 -10.534 530 HA3 GLY 159 HA1 GLY 159 2.834 7.788 -10.110 531 H VAL 160 HN VAL 160 6.266 8.350 -9.307 532 HA VAL 160 HA VAL 160 6.002 11.041 -10.609 533 HB VAL 160 HB VAL 160 7.897 11.543 -8.899 534 HG11 VAL 160 HG11 VAL 160 5.850 11.225 -7.047 535 HG12 VAL 160 HG12 VAL 160 4.998 11.316 -8.588 536 HG13 VAL 160 HG13 VAL 160 6.080 12.621 -8.100 537 HG21 VAL 160 HG21 VAL 160 6.700 9.123 -7.534 538 HG22 VAL 160 HG22 VAL 160 8.101 10.069 -7.034 539 HG23 VAL 160 HG23 VAL 160 8.200 9.032 -8.458 540 H GLU 161 HN GLU 161 7.056 8.259 -11.588 541 HA GLU 161 HA GLU 161 9.873 9.002 -12.213 542 HB2 GLU 161 HB2 GLU 161 9.221 6.746 -11.314 543 HB3 GLU 161 HB1 GLU 161 8.294 6.475 -12.791 544 HG2 GLU 161 HG2 GLU 161 10.622 7.194 -13.911 545 HG3 GLU 161 HG1 GLU 161 11.249 6.549 -12.394 546 HO1 KDH 1 H1 KDH 1 9.673 8.647 -9.790 547 H21 KDH 1 H21 KDH 1 12.349 8.816 -1.353 548 H33 KDH 1 H33 KDH 1 10.663 12.300 -5.865 549 H4 KDH 1 H4 KDH 1 9.896 10.566 -7.422 550 HO7 KDH 1 H7 KDH 1 13.108 6.793 -9.489 551 H01 KDH 1 H01 KDH 1 11.345 13.653 -3.789 552 H01A KDH 1 H02 KDH 1 9.941 12.520 -3.666 553 HO03 KDH 1 H03 KDH 1 12.172 14.482 -2.230 554 HO10 KDH 1 H10 KDH 1 14.666 7.457 -8.229 555 H12 KDH 1 H12 KDH 1 13.282 8.707 -5.300 556 H15 KDH 1 H15 KDH 1 10.148 10.267 -4.862 557 H26 KDH 1 H26 KDH 1 12.323 12.666 0.753 558 H39 KDH 1 H39 KDH 1 10.510 13.665 -6.793 559 H41 KDH 1 H41 KDH 1 14.666 14.091 -8.174 560 HO02 KDH 1 H42 KDH 1 13.735 10.112 1.125 561 HO44 KDH 1 H44 KDH 1 15.063 15.962 -9.493 562 HO47 KDH 1 H47 KDH 1 11.658 17.522 -9.929 563 HO50 KDH 1 H50 KDH 1 9.146 15.474 -7.167 Start of MODEL 5 1 H1 MET 90 HT1 MET 90 13.889 8.930 4.060 2 H2 MET 90 HT2 MET 90 13.501 10.217 3.021 3 H3 MET 90 HT3 MET 90 14.951 9.358 2.808 4 HA MET 90 HA MET 90 13.367 8.648 1.142 5 HB2 MET 90 HB2 MET 90 14.174 6.863 3.430 6 HB3 MET 90 HB1 MET 90 13.301 6.190 2.053 7 HG2 MET 90 HG2 MET 90 15.215 7.713 0.806 8 HG3 MET 90 HG1 MET 90 16.086 7.139 2.228 9 HE1 MET 90 HE1 MET 90 14.100 6.664 -0.674 10 HE2 MET 90 HE2 MET 90 13.398 5.066 -0.434 11 HE3 MET 90 HE3 MET 90 14.783 5.260 -1.505 12 H GLY 91 HN GLY 91 11.283 7.551 0.738 13 HA2 GLY 91 HA2 GLY 91 9.333 7.840 2.985 14 HA3 GLY 91 HA1 GLY 91 8.951 8.450 1.375 15 H LYS 92 HN LYS 92 7.311 6.541 2.569 16 HA LYS 92 HA LYS 92 7.502 4.357 0.602 17 HB2 LYS 92 HB2 LYS 92 8.482 4.172 3.332 18 HB3 LYS 92 HB1 LYS 92 7.189 3.006 3.051 19 HG2 LYS 92 HG2 LYS 92 8.353 2.167 1.057 20 HG3 LYS 92 HG1 LYS 92 9.636 3.353 1.295 21 HD2 LYS 92 HD2 LYS 92 10.332 2.328 3.342 22 HD3 LYS 92 HD1 LYS 92 8.888 1.317 3.403 23 HE2 LYS 92 HE2 LYS 92 9.645 -0.092 1.674 24 HE3 LYS 92 HE1 LYS 92 10.792 1.119 1.067 25 HZ1 LYS 92 HZ1 LYS 92 11.603 0.882 3.589 26 HZ2 LYS 92 HZ2 LYS 92 12.246 -0.044 2.318 27 HZ3 LYS 92 HZ3 LYS 92 11.044 -0.697 3.324 28 H SER 93 HN SER 93 5.938 4.464 3.801 29 HA SER 93 HA SER 93 3.283 4.572 2.401 30 HB2 SER 93 HB2 SER 93 4.495 2.732 4.328 31 HB3 SER 93 HB1 SER 93 2.932 3.332 4.873 32 HG SER 93 HG SER 93 1.982 2.304 3.282 33 H GLU 94 HN GLU 94 1.630 4.975 4.523 34 HA GLU 94 HA GLU 94 1.824 7.732 5.126 35 HB2 GLU 94 HB2 GLU 94 0.490 5.519 6.719 36 HB3 GLU 94 HB1 GLU 94 0.029 7.222 6.709 37 HG2 GLU 94 HG2 GLU 94 -0.138 6.831 4.097 38 HG3 GLU 94 HG1 GLU 94 -0.343 5.147 4.581 39 H GLU 95 HN GLU 95 3.436 5.016 6.567 40 HA GLU 95 HA GLU 95 3.985 6.199 9.157 41 HB2 GLU 95 HB2 GLU 95 4.890 3.879 7.496 42 HB3 GLU 95 HB1 GLU 95 5.885 4.341 8.877 43 HG2 GLU 95 HG2 GLU 95 2.910 3.762 8.996 44 HG3 GLU 95 HG1 GLU 95 4.180 2.642 9.493 45 H GLU 96 HN GLU 96 5.885 5.871 6.139 46 HA GLU 96 HA GLU 96 7.991 7.642 7.250 47 HB2 GLU 96 HB2 GLU 96 7.765 5.489 5.363 48 HB3 GLU 96 HB1 GLU 96 8.438 6.894 4.535 49 HG2 GLU 96 HG2 GLU 96 10.175 7.115 6.234 50 HG3 GLU 96 HG1 GLU 96 9.472 5.790 7.163 51 H LEU 97 HN LEU 97 5.601 7.570 4.601 52 HA LEU 97 HA LEU 97 6.340 9.971 3.283 53 HB2 LEU 97 HB2 LEU 97 3.636 8.671 3.753 54 HB3 LEU 97 HB1 LEU 97 3.942 9.921 2.547 55 HG LEU 97 HG LEU 97 5.037 7.108 2.643 56 HD11 LEU 97 HD11 LEU 97 2.967 7.293 1.452 57 HD12 LEU 97 HD12 LEU 97 4.235 7.228 0.228 58 HD13 LEU 97 HD13 LEU 97 3.488 8.771 0.644 59 HD21 LEU 97 HD21 LEU 97 6.043 9.489 1.052 60 HD22 LEU 97 HD22 LEU 97 6.440 7.815 0.663 61 HD23 LEU 97 HD23 LEU 97 6.963 8.511 2.196 62 H SER 98 HN SER 98 4.121 9.463 6.042 63 HA SER 98 HA SER 98 3.076 12.019 6.402 64 HB2 SER 98 HB2 SER 98 2.975 11.374 8.785 65 HB3 SER 98 HB1 SER 98 2.590 9.999 7.754 66 HG SER 98 HG SER 98 4.185 9.040 8.714 67 H ASP 99 HN ASP 99 6.246 10.832 7.567 68 HA ASP 99 HA ASP 99 7.046 13.370 8.709 69 HB2 ASP 99 HB2 ASP 99 8.168 10.682 8.141 70 HB3 ASP 99 HB1 ASP 99 9.350 11.985 8.267 71 H LEU 100 HN LEU 100 6.700 12.359 5.504 72 HA LEU 100 HA LEU 100 8.954 13.970 4.448 73 HB2 LEU 100 HB2 LEU 100 7.322 11.741 3.645 74 HB3 LEU 100 HB1 LEU 100 7.200 13.007 2.422 75 HG LEU 100 HG LEU 100 9.863 12.132 3.549 76 HD11 LEU 100 HD11 LEU 100 9.411 11.132 0.900 77 HD12 LEU 100 HD12 LEU 100 8.098 10.578 1.940 78 HD13 LEU 100 HD13 LEU 100 9.771 10.221 2.367 79 HD21 LEU 100 HD21 LEU 100 10.326 14.046 2.373 80 HD22 LEU 100 HD22 LEU 100 8.860 13.924 1.400 81 HD23 LEU 100 HD23 LEU 100 10.272 12.948 0.994 82 H PHE 101 HN PHE 101 5.378 13.945 4.376 83 HA PHE 101 HA PHE 101 4.979 16.207 2.711 84 HB2 PHE 101 HB2 PHE 101 3.398 14.410 3.846 85 HB3 PHE 101 HB1 PHE 101 3.238 15.648 5.092 86 HD1 PHE 101 HD2 PHE 101 2.201 17.813 4.603 87 HD2 PHE 101 HD1 PHE 101 2.569 14.786 1.577 88 HE1 PHE 101 HE2 PHE 101 0.594 19.047 3.174 89 HE2 PHE 101 HE1 PHE 101 0.962 16.020 0.148 90 HZ PHE 101 HZ PHE 101 -0.026 18.150 0.946 91 H ARG 102 HN ARG 102 5.221 16.063 6.290 92 HA ARG 102 HA ARG 102 4.912 18.834 6.807 93 HB2 ARG 102 HB2 ARG 102 6.149 18.247 8.908 94 HB3 ARG 102 HB1 ARG 102 4.875 17.090 8.519 95 HG2 ARG 102 HG2 ARG 102 6.374 15.429 7.920 96 HG3 ARG 102 HG1 ARG 102 7.623 16.582 7.449 97 HD2 ARG 102 HD2 ARG 102 8.404 15.614 9.499 98 HD3 ARG 102 HD1 ARG 102 7.745 17.196 9.964 99 HE ARG 102 HE ARG 102 5.682 15.170 9.992 100 HH11 ARG 102 HH21 ARG 102 8.401 16.442 11.703 101 HH12 ARG 102 HH22 ARG 102 7.826 15.930 13.254 102 HH21 ARG 102 HH11 ARG 102 4.927 14.498 12.011 103 HH22 ARG 102 HH12 ARG 102 5.865 14.832 13.428 104 H MET 103 HN MET 103 7.609 17.058 5.480 105 HA MET 103 HA MET 103 9.486 19.324 5.896 106 HB2 MET 103 HB2 MET 103 10.299 17.084 6.318 107 HB3 MET 103 HB1 MET 103 9.705 16.521 4.755 108 HG2 MET 103 HG2 MET 103 11.837 16.924 4.064 109 HG3 MET 103 HG1 MET 103 11.300 18.601 3.984 110 HE1 MET 103 HE1 MET 103 13.883 18.600 3.908 111 HE2 MET 103 HE2 MET 103 14.774 19.136 5.331 112 HE3 MET 103 HE3 MET 103 13.442 20.111 4.716 113 H PHE 104 HN PHE 104 7.851 17.553 3.275 114 HA PHE 104 HA PHE 104 9.057 18.788 1.034 115 HB2 PHE 104 HB2 PHE 104 7.261 16.877 1.383 116 HB3 PHE 104 HB1 PHE 104 6.114 18.194 1.150 117 HD1 PHE 104 HD2 PHE 104 8.558 19.538 -0.655 118 HD2 PHE 104 HD1 PHE 104 6.140 15.988 -0.770 119 HE1 PHE 104 HE2 PHE 104 8.888 19.392 -3.108 120 HE2 PHE 104 HE1 PHE 104 6.470 15.844 -3.223 121 HZ PHE 104 HZ PHE 104 7.843 17.545 -4.393 122 H ASP 105 HN ASP 105 5.923 19.712 2.525 123 HA ASP 105 HA ASP 105 5.691 22.192 1.102 124 HB2 ASP 105 HB2 ASP 105 3.923 20.790 2.300 125 HB3 ASP 105 HB1 ASP 105 4.527 21.484 3.806 126 H LYS 106 HN LYS 106 8.023 22.915 1.518 127 HA LYS 106 HA LYS 106 8.890 23.726 4.141 128 HB2 LYS 106 HB2 LYS 106 9.927 23.495 1.591 129 HB3 LYS 106 HB1 LYS 106 9.881 25.243 1.821 130 HG2 LYS 106 HG2 LYS 106 11.082 24.974 3.976 131 HG3 LYS 106 HG1 LYS 106 11.173 23.236 3.690 132 HD2 LYS 106 HD2 LYS 106 13.034 23.546 2.468 133 HD3 LYS 106 HD1 LYS 106 12.109 24.530 1.334 134 HE2 LYS 106 HE2 LYS 106 13.188 26.387 2.045 135 HE3 LYS 106 HE1 LYS 106 12.646 26.082 3.708 136 HZ1 LYS 106 HZ1 LYS 106 14.932 24.717 2.387 137 HZ2 LYS 106 HZ2 LYS 106 14.425 24.502 3.994 138 HZ3 LYS 106 HZ3 LYS 106 15.081 25.989 3.499 139 H ASN 107 HN ASN 107 6.576 25.034 1.974 140 HA ASN 107 HA ASN 107 6.842 27.841 2.625 141 HB2 ASN 107 HB2 ASN 107 5.715 26.819 0.623 142 HB3 ASN 107 HB1 ASN 107 4.431 26.252 1.692 143 HD21 ASN 107 HD21 ASN 107 3.627 27.987 -0.294 144 HD22 ASN 107 HD22 ASN 107 3.305 29.526 0.345 145 H ALA 108 HN ALA 108 5.767 25.168 4.435 146 HA ALA 108 HA ALA 108 4.764 25.052 6.575 147 HB1 ALA 108 HB1 ALA 108 6.306 27.214 6.591 148 HB2 ALA 108 HB2 ALA 108 5.191 26.904 7.923 149 HB3 ALA 108 HB3 ALA 108 4.754 28.051 6.656 150 H ASP 109 HN ASP 109 2.698 24.325 5.857 151 HA ASP 109 HA ASP 109 0.456 26.033 6.363 152 HB2 ASP 109 HB2 ASP 109 -0.280 26.186 3.923 153 HB3 ASP 109 HB1 ASP 109 1.108 27.185 4.355 154 H GLY 110 HN GLY 110 1.749 23.190 4.710 155 HA2 GLY 110 HA2 GLY 110 0.873 20.970 5.261 156 HA3 GLY 110 HA1 GLY 110 -0.706 21.708 5.531 157 H TYR 111 HN TYR 111 0.958 22.903 2.790 158 HA TYR 111 HA TYR 111 -0.317 20.943 0.950 159 HB2 TYR 111 HB2 TYR 111 -0.853 23.932 1.012 160 HB3 TYR 111 HB1 TYR 111 -1.455 22.823 -0.221 161 HD1 TYR 111 HD1 TYR 111 -2.983 20.919 0.472 162 HD2 TYR 111 HD2 TYR 111 -1.942 24.143 3.115 163 HE1 TYR 111 HE1 TYR 111 -4.910 20.350 1.926 164 HE2 TYR 111 HE2 TYR 111 -3.869 23.573 4.568 165 HH TYR 111 HH TYR 111 -5.745 20.664 4.077 166 H ILE 112 HN ILE 112 1.170 20.503 -0.628 167 HA ILE 112 HA ILE 112 3.550 22.188 -0.954 168 HB ILE 112 HB ILE 112 2.542 19.714 -2.399 169 HG12 ILE 112 HG12 ILE 112 4.446 20.067 -0.060 170 HG13 ILE 112 HG11 ILE 112 2.843 19.333 0.005 171 HG21 ILE 112 HG21 ILE 112 4.782 21.460 -2.877 172 HG22 ILE 112 HG22 ILE 112 4.309 20.008 -3.758 173 HG23 ILE 112 HG23 ILE 112 5.371 19.882 -2.356 174 HD11 ILE 112 HD11 ILE 112 4.831 17.717 -0.154 175 HD12 ILE 112 HD12 ILE 112 5.013 18.278 -1.816 176 HD13 ILE 112 HD13 ILE 112 3.526 17.473 -1.314 177 H ASP 113 HN ASP 113 3.837 23.708 -2.561 178 HA ASP 113 HA ASP 113 1.605 24.125 -4.489 179 HB2 ASP 113 HB2 ASP 113 2.794 25.838 -2.855 180 HB3 ASP 113 HB1 ASP 113 3.979 25.932 -4.158 181 H LEU 114 HN LEU 114 2.789 25.323 -6.593 182 HA LEU 114 HA LEU 114 4.055 23.136 -8.022 183 HB2 LEU 114 HB2 LEU 114 3.125 25.924 -8.505 184 HB3 LEU 114 HB1 LEU 114 4.327 25.291 -9.630 185 HG LEU 114 HG LEU 114 1.920 23.638 -8.906 186 HD11 LEU 114 HD11 LEU 114 1.943 26.160 -10.378 187 HD12 LEU 114 HD12 LEU 114 0.571 25.195 -9.832 188 HD13 LEU 114 HD13 LEU 114 1.357 24.821 -11.365 189 HD21 LEU 114 HD21 LEU 114 3.497 23.854 -11.484 190 HD22 LEU 114 HD22 LEU 114 2.385 22.570 -11.007 191 HD23 LEU 114 HD23 LEU 114 3.935 22.745 -10.184 192 H ASP 115 HN ASP 115 5.206 26.036 -6.376 193 HA ASP 115 HA ASP 115 7.923 25.799 -7.494 194 HB2 ASP 115 HB2 ASP 115 6.290 27.676 -5.933 195 HB3 ASP 115 HB1 ASP 115 7.962 27.588 -5.377 196 H GLU 116 HN GLU 116 6.387 25.441 -4.272 197 HA GLU 116 HA GLU 116 8.606 24.728 -2.731 198 HB2 GLU 116 HB2 GLU 116 5.779 23.621 -2.747 199 HB3 GLU 116 HB1 GLU 116 6.913 23.429 -1.409 200 HG2 GLU 116 HG2 GLU 116 6.890 25.711 -0.888 201 HG3 GLU 116 HG1 GLU 116 6.323 26.171 -2.494 202 H LEU 117 HN LEU 117 7.099 22.923 -5.304 203 HA LEU 117 HA LEU 117 8.143 20.309 -4.554 204 HB2 LEU 117 HB2 LEU 117 7.024 21.539 -7.089 205 HB3 LEU 117 HB1 LEU 117 7.447 19.832 -6.955 206 HG LEU 117 HG LEU 117 5.651 21.072 -4.892 207 HD11 LEU 117 HD11 LEU 117 3.748 20.934 -6.221 208 HD12 LEU 117 HD12 LEU 117 4.483 19.779 -7.333 209 HD13 LEU 117 HD13 LEU 117 4.931 21.483 -7.408 210 HD21 LEU 117 HD21 LEU 117 5.967 18.906 -4.236 211 HD22 LEU 117 HD22 LEU 117 6.458 18.387 -5.848 212 HD23 LEU 117 HD23 LEU 117 4.747 18.559 -5.461 213 H LYS 118 HN LYS 118 9.423 23.104 -6.172 214 HA LYS 118 HA LYS 118 11.516 21.694 -7.644 215 HB2 LYS 118 HB2 LYS 118 10.829 23.709 -8.606 216 HB3 LYS 118 HB1 LYS 118 10.672 24.514 -7.046 217 HG2 LYS 118 HG2 LYS 118 13.392 23.603 -7.875 218 HG3 LYS 118 HG1 LYS 118 12.723 25.029 -8.667 219 HD2 LYS 118 HD2 LYS 118 12.212 25.200 -5.844 220 HD3 LYS 118 HD1 LYS 118 13.928 24.882 -6.100 221 HE2 LYS 118 HE2 LYS 118 13.575 27.300 -6.134 222 HE3 LYS 118 HE1 LYS 118 13.939 26.773 -7.789 223 HZ1 LYS 118 HZ1 LYS 118 11.667 26.750 -8.346 224 HZ2 LYS 118 HZ2 LYS 118 11.900 28.216 -7.520 225 HZ3 LYS 118 HZ3 LYS 118 11.175 26.898 -6.730 226 H ILE 119 HN ILE 119 11.091 22.658 -4.379 227 HA ILE 119 HA ILE 119 13.988 23.003 -3.861 228 HB ILE 119 HB ILE 119 11.458 23.141 -2.202 229 HG12 ILE 119 HG12 ILE 119 13.460 25.326 -2.780 230 HG13 ILE 119 HG11 ILE 119 12.158 24.960 -3.912 231 HG21 ILE 119 HG21 ILE 119 14.348 23.545 -1.376 232 HG22 ILE 119 HG22 ILE 119 13.234 22.329 -0.753 233 HG23 ILE 119 HG23 ILE 119 12.961 24.036 -0.403 234 HD11 ILE 119 HD11 ILE 119 11.622 25.461 -0.983 235 HD12 ILE 119 HD12 ILE 119 10.477 25.502 -2.325 236 HD13 ILE 119 HD13 ILE 119 11.684 26.777 -2.155 237 H MET 120 HN MET 120 11.366 20.886 -2.607 238 HA MET 120 HA MET 120 12.928 19.107 -1.104 239 HB2 MET 120 HB2 MET 120 10.393 19.278 -1.429 240 HB3 MET 120 HB1 MET 120 10.615 18.313 -2.889 241 HG2 MET 120 HG2 MET 120 11.992 17.214 -0.537 242 HG3 MET 120 HG1 MET 120 10.239 17.279 -0.361 243 HE1 MET 120 HE1 MET 120 9.636 14.324 -0.763 244 HE2 MET 120 HE2 MET 120 8.720 14.810 -2.188 245 HE3 MET 120 HE3 MET 120 8.891 15.927 -0.836 246 H LEU 121 HN LEU 121 12.469 19.255 -4.604 247 HA LEU 121 HA LEU 121 13.849 16.718 -5.105 248 HB2 LEU 121 HB2 LEU 121 12.536 18.925 -6.624 249 HB3 LEU 121 HB1 LEU 121 13.719 17.949 -7.496 250 HG LEU 121 HG LEU 121 12.518 15.896 -6.830 251 HD11 LEU 121 HD11 LEU 121 11.574 16.636 -4.717 252 HD12 LEU 121 HD12 LEU 121 10.252 16.164 -5.786 253 HD13 LEU 121 HD13 LEU 121 10.617 17.872 -5.534 254 HD21 LEU 121 HD21 LEU 121 10.175 17.108 -7.888 255 HD22 LEU 121 HD22 LEU 121 11.414 16.213 -8.768 256 HD23 LEU 121 HD23 LEU 121 11.552 17.962 -8.585 257 H GLN 122 HN GLN 122 14.708 20.100 -4.819 258 HA GLN 122 HA GLN 122 17.097 20.274 -6.289 259 HB2 GLN 122 HB2 GLN 122 15.692 21.684 -4.270 260 HB3 GLN 122 HB1 GLN 122 17.352 21.521 -3.696 261 HG2 GLN 122 HG2 GLN 122 17.580 22.154 -6.424 262 HG3 GLN 122 HG1 GLN 122 16.308 23.212 -5.809 263 HE21 GLN 122 HE21 GLN 122 19.585 23.161 -6.260 264 HE22 GLN 122 HE22 GLN 122 20.068 24.182 -4.994 265 H ALA 123 HN ALA 123 16.454 18.599 -3.260 266 HA ALA 123 HA ALA 123 19.126 18.226 -2.337 267 HB1 ALA 123 HB1 ALA 123 18.000 16.146 -1.293 268 HB2 ALA 123 HB2 ALA 123 16.538 16.677 -2.123 269 HB3 ALA 123 HB3 ALA 123 17.290 17.714 -0.911 270 H THR 124 HN THR 124 17.437 16.872 -5.041 271 HA THR 124 HA THR 124 19.512 14.733 -5.347 272 HB THR 124 HB THR 124 17.590 14.187 -7.186 273 HG1 THR 124 HG1 THR 124 15.718 15.019 -6.635 274 HG21 THR 124 HG21 THR 124 17.511 13.571 -4.221 275 HG22 THR 124 HG22 THR 124 18.342 12.637 -5.464 276 HG23 THR 124 HG23 THR 124 16.580 12.710 -5.447 277 H GLY 125 HN GLY 125 19.744 17.690 -6.047 278 HA2 GLY 125 HA2 GLY 125 20.614 18.968 -7.812 279 HA3 GLY 125 HA1 GLY 125 21.152 17.435 -8.503 280 H GLU 126 HN GLU 126 17.772 18.116 -7.822 281 HA GLU 126 HA GLU 126 16.722 17.276 -10.260 282 HB2 GLU 126 HB2 GLU 126 14.774 18.630 -9.626 283 HB3 GLU 126 HB1 GLU 126 15.477 17.893 -8.188 284 HG2 GLU 126 HG2 GLU 126 15.567 19.967 -7.307 285 HG3 GLU 126 HG1 GLU 126 16.863 20.299 -8.455 286 H THR 127 HN THR 127 18.057 17.984 -12.029 287 HA THR 127 HA THR 127 18.010 20.931 -12.577 288 HB THR 127 HB THR 127 20.240 20.096 -12.483 289 HG1 THR 127 HG1 THR 127 19.871 19.720 -15.209 290 HG21 THR 127 HG21 THR 127 19.875 17.736 -12.447 291 HG22 THR 127 HG22 THR 127 20.871 18.050 -13.868 292 HG23 THR 127 HG23 THR 127 19.141 17.757 -14.051 293 H ILE 128 HN ILE 128 15.929 21.006 -13.572 294 HA ILE 128 HA ILE 128 15.808 19.695 -16.258 295 HB ILE 128 HB ILE 128 13.508 19.046 -15.794 296 HG12 ILE 128 HG12 ILE 128 13.961 20.609 -13.239 297 HG13 ILE 128 HG11 ILE 128 12.723 20.879 -14.466 298 HG21 ILE 128 HG21 ILE 128 15.689 17.888 -14.661 299 HG22 ILE 128 HG22 ILE 128 14.057 17.238 -14.506 300 HG23 ILE 128 HG23 ILE 128 14.736 18.235 -13.219 301 HD11 ILE 128 HD11 ILE 128 12.705 19.043 -12.194 302 HD12 ILE 128 HD12 ILE 128 12.324 18.231 -13.713 303 HD13 ILE 128 HD13 ILE 128 11.362 19.612 -13.185 304 H THR 129 HN THR 129 14.251 20.838 -17.714 305 HA THR 129 HA THR 129 14.546 23.679 -17.662 306 HB THR 129 HB THR 129 12.233 22.511 -19.099 307 HG1 THR 129 HG1 THR 129 13.263 20.878 -19.887 308 HG21 THR 129 HG21 THR 129 13.076 23.794 -20.887 309 HG22 THR 129 HG22 THR 129 14.718 23.774 -20.244 310 HG23 THR 129 HG23 THR 129 13.477 24.756 -19.464 311 H GLU 130 HN GLU 130 12.871 25.303 -17.291 312 HA GLU 130 HA GLU 130 11.371 24.992 -14.897 313 HB2 GLU 130 HB2 GLU 130 11.972 27.166 -15.631 314 HB3 GLU 130 HB1 GLU 130 11.309 26.894 -17.243 315 HG2 GLU 130 HG2 GLU 130 9.064 27.005 -16.448 316 HG3 GLU 130 HG1 GLU 130 9.577 26.880 -14.765 317 H ASP 131 HN ASP 131 10.326 24.771 -18.310 318 HA ASP 131 HA ASP 131 7.539 24.427 -17.839 319 HB2 ASP 131 HB2 ASP 131 9.073 24.755 -19.984 320 HB3 ASP 131 HB1 ASP 131 8.971 22.996 -20.048 321 H ASP 132 HN ASP 132 10.193 22.268 -17.269 322 HA ASP 132 HA ASP 132 8.578 19.814 -17.400 323 HB2 ASP 132 HB2 ASP 132 11.249 20.482 -17.588 324 HB3 ASP 132 HB1 ASP 132 11.152 19.786 -15.970 325 H ILE 133 HN ILE 133 9.141 22.287 -15.089 326 HA ILE 133 HA ILE 133 9.032 20.793 -12.643 327 HB ILE 133 HB ILE 133 8.102 23.595 -13.350 328 HG12 ILE 133 HG12 ILE 133 10.478 23.070 -13.931 329 HG13 ILE 133 HG11 ILE 133 10.342 24.281 -12.655 330 HG21 ILE 133 HG21 ILE 133 7.238 23.295 -11.217 331 HG22 ILE 133 HG22 ILE 133 8.870 23.833 -10.821 332 HG23 ILE 133 HG23 ILE 133 8.472 22.116 -10.771 333 HD11 ILE 133 HD11 ILE 133 10.344 21.888 -11.253 334 HD12 ILE 133 HD12 ILE 133 11.731 22.958 -11.456 335 HD13 ILE 133 HD13 ILE 133 11.501 21.594 -12.551 336 H GLU 134 HN GLU 134 6.582 21.676 -14.967 337 HA GLU 134 HA GLU 134 4.341 21.243 -13.098 338 HB2 GLU 134 HB2 GLU 134 4.258 21.506 -16.110 339 HB3 GLU 134 HB1 GLU 134 3.022 21.977 -14.943 340 HG2 GLU 134 HG2 GLU 134 5.093 23.482 -14.055 341 HG3 GLU 134 HG1 GLU 134 5.483 23.413 -15.774 342 H GLU 135 HN GLU 135 6.243 19.382 -15.330 343 HA GLU 135 HA GLU 135 4.440 17.368 -16.154 344 HB2 GLU 135 HB2 GLU 135 6.731 17.653 -16.979 345 HB3 GLU 135 HB1 GLU 135 7.375 17.232 -15.392 346 HG2 GLU 135 HG2 GLU 135 7.521 15.197 -16.544 347 HG3 GLU 135 HG1 GLU 135 5.986 15.037 -15.690 348 H LEU 136 HN LEU 136 5.911 17.917 -13.011 349 HA LEU 136 HA LEU 136 5.162 15.228 -12.027 350 HB2 LEU 136 HB2 LEU 136 6.446 17.674 -10.770 351 HB3 LEU 136 HB1 LEU 136 6.231 16.133 -9.941 352 HG LEU 136 HG LEU 136 7.529 16.017 -12.612 353 HD11 LEU 136 HD11 LEU 136 9.752 16.537 -11.440 354 HD12 LEU 136 HD12 LEU 136 8.784 17.287 -10.171 355 HD13 LEU 136 HD13 LEU 136 8.724 17.919 -11.817 356 HD21 LEU 136 HD21 LEU 136 7.235 14.426 -10.235 357 HD22 LEU 136 HD22 LEU 136 8.953 14.689 -10.537 358 HD23 LEU 136 HD23 LEU 136 7.939 13.962 -11.784 359 H MET 137 HN MET 137 4.066 18.583 -11.785 360 HA MET 137 HA MET 137 2.335 18.457 -9.574 361 HB2 MET 137 HB2 MET 137 3.015 20.347 -11.257 362 HB3 MET 137 HB1 MET 137 1.581 19.831 -12.145 363 HG2 MET 137 HG2 MET 137 0.828 21.559 -10.687 364 HG3 MET 137 HG1 MET 137 0.314 20.051 -9.929 365 HE1 MET 137 HE1 MET 137 0.334 22.481 -7.970 366 HE2 MET 137 HE2 MET 137 1.045 21.568 -6.642 367 HE3 MET 137 HE3 MET 137 -0.054 20.768 -7.762 368 H LYS 138 HN LYS 138 2.005 16.941 -12.705 369 HA LYS 138 HA LYS 138 -0.851 16.557 -12.692 370 HB2 LYS 138 HB2 LYS 138 1.499 15.155 -13.992 371 HB3 LYS 138 HB1 LYS 138 -0.177 14.727 -14.345 372 HG2 LYS 138 HG2 LYS 138 1.166 17.405 -14.793 373 HG3 LYS 138 HG1 LYS 138 0.516 16.316 -16.018 374 HD2 LYS 138 HD2 LYS 138 -1.681 16.664 -14.445 375 HD3 LYS 138 HD1 LYS 138 -0.895 18.232 -14.259 376 HE2 LYS 138 HE2 LYS 138 -0.636 17.920 -16.941 377 HE3 LYS 138 HE1 LYS 138 -2.149 17.032 -16.670 378 HZ1 LYS 138 HZ1 LYS 138 -1.619 19.684 -15.459 379 HZ2 LYS 138 HZ2 LYS 138 -3.104 18.867 -15.580 380 HZ3 LYS 138 HZ3 LYS 138 -2.373 19.517 -16.969 381 H ASP 139 HN ASP 139 1.875 14.606 -11.479 382 HA ASP 139 HA ASP 139 0.172 12.387 -10.637 383 HB2 ASP 139 HB2 ASP 139 3.012 13.166 -10.700 384 HB3 ASP 139 HB1 ASP 139 2.580 12.180 -9.303 385 H GLY 140 HN GLY 140 1.060 15.447 -9.305 386 HA2 GLY 140 HA2 GLY 140 0.206 14.543 -6.586 387 HA3 GLY 140 HA1 GLY 140 1.237 15.943 -6.884 388 H ASP 141 HN ASP 141 -0.892 16.161 -9.313 389 HA ASP 141 HA ASP 141 -3.208 17.224 -7.833 390 HB2 ASP 141 HB2 ASP 141 -1.114 18.858 -7.927 391 HB3 ASP 141 HB1 ASP 141 -1.720 19.175 -9.553 392 H LYS 142 HN LYS 142 -3.981 15.444 -9.377 393 HA LYS 142 HA LYS 142 -3.888 15.723 -12.218 394 HB2 LYS 142 HB2 LYS 142 -5.497 14.297 -10.154 395 HB3 LYS 142 HB1 LYS 142 -6.199 14.399 -11.769 396 HG2 LYS 142 HG2 LYS 142 -4.002 13.544 -12.681 397 HG3 LYS 142 HG1 LYS 142 -3.502 13.246 -11.016 398 HD2 LYS 142 HD2 LYS 142 -4.436 11.195 -11.382 399 HD3 LYS 142 HD1 LYS 142 -5.938 12.042 -11.011 400 HE2 LYS 142 HE2 LYS 142 -6.375 12.420 -13.379 401 HE3 LYS 142 HE1 LYS 142 -4.800 11.725 -13.812 402 HZ1 LYS 142 HZ1 LYS 142 -5.664 9.768 -12.337 403 HZ2 LYS 142 HZ2 LYS 142 -6.125 9.879 -13.968 404 HZ3 LYS 142 HZ3 LYS 142 -7.189 10.389 -12.746 405 H ASN 143 HN ASN 143 -6.057 17.097 -9.772 406 HA ASN 143 HA ASN 143 -7.994 18.164 -11.647 407 HB2 ASN 143 HB2 ASN 143 -7.338 19.192 -8.877 408 HB3 ASN 143 HB1 ASN 143 -8.905 19.177 -9.686 409 HD21 ASN 143 HD21 ASN 143 -7.307 17.637 -7.254 410 HD22 ASN 143 HD22 ASN 143 -8.018 16.099 -7.358 411 H ASN 144 HN ASN 144 -4.870 19.204 -10.505 412 HA ASN 144 HA ASN 144 -3.556 21.065 -11.142 413 HB2 ASN 144 HB2 ASN 144 -5.317 20.437 -13.247 414 HB3 ASN 144 HB1 ASN 144 -5.424 22.187 -13.059 415 HD21 ASN 144 HD21 ASN 144 -4.238 22.249 -15.212 416 HD22 ASN 144 HD22 ASN 144 -2.549 22.085 -15.211 417 H ASP 145 HN ASP 145 -5.664 21.245 -9.035 418 HA ASP 145 HA ASP 145 -6.936 23.856 -9.257 419 HB2 ASP 145 HB2 ASP 145 -7.694 23.340 -7.030 420 HB3 ASP 145 HB1 ASP 145 -7.673 21.816 -7.917 421 H GLY 146 HN GLY 146 -3.762 22.823 -8.535 422 HA2 GLY 146 HA2 GLY 146 -1.919 24.320 -8.180 423 HA3 GLY 146 HA1 GLY 146 -3.058 25.559 -7.651 424 H ARG 147 HN ARG 147 -3.426 22.362 -6.365 425 HA ARG 147 HA ARG 147 -1.903 23.049 -3.902 426 HB2 ARG 147 HB2 ARG 147 -4.869 22.407 -4.019 427 HB3 ARG 147 HB1 ARG 147 -3.938 22.667 -2.544 428 HG2 ARG 147 HG2 ARG 147 -3.382 24.959 -3.315 429 HG3 ARG 147 HG1 ARG 147 -4.367 24.698 -4.755 430 HD2 ARG 147 HD2 ARG 147 -6.339 24.933 -3.604 431 HD3 ARG 147 HD1 ARG 147 -5.702 24.130 -2.156 432 HE ARG 147 HE ARG 147 -5.629 26.975 -2.644 433 HH11 ARG 147 HH21 ARG 147 -3.835 24.300 -1.395 434 HH12 ARG 147 HH22 ARG 147 -2.924 25.266 -0.284 435 HH21 ARG 147 HH11 ARG 147 -4.447 28.241 -1.199 436 HH22 ARG 147 HH12 ARG 147 -3.269 27.493 -0.173 437 H ILE 148 HN ILE 148 -0.956 21.212 -3.072 438 HA ILE 148 HA ILE 148 -1.930 18.566 -4.102 439 HB ILE 148 HB ILE 148 0.821 19.419 -3.144 440 HG12 ILE 148 HG12 ILE 148 -0.405 19.235 -5.907 441 HG13 ILE 148 HG11 ILE 148 0.363 20.635 -5.158 442 HG21 ILE 148 HG21 ILE 148 0.096 17.015 -4.822 443 HG22 ILE 148 HG22 ILE 148 0.091 16.944 -3.060 444 HG23 ILE 148 HG23 ILE 148 1.583 17.314 -3.923 445 HD11 ILE 148 HD11 ILE 148 2.166 19.929 -6.380 446 HD12 ILE 148 HD12 ILE 148 1.601 18.260 -6.443 447 HD13 ILE 148 HD13 ILE 148 2.400 18.867 -4.992 448 H ASP 149 HN ASP 149 -3.375 18.164 -2.321 449 HA ASP 149 HA ASP 149 -2.591 18.465 0.448 450 HB2 ASP 149 HB2 ASP 149 -4.920 18.422 -0.475 451 HB3 ASP 149 HB1 ASP 149 -4.707 16.708 -0.837 452 H TYR 150 HN TYR 150 -2.584 16.444 1.923 453 HA TYR 150 HA TYR 150 -0.407 14.721 1.220 454 HB2 TYR 150 HB2 TYR 150 -1.020 15.286 3.513 455 HB3 TYR 150 HB1 TYR 150 -2.602 14.535 3.308 456 HD1 TYR 150 HD1 TYR 150 1.016 13.922 3.669 457 HD2 TYR 150 HD2 TYR 150 -2.860 12.115 3.265 458 HE1 TYR 150 HE1 TYR 150 1.969 11.731 4.336 459 HE2 TYR 150 HE2 TYR 150 -1.908 9.924 3.932 460 HH TYR 150 HH TYR 150 0.093 9.122 5.271 461 H ASP 151 HN ASP 151 -3.940 14.246 1.154 462 HA ASP 151 HA ASP 151 -4.048 11.487 0.567 463 HB2 ASP 151 HB2 ASP 151 -5.748 13.732 0.656 464 HB3 ASP 151 HB1 ASP 151 -5.964 13.050 -0.956 465 H GLU 152 HN GLU 152 -3.796 14.244 -1.705 466 HA GLU 152 HA GLU 152 -3.613 12.586 -4.072 467 HB2 GLU 152 HB2 GLU 152 -2.891 15.458 -3.412 468 HB3 GLU 152 HB1 GLU 152 -2.845 14.799 -5.048 469 HG2 GLU 152 HG2 GLU 152 -5.227 14.238 -4.916 470 HG3 GLU 152 HG1 GLU 152 -5.291 14.827 -3.255 471 H PHE 153 HN PHE 153 -1.391 13.363 -1.576 472 HA PHE 153 HA PHE 153 1.065 13.329 -3.110 473 HB2 PHE 153 HB2 PHE 153 0.577 14.237 -0.757 474 HB3 PHE 153 HB1 PHE 153 0.673 12.563 -0.209 475 HD1 PHE 153 HD1 PHE 153 2.577 15.131 -2.159 476 HD2 PHE 153 HD2 PHE 153 2.759 11.599 0.281 477 HE1 PHE 153 HE1 PHE 153 5.052 15.280 -2.130 478 HE2 PHE 153 HE2 PHE 153 5.234 11.749 0.310 479 HZ PHE 153 HZ PHE 153 6.380 13.588 -0.894 480 H LEU 154 HN LEU 154 -0.958 10.852 -1.615 481 HA LEU 154 HA LEU 154 0.873 8.678 -1.588 482 HB2 LEU 154 HB2 LEU 154 -2.044 9.157 -1.572 483 HB3 LEU 154 HB1 LEU 154 -1.569 7.559 -2.150 484 HG LEU 154 HG LEU 154 -1.926 7.665 0.337 485 HD11 LEU 154 HD11 LEU 154 -0.557 5.878 -0.343 486 HD12 LEU 154 HD12 LEU 154 0.448 6.708 0.845 487 HD13 LEU 154 HD13 LEU 154 0.737 6.950 -0.878 488 HD21 LEU 154 HD21 LEU 154 -0.722 9.087 1.689 489 HD22 LEU 154 HD22 LEU 154 -0.702 10.066 0.222 490 HD23 LEU 154 HD23 LEU 154 0.689 9.063 0.632 491 H GLU 155 HN GLU 155 -1.661 9.264 -4.062 492 HA GLU 155 HA GLU 155 -0.788 7.420 -5.988 493 HB2 GLU 155 HB2 GLU 155 -2.573 9.635 -5.740 494 HB3 GLU 155 HB1 GLU 155 -1.692 9.832 -7.256 495 HG2 GLU 155 HG2 GLU 155 -2.287 7.117 -7.203 496 HG3 GLU 155 HG1 GLU 155 -3.740 7.871 -6.544 497 H PHE 156 HN PHE 156 0.272 10.799 -5.519 498 HA PHE 156 HA PHE 156 1.922 11.221 -7.711 499 HB2 PHE 156 HB2 PHE 156 1.542 12.848 -5.936 500 HB3 PHE 156 HB1 PHE 156 2.382 11.824 -4.772 501 HD1 PHE 156 HD2 PHE 156 2.815 13.879 -7.836 502 HD2 PHE 156 HD1 PHE 156 4.770 11.783 -4.637 503 HE1 PHE 156 HE2 PHE 156 4.974 14.916 -8.477 504 HE2 PHE 156 HE1 PHE 156 6.930 12.820 -5.277 505 HZ PHE 156 HZ PHE 156 7.032 14.386 -7.198 506 H MET 157 HN MET 157 2.666 9.296 -4.806 507 HA MET 157 HA MET 157 5.361 8.617 -5.753 508 HB2 MET 157 HB2 MET 157 3.664 7.469 -3.512 509 HB3 MET 157 HB1 MET 157 5.416 7.341 -3.670 510 HG2 MET 157 HG2 MET 157 5.182 10.016 -3.808 511 HG3 MET 157 HG1 MET 157 3.754 9.666 -2.834 512 HE1 MET 157 HE1 MET 157 7.731 9.940 -2.759 513 HE2 MET 157 HE2 MET 157 7.480 10.674 -1.178 514 HE3 MET 157 HE3 MET 157 6.496 11.188 -2.546 515 H LYS 158 HN LYS 158 2.220 6.952 -5.414 516 HA LYS 158 HA LYS 158 1.532 4.828 -6.230 517 HB2 LYS 158 HB2 LYS 158 2.628 6.589 -8.273 518 HB3 LYS 158 HB1 LYS 158 2.775 4.897 -8.747 519 HG2 LYS 158 HG2 LYS 158 0.427 4.525 -8.513 520 HG3 LYS 158 HG1 LYS 158 0.199 6.057 -7.669 521 HD2 LYS 158 HD2 LYS 158 0.062 7.223 -9.604 522 HD3 LYS 158 HD1 LYS 158 1.451 6.385 -10.297 523 HE2 LYS 158 HE2 LYS 158 -0.051 4.397 -10.725 524 HE3 LYS 158 HE1 LYS 158 -1.423 5.408 -10.229 525 HZ1 LYS 158 HZ1 LYS 158 -0.622 5.366 -12.716 526 HZ2 LYS 158 HZ2 LYS 158 0.497 6.512 -12.148 527 HZ3 LYS 158 HZ3 LYS 158 -1.171 6.802 -12.000 528 H GLY 159 HN GLY 159 4.188 4.906 -4.796 529 HA2 GLY 159 HA2 GLY 159 5.508 2.952 -4.244 530 HA3 GLY 159 HA1 GLY 159 5.214 2.332 -5.870 531 H VAL 160 HN VAL 160 5.865 4.725 -7.300 532 HA VAL 160 HA VAL 160 7.772 5.737 -8.262 533 HB VAL 160 HB VAL 160 8.581 5.619 -5.338 534 HG11 VAL 160 HG11 VAL 160 9.718 6.962 -7.756 535 HG12 VAL 160 HG12 VAL 160 10.548 6.290 -6.352 536 HG13 VAL 160 HG13 VAL 160 9.737 7.851 -6.232 537 HG21 VAL 160 HG21 VAL 160 6.600 6.832 -5.306 538 HG22 VAL 160 HG22 VAL 160 6.804 7.405 -6.962 539 HG23 VAL 160 HG23 VAL 160 7.751 8.121 -5.658 540 H GLU 161 HN GLU 161 8.553 3.955 -9.497 541 HA GLU 161 HA GLU 161 10.654 2.275 -8.167 542 HB2 GLU 161 HB2 GLU 161 8.535 1.195 -9.040 543 HB3 GLU 161 HB1 GLU 161 9.022 1.701 -10.658 544 HG2 GLU 161 HG2 GLU 161 10.191 -0.227 -10.780 545 HG3 GLU 161 HG1 GLU 161 11.309 0.490 -9.619 546 HO1 KDH 1 H1 KDH 1 9.960 7.970 -10.184 547 H21 KDH 1 H21 KDH 1 10.005 7.912 -3.616 548 H33 KDH 1 H33 KDH 1 8.697 13.132 -6.168 549 H4 KDH 1 H4 KDH 1 10.212 9.282 -7.674 550 HO7 KDH 1 H7 KDH 1 7.184 10.052 -11.897 551 H01 KDH 1 H01 KDH 1 10.119 13.403 -4.065 552 H01A KDH 1 H02 KDH 1 8.487 12.643 -3.883 553 HO03 KDH 1 H03 KDH 1 11.791 13.268 -2.498 554 HO10 KDH 1 H10 KDH 1 6.715 12.180 -11.195 555 H12 KDH 1 H12 KDH 1 6.754 12.005 -7.615 556 H15 KDH 1 H15 KDH 1 7.688 11.086 -5.704 557 H26 KDH 1 H26 KDH 1 11.793 10.592 -0.637 558 H39 KDH 1 H39 KDH 1 12.378 11.106 -7.438 559 H41 KDH 1 H41 KDH 1 10.692 14.144 -10.140 560 HO02 KDH 1 H42 KDH 1 10.850 7.245 -1.581 561 HO44 KDH 1 H44 KDH 1 12.469 14.302 -12.231 562 HO47 KDH 1 H47 KDH 1 14.662 10.803 -11.453 563 HO50 KDH 1 H50 KDH 1 13.536 9.170 -9.626 Start of MODEL 6 1 H1 MET 90 HT1 MET 90 13.121 6.837 0.019 2 H2 MET 90 HT2 MET 90 12.247 5.860 1.101 3 H3 MET 90 HT3 MET 90 13.827 6.353 1.483 4 HA MET 90 HA MET 90 12.885 8.013 2.639 5 HB2 MET 90 HB2 MET 90 12.643 8.664 -0.283 6 HB3 MET 90 HB1 MET 90 12.009 9.811 0.897 7 HG2 MET 90 HG2 MET 90 14.487 9.116 1.945 8 HG3 MET 90 HG1 MET 90 14.785 9.206 0.209 9 HE1 MET 90 HE1 MET 90 16.297 12.278 0.846 10 HE2 MET 90 HE2 MET 90 15.503 12.059 -0.711 11 HE3 MET 90 HE3 MET 90 16.197 10.668 0.119 12 H GLY 91 HN GLY 91 10.510 8.481 0.089 13 HA2 GLY 91 HA2 GLY 91 8.323 8.423 1.983 14 HA3 GLY 91 HA1 GLY 91 8.161 8.552 0.231 15 H LYS 92 HN LYS 92 6.776 6.794 2.299 16 HA LYS 92 HA LYS 92 7.160 4.230 0.807 17 HB2 LYS 92 HB2 LYS 92 7.234 4.772 3.779 18 HB3 LYS 92 HB1 LYS 92 6.879 3.164 3.147 19 HG2 LYS 92 HG2 LYS 92 9.037 2.794 2.577 20 HG3 LYS 92 HG1 LYS 92 9.208 4.401 1.869 21 HD2 LYS 92 HD2 LYS 92 10.190 5.217 3.731 22 HD3 LYS 92 HD1 LYS 92 8.954 4.512 4.774 23 HE2 LYS 92 HE2 LYS 92 11.131 2.811 3.532 24 HE3 LYS 92 HE1 LYS 92 11.342 3.614 5.101 25 HZ1 LYS 92 HZ1 LYS 92 9.146 2.634 5.737 26 HZ2 LYS 92 HZ2 LYS 92 10.395 1.500 5.543 27 HZ3 LYS 92 HZ3 LYS 92 9.219 1.689 4.331 28 H SER 93 HN SER 93 5.224 4.721 3.704 29 HA SER 93 HA SER 93 2.742 4.655 2.017 30 HB2 SER 93 HB2 SER 93 3.816 2.746 3.853 31 HB3 SER 93 HB1 SER 93 2.364 3.426 4.581 32 HG SER 93 HG SER 93 2.677 2.117 2.094 33 H GLU 94 HN GLU 94 0.815 5.090 3.802 34 HA GLU 94 HA GLU 94 0.852 7.811 4.464 35 HB2 GLU 94 HB2 GLU 94 -0.549 5.572 5.958 36 HB3 GLU 94 HB1 GLU 94 -1.083 7.249 5.833 37 HG2 GLU 94 HG2 GLU 94 -0.704 6.436 3.182 38 HG3 GLU 94 HG1 GLU 94 -1.474 5.054 3.963 39 H GLU 95 HN GLU 95 2.412 5.172 6.107 40 HA GLU 95 HA GLU 95 2.632 6.354 8.731 41 HB2 GLU 95 HB2 GLU 95 2.939 3.956 8.184 42 HB3 GLU 95 HB1 GLU 95 4.378 4.360 7.248 43 HG2 GLU 95 HG2 GLU 95 5.400 5.333 9.306 44 HG3 GLU 95 HG1 GLU 95 3.991 4.798 10.223 45 H GLU 96 HN GLU 96 4.987 6.120 6.032 46 HA GLU 96 HA GLU 96 6.701 8.161 7.324 47 HB2 GLU 96 HB2 GLU 96 7.274 5.911 6.014 48 HB3 GLU 96 HB1 GLU 96 7.192 6.981 4.614 49 HG2 GLU 96 HG2 GLU 96 9.258 7.729 5.085 50 HG3 GLU 96 HG1 GLU 96 8.665 8.348 6.626 51 H LEU 97 HN LEU 97 4.351 7.880 4.753 52 HA LEU 97 HA LEU 97 5.115 10.174 3.198 53 HB2 LEU 97 HB2 LEU 97 2.518 8.686 3.672 54 HB3 LEU 97 HB1 LEU 97 2.685 9.961 2.464 55 HG LEU 97 HG LEU 97 4.326 7.413 2.584 56 HD11 LEU 97 HD11 LEU 97 1.772 8.073 1.388 57 HD12 LEU 97 HD12 LEU 97 2.607 6.520 1.436 58 HD13 LEU 97 HD13 LEU 97 2.951 7.667 0.141 59 HD21 LEU 97 HD21 LEU 97 5.782 8.926 1.590 60 HD22 LEU 97 HD22 LEU 97 4.474 9.918 0.944 61 HD23 LEU 97 HD23 LEU 97 4.877 8.381 0.178 62 H SER 98 HN SER 98 2.981 9.761 6.022 63 HA SER 98 HA SER 98 1.796 12.331 6.096 64 HB2 SER 98 HB2 SER 98 1.820 10.040 7.617 65 HB3 SER 98 HB1 SER 98 2.647 11.176 8.678 66 HG SER 98 HG SER 98 0.747 12.597 7.889 67 H ASP 99 HN ASP 99 4.728 11.251 7.868 68 HA ASP 99 HA ASP 99 5.479 13.934 8.657 69 HB2 ASP 99 HB2 ASP 99 6.073 11.722 9.755 70 HB3 ASP 99 HB1 ASP 99 7.194 11.443 8.421 71 H LEU 100 HN LEU 100 6.008 11.972 5.821 72 HA LEU 100 HA LEU 100 8.282 13.547 4.832 73 HB2 LEU 100 HB2 LEU 100 7.910 11.110 4.403 74 HB3 LEU 100 HB1 LEU 100 6.467 11.525 3.476 75 HG LEU 100 HG LEU 100 8.046 13.070 2.115 76 HD11 LEU 100 HD11 LEU 100 10.354 11.558 2.224 77 HD12 LEU 100 HD12 LEU 100 9.895 11.674 3.923 78 HD13 LEU 100 HD13 LEU 100 10.144 13.140 2.974 79 HD21 LEU 100 HD21 LEU 100 8.999 10.513 1.297 80 HD22 LEU 100 HD22 LEU 100 7.653 11.431 0.620 81 HD23 LEU 100 HD23 LEU 100 7.369 10.285 1.930 82 H PHE 101 HN PHE 101 4.787 13.538 4.525 83 HA PHE 101 HA PHE 101 4.564 15.117 2.131 84 HB2 PHE 101 HB2 PHE 101 2.741 13.789 3.079 85 HB3 PHE 101 HB1 PHE 101 2.774 14.753 4.556 86 HD1 PHE 101 HD2 PHE 101 3.122 15.944 1.040 87 HD2 PHE 101 HD1 PHE 101 0.647 15.803 4.548 88 HE1 PHE 101 HE2 PHE 101 1.567 17.579 0.009 89 HE2 PHE 101 HE1 PHE 101 -0.907 17.437 3.517 90 HZ PHE 101 HZ PHE 101 -0.447 18.325 1.248 91 H ARG 102 HN ARG 102 4.552 15.993 5.599 92 HA ARG 102 HA ARG 102 4.462 18.868 5.002 93 HB2 ARG 102 HB2 ARG 102 4.460 19.042 7.434 94 HB3 ARG 102 HB1 ARG 102 3.389 17.719 6.969 95 HG2 ARG 102 HG2 ARG 102 5.540 16.241 7.224 96 HG3 ARG 102 HG1 ARG 102 6.127 17.586 8.202 97 HD2 ARG 102 HD2 ARG 102 3.363 16.795 8.849 98 HD3 ARG 102 HD1 ARG 102 4.569 15.534 9.178 99 HE ARG 102 HE ARG 102 5.495 18.138 10.051 100 HH11 ARG 102 HH21 ARG 102 3.455 15.455 10.812 101 HH12 ARG 102 HH22 ARG 102 3.542 15.710 12.522 102 HH21 ARG 102 HH11 ARG 102 5.615 18.478 12.279 103 HH22 ARG 102 HH12 ARG 102 4.762 17.418 13.352 104 H MET 103 HN MET 103 6.886 16.449 5.286 105 HA MET 103 HA MET 103 9.050 18.098 6.293 106 HB2 MET 103 HB2 MET 103 9.078 15.679 6.472 107 HB3 MET 103 HB1 MET 103 8.899 15.505 4.726 108 HG2 MET 103 HG2 MET 103 11.086 16.579 4.381 109 HG3 MET 103 HG1 MET 103 11.265 16.790 6.122 110 HE1 MET 103 HE1 MET 103 13.862 14.602 4.972 111 HE2 MET 103 HE2 MET 103 13.580 14.553 6.710 112 HE3 MET 103 HE3 MET 103 13.312 16.052 5.823 113 H PHE 104 HN PHE 104 8.387 16.808 3.004 114 HA PHE 104 HA PHE 104 10.380 18.318 1.652 115 HB2 PHE 104 HB2 PHE 104 7.689 17.202 0.812 116 HB3 PHE 104 HB1 PHE 104 8.863 17.850 -0.332 117 HD1 PHE 104 HD1 PHE 104 11.384 16.889 1.132 118 HD2 PHE 104 HD2 PHE 104 7.707 14.912 0.109 119 HE1 PHE 104 HE1 PHE 104 12.560 14.709 1.113 120 HE2 PHE 104 HE2 PHE 104 8.887 12.733 0.090 121 HZ PHE 104 HZ PHE 104 11.313 12.631 0.592 122 H ASP 105 HN ASP 105 7.098 19.173 2.643 123 HA ASP 105 HA ASP 105 6.773 21.532 1.059 124 HB2 ASP 105 HB2 ASP 105 4.943 20.445 2.229 125 HB3 ASP 105 HB1 ASP 105 5.735 20.697 3.785 126 H LYS 106 HN LYS 106 9.058 22.394 1.267 127 HA LYS 106 HA LYS 106 10.272 23.295 3.642 128 HB2 LYS 106 HB2 LYS 106 10.492 23.626 0.802 129 HB3 LYS 106 HB1 LYS 106 10.674 25.209 1.558 130 HG2 LYS 106 HG2 LYS 106 12.116 23.267 3.109 131 HG3 LYS 106 HG1 LYS 106 12.599 23.125 1.418 132 HD2 LYS 106 HD2 LYS 106 12.727 25.737 1.499 133 HD3 LYS 106 HD1 LYS 106 12.807 25.505 3.246 134 HE2 LYS 106 HE2 LYS 106 15.074 25.382 2.755 135 HE3 LYS 106 HE1 LYS 106 14.648 23.677 2.501 136 HZ1 LYS 106 HZ1 LYS 106 14.420 25.721 0.367 137 HZ2 LYS 106 HZ2 LYS 106 14.357 24.031 0.204 138 HZ3 LYS 106 HZ3 LYS 106 15.824 24.796 0.590 139 H ASN 107 HN ASN 107 7.426 24.494 2.050 140 HA ASN 107 HA ASN 107 7.513 27.161 3.267 141 HB2 ASN 107 HB2 ASN 107 6.436 26.363 1.050 142 HB3 ASN 107 HB1 ASN 107 5.130 25.748 2.064 143 HD21 ASN 107 HD21 ASN 107 3.505 27.296 1.522 144 HD22 ASN 107 HD22 ASN 107 3.664 28.956 1.841 145 H ALA 108 HN ALA 108 6.489 24.004 4.225 146 HA ALA 108 HA ALA 108 5.284 23.242 6.114 147 HB1 ALA 108 HB1 ALA 108 6.298 24.120 7.961 148 HB2 ALA 108 HB2 ALA 108 5.809 25.765 7.556 149 HB3 ALA 108 HB3 ALA 108 7.233 25.056 6.794 150 H ASP 109 HN ASP 109 3.274 23.712 4.701 151 HA ASP 109 HA ASP 109 1.534 25.662 6.156 152 HB2 ASP 109 HB2 ASP 109 0.714 26.478 3.995 153 HB3 ASP 109 HB1 ASP 109 2.468 26.651 4.061 154 H GLY 110 HN GLY 110 1.994 22.521 5.352 155 HA2 GLY 110 HA2 GLY 110 0.414 20.760 5.732 156 HA3 GLY 110 HA1 GLY 110 -0.894 21.932 5.567 157 H TYR 111 HN TYR 111 0.260 23.031 3.053 158 HA TYR 111 HA TYR 111 -0.430 20.741 1.237 159 HB2 TYR 111 HB2 TYR 111 -0.981 23.716 0.984 160 HB3 TYR 111 HB1 TYR 111 -1.452 22.491 -0.194 161 HD1 TYR 111 HD2 TYR 111 -1.855 23.459 3.396 162 HD2 TYR 111 HD1 TYR 111 -3.475 21.307 0.049 163 HE1 TYR 111 HE2 TYR 111 -3.929 23.017 4.683 164 HE2 TYR 111 HE1 TYR 111 -5.548 20.866 1.336 165 HH TYR 111 HH TYR 111 -5.788 21.177 4.598 166 H ILE 112 HN ILE 112 0.580 20.921 -0.943 167 HA ILE 112 HA ILE 112 3.221 22.345 -0.834 168 HB ILE 112 HB ILE 112 2.331 19.701 -2.017 169 HG12 ILE 112 HG12 ILE 112 4.591 20.335 -0.102 170 HG13 ILE 112 HG11 ILE 112 2.966 19.920 0.444 171 HG21 ILE 112 HG21 ILE 112 3.793 20.369 -3.688 172 HG22 ILE 112 HG22 ILE 112 4.937 19.672 -2.541 173 HG23 ILE 112 HG23 ILE 112 4.710 21.420 -2.609 174 HD11 ILE 112 HD11 ILE 112 5.059 18.192 -0.723 175 HD12 ILE 112 HD12 ILE 112 3.437 17.921 -1.359 176 HD13 ILE 112 HD13 ILE 112 3.740 17.780 0.373 177 H ASP 113 HN ASP 113 3.737 23.634 -2.610 178 HA ASP 113 HA ASP 113 1.647 23.848 -4.746 179 HB2 ASP 113 HB2 ASP 113 3.598 25.758 -3.452 180 HB3 ASP 113 HB1 ASP 113 2.805 26.155 -4.977 181 H LEU 114 HN LEU 114 2.850 24.962 -6.797 182 HA LEU 114 HA LEU 114 4.626 22.936 -7.864 183 HB2 LEU 114 HB2 LEU 114 3.609 25.644 -8.750 184 HB3 LEU 114 HB1 LEU 114 4.701 24.690 -9.754 185 HG LEU 114 HG LEU 114 2.548 23.033 -8.755 186 HD11 LEU 114 HD11 LEU 114 1.163 24.609 -10.657 187 HD12 LEU 114 HD12 LEU 114 1.816 25.732 -9.464 188 HD13 LEU 114 HD13 LEU 114 0.774 24.405 -8.949 189 HD21 LEU 114 HD21 LEU 114 2.624 22.215 -10.911 190 HD22 LEU 114 HD22 LEU 114 4.191 23.024 -10.879 191 HD23 LEU 114 HD23 LEU 114 2.804 23.818 -11.624 192 H ASP 115 HN ASP 115 5.085 26.263 -6.673 193 HA ASP 115 HA ASP 115 7.852 26.504 -7.414 194 HB2 ASP 115 HB2 ASP 115 5.843 27.860 -5.700 195 HB3 ASP 115 HB1 ASP 115 7.530 28.169 -5.290 196 H GLU 116 HN GLU 116 6.246 24.867 -4.786 197 HA GLU 116 HA GLU 116 8.786 24.629 -3.246 198 HB2 GLU 116 HB2 GLU 116 5.928 23.779 -2.671 199 HB3 GLU 116 HB1 GLU 116 7.263 23.719 -1.520 200 HG2 GLU 116 HG2 GLU 116 7.307 26.003 -1.236 201 HG3 GLU 116 HG1 GLU 116 6.749 26.324 -2.878 202 H LEU 117 HN LEU 117 6.863 22.879 -5.505 203 HA LEU 117 HA LEU 117 7.457 20.186 -4.642 204 HB2 LEU 117 HB2 LEU 117 6.478 21.575 -7.119 205 HB3 LEU 117 HB1 LEU 117 6.903 19.865 -7.208 206 HG LEU 117 HG LEU 117 5.095 20.896 -5.027 207 HD11 LEU 117 HD11 LEU 117 4.540 20.837 -7.863 208 HD12 LEU 117 HD12 LEU 117 3.493 21.355 -6.542 209 HD13 LEU 117 HD13 LEU 117 3.528 19.659 -7.026 210 HD21 LEU 117 HD21 LEU 117 5.370 18.211 -6.419 211 HD22 LEU 117 HD22 LEU 117 4.327 18.561 -5.041 212 HD23 LEU 117 HD23 LEU 117 6.080 18.618 -4.857 213 H LYS 118 HN LYS 118 9.183 22.553 -6.606 214 HA LYS 118 HA LYS 118 11.146 20.545 -7.538 215 HB2 LYS 118 HB2 LYS 118 11.935 22.357 -8.898 216 HB3 LYS 118 HB1 LYS 118 10.177 22.497 -8.874 217 HG2 LYS 118 HG2 LYS 118 11.121 23.920 -6.615 218 HG3 LYS 118 HG1 LYS 118 12.143 24.399 -7.971 219 HD2 LYS 118 HD2 LYS 118 9.913 24.630 -9.285 220 HD3 LYS 118 HD1 LYS 118 9.152 24.642 -7.694 221 HE2 LYS 118 HE2 LYS 118 9.989 26.719 -7.165 222 HE3 LYS 118 HE1 LYS 118 11.505 26.441 -8.046 223 HZ1 LYS 118 HZ1 LYS 118 8.843 26.836 -9.310 224 HZ2 LYS 118 HZ2 LYS 118 10.318 26.618 -10.125 225 HZ3 LYS 118 HZ3 LYS 118 10.051 28.022 -9.207 226 H ILE 119 HN ILE 119 10.718 22.539 -4.808 227 HA ILE 119 HA ILE 119 13.600 22.989 -4.327 228 HB ILE 119 HB ILE 119 11.099 23.533 -2.693 229 HG12 ILE 119 HG12 ILE 119 12.773 25.327 -4.483 230 HG13 ILE 119 HG11 ILE 119 11.151 24.736 -4.847 231 HG21 ILE 119 HG21 ILE 119 14.012 24.121 -2.298 232 HG22 ILE 119 HG22 ILE 119 12.795 23.658 -1.109 233 HG23 ILE 119 HG23 ILE 119 12.826 25.303 -1.745 234 HD11 ILE 119 HD11 ILE 119 11.516 26.126 -2.240 235 HD12 ILE 119 HD12 ILE 119 10.146 26.160 -3.350 236 HD13 ILE 119 HD13 ILE 119 11.581 27.127 -3.690 237 H MET 120 HN MET 120 11.184 20.621 -3.569 238 HA MET 120 HA MET 120 12.514 19.626 -1.146 239 HB2 MET 120 HB2 MET 120 10.706 17.997 -1.206 240 HB3 MET 120 HB1 MET 120 10.042 19.580 -1.613 241 HG2 MET 120 HG2 MET 120 9.177 18.536 -3.432 242 HG3 MET 120 HG1 MET 120 10.816 18.635 -4.078 243 HE1 MET 120 HE1 MET 120 7.969 16.891 -3.142 244 HE2 MET 120 HE2 MET 120 8.548 16.068 -1.696 245 HE3 MET 120 HE3 MET 120 8.295 15.153 -3.180 246 H LEU 121 HN LEU 121 12.671 19.026 -4.584 247 HA LEU 121 HA LEU 121 13.970 16.395 -4.273 248 HB2 LEU 121 HB2 LEU 121 13.448 18.213 -6.649 249 HB3 LEU 121 HB1 LEU 121 14.031 16.551 -6.758 250 HG LEU 121 HG LEU 121 11.429 17.358 -5.427 251 HD11 LEU 121 HD11 LEU 121 10.763 15.875 -7.630 252 HD12 LEU 121 HD12 LEU 121 12.142 16.792 -8.237 253 HD13 LEU 121 HD13 LEU 121 10.742 17.638 -7.579 254 HD21 LEU 121 HD21 LEU 121 12.273 15.288 -4.528 255 HD22 LEU 121 HD22 LEU 121 12.710 14.703 -6.133 256 HD23 LEU 121 HD23 LEU 121 11.012 14.866 -5.686 257 H GLN 122 HN GLN 122 14.915 19.712 -4.375 258 HA GLN 122 HA GLN 122 17.384 19.806 -5.631 259 HB2 GLN 122 HB2 GLN 122 15.925 21.295 -3.789 260 HB3 GLN 122 HB1 GLN 122 17.433 20.958 -2.938 261 HG2 GLN 122 HG2 GLN 122 17.767 21.740 -5.765 262 HG3 GLN 122 HG1 GLN 122 17.108 23.003 -4.725 263 HE21 GLN 122 HE21 GLN 122 19.604 20.430 -4.239 264 HE22 GLN 122 HE22 GLN 122 20.781 21.490 -3.628 265 H ALA 123 HN ALA 123 16.601 18.182 -2.586 266 HA ALA 123 HA ALA 123 19.208 17.711 -1.582 267 HB1 ALA 123 HB1 ALA 123 17.012 15.657 -1.470 268 HB2 ALA 123 HB2 ALA 123 16.780 17.226 -0.698 269 HB3 ALA 123 HB3 ALA 123 18.106 16.181 -0.189 270 H THR 124 HN THR 124 17.584 16.331 -4.341 271 HA THR 124 HA THR 124 19.668 14.194 -4.560 272 HB THR 124 HB THR 124 17.190 13.670 -4.586 273 HG1 THR 124 HG1 THR 124 18.847 13.116 -6.802 274 HG21 THR 124 HG21 THR 124 17.253 15.788 -6.527 275 HG22 THR 124 HG22 THR 124 15.853 14.952 -5.856 276 HG23 THR 124 HG23 THR 124 16.651 14.318 -7.294 277 H GLY 125 HN GLY 125 19.018 17.299 -5.656 278 HA2 GLY 125 HA2 GLY 125 20.332 18.515 -7.238 279 HA3 GLY 125 HA1 GLY 125 20.933 16.984 -7.878 280 H GLU 126 HN GLU 126 17.525 17.724 -7.365 281 HA GLU 126 HA GLU 126 16.533 16.759 -9.772 282 HB2 GLU 126 HB2 GLU 126 14.625 18.250 -9.310 283 HB3 GLU 126 HB1 GLU 126 15.238 17.560 -7.807 284 HG2 GLU 126 HG2 GLU 126 15.427 19.669 -7.034 285 HG3 GLU 126 HG1 GLU 126 16.756 19.879 -8.174 286 H THR 127 HN THR 127 17.962 17.294 -11.540 287 HA THR 127 HA THR 127 18.017 20.190 -12.309 288 HB THR 127 HB THR 127 20.217 19.283 -12.033 289 HG1 THR 127 HG1 THR 127 19.692 18.929 -14.786 290 HG21 THR 127 HG21 THR 127 20.817 17.160 -13.367 291 HG22 THR 127 HG22 THR 127 19.077 16.905 -13.498 292 HG23 THR 127 HG23 THR 127 19.845 16.949 -11.911 293 H ILE 128 HN ILE 128 15.997 20.256 -13.418 294 HA ILE 128 HA ILE 128 15.936 18.691 -15.971 295 HB ILE 128 HB ILE 128 13.589 18.207 -15.561 296 HG12 ILE 128 HG12 ILE 128 13.974 19.924 -13.089 297 HG13 ILE 128 HG11 ILE 128 12.946 20.292 -14.475 298 HG21 ILE 128 HG21 ILE 128 13.864 16.610 -13.887 299 HG22 ILE 128 HG22 ILE 128 14.832 17.687 -12.879 300 HG23 ILE 128 HG23 ILE 128 15.541 16.948 -14.315 301 HD11 ILE 128 HD11 ILE 128 12.376 18.627 -12.160 302 HD12 ILE 128 HD12 ILE 128 12.141 17.737 -13.665 303 HD13 ILE 128 HD13 ILE 128 11.272 19.247 -13.387 304 H THR 129 HN THR 129 14.235 19.713 -17.492 305 HA THR 129 HA THR 129 14.776 22.551 -17.757 306 HB THR 129 HB THR 129 13.305 22.288 -19.728 307 HG1 THR 129 HG1 THR 129 11.719 20.977 -18.968 308 HG21 THR 129 HG21 THR 129 15.017 21.273 -20.771 309 HG22 THR 129 HG22 THR 129 14.616 19.730 -20.017 310 HG23 THR 129 HG23 THR 129 15.678 20.867 -19.187 311 H GLU 130 HN GLU 130 13.090 24.235 -17.774 312 HA GLU 130 HA GLU 130 11.444 24.302 -15.462 313 HB2 GLU 130 HB2 GLU 130 10.591 26.346 -16.477 314 HB3 GLU 130 HB1 GLU 130 12.310 26.214 -16.853 315 HG2 GLU 130 HG2 GLU 130 11.608 25.077 -19.030 316 HG3 GLU 130 HG1 GLU 130 9.966 25.606 -18.664 317 H ASP 131 HN ASP 131 10.743 23.269 -18.778 318 HA ASP 131 HA ASP 131 7.891 23.113 -18.557 319 HB2 ASP 131 HB2 ASP 131 10.006 21.735 -20.223 320 HB3 ASP 131 HB1 ASP 131 8.286 21.427 -20.465 321 H ASP 132 HN ASP 132 10.433 21.136 -17.264 322 HA ASP 132 HA ASP 132 8.661 18.797 -16.845 323 HB2 ASP 132 HB2 ASP 132 11.567 19.486 -16.428 324 HB3 ASP 132 HB1 ASP 132 10.883 18.026 -15.711 325 H ILE 133 HN ILE 133 10.072 21.485 -15.048 326 HA ILE 133 HA ILE 133 9.769 20.629 -12.386 327 HB ILE 133 HB ILE 133 9.257 23.330 -13.677 328 HG12 ILE 133 HG12 ILE 133 11.503 22.183 -14.047 329 HG13 ILE 133 HG11 ILE 133 11.584 23.762 -13.264 330 HG21 ILE 133 HG21 ILE 133 10.198 23.903 -11.213 331 HG22 ILE 133 HG22 ILE 133 9.341 22.406 -10.850 332 HG23 ILE 133 HG23 ILE 133 8.475 23.766 -11.564 333 HD11 ILE 133 HD11 ILE 133 11.352 21.303 -11.561 334 HD12 ILE 133 HD12 ILE 133 12.098 22.856 -11.182 335 HD13 ILE 133 HD13 ILE 133 12.919 21.722 -12.254 336 H GLU 134 HN GLU 134 7.327 22.093 -14.546 337 HA GLU 134 HA GLU 134 5.200 22.010 -12.566 338 HB2 GLU 134 HB2 GLU 134 5.307 22.328 -15.582 339 HB3 GLU 134 HB1 GLU 134 3.830 22.522 -14.635 340 HG2 GLU 134 HG2 GLU 134 4.471 24.698 -14.480 341 HG3 GLU 134 HG1 GLU 134 5.579 24.106 -13.242 342 H GLU 135 HN GLU 135 6.407 19.822 -15.054 343 HA GLU 135 HA GLU 135 4.204 18.073 -15.346 344 HB2 GLU 135 HB2 GLU 135 6.369 18.103 -16.622 345 HB3 GLU 135 HB1 GLU 135 7.157 17.383 -15.218 346 HG2 GLU 135 HG2 GLU 135 4.697 16.050 -16.263 347 HG3 GLU 135 HG1 GLU 135 6.187 15.868 -17.189 348 H LEU 136 HN LEU 136 6.439 18.481 -12.678 349 HA LEU 136 HA LEU 136 6.036 15.960 -11.363 350 HB2 LEU 136 HB2 LEU 136 6.987 18.717 -10.689 351 HB3 LEU 136 HB1 LEU 136 6.630 17.623 -9.351 352 HG LEU 136 HG LEU 136 8.150 16.314 -11.475 353 HD11 LEU 136 HD11 LEU 136 10.221 17.719 -10.335 354 HD12 LEU 136 HD12 LEU 136 8.994 18.971 -10.526 355 HD13 LEU 136 HD13 LEU 136 9.541 18.052 -11.928 356 HD21 LEU 136 HD21 LEU 136 8.415 15.098 -9.579 357 HD22 LEU 136 HD22 LEU 136 7.963 16.458 -8.550 358 HD23 LEU 136 HD23 LEU 136 9.623 16.301 -9.126 359 H MET 137 HN MET 137 4.058 18.815 -11.653 360 HA MET 137 HA MET 137 2.374 18.174 -9.324 361 HB2 MET 137 HB2 MET 137 2.849 20.487 -10.009 362 HB3 MET 137 HB1 MET 137 2.143 20.176 -11.595 363 HG2 MET 137 HG2 MET 137 0.594 21.335 -9.958 364 HG3 MET 137 HG1 MET 137 -0.042 19.842 -10.647 365 HE1 MET 137 HE1 MET 137 1.045 21.902 -8.113 366 HE2 MET 137 HE2 MET 137 1.627 20.976 -6.731 367 HE3 MET 137 HE3 MET 137 -0.086 21.362 -6.865 368 H LYS 138 HN LYS 138 2.203 17.910 -12.869 369 HA LYS 138 HA LYS 138 -0.480 17.216 -13.256 370 HB2 LYS 138 HB2 LYS 138 2.145 16.657 -14.512 371 HB3 LYS 138 HB1 LYS 138 0.852 15.543 -14.960 372 HG2 LYS 138 HG2 LYS 138 -0.585 17.463 -15.568 373 HG3 LYS 138 HG1 LYS 138 0.723 18.568 -15.145 374 HD2 LYS 138 HD2 LYS 138 1.281 18.385 -17.343 375 HD3 LYS 138 HD1 LYS 138 2.012 16.859 -16.845 376 HE2 LYS 138 HE2 LYS 138 0.574 15.758 -18.203 377 HE3 LYS 138 HE1 LYS 138 -0.783 16.389 -17.249 378 HZ1 LYS 138 HZ1 LYS 138 -0.844 18.352 -18.531 379 HZ2 LYS 138 HZ2 LYS 138 -0.741 17.083 -19.656 380 HZ3 LYS 138 HZ3 LYS 138 0.634 18.009 -19.288 381 H ASP 139 HN ASP 139 2.037 15.394 -11.659 382 HA ASP 139 HA ASP 139 0.415 12.903 -11.655 383 HB2 ASP 139 HB2 ASP 139 3.212 13.732 -10.894 384 HB3 ASP 139 HB1 ASP 139 2.563 12.191 -10.334 385 H GLY 140 HN GLY 140 1.834 15.250 -9.363 386 HA2 GLY 140 HA2 GLY 140 0.693 14.011 -7.019 387 HA3 GLY 140 HA1 GLY 140 1.347 15.648 -7.098 388 H ASP 141 HN ASP 141 -0.557 16.123 -9.463 389 HA ASP 141 HA ASP 141 -3.199 16.101 -8.123 390 HB2 ASP 141 HB2 ASP 141 -1.459 18.180 -7.689 391 HB3 ASP 141 HB1 ASP 141 -2.369 18.770 -9.081 392 H LYS 142 HN LYS 142 -3.145 14.672 -10.246 393 HA LYS 142 HA LYS 142 -2.972 15.657 -12.852 394 HB2 LYS 142 HB2 LYS 142 -4.264 13.495 -11.402 395 HB3 LYS 142 HB1 LYS 142 -5.259 14.016 -12.762 396 HG2 LYS 142 HG2 LYS 142 -2.622 13.976 -13.743 397 HG3 LYS 142 HG1 LYS 142 -2.790 12.501 -12.791 398 HD2 LYS 142 HD2 LYS 142 -3.842 11.611 -14.579 399 HD3 LYS 142 HD1 LYS 142 -5.197 12.670 -14.185 400 HE2 LYS 142 HE2 LYS 142 -4.763 13.273 -16.414 401 HE3 LYS 142 HE1 LYS 142 -3.778 14.462 -15.538 402 HZ1 LYS 142 HZ1 LYS 142 -2.759 12.833 -17.368 403 HZ2 LYS 142 HZ2 LYS 142 -2.571 11.852 -15.994 404 HZ3 LYS 142 HZ3 LYS 142 -1.865 13.397 -16.042 405 H ASN 143 HN ASN 143 -5.350 16.388 -10.412 406 HA ASN 143 HA ASN 143 -7.216 17.641 -12.340 407 HB2 ASN 143 HB2 ASN 143 -8.415 18.161 -10.123 408 HB3 ASN 143 HB1 ASN 143 -8.223 16.456 -10.527 409 HD21 ASN 143 HD21 ASN 143 -7.500 18.863 -8.144 410 HD22 ASN 143 HD22 ASN 143 -6.492 17.902 -7.176 411 H ASN 144 HN ASN 144 -4.405 18.675 -11.850 412 HA ASN 144 HA ASN 144 -3.323 20.737 -11.400 413 HB2 ASN 144 HB2 ASN 144 -4.568 21.153 -13.452 414 HB3 ASN 144 HB1 ASN 144 -6.030 21.510 -12.531 415 HD21 ASN 144 HD21 ASN 144 -5.460 23.596 -14.061 416 HD22 ASN 144 HD22 ASN 144 -4.630 24.828 -13.240 417 H ASP 145 HN ASP 145 -6.402 22.296 -10.868 418 HA ASP 145 HA ASP 145 -7.377 23.204 -8.910 419 HB2 ASP 145 HB2 ASP 145 -6.386 20.678 -8.275 420 HB3 ASP 145 HB1 ASP 145 -5.694 21.719 -7.030 421 H GLY 146 HN GLY 146 -3.916 22.520 -8.217 422 HA2 GLY 146 HA2 GLY 146 -2.300 24.404 -8.261 423 HA3 GLY 146 HA1 GLY 146 -3.589 25.434 -7.639 424 H ARG 147 HN ARG 147 -3.776 22.418 -6.180 425 HA ARG 147 HA ARG 147 -1.863 23.076 -4.002 426 HB2 ARG 147 HB2 ARG 147 -4.722 23.568 -4.007 427 HB3 ARG 147 HB1 ARG 147 -4.292 22.432 -2.727 428 HG2 ARG 147 HG2 ARG 147 -2.431 24.047 -2.085 429 HG3 ARG 147 HG1 ARG 147 -3.179 25.208 -3.182 430 HD2 ARG 147 HD2 ARG 147 -4.690 23.853 -0.924 431 HD3 ARG 147 HD1 ARG 147 -3.937 25.455 -0.781 432 HE ARG 147 HE ARG 147 -6.362 24.867 -2.258 433 HH11 ARG 147 HH21 ARG 147 -3.474 26.761 -2.180 434 HH12 ARG 147 HH22 ARG 147 -4.146 28.058 -3.109 435 HH21 ARG 147 HH11 ARG 147 -7.248 26.551 -3.470 436 HH22 ARG 147 HH12 ARG 147 -6.281 27.940 -3.838 437 H ILE 148 HN ILE 148 -0.969 21.197 -3.238 438 HA ILE 148 HA ILE 148 -2.170 18.613 -4.109 439 HB ILE 148 HB ILE 148 0.525 19.261 -2.871 440 HG12 ILE 148 HG12 ILE 148 -0.277 18.998 -5.788 441 HG13 ILE 148 HG11 ILE 148 0.170 20.502 -4.981 442 HG21 ILE 148 HG21 ILE 148 0.080 16.919 -2.691 443 HG22 ILE 148 HG22 ILE 148 1.111 17.102 -4.110 444 HG23 ILE 148 HG23 ILE 148 -0.624 16.858 -4.307 445 HD11 ILE 148 HD11 ILE 148 1.914 18.743 -6.272 446 HD12 ILE 148 HD12 ILE 148 2.166 18.423 -4.556 447 HD13 ILE 148 HD13 ILE 148 2.371 20.056 -5.188 448 H ASP 149 HN ASP 149 -3.512 17.696 -2.600 449 HA ASP 149 HA ASP 149 -3.077 18.252 0.289 450 HB2 ASP 149 HB2 ASP 149 -5.293 18.384 -1.093 451 HB3 ASP 149 HB1 ASP 149 -5.299 16.627 -0.939 452 H TYR 150 HN TYR 150 -3.407 16.290 1.768 453 HA TYR 150 HA TYR 150 -1.437 14.361 1.557 454 HB2 TYR 150 HB2 TYR 150 -3.355 14.965 3.324 455 HB3 TYR 150 HB1 TYR 150 -4.108 13.534 2.619 456 HD1 TYR 150 HD2 TYR 150 -1.666 11.946 1.931 457 HD2 TYR 150 HD1 TYR 150 -2.663 14.186 5.458 458 HE1 TYR 150 HE2 TYR 150 -0.172 10.493 3.276 459 HE2 TYR 150 HE1 TYR 150 -1.170 12.734 6.803 460 HH TYR 150 HH TYR 150 0.672 10.083 5.281 461 H ASP 151 HN ASP 151 -4.852 13.510 0.885 462 HA ASP 151 HA ASP 151 -4.507 11.074 -0.381 463 HB2 ASP 151 HB2 ASP 151 -6.593 12.575 0.132 464 HB3 ASP 151 HB1 ASP 151 -6.365 13.154 -1.519 465 H GLU 152 HN GLU 152 -4.331 14.281 -1.972 466 HA GLU 152 HA GLU 152 -3.693 13.246 -4.585 467 HB2 GLU 152 HB2 GLU 152 -3.149 15.929 -3.270 468 HB3 GLU 152 HB1 GLU 152 -3.116 15.620 -5.007 469 HG2 GLU 152 HG2 GLU 152 -5.477 15.000 -4.981 470 HG3 GLU 152 HG1 GLU 152 -5.533 15.188 -3.228 471 H PHE 153 HN PHE 153 -1.781 13.920 -1.726 472 HA PHE 153 HA PHE 153 0.806 14.163 -2.936 473 HB2 PHE 153 HB2 PHE 153 0.034 14.668 -0.555 474 HB3 PHE 153 HB1 PHE 153 0.112 12.932 -0.255 475 HD1 PHE 153 HD1 PHE 153 2.258 15.504 -1.966 476 HD2 PHE 153 HD2 PHE 153 2.060 12.215 0.790 477 HE1 PHE 153 HE1 PHE 153 4.702 15.676 -1.584 478 HE2 PHE 153 HE2 PHE 153 4.504 12.387 1.171 479 HZ PHE 153 HZ PHE 153 5.826 14.117 -0.016 480 H LEU 154 HN LEU 154 -1.292 11.440 -2.500 481 HA LEU 154 HA LEU 154 0.744 9.369 -2.476 482 HB2 LEU 154 HB2 LEU 154 -2.080 9.665 -2.241 483 HB3 LEU 154 HB1 LEU 154 -1.786 8.513 -3.544 484 HG LEU 154 HG LEU 154 -1.883 7.260 -1.485 485 HD11 LEU 154 HD11 LEU 154 1.077 7.484 -1.797 486 HD12 LEU 154 HD12 LEU 154 0.140 7.044 -3.226 487 HD13 LEU 154 HD13 LEU 154 0.056 6.046 -1.775 488 HD21 LEU 154 HD21 LEU 154 0.241 9.172 -0.459 489 HD22 LEU 154 HD22 LEU 154 -0.422 7.796 0.423 490 HD23 LEU 154 HD23 LEU 154 -1.452 9.175 0.035 491 H GLU 155 HN GLU 155 -1.657 10.188 -5.017 492 HA GLU 155 HA GLU 155 -0.509 8.757 -7.141 493 HB2 GLU 155 HB2 GLU 155 -1.933 11.439 -7.087 494 HB3 GLU 155 HB1 GLU 155 -1.701 10.469 -8.542 495 HG2 GLU 155 HG2 GLU 155 -2.881 9.066 -6.202 496 HG3 GLU 155 HG1 GLU 155 -3.903 10.268 -6.992 497 H PHE 156 HN PHE 156 0.573 11.730 -5.650 498 HA PHE 156 HA PHE 156 2.125 12.931 -7.658 499 HB2 PHE 156 HB2 PHE 156 1.813 13.935 -5.494 500 HB3 PHE 156 HB1 PHE 156 2.542 12.550 -4.681 501 HD1 PHE 156 HD1 PHE 156 3.540 14.651 -7.629 502 HD2 PHE 156 HD2 PHE 156 4.610 13.110 -3.765 503 HE1 PHE 156 HE1 PHE 156 5.774 15.711 -7.825 504 HE2 PHE 156 HE2 PHE 156 6.843 14.169 -3.961 505 HZ PHE 156 HZ PHE 156 7.426 15.470 -5.990 506 H MET 157 HN MET 157 3.487 10.728 -5.178 507 HA MET 157 HA MET 157 5.660 10.018 -7.085 508 HB2 MET 157 HB2 MET 157 6.795 9.268 -5.074 509 HB3 MET 157 HB1 MET 157 6.068 10.837 -4.733 510 HG2 MET 157 HG2 MET 157 4.041 9.040 -4.115 511 HG3 MET 157 HG1 MET 157 5.498 8.232 -3.537 512 HE1 MET 157 HE1 MET 157 7.168 10.889 -1.295 513 HE2 MET 157 HE2 MET 157 7.441 10.348 -2.949 514 HE3 MET 157 HE3 MET 157 7.112 9.164 -1.686 515 H LYS 158 HN LYS 158 2.839 8.677 -5.512 516 HA LYS 158 HA LYS 158 1.788 6.576 -5.769 517 HB2 LYS 158 HB2 LYS 158 2.579 7.346 -8.177 518 HB3 LYS 158 HB1 LYS 158 3.704 5.999 -8.005 519 HG2 LYS 158 HG2 LYS 158 1.528 4.701 -7.231 520 HG3 LYS 158 HG1 LYS 158 0.712 5.960 -8.160 521 HD2 LYS 158 HD2 LYS 158 1.842 5.360 -10.166 522 HD3 LYS 158 HD1 LYS 158 3.017 4.372 -9.298 523 HE2 LYS 158 HE2 LYS 158 1.566 2.588 -9.090 524 HE3 LYS 158 HE1 LYS 158 0.134 3.633 -9.001 525 HZ1 LYS 158 HZ1 LYS 158 1.619 2.716 -11.355 526 HZ2 LYS 158 HZ2 LYS 158 0.934 4.269 -11.406 527 HZ3 LYS 158 HZ3 LYS 158 -0.053 2.910 -11.145 528 H GLY 159 HN GLY 159 4.344 6.896 -4.157 529 HA2 GLY 159 HA2 GLY 159 5.237 5.172 -2.701 530 HA3 GLY 159 HA1 GLY 159 4.946 3.989 -3.977 531 H VAL 160 HN VAL 160 6.259 4.459 -6.055 532 HA VAL 160 HA VAL 160 8.486 4.258 -6.884 533 HB VAL 160 HB VAL 160 7.834 6.523 -7.392 534 HG11 VAL 160 HG11 VAL 160 8.296 8.355 -5.721 535 HG12 VAL 160 HG12 VAL 160 8.613 7.105 -4.521 536 HG13 VAL 160 HG13 VAL 160 7.009 7.252 -5.239 537 HG21 VAL 160 HG21 VAL 160 10.422 5.730 -7.184 538 HG22 VAL 160 HG22 VAL 160 10.444 7.137 -6.120 539 HG23 VAL 160 HG23 VAL 160 9.943 7.312 -7.802 540 H GLU 161 HN GLU 161 9.189 2.675 -5.188 541 HA GLU 161 HA GLU 161 10.592 1.995 -3.396 542 HB2 GLU 161 HB2 GLU 161 12.008 4.228 -4.862 543 HB3 GLU 161 HB1 GLU 161 12.808 3.299 -3.595 544 HG2 GLU 161 HG2 GLU 161 12.250 1.204 -4.842 545 HG3 GLU 161 HG1 GLU 161 11.594 2.195 -6.145 546 HO1 KDH 1 H1 KDH 1 8.433 9.677 -11.490 547 H21 KDH 1 H21 KDH 1 10.833 7.750 -4.425 548 H33 KDH 1 H33 KDH 1 9.068 13.280 -5.764 549 H4 KDH 1 H4 KDH 1 9.857 9.598 -8.104 550 HO7 KDH 1 H7 KDH 1 6.961 10.228 -11.628 551 H01 KDH 1 H01 KDH 1 11.038 13.249 -4.143 552 H01A KDH 1 H02 KDH 1 9.495 12.477 -3.600 553 HO03 KDH 1 H03 KDH 1 12.503 13.107 -3.157 554 HO10 KDH 1 H10 KDH 1 5.380 13.240 -8.358 555 H12 KDH 1 H12 KDH 1 6.847 12.524 -6.767 556 H15 KDH 1 H15 KDH 1 8.141 11.193 -5.294 557 H26 KDH 1 H26 KDH 1 13.469 9.980 -1.717 558 H39 KDH 1 H39 KDH 1 11.136 11.097 -9.097 559 H41 KDH 1 H41 KDH 1 11.905 15.425 -8.914 560 HO02 KDH 1 H42 KDH 1 12.128 6.837 -2.635 561 HO44 KDH 1 H44 KDH 1 13.567 16.192 -10.309 562 HO47 KDH 1 H47 KDH 1 15.177 13.016 -11.595 563 HO50 KDH 1 H50 KDH 1 12.208 9.980 -10.818 Start of MODEL 7 1 H1 MET 90 HT1 MET 90 13.283 6.621 1.548 2 H2 MET 90 HT2 MET 90 14.276 7.306 2.744 3 H3 MET 90 HT3 MET 90 12.901 8.141 2.198 4 HA MET 90 HA MET 90 12.835 5.544 3.653 5 HB2 MET 90 HB2 MET 90 12.973 8.404 4.420 6 HB3 MET 90 HB1 MET 90 11.751 7.458 5.269 7 HG2 MET 90 HG2 MET 90 13.524 6.964 6.637 8 HG3 MET 90 HG1 MET 90 13.815 5.727 5.413 9 HE1 MET 90 HE1 MET 90 16.486 8.834 6.890 10 HE2 MET 90 HE2 MET 90 16.325 7.145 7.366 11 HE3 MET 90 HE3 MET 90 14.932 8.220 7.471 12 H GLY 91 HN GLY 91 11.447 6.830 1.150 13 HA2 GLY 91 HA2 GLY 91 8.688 7.186 2.071 14 HA3 GLY 91 HA1 GLY 91 9.229 7.195 0.392 15 H LYS 92 HN LYS 92 7.394 5.481 2.524 16 HA LYS 92 HA LYS 92 7.641 3.005 0.867 17 HB2 LYS 92 HB2 LYS 92 7.854 3.356 3.855 18 HB3 LYS 92 HB1 LYS 92 7.312 1.822 3.173 19 HG2 LYS 92 HG2 LYS 92 9.399 1.267 2.512 20 HG3 LYS 92 HG1 LYS 92 9.683 2.863 1.816 21 HD2 LYS 92 HD2 LYS 92 10.383 3.766 3.899 22 HD3 LYS 92 HD1 LYS 92 9.729 2.398 4.801 23 HE2 LYS 92 HE2 LYS 92 11.766 1.727 2.739 24 HE3 LYS 92 HE1 LYS 92 12.355 2.587 4.175 25 HZ1 LYS 92 HZ1 LYS 92 10.401 0.473 4.621 26 HZ2 LYS 92 HZ2 LYS 92 11.752 0.915 5.552 27 HZ3 LYS 92 HZ3 LYS 92 11.951 -0.032 4.156 28 H SER 93 HN SER 93 5.771 3.207 3.818 29 HA SER 93 HA SER 93 3.272 2.975 2.225 30 HB2 SER 93 HB2 SER 93 2.386 2.041 4.236 31 HB3 SER 93 HB1 SER 93 4.038 1.437 4.144 32 HG SER 93 HG SER 93 3.748 2.243 6.186 33 H GLU 94 HN GLU 94 1.388 4.067 3.863 34 HA GLU 94 HA GLU 94 1.692 6.909 3.439 35 HB2 GLU 94 HB2 GLU 94 -0.341 5.059 3.921 36 HB3 GLU 94 HB1 GLU 94 -0.361 6.099 5.348 37 HG2 GLU 94 HG2 GLU 94 -1.092 7.901 4.175 38 HG3 GLU 94 HG1 GLU 94 -0.033 7.554 2.807 39 H GLU 95 HN GLU 95 2.850 4.865 5.889 40 HA GLU 95 HA GLU 95 2.558 6.480 8.232 41 HB2 GLU 95 HB2 GLU 95 4.429 4.346 7.236 42 HB3 GLU 95 HB1 GLU 95 4.768 5.148 8.770 43 HG2 GLU 95 HG2 GLU 95 1.961 4.355 8.498 44 HG3 GLU 95 HG1 GLU 95 3.070 2.985 8.434 45 H GLU 96 HN GLU 96 5.653 6.018 6.499 46 HA GLU 96 HA GLU 96 6.746 8.521 7.453 47 HB2 GLU 96 HB2 GLU 96 7.633 6.158 6.290 48 HB3 GLU 96 HB1 GLU 96 7.920 7.356 5.028 49 HG2 GLU 96 HG2 GLU 96 9.374 8.612 6.367 50 HG3 GLU 96 HG1 GLU 96 8.729 7.940 7.865 51 H LEU 97 HN LEU 97 4.880 7.568 4.663 52 HA LEU 97 HA LEU 97 5.478 9.576 2.778 53 HB2 LEU 97 HB2 LEU 97 3.376 7.673 3.439 54 HB3 LEU 97 HB1 LEU 97 2.706 9.133 2.714 55 HG LEU 97 HG LEU 97 3.420 7.244 1.113 56 HD11 LEU 97 HD11 LEU 97 3.068 9.076 -0.168 57 HD12 LEU 97 HD12 LEU 97 4.826 9.227 -0.185 58 HD13 LEU 97 HD13 LEU 97 3.872 10.144 0.983 59 HD21 LEU 97 HD21 LEU 97 5.669 6.807 0.766 60 HD22 LEU 97 HD22 LEU 97 5.700 7.161 2.493 61 HD23 LEU 97 HD23 LEU 97 6.173 8.400 1.331 62 H SER 98 HN SER 98 3.430 9.721 5.672 63 HA SER 98 HA SER 98 2.316 12.342 5.090 64 HB2 SER 98 HB2 SER 98 1.564 10.331 6.627 65 HB3 SER 98 HB1 SER 98 2.561 11.141 7.833 66 HG SER 98 HG SER 98 1.088 12.628 8.001 67 H ASP 99 HN ASP 99 5.305 11.222 6.469 68 HA ASP 99 HA ASP 99 5.836 13.764 7.881 69 HB2 ASP 99 HB2 ASP 99 7.701 11.440 7.355 70 HB3 ASP 99 HB1 ASP 99 7.766 12.597 8.683 71 H LEU 100 HN LEU 100 7.566 11.896 5.341 72 HA LEU 100 HA LEU 100 9.362 13.892 4.526 73 HB2 LEU 100 HB2 LEU 100 9.567 12.564 2.533 74 HB3 LEU 100 HB1 LEU 100 9.155 11.446 3.833 75 HG LEU 100 HG LEU 100 6.672 12.042 3.059 76 HD11 LEU 100 HD11 LEU 100 7.489 11.899 0.322 77 HD12 LEU 100 HD12 LEU 100 8.310 13.271 1.065 78 HD13 LEU 100 HD13 LEU 100 6.550 13.165 1.113 79 HD21 LEU 100 HD21 LEU 100 7.338 9.780 3.059 80 HD22 LEU 100 HD22 LEU 100 8.643 10.070 1.910 81 HD23 LEU 100 HD23 LEU 100 6.967 10.086 1.362 82 H PHE 101 HN PHE 101 5.919 13.605 3.846 83 HA PHE 101 HA PHE 101 5.728 15.374 1.612 84 HB2 PHE 101 HB2 PHE 101 3.889 13.971 2.280 85 HB3 PHE 101 HB1 PHE 101 3.877 14.659 3.904 86 HD1 PHE 101 HD1 PHE 101 3.080 15.279 0.351 87 HD2 PHE 101 HD2 PHE 101 2.899 16.833 4.350 88 HE1 PHE 101 HE1 PHE 101 1.511 17.045 -0.407 89 HE2 PHE 101 HE2 PHE 101 1.330 18.599 3.593 90 HZ PHE 101 HZ PHE 101 0.636 18.705 1.214 91 H ARG 102 HN ARG 102 5.098 16.091 5.069 92 HA ARG 102 HA ARG 102 5.099 18.968 4.641 93 HB2 ARG 102 HB2 ARG 102 5.070 18.909 7.184 94 HB3 ARG 102 HB1 ARG 102 3.792 17.970 6.411 95 HG2 ARG 102 HG2 ARG 102 4.694 15.958 7.049 96 HG3 ARG 102 HG1 ARG 102 6.351 16.550 6.935 97 HD2 ARG 102 HD2 ARG 102 5.398 16.059 9.312 98 HD3 ARG 102 HD1 ARG 102 6.241 17.601 9.068 99 HE ARG 102 HE ARG 102 4.170 18.703 9.336 100 HH11 ARG 102 HH21 ARG 102 3.750 15.365 8.550 101 HH12 ARG 102 HH22 ARG 102 2.028 15.408 8.727 102 HH21 ARG 102 HH11 ARG 102 1.927 18.770 9.570 103 HH22 ARG 102 HH12 ARG 102 0.996 17.334 9.303 104 H MET 103 HN MET 103 7.572 16.635 4.958 105 HA MET 103 HA MET 103 9.550 18.222 6.364 106 HB2 MET 103 HB2 MET 103 9.376 15.674 5.961 107 HB3 MET 103 HB1 MET 103 10.053 16.009 4.367 108 HG2 MET 103 HG2 MET 103 11.648 17.443 6.204 109 HG3 MET 103 HG1 MET 103 11.413 15.843 6.909 110 HE1 MET 103 HE1 MET 103 13.613 14.211 6.367 111 HE2 MET 103 HE2 MET 103 13.805 15.887 6.876 112 HE3 MET 103 HE3 MET 103 14.808 15.248 5.575 113 H PHE 104 HN PHE 104 9.054 17.453 2.897 114 HA PHE 104 HA PHE 104 11.169 19.234 2.003 115 HB2 PHE 104 HB2 PHE 104 8.817 17.918 0.606 116 HB3 PHE 104 HB1 PHE 104 10.175 18.682 -0.220 117 HD1 PHE 104 HD1 PHE 104 12.549 17.897 1.056 118 HD2 PHE 104 HD2 PHE 104 8.954 15.595 0.579 119 HE1 PHE 104 HE1 PHE 104 13.861 15.804 1.270 120 HE2 PHE 104 HE2 PHE 104 10.267 13.501 0.794 121 HZ PHE 104 HZ PHE 104 12.720 13.606 1.140 122 H ASP 105 HN ASP 105 7.957 19.743 3.067 123 HA ASP 105 HA ASP 105 7.253 21.999 1.389 124 HB2 ASP 105 HB2 ASP 105 5.843 20.401 2.908 125 HB3 ASP 105 HB1 ASP 105 6.279 21.521 4.201 126 H LYS 106 HN LYS 106 9.704 22.793 1.841 127 HA LYS 106 HA LYS 106 10.581 23.982 4.195 128 HB2 LYS 106 HB2 LYS 106 11.376 23.894 1.609 129 HB3 LYS 106 HB1 LYS 106 10.846 25.574 1.696 130 HG2 LYS 106 HG2 LYS 106 12.395 26.107 3.385 131 HG3 LYS 106 HG1 LYS 106 12.631 24.416 3.828 132 HD2 LYS 106 HD2 LYS 106 13.344 24.510 1.134 133 HD3 LYS 106 HD1 LYS 106 14.009 26.000 1.805 134 HE2 LYS 106 HE2 LYS 106 15.626 24.860 2.916 135 HE3 LYS 106 HE1 LYS 106 14.438 23.727 3.594 136 HZ1 LYS 106 HZ1 LYS 106 16.205 23.044 1.710 137 HZ2 LYS 106 HZ2 LYS 106 14.894 23.512 0.735 138 HZ3 LYS 106 HZ3 LYS 106 14.698 22.289 1.898 139 H ASN 107 HN ASN 107 8.014 25.094 2.052 140 HA ASN 107 HA ASN 107 7.801 27.762 3.175 141 HB2 ASN 107 HB2 ASN 107 7.023 26.823 0.906 142 HB3 ASN 107 HB1 ASN 107 5.648 26.154 1.785 143 HD21 ASN 107 HD21 ASN 107 4.059 27.586 0.848 144 HD22 ASN 107 HD22 ASN 107 4.045 29.254 1.164 145 H ALA 108 HN ALA 108 6.681 24.610 4.128 146 HA ALA 108 HA ALA 108 5.326 23.907 5.934 147 HB1 ALA 108 HB1 ALA 108 7.025 24.970 7.225 148 HB2 ALA 108 HB2 ALA 108 5.506 25.584 7.878 149 HB3 ALA 108 HB3 ALA 108 6.460 26.580 6.779 150 H ASP 109 HN ASP 109 3.407 24.215 4.416 151 HA ASP 109 HA ASP 109 1.550 26.246 5.580 152 HB2 ASP 109 HB2 ASP 109 1.858 25.694 2.618 153 HB3 ASP 109 HB1 ASP 109 0.934 26.992 3.376 154 H GLY 110 HN GLY 110 2.096 23.051 4.981 155 HA2 GLY 110 HA2 GLY 110 0.504 21.306 5.387 156 HA3 GLY 110 HA1 GLY 110 -0.797 22.454 5.070 157 H TYR 111 HN TYR 111 0.996 23.208 2.586 158 HA TYR 111 HA TYR 111 0.305 20.847 0.887 159 HB2 TYR 111 HB2 TYR 111 -0.395 23.714 0.201 160 HB3 TYR 111 HB1 TYR 111 -0.947 22.248 -0.610 161 HD1 TYR 111 HD2 TYR 111 -1.150 24.187 2.557 162 HD2 TYR 111 HD1 TYR 111 -2.818 21.005 0.204 163 HE1 TYR 111 HE2 TYR 111 -3.087 24.063 4.100 164 HE2 TYR 111 HE1 TYR 111 -4.756 20.879 1.747 165 HH TYR 111 HH TYR 111 -4.805 22.090 4.736 166 H ILE 112 HN ILE 112 1.688 20.616 -0.915 167 HA ILE 112 HA ILE 112 4.131 22.311 -0.868 168 HB ILE 112 HB ILE 112 3.384 19.684 -2.193 169 HG12 ILE 112 HG12 ILE 112 5.383 20.201 0.019 170 HG13 ILE 112 HG11 ILE 112 3.690 19.835 0.353 171 HG21 ILE 112 HG21 ILE 112 5.042 20.605 -3.604 172 HG22 ILE 112 HG22 ILE 112 5.955 19.592 -2.485 173 HG23 ILE 112 HG23 ILE 112 5.906 21.340 -2.254 174 HD11 ILE 112 HD11 ILE 112 5.829 18.027 -0.379 175 HD12 ILE 112 HD12 ILE 112 4.509 17.924 -1.545 176 HD13 ILE 112 HD13 ILE 112 4.195 17.649 0.169 177 H ASP 113 HN ASP 113 4.104 24.044 -2.251 178 HA ASP 113 HA ASP 113 2.353 24.069 -4.623 179 HB2 ASP 113 HB2 ASP 113 4.330 26.037 -3.422 180 HB3 ASP 113 HB1 ASP 113 3.250 26.404 -4.769 181 H LEU 114 HN LEU 114 3.467 24.996 -6.704 182 HA LEU 114 HA LEU 114 5.356 23.096 -7.693 183 HB2 LEU 114 HB2 LEU 114 4.501 25.863 -8.594 184 HB3 LEU 114 HB1 LEU 114 5.483 24.781 -9.583 185 HG LEU 114 HG LEU 114 3.329 23.212 -8.682 186 HD11 LEU 114 HD11 LEU 114 2.594 26.002 -8.782 187 HD12 LEU 114 HD12 LEU 114 1.593 24.611 -8.365 188 HD13 LEU 114 HD13 LEU 114 1.743 25.115 -10.048 189 HD21 LEU 114 HD21 LEU 114 2.955 22.909 -10.980 190 HD22 LEU 114 HD22 LEU 114 4.640 23.428 -10.941 191 HD23 LEU 114 HD23 LEU 114 3.372 24.579 -11.365 192 H ASP 115 HN ASP 115 5.777 26.220 -6.117 193 HA ASP 115 HA ASP 115 8.540 26.628 -6.863 194 HB2 ASP 115 HB2 ASP 115 6.449 27.895 -5.381 195 HB3 ASP 115 HB1 ASP 115 7.875 27.821 -4.345 196 H GLU 116 HN GLU 116 6.954 25.146 -4.029 197 HA GLU 116 HA GLU 116 9.467 24.605 -2.653 198 HB2 GLU 116 HB2 GLU 116 6.706 23.406 -2.266 199 HB3 GLU 116 HB1 GLU 116 7.996 23.498 -1.066 200 HG2 GLU 116 HG2 GLU 116 7.756 25.807 -0.787 201 HG3 GLU 116 HG1 GLU 116 6.978 26.015 -2.356 202 H LEU 117 HN LEU 117 7.630 23.014 -5.133 203 HA LEU 117 HA LEU 117 8.456 20.297 -4.636 204 HB2 LEU 117 HB2 LEU 117 7.504 21.868 -7.042 205 HB3 LEU 117 HB1 LEU 117 7.852 20.142 -7.136 206 HG LEU 117 HG LEU 117 5.986 21.305 -5.060 207 HD11 LEU 117 HD11 LEU 117 5.550 21.228 -7.849 208 HD12 LEU 117 HD12 LEU 117 4.344 21.491 -6.590 209 HD13 LEU 117 HD13 LEU 117 4.656 19.861 -7.184 210 HD21 LEU 117 HD21 LEU 117 6.379 18.520 -6.205 211 HD22 LEU 117 HD22 LEU 117 5.181 18.960 -4.987 212 HD23 LEU 117 HD23 LEU 117 6.901 19.063 -4.610 213 H LYS 118 HN LYS 118 9.626 22.630 -7.104 214 HA LYS 118 HA LYS 118 11.811 21.238 -8.111 215 HB2 LYS 118 HB2 LYS 118 12.799 23.603 -8.326 216 HB3 LYS 118 HB1 LYS 118 11.184 23.368 -8.996 217 HG2 LYS 118 HG2 LYS 118 10.272 24.830 -7.539 218 HG3 LYS 118 HG1 LYS 118 11.081 24.068 -6.169 219 HD2 LYS 118 HD2 LYS 118 12.417 25.880 -6.060 220 HD3 LYS 118 HD1 LYS 118 13.130 25.358 -7.587 221 HE2 LYS 118 HE2 LYS 118 11.577 26.698 -8.863 222 HE3 LYS 118 HE1 LYS 118 10.627 27.069 -7.410 223 HZ1 LYS 118 HZ1 LYS 118 12.213 28.458 -6.602 224 HZ2 LYS 118 HZ2 LYS 118 12.546 28.663 -8.256 225 HZ3 LYS 118 HZ3 LYS 118 13.496 27.611 -7.319 226 H ILE 119 HN ILE 119 11.461 22.676 -4.935 227 HA ILE 119 HA ILE 119 14.343 22.395 -4.316 228 HB ILE 119 HB ILE 119 11.898 23.335 -2.785 229 HG12 ILE 119 HG12 ILE 119 14.233 25.063 -3.492 230 HG13 ILE 119 HG11 ILE 119 13.123 24.620 -4.790 231 HG21 ILE 119 HG21 ILE 119 14.720 23.824 -1.888 232 HG22 ILE 119 HG22 ILE 119 13.951 22.287 -1.492 233 HG23 ILE 119 HG23 ILE 119 13.236 23.800 -0.936 234 HD11 ILE 119 HD11 ILE 119 11.778 26.285 -4.077 235 HD12 ILE 119 HD12 ILE 119 12.745 26.519 -2.621 236 HD13 ILE 119 HD13 ILE 119 11.461 25.310 -2.642 237 H MET 120 HN MET 120 11.269 20.795 -3.668 238 HA MET 120 HA MET 120 12.057 19.129 -1.490 239 HB2 MET 120 HB2 MET 120 9.757 19.328 -2.028 240 HB3 MET 120 HB1 MET 120 10.039 18.969 -3.732 241 HG2 MET 120 HG2 MET 120 10.475 16.663 -3.271 242 HG3 MET 120 HG1 MET 120 10.578 16.960 -1.536 243 HE1 MET 120 HE1 MET 120 8.362 14.644 -2.928 244 HE2 MET 120 HE2 MET 120 7.559 14.871 -1.377 245 HE3 MET 120 HE3 MET 120 9.317 14.947 -1.470 246 H LEU 121 HN LEU 121 12.189 18.577 -5.021 247 HA LEU 121 HA LEU 121 13.531 15.977 -4.653 248 HB2 LEU 121 HB2 LEU 121 12.902 17.628 -7.123 249 HB3 LEU 121 HB1 LEU 121 13.353 15.923 -7.104 250 HG LEU 121 HG LEU 121 10.857 17.153 -5.905 251 HD11 LEU 121 HD11 LEU 121 9.678 16.031 -7.606 252 HD12 LEU 121 HD12 LEU 121 11.027 14.951 -7.955 253 HD13 LEU 121 HD13 LEU 121 11.103 16.644 -8.445 254 HD21 LEU 121 HD21 LEU 121 12.120 14.431 -5.631 255 HD22 LEU 121 HD22 LEU 121 10.368 14.611 -5.538 256 HD23 LEU 121 HD23 LEU 121 11.404 15.447 -4.381 257 H GLN 122 HN GLN 122 14.418 19.293 -5.062 258 HA GLN 122 HA GLN 122 16.792 19.327 -6.484 259 HB2 GLN 122 HB2 GLN 122 15.446 20.970 -4.758 260 HB3 GLN 122 HB1 GLN 122 16.906 20.627 -3.829 261 HG2 GLN 122 HG2 GLN 122 17.592 21.131 -6.589 262 HG3 GLN 122 HG1 GLN 122 16.634 22.468 -5.951 263 HE21 GLN 122 HE21 GLN 122 17.437 22.567 -3.280 264 HE22 GLN 122 HE22 GLN 122 19.100 22.895 -3.185 265 H ALA 123 HN ALA 123 16.463 18.369 -3.045 266 HA ALA 123 HA ALA 123 19.138 17.783 -2.450 267 HB1 ALA 123 HB1 ALA 123 17.785 15.842 -1.117 268 HB2 ALA 123 HB2 ALA 123 16.440 16.878 -1.596 269 HB3 ALA 123 HB3 ALA 123 17.760 17.536 -0.630 270 H THR 124 HN THR 124 16.977 16.120 -4.610 271 HA THR 124 HA THR 124 18.697 13.698 -4.701 272 HB THR 124 HB THR 124 16.082 14.503 -6.013 273 HG1 THR 124 HG1 THR 124 16.669 12.596 -4.001 274 HG21 THR 124 HG21 THR 124 16.267 11.767 -6.183 275 HG22 THR 124 HG22 THR 124 17.928 12.266 -6.500 276 HG23 THR 124 HG23 THR 124 16.616 12.881 -7.504 277 H GLY 125 HN GLY 125 18.679 16.723 -6.121 278 HA2 GLY 125 HA2 GLY 125 20.063 17.496 -7.888 279 HA3 GLY 125 HA1 GLY 125 20.431 15.818 -8.292 280 H GLU 126 HN GLU 126 17.175 17.134 -7.936 281 HA GLU 126 HA GLU 126 16.232 15.998 -10.384 282 HB2 GLU 126 HB2 GLU 126 14.240 17.345 -9.875 283 HB3 GLU 126 HB1 GLU 126 14.879 16.634 -8.393 284 HG2 GLU 126 HG2 GLU 126 14.931 18.719 -7.534 285 HG3 GLU 126 HG1 GLU 126 16.252 19.059 -8.652 286 H THR 127 HN THR 127 17.731 16.716 -12.058 287 HA THR 127 HA THR 127 17.830 19.630 -12.632 288 HB THR 127 HB THR 127 19.504 18.844 -14.326 289 HG1 THR 127 HG1 THR 127 20.027 16.483 -13.832 290 HG21 THR 127 HG21 THR 127 20.988 19.005 -12.648 291 HG22 THR 127 HG22 THR 127 20.584 17.375 -12.108 292 HG23 THR 127 HG23 THR 127 19.678 18.758 -11.494 293 H ILE 128 HN ILE 128 15.685 20.011 -13.423 294 HA ILE 128 HA ILE 128 15.143 18.806 -16.108 295 HB ILE 128 HB ILE 128 13.809 17.595 -14.494 296 HG12 ILE 128 HG12 ILE 128 11.557 19.233 -15.151 297 HG13 ILE 128 HG11 ILE 128 12.678 19.273 -16.513 298 HG21 ILE 128 HG21 ILE 128 12.126 19.123 -13.143 299 HG22 ILE 128 HG22 ILE 128 13.373 20.347 -13.386 300 HG23 ILE 128 HG23 ILE 128 13.760 18.850 -12.537 301 HD11 ILE 128 HD11 ILE 128 11.295 17.375 -16.901 302 HD12 ILE 128 HD12 ILE 128 11.409 16.853 -15.220 303 HD13 ILE 128 HD13 ILE 128 12.812 16.724 -16.281 304 H THR 129 HN THR 129 13.951 20.223 -17.521 305 HA THR 129 HA THR 129 14.482 23.001 -17.330 306 HB THR 129 HB THR 129 12.154 22.595 -18.899 307 HG1 THR 129 HG1 THR 129 12.933 20.713 -20.067 308 HG21 THR 129 HG21 THR 129 15.055 23.026 -19.263 309 HG22 THR 129 HG22 THR 129 13.689 23.863 -20.001 310 HG23 THR 129 HG23 THR 129 14.225 22.311 -20.645 311 H GLU 130 HN GLU 130 13.093 24.778 -16.772 312 HA GLU 130 HA GLU 130 11.448 24.456 -14.466 313 HB2 GLU 130 HB2 GLU 130 12.494 26.555 -14.974 314 HB3 GLU 130 HB1 GLU 130 11.749 26.612 -16.572 315 HG2 GLU 130 HG2 GLU 130 9.516 26.785 -15.520 316 HG3 GLU 130 HG1 GLU 130 10.274 26.761 -13.927 317 H ASP 131 HN ASP 131 10.600 24.773 -17.919 318 HA ASP 131 HA ASP 131 7.764 24.873 -17.610 319 HB2 ASP 131 HB2 ASP 131 9.280 25.319 -19.637 320 HB3 ASP 131 HB1 ASP 131 9.292 23.571 -19.873 321 H ASP 132 HN ASP 132 9.952 22.322 -16.999 322 HA ASP 132 HA ASP 132 7.960 20.182 -17.510 323 HB2 ASP 132 HB2 ASP 132 10.842 20.239 -16.560 324 HB3 ASP 132 HB1 ASP 132 9.924 18.757 -16.830 325 H ILE 133 HN ILE 133 9.407 21.981 -14.858 326 HA ILE 133 HA ILE 133 8.874 20.298 -12.658 327 HB ILE 133 HB ILE 133 8.750 23.307 -13.017 328 HG12 ILE 133 HG12 ILE 133 10.909 22.056 -13.493 329 HG13 ILE 133 HG11 ILE 133 11.024 23.272 -12.220 330 HG21 ILE 133 HG21 ILE 133 7.513 22.457 -10.977 331 HG22 ILE 133 HG22 ILE 133 8.877 23.516 -10.620 332 HG23 ILE 133 HG23 ILE 133 9.040 21.771 -10.421 333 HD11 ILE 133 HD11 ILE 133 12.008 20.862 -11.817 334 HD12 ILE 133 HD12 ILE 133 10.326 20.445 -11.490 335 HD13 ILE 133 HD13 ILE 133 11.133 21.679 -10.522 336 H GLU 134 HN GLU 134 6.646 21.945 -14.743 337 HA GLU 134 HA GLU 134 4.423 21.903 -12.807 338 HB2 GLU 134 HB2 GLU 134 4.952 22.805 -15.615 339 HB3 GLU 134 HB1 GLU 134 3.276 22.559 -15.122 340 HG2 GLU 134 HG2 GLU 134 3.638 24.058 -13.182 341 HG3 GLU 134 HG1 GLU 134 5.296 24.331 -13.717 342 H GLU 135 HN GLU 135 5.736 19.871 -15.324 343 HA GLU 135 HA GLU 135 3.399 18.353 -15.991 344 HB2 GLU 135 HB2 GLU 135 6.341 18.207 -16.250 345 HB3 GLU 135 HB1 GLU 135 5.524 16.644 -16.292 346 HG2 GLU 135 HG2 GLU 135 3.885 18.034 -17.922 347 HG3 GLU 135 HG1 GLU 135 5.391 18.902 -18.222 348 H LEU 136 HN LEU 136 5.543 18.286 -13.223 349 HA LEU 136 HA LEU 136 4.708 15.617 -12.328 350 HB2 LEU 136 HB2 LEU 136 6.297 17.903 -11.126 351 HB3 LEU 136 HB1 LEU 136 6.055 16.361 -10.306 352 HG LEU 136 HG LEU 136 6.878 15.718 -12.927 353 HD11 LEU 136 HD11 LEU 136 7.833 18.304 -12.206 354 HD12 LEU 136 HD12 LEU 136 8.288 17.334 -13.607 355 HD13 LEU 136 HD13 LEU 136 9.196 17.190 -12.102 356 HD21 LEU 136 HD21 LEU 136 8.843 14.807 -11.748 357 HD22 LEU 136 HD22 LEU 136 7.368 14.479 -10.837 358 HD23 LEU 136 HD23 LEU 136 8.448 15.777 -10.328 359 H MET 137 HN MET 137 3.711 18.941 -11.838 360 HA MET 137 HA MET 137 2.272 18.633 -9.379 361 HB2 MET 137 HB2 MET 137 2.793 20.812 -10.167 362 HB3 MET 137 HB1 MET 137 2.136 20.476 -11.769 363 HG2 MET 137 HG2 MET 137 0.028 21.006 -11.135 364 HG3 MET 137 HG1 MET 137 0.173 20.117 -9.619 365 HE1 MET 137 HE1 MET 137 0.506 21.877 -7.064 366 HE2 MET 137 HE2 MET 137 2.217 22.111 -7.409 367 HE3 MET 137 HE3 MET 137 1.429 20.607 -7.879 368 H LYS 138 HN LYS 138 1.452 17.927 -12.737 369 HA LYS 138 HA LYS 138 -1.328 17.755 -12.714 370 HB2 LYS 138 HB2 LYS 138 0.906 16.195 -13.975 371 HB3 LYS 138 HB1 LYS 138 -0.755 15.656 -14.226 372 HG2 LYS 138 HG2 LYS 138 -1.376 17.688 -15.273 373 HG3 LYS 138 HG1 LYS 138 0.053 18.530 -14.674 374 HD2 LYS 138 HD2 LYS 138 1.490 17.407 -16.181 375 HD3 LYS 138 HD1 LYS 138 0.292 16.158 -16.522 376 HE2 LYS 138 HE2 LYS 138 -1.146 18.228 -17.376 377 HE3 LYS 138 HE1 LYS 138 0.459 18.956 -17.588 378 HZ1 LYS 138 HZ1 LYS 138 -0.050 17.728 -19.557 379 HZ2 LYS 138 HZ2 LYS 138 -0.482 16.350 -18.661 380 HZ3 LYS 138 HZ3 LYS 138 1.137 16.863 -18.708 381 H ASP 139 HN ASP 139 0.890 15.073 -11.826 382 HA ASP 139 HA ASP 139 -1.245 13.410 -10.779 383 HB2 ASP 139 HB2 ASP 139 1.607 13.339 -11.297 384 HB3 ASP 139 HB1 ASP 139 1.250 12.618 -9.727 385 H GLY 140 HN GLY 140 1.423 15.203 -9.181 386 HA2 GLY 140 HA2 GLY 140 0.643 14.684 -6.512 387 HA3 GLY 140 HA1 GLY 140 1.561 16.102 -7.019 388 H ASP 141 HN ASP 141 -0.884 16.641 -8.893 389 HA ASP 141 HA ASP 141 -2.861 17.536 -6.858 390 HB2 ASP 141 HB2 ASP 141 -0.852 19.178 -7.426 391 HB3 ASP 141 HB1 ASP 141 -1.832 19.524 -8.851 392 H LYS 142 HN LYS 142 -3.402 15.550 -8.684 393 HA LYS 142 HA LYS 142 -4.270 16.190 -11.271 394 HB2 LYS 142 HB2 LYS 142 -4.843 14.217 -9.170 395 HB3 LYS 142 HB1 LYS 142 -6.197 14.463 -10.273 396 HG2 LYS 142 HG2 LYS 142 -3.661 14.329 -11.702 397 HG3 LYS 142 HG1 LYS 142 -3.954 12.870 -10.754 398 HD2 LYS 142 HD2 LYS 142 -5.313 12.191 -12.421 399 HD3 LYS 142 HD1 LYS 142 -6.434 13.451 -11.902 400 HE2 LYS 142 HE2 LYS 142 -5.841 14.875 -13.622 401 HE3 LYS 142 HE1 LYS 142 -4.169 14.282 -13.672 402 HZ1 LYS 142 HZ1 LYS 142 -6.570 13.164 -14.903 403 HZ2 LYS 142 HZ2 LYS 142 -5.436 12.059 -14.287 404 HZ3 LYS 142 HZ3 LYS 142 -4.973 13.184 -15.474 405 H ASN 143 HN ASN 143 -5.631 17.148 -8.201 406 HA ASN 143 HA ASN 143 -8.271 17.863 -9.165 407 HB2 ASN 143 HB2 ASN 143 -7.928 17.430 -6.836 408 HB3 ASN 143 HB1 ASN 143 -6.570 18.554 -6.758 409 HD21 ASN 143 HD21 ASN 143 -7.337 20.203 -5.391 410 HD22 ASN 143 HD22 ASN 143 -8.785 21.053 -5.642 411 H ASN 144 HN ASN 144 -5.157 19.307 -9.448 412 HA ASN 144 HA ASN 144 -4.459 21.440 -10.204 413 HB2 ASN 144 HB2 ASN 144 -5.652 20.425 -12.138 414 HB3 ASN 144 HB1 ASN 144 -7.154 21.160 -11.576 415 HD21 ASN 144 HD21 ASN 144 -4.190 21.758 -13.312 416 HD22 ASN 144 HD22 ASN 144 -4.469 23.402 -13.626 417 H ASP 145 HN ASP 145 -4.891 22.231 -7.891 418 HA ASP 145 HA ASP 145 -7.131 24.232 -7.892 419 HB2 ASP 145 HB2 ASP 145 -7.167 23.826 -5.424 420 HB3 ASP 145 HB1 ASP 145 -7.515 22.365 -6.351 421 H GLY 146 HN GLY 146 -3.739 23.645 -7.501 422 HA2 GLY 146 HA2 GLY 146 -2.244 25.612 -7.731 423 HA3 GLY 146 HA1 GLY 146 -3.376 26.508 -6.717 424 H ARG 147 HN ARG 147 -3.198 23.432 -5.478 425 HA ARG 147 HA ARG 147 -0.760 23.899 -3.848 426 HB2 ARG 147 HB2 ARG 147 -3.621 24.056 -2.952 427 HB3 ARG 147 HB1 ARG 147 -2.407 23.448 -1.826 428 HG2 ARG 147 HG2 ARG 147 -1.071 25.497 -2.154 429 HG3 ARG 147 HG1 ARG 147 -2.286 26.108 -3.277 430 HD2 ARG 147 HD2 ARG 147 -3.042 25.295 -0.464 431 HD3 ARG 147 HD1 ARG 147 -2.457 26.930 -0.831 432 HE ARG 147 HE ARG 147 -4.491 26.098 -2.715 433 HH11 ARG 147 HH21 ARG 147 -3.912 27.285 0.476 434 HH12 ARG 147 HH22 ARG 147 -5.456 28.057 0.607 435 HH21 ARG 147 HH11 ARG 147 -6.506 27.102 -2.554 436 HH22 ARG 147 HH12 ARG 147 -6.923 27.955 -1.105 437 H ILE 148 HN ILE 148 0.064 21.952 -2.997 438 HA ILE 148 HA ILE 148 -1.301 19.466 -3.935 439 HB ILE 148 HB ILE 148 1.537 20.072 -3.038 440 HG12 ILE 148 HG12 ILE 148 0.340 19.581 -5.786 441 HG13 ILE 148 HG11 ILE 148 0.918 21.133 -5.179 442 HG21 ILE 148 HG21 ILE 148 0.263 17.619 -3.038 443 HG22 ILE 148 HG22 ILE 148 2.005 17.859 -3.178 444 HG23 ILE 148 HG23 ILE 148 1.023 17.658 -4.629 445 HD11 ILE 148 HD11 ILE 148 3.171 19.975 -4.797 446 HD12 ILE 148 HD12 ILE 148 2.715 20.257 -6.477 447 HD13 ILE 148 HD13 ILE 148 2.537 18.650 -5.773 448 H ASP 149 HN ASP 149 -2.369 18.303 -2.395 449 HA ASP 149 HA ASP 149 -1.835 18.821 0.478 450 HB2 ASP 149 HB2 ASP 149 -4.096 18.514 -1.001 451 HB3 ASP 149 HB1 ASP 149 -3.869 16.858 -0.436 452 H TYR 150 HN TYR 150 -2.205 16.561 1.780 453 HA TYR 150 HA TYR 150 0.090 14.885 1.053 454 HB2 TYR 150 HB2 TYR 150 -0.305 15.445 3.366 455 HB3 TYR 150 HB1 TYR 150 -1.974 14.881 3.274 456 HD1 TYR 150 HD2 TYR 150 1.184 13.341 1.985 457 HD2 TYR 150 HD1 TYR 150 -2.129 13.018 4.700 458 HE1 TYR 150 HE2 TYR 150 1.920 11.057 2.612 459 HE2 TYR 150 HE1 TYR 150 -1.394 10.734 5.326 460 HH TYR 150 HH TYR 150 0.186 9.186 5.099 461 H ASP 151 HN ASP 151 -3.438 14.379 1.414 462 HA ASP 151 HA ASP 151 -3.618 11.658 0.775 463 HB2 ASP 151 HB2 ASP 151 -5.536 12.915 1.470 464 HB3 ASP 151 HB1 ASP 151 -5.361 14.048 0.130 465 H GLU 152 HN GLU 152 -2.944 14.381 -1.347 466 HA GLU 152 HA GLU 152 -3.312 12.791 -3.804 467 HB2 GLU 152 HB2 GLU 152 -2.244 15.579 -3.244 468 HB3 GLU 152 HB1 GLU 152 -2.599 14.938 -4.848 469 HG2 GLU 152 HG2 GLU 152 -4.944 14.702 -4.310 470 HG3 GLU 152 HG1 GLU 152 -4.646 15.117 -2.622 471 H PHE 153 HN PHE 153 -0.635 14.112 -1.863 472 HA PHE 153 HA PHE 153 1.575 13.662 -3.493 473 HB2 PHE 153 HB2 PHE 153 1.497 14.597 -1.167 474 HB3 PHE 153 HB1 PHE 153 1.297 12.956 -0.553 475 HD1 PHE 153 HD1 PHE 153 3.520 14.817 -2.946 476 HD2 PHE 153 HD2 PHE 153 3.219 11.851 0.146 477 HE1 PHE 153 HE1 PHE 153 5.977 14.491 -3.020 478 HE2 PHE 153 HE2 PHE 153 5.675 11.524 0.072 479 HZ PHE 153 HZ PHE 153 7.055 12.844 -1.511 480 H LEU 154 HN LEU 154 -0.429 11.269 -1.848 481 HA LEU 154 HA LEU 154 1.335 9.008 -2.199 482 HB2 LEU 154 HB2 LEU 154 -1.429 9.627 -1.367 483 HB3 LEU 154 HB1 LEU 154 -1.231 8.021 -2.068 484 HG LEU 154 HG LEU 154 -0.871 8.003 0.387 485 HD11 LEU 154 HD11 LEU 154 0.846 6.487 0.238 486 HD12 LEU 154 HD12 LEU 154 1.868 7.579 -0.697 487 HD13 LEU 154 HD13 LEU 154 0.561 6.699 -1.490 488 HD21 LEU 154 HD21 LEU 154 1.207 9.119 1.245 489 HD22 LEU 154 HD22 LEU 154 -0.013 10.263 0.685 490 HD23 LEU 154 HD23 LEU 154 1.387 9.902 -0.325 491 H GLU 155 HN GLU 155 -1.137 10.532 -4.211 492 HA GLU 155 HA GLU 155 -1.215 8.364 -6.180 493 HB2 GLU 155 HB2 GLU 155 -2.810 10.484 -5.410 494 HB3 GLU 155 HB1 GLU 155 -2.143 11.053 -6.941 495 HG2 GLU 155 HG2 GLU 155 -2.773 8.463 -7.564 496 HG3 GLU 155 HG1 GLU 155 -4.055 8.867 -6.421 497 H PHE 156 HN PHE 156 0.980 10.851 -5.501 498 HA PHE 156 HA PHE 156 1.737 11.432 -8.284 499 HB2 PHE 156 HB2 PHE 156 1.854 13.171 -6.616 500 HB3 PHE 156 HB1 PHE 156 2.823 12.154 -5.550 501 HD1 PHE 156 HD1 PHE 156 2.901 13.347 -9.114 502 HD2 PHE 156 HD2 PHE 156 5.108 12.570 -5.511 503 HE1 PHE 156 HE1 PHE 156 4.969 14.175 -10.203 504 HE2 PHE 156 HE2 PHE 156 7.177 13.399 -6.600 505 HZ PHE 156 HZ PHE 156 7.107 14.201 -8.946 506 H MET 157 HN MET 157 3.193 9.701 -5.499 507 HA MET 157 HA MET 157 5.355 8.696 -7.281 508 HB2 MET 157 HB2 MET 157 6.397 8.066 -5.161 509 HB3 MET 157 HB1 MET 157 5.808 9.725 -5.048 510 HG2 MET 157 HG2 MET 157 3.809 8.984 -3.871 511 HG3 MET 157 HG1 MET 157 4.277 7.296 -4.075 512 HE1 MET 157 HE1 MET 157 6.528 10.510 -1.757 513 HE2 MET 157 HE2 MET 157 5.625 10.637 -3.264 514 HE3 MET 157 HE3 MET 157 7.246 9.944 -3.273 515 H LYS 158 HN LYS 158 2.291 7.705 -6.305 516 HA LYS 158 HA LYS 158 2.513 4.996 -5.592 517 HB2 LYS 158 HB2 LYS 158 0.257 4.835 -6.622 518 HB3 LYS 158 HB1 LYS 158 0.434 6.316 -5.682 519 HG2 LYS 158 HG2 LYS 158 0.361 7.659 -7.529 520 HG3 LYS 158 HG1 LYS 158 1.236 6.501 -8.530 521 HD2 LYS 158 HD2 LYS 158 -1.379 5.493 -7.715 522 HD3 LYS 158 HD1 LYS 158 -1.499 6.998 -8.627 523 HE2 LYS 158 HE2 LYS 158 0.206 4.670 -9.562 524 HE3 LYS 158 HE1 LYS 158 -1.486 4.884 -10.055 525 HZ1 LYS 158 HZ1 LYS 158 0.686 6.892 -10.362 526 HZ2 LYS 158 HZ2 LYS 158 -0.944 7.138 -10.776 527 HZ3 LYS 158 HZ3 LYS 158 -0.014 5.990 -11.616 528 H GLY 159 HN GLY 159 3.309 6.507 -8.618 529 HA2 GLY 159 HA2 GLY 159 3.445 3.827 -9.935 530 HA3 GLY 159 HA1 GLY 159 3.319 5.355 -10.806 531 H VAL 160 HN VAL 160 5.488 4.200 -8.195 532 HA VAL 160 HA VAL 160 7.826 4.185 -9.923 533 HB VAL 160 HB VAL 160 7.262 6.625 -9.698 534 HG11 VAL 160 HG11 VAL 160 7.111 5.817 -6.907 535 HG12 VAL 160 HG12 VAL 160 6.540 7.300 -7.670 536 HG13 VAL 160 HG13 VAL 160 8.212 7.178 -7.122 537 HG21 VAL 160 HG21 VAL 160 9.508 6.492 -10.153 538 HG22 VAL 160 HG22 VAL 160 9.812 5.361 -8.835 539 HG23 VAL 160 HG23 VAL 160 9.648 7.084 -8.498 540 H GLU 161 HN GLU 161 6.809 2.305 -8.092 541 HA GLU 161 HA GLU 161 8.042 2.505 -5.480 542 HB2 GLU 161 HB2 GLU 161 6.735 0.397 -7.180 543 HB3 GLU 161 HB1 GLU 161 7.545 -0.076 -5.686 544 HG2 GLU 161 HG2 GLU 161 5.813 0.668 -4.459 545 HG3 GLU 161 HG1 GLU 161 5.925 2.261 -5.209 546 HO1 KDH 1 H1 KDH 1 10.479 8.401 -11.028 547 H21 KDH 1 H21 KDH 1 9.760 7.034 -4.887 548 H33 KDH 1 H33 KDH 1 8.404 12.482 -6.879 549 H4 KDH 1 H4 KDH 1 9.927 8.899 -8.801 550 HO7 KDH 1 H7 KDH 1 7.513 10.779 -12.993 551 H01 KDH 1 H01 KDH 1 9.866 12.537 -4.779 552 H01A KDH 1 H02 KDH 1 8.216 11.808 -4.648 553 HO03 KDH 1 H03 KDH 1 11.118 11.633 -1.703 554 HO10 KDH 1 H10 KDH 1 6.136 12.182 -11.605 555 H12 KDH 1 H12 KDH 1 6.456 11.574 -8.367 556 H15 KDH 1 H15 KDH 1 7.388 10.402 -6.573 557 H26 KDH 1 H26 KDH 1 11.388 9.392 -1.565 558 H39 KDH 1 H39 KDH 1 10.605 13.589 -10.900 559 H41 KDH 1 H41 KDH 1 12.278 10.645 -8.086 560 HO02 KDH 1 H42 KDH 1 11.608 6.386 -3.214 561 HO44 KDH 1 H44 KDH 1 14.039 9.006 -10.399 562 HO47 KDH 1 H47 KDH 1 13.721 10.856 -13.145 563 HO50 KDH 1 H50 KDH 1 11.701 13.773 -12.912 Start of MODEL 8 1 H1 MET 90 HT1 MET 90 14.289 8.664 4.717 2 H2 MET 90 HT2 MET 90 12.782 9.308 4.270 3 H3 MET 90 HT3 MET 90 14.185 9.755 3.423 4 HA MET 90 HA MET 90 13.516 8.188 1.954 5 HB2 MET 90 HB2 MET 90 15.382 7.374 3.888 6 HB3 MET 90 HB1 MET 90 14.313 5.986 3.683 7 HG2 MET 90 HG2 MET 90 14.631 6.629 1.099 8 HG3 MET 90 HG1 MET 90 16.153 7.267 1.720 9 HE1 MET 90 HE1 MET 90 18.268 5.730 1.871 10 HE2 MET 90 HE2 MET 90 17.444 5.899 0.323 11 HE3 MET 90 HE3 MET 90 18.053 4.322 0.821 12 H GLY 91 HN GLY 91 11.119 8.598 2.437 13 HA2 GLY 91 HA2 GLY 91 9.757 6.659 4.150 14 HA3 GLY 91 HA1 GLY 91 8.976 7.852 3.111 15 H LYS 92 HN LYS 92 7.551 5.948 2.591 16 HA LYS 92 HA LYS 92 8.303 4.796 0.040 17 HB2 LYS 92 HB2 LYS 92 9.666 3.461 1.654 18 HB3 LYS 92 HB1 LYS 92 8.178 2.971 2.464 19 HG2 LYS 92 HG2 LYS 92 8.099 2.551 -0.439 20 HG3 LYS 92 HG1 LYS 92 9.365 1.620 0.362 21 HD2 LYS 92 HD2 LYS 92 7.008 1.484 1.977 22 HD3 LYS 92 HD1 LYS 92 6.561 1.089 0.316 23 HE2 LYS 92 HE2 LYS 92 8.997 -0.250 0.725 24 HE3 LYS 92 HE1 LYS 92 8.072 -0.509 2.217 25 HZ1 LYS 92 HZ1 LYS 92 6.696 -0.684 -0.373 26 HZ2 LYS 92 HZ2 LYS 92 6.329 -1.457 1.095 27 HZ3 LYS 92 HZ3 LYS 92 7.628 -2.003 0.145 28 H SER 93 HN SER 93 6.303 3.987 2.905 29 HA SER 93 HA SER 93 3.922 3.866 1.081 30 HB2 SER 93 HB2 SER 93 4.893 2.260 3.416 31 HB3 SER 93 HB1 SER 93 3.154 2.401 3.171 32 HG SER 93 HG SER 93 4.698 0.726 1.994 33 H GLU 94 HN GLU 94 1.828 4.264 2.468 34 HA GLU 94 HA GLU 94 1.621 6.889 3.327 35 HB2 GLU 94 HB2 GLU 94 0.228 4.347 4.185 36 HB3 GLU 94 HB1 GLU 94 -0.318 5.936 4.725 37 HG2 GLU 94 HG2 GLU 94 -0.155 6.495 2.134 38 HG3 GLU 94 HG1 GLU 94 -0.361 4.750 1.978 39 H GLU 95 HN GLU 95 2.986 4.186 5.088 40 HA GLU 95 HA GLU 95 2.857 5.129 7.755 41 HB2 GLU 95 HB2 GLU 95 3.649 2.897 6.801 42 HB3 GLU 95 HB1 GLU 95 5.184 3.693 6.450 43 HG2 GLU 95 HG2 GLU 95 5.811 3.234 8.565 44 HG3 GLU 95 HG1 GLU 95 4.593 4.390 9.105 45 H GLU 96 HN GLU 96 5.565 5.544 5.430 46 HA GLU 96 HA GLU 96 6.681 7.697 7.143 47 HB2 GLU 96 HB2 GLU 96 7.592 6.048 4.786 48 HB3 GLU 96 HB1 GLU 96 8.502 7.471 5.296 49 HG2 GLU 96 HG2 GLU 96 9.441 6.306 6.975 50 HG3 GLU 96 HG1 GLU 96 7.847 5.901 7.614 51 H LEU 97 HN LEU 97 4.873 7.297 4.190 52 HA LEU 97 HA LEU 97 5.544 9.548 2.670 53 HB2 LEU 97 HB2 LEU 97 3.210 7.820 3.145 54 HB3 LEU 97 HB1 LEU 97 2.782 9.418 2.540 55 HG LEU 97 HG LEU 97 3.120 8.002 0.625 56 HD11 LEU 97 HD11 LEU 97 4.510 10.343 1.033 57 HD12 LEU 97 HD12 LEU 97 4.385 9.503 -0.512 58 HD13 LEU 97 HD13 LEU 97 5.788 9.240 0.524 59 HD21 LEU 97 HD21 LEU 97 5.721 7.157 0.563 60 HD22 LEU 97 HD22 LEU 97 4.367 6.155 1.088 61 HD23 LEU 97 HD23 LEU 97 5.352 7.002 2.281 62 H SER 98 HN SER 98 3.077 9.429 5.275 63 HA SER 98 HA SER 98 2.327 12.127 5.332 64 HB2 SER 98 HB2 SER 98 1.583 11.621 7.564 65 HB3 SER 98 HB1 SER 98 1.472 10.118 6.652 66 HG SER 98 HG SER 98 2.536 9.608 8.500 67 H ASP 99 HN ASP 99 4.876 10.654 7.388 68 HA ASP 99 HA ASP 99 5.877 13.114 8.433 69 HB2 ASP 99 HB2 ASP 99 6.401 10.311 8.524 70 HB3 ASP 99 HB1 ASP 99 7.931 11.122 8.188 71 H LEU 100 HN LEU 100 6.135 11.772 5.289 72 HA LEU 100 HA LEU 100 8.643 13.250 4.666 73 HB2 LEU 100 HB2 LEU 100 8.181 10.843 4.003 74 HB3 LEU 100 HB1 LEU 100 6.929 11.457 2.923 75 HG LEU 100 HG LEU 100 8.859 13.027 2.057 76 HD11 LEU 100 HD11 LEU 100 10.220 11.315 3.922 77 HD12 LEU 100 HD12 LEU 100 10.887 12.623 2.945 78 HD13 LEU 100 HD13 LEU 100 10.821 10.983 2.297 79 HD21 LEU 100 HD21 LEU 100 7.723 11.329 0.695 80 HD22 LEU 100 HD22 LEU 100 8.706 10.061 1.426 81 HD23 LEU 100 HD23 LEU 100 9.459 11.276 0.393 82 H PHE 101 HN PHE 101 5.187 13.180 3.860 83 HA PHE 101 HA PHE 101 5.250 15.099 1.728 84 HB2 PHE 101 HB2 PHE 101 3.342 13.705 2.010 85 HB3 PHE 101 HB1 PHE 101 3.186 14.130 3.714 86 HD1 PHE 101 HD1 PHE 101 2.373 16.380 4.383 87 HD2 PHE 101 HD2 PHE 101 2.464 15.132 0.273 88 HE1 PHE 101 HE1 PHE 101 0.850 18.243 3.784 89 HE2 PHE 101 HE2 PHE 101 0.940 16.996 -0.326 90 HZ PHE 101 HZ PHE 101 0.133 18.551 1.430 91 H ARG 102 HN ARG 102 4.508 15.501 5.212 92 HA ARG 102 HA ARG 102 4.177 18.354 5.099 93 HB2 ARG 102 HB2 ARG 102 4.128 18.145 7.493 94 HB3 ARG 102 HB1 ARG 102 3.416 16.664 6.852 95 HG2 ARG 102 HG2 ARG 102 5.707 15.602 7.013 96 HG3 ARG 102 HG1 ARG 102 6.239 17.042 7.881 97 HD2 ARG 102 HD2 ARG 102 3.829 16.254 9.134 98 HD3 ARG 102 HD1 ARG 102 4.778 14.770 8.909 99 HE ARG 102 HE ARG 102 6.358 17.049 9.851 100 HH11 ARG 102 HH21 ARG 102 4.376 14.342 10.679 101 HH12 ARG 102 HH22 ARG 102 5.073 14.152 12.252 102 HH21 ARG 102 HH11 ARG 102 7.272 16.807 11.897 103 HH22 ARG 102 HH12 ARG 102 6.707 15.547 12.943 104 H MET 103 HN MET 103 6.978 16.464 4.766 105 HA MET 103 HA MET 103 8.815 18.365 6.070 106 HB2 MET 103 HB2 MET 103 8.875 15.724 5.710 107 HB3 MET 103 HB1 MET 103 9.673 16.186 4.206 108 HG2 MET 103 HG2 MET 103 10.802 17.773 6.283 109 HG3 MET 103 HG1 MET 103 10.779 16.103 6.851 110 HE1 MET 103 HE1 MET 103 12.666 14.748 6.609 111 HE2 MET 103 HE2 MET 103 13.446 16.296 6.924 112 HE3 MET 103 HE3 MET 103 14.110 15.216 5.701 113 H PHE 104 HN PHE 104 8.217 17.230 2.717 114 HA PHE 104 HA PHE 104 10.050 18.976 1.422 115 HB2 PHE 104 HB2 PHE 104 7.418 17.744 0.554 116 HB3 PHE 104 HB1 PHE 104 8.566 18.496 -0.555 117 HD1 PHE 104 HD2 PHE 104 11.149 17.665 0.657 118 HD2 PHE 104 HD1 PHE 104 7.531 15.444 0.002 119 HE1 PHE 104 HE2 PHE 104 12.457 15.560 0.576 120 HE2 PHE 104 HE1 PHE 104 8.839 13.339 -0.078 121 HZ PHE 104 HZ PHE 104 11.302 13.396 0.209 122 H ASP 105 HN ASP 105 6.997 19.661 2.917 123 HA ASP 105 HA ASP 105 6.206 21.957 1.381 124 HB2 ASP 105 HB2 ASP 105 4.896 20.569 3.078 125 HB3 ASP 105 HB1 ASP 105 5.768 21.447 4.336 126 H LYS 106 HN LYS 106 8.567 22.800 1.200 127 HA LYS 106 HA LYS 106 9.973 23.923 3.409 128 HB2 LYS 106 HB2 LYS 106 10.191 23.713 0.615 129 HB3 LYS 106 HB1 LYS 106 10.200 25.446 0.939 130 HG2 LYS 106 HG2 LYS 106 12.001 25.135 2.595 131 HG3 LYS 106 HG1 LYS 106 11.994 23.400 2.279 132 HD2 LYS 106 HD2 LYS 106 13.791 24.483 1.003 133 HD3 LYS 106 HD1 LYS 106 12.566 23.844 -0.094 134 HE2 LYS 106 HE2 LYS 106 11.838 25.947 -0.724 135 HE3 LYS 106 HE1 LYS 106 12.234 26.666 0.850 136 HZ1 LYS 106 HZ1 LYS 106 14.505 25.558 -0.538 137 HZ2 LYS 106 HZ2 LYS 106 14.334 27.062 0.233 138 HZ3 LYS 106 HZ3 LYS 106 13.784 26.854 -1.361 139 H ASN 107 HN ASN 107 7.058 24.926 1.857 140 HA ASN 107 HA ASN 107 7.260 27.764 2.536 141 HB2 ASN 107 HB2 ASN 107 5.966 26.619 0.637 142 HB3 ASN 107 HB1 ASN 107 4.795 26.142 1.866 143 HD21 ASN 107 HD21 ASN 107 3.041 27.543 1.572 144 HD22 ASN 107 HD22 ASN 107 3.165 29.233 1.469 145 H ALA 108 HN ALA 108 6.292 24.864 4.169 146 HA ALA 108 HA ALA 108 5.508 24.535 6.377 147 HB1 ALA 108 HB1 ALA 108 5.603 27.363 7.124 148 HB2 ALA 108 HB2 ALA 108 7.080 26.834 6.319 149 HB3 ALA 108 HB3 ALA 108 6.524 26.006 7.773 150 H ASP 109 HN ASP 109 3.322 24.057 6.115 151 HA ASP 109 HA ASP 109 1.327 25.928 6.921 152 HB2 ASP 109 HB2 ASP 109 0.279 26.215 4.609 153 HB3 ASP 109 HB1 ASP 109 1.789 27.089 4.867 154 H GLY 110 HN GLY 110 2.145 23.046 5.064 155 HA2 GLY 110 HA2 GLY 110 1.103 20.917 5.849 156 HA3 GLY 110 HA1 GLY 110 -0.411 21.811 6.009 157 H TYR 111 HN TYR 111 1.370 22.779 3.288 158 HA TYR 111 HA TYR 111 0.008 20.819 1.494 159 HB2 TYR 111 HB2 TYR 111 -0.194 23.847 1.396 160 HB3 TYR 111 HB1 TYR 111 -0.841 22.758 0.169 161 HD1 TYR 111 HD1 TYR 111 -2.619 21.082 0.813 162 HD2 TYR 111 HD2 TYR 111 -1.364 24.245 3.436 163 HE1 TYR 111 HE1 TYR 111 -4.682 20.786 2.157 164 HE2 TYR 111 HE2 TYR 111 -3.427 23.948 4.780 165 HH TYR 111 HH TYR 111 -5.200 22.607 5.153 166 H ILE 112 HN ILE 112 0.823 21.131 -0.817 167 HA ILE 112 HA ILE 112 3.650 22.145 -0.825 168 HB ILE 112 HB ILE 112 2.478 19.765 -2.304 169 HG12 ILE 112 HG12 ILE 112 4.054 19.942 0.283 170 HG13 ILE 112 HG11 ILE 112 2.431 19.286 0.071 171 HG21 ILE 112 HG21 ILE 112 4.632 21.103 -3.060 172 HG22 ILE 112 HG22 ILE 112 4.632 19.340 -3.067 173 HG23 ILE 112 HG23 ILE 112 5.388 20.216 -1.736 174 HD11 ILE 112 HD11 ILE 112 5.060 18.063 -0.552 175 HD12 ILE 112 HD12 ILE 112 3.784 17.783 -1.737 176 HD13 ILE 112 HD13 ILE 112 3.551 17.297 -0.057 177 H ASP 113 HN ASP 113 4.054 23.624 -2.443 178 HA ASP 113 HA ASP 113 1.905 24.100 -4.457 179 HB2 ASP 113 HB2 ASP 113 4.049 25.668 -3.093 180 HB3 ASP 113 HB1 ASP 113 3.570 26.189 -4.709 181 H LEU 114 HN LEU 114 3.013 25.094 -6.586 182 HA LEU 114 HA LEU 114 4.389 22.937 -7.900 183 HB2 LEU 114 HB2 LEU 114 3.614 25.778 -8.481 184 HB3 LEU 114 HB1 LEU 114 4.702 24.952 -9.597 185 HG LEU 114 HG LEU 114 2.258 23.483 -8.714 186 HD11 LEU 114 HD11 LEU 114 0.784 24.942 -9.584 187 HD12 LEU 114 HD12 LEU 114 1.678 24.975 -11.104 188 HD13 LEU 114 HD13 LEU 114 2.096 26.098 -9.810 189 HD21 LEU 114 HD21 LEU 114 3.383 23.758 -11.497 190 HD22 LEU 114 HD22 LEU 114 2.512 22.400 -10.786 191 HD23 LEU 114 HD23 LEU 114 4.180 22.722 -10.313 192 H ASP 115 HN ASP 115 5.489 25.981 -6.436 193 HA ASP 115 HA ASP 115 8.231 25.721 -7.397 194 HB2 ASP 115 HB2 ASP 115 6.769 27.428 -5.372 195 HB3 ASP 115 HB1 ASP 115 8.504 27.590 -5.648 196 H GLU 116 HN GLU 116 6.530 25.029 -4.340 197 HA GLU 116 HA GLU 116 8.796 24.378 -2.746 198 HB2 GLU 116 HB2 GLU 116 6.000 23.189 -2.735 199 HB3 GLU 116 HB1 GLU 116 7.128 23.192 -1.379 200 HG2 GLU 116 HG2 GLU 116 7.121 25.675 -1.404 201 HG3 GLU 116 HG1 GLU 116 5.931 25.642 -2.705 202 H LEU 117 HN LEU 117 7.002 22.495 -5.145 203 HA LEU 117 HA LEU 117 8.255 19.950 -4.519 204 HB2 LEU 117 HB2 LEU 117 6.767 21.078 -6.909 205 HB3 LEU 117 HB1 LEU 117 7.266 19.391 -6.794 206 HG LEU 117 HG LEU 117 5.711 20.623 -4.540 207 HD11 LEU 117 HD11 LEU 117 4.775 20.395 -7.252 208 HD12 LEU 117 HD12 LEU 117 3.895 20.951 -5.828 209 HD13 LEU 117 HD13 LEU 117 3.913 19.236 -6.241 210 HD21 LEU 117 HD21 LEU 117 4.818 18.077 -4.918 211 HD22 LEU 117 HD22 LEU 117 6.195 18.483 -3.893 212 HD23 LEU 117 HD23 LEU 117 6.460 17.936 -5.548 213 H LYS 118 HN LYS 118 9.193 22.765 -6.320 214 HA LYS 118 HA LYS 118 11.102 21.459 -8.086 215 HB2 LYS 118 HB2 LYS 118 10.012 23.620 -8.557 216 HB3 LYS 118 HB1 LYS 118 10.782 24.324 -7.135 217 HG2 LYS 118 HG2 LYS 118 12.999 23.916 -8.105 218 HG3 LYS 118 HG1 LYS 118 12.256 23.158 -9.514 219 HD2 LYS 118 HD2 LYS 118 12.483 25.287 -10.357 220 HD3 LYS 118 HD1 LYS 118 10.922 25.485 -9.560 221 HE2 LYS 118 HE2 LYS 118 11.833 26.688 -7.776 222 HE3 LYS 118 HE1 LYS 118 13.446 25.981 -7.995 223 HZ1 LYS 118 HZ1 LYS 118 13.944 27.385 -9.671 224 HZ2 LYS 118 HZ2 LYS 118 12.782 28.380 -8.933 225 HZ3 LYS 118 HZ3 LYS 118 12.358 27.423 -10.271 226 H ILE 119 HN ILE 119 11.722 23.815 -5.455 227 HA ILE 119 HA ILE 119 14.474 23.170 -5.130 228 HB ILE 119 HB ILE 119 12.406 24.259 -3.192 229 HG12 ILE 119 HG12 ILE 119 14.078 26.299 -4.117 230 HG13 ILE 119 HG11 ILE 119 13.755 25.323 -5.550 231 HG21 ILE 119 HG21 ILE 119 14.079 24.137 -1.679 232 HG22 ILE 119 HG22 ILE 119 14.901 25.373 -2.632 233 HG23 ILE 119 HG23 ILE 119 15.250 23.667 -2.912 234 HD11 ILE 119 HD11 ILE 119 11.446 25.673 -5.431 235 HD12 ILE 119 HD12 ILE 119 12.079 27.231 -4.900 236 HD13 ILE 119 HD13 ILE 119 11.496 26.065 -3.713 237 H MET 120 HN MET 120 11.629 21.474 -4.110 238 HA MET 120 HA MET 120 12.615 20.103 -1.805 239 HB2 MET 120 HB2 MET 120 10.287 20.068 -2.325 240 HB3 MET 120 HB1 MET 120 10.587 19.498 -3.967 241 HG2 MET 120 HG2 MET 120 11.770 17.641 -2.132 242 HG3 MET 120 HG1 MET 120 10.103 17.934 -1.636 243 HE1 MET 120 HE1 MET 120 8.650 16.724 -2.012 244 HE2 MET 120 HE2 MET 120 9.012 15.165 -2.748 245 HE3 MET 120 HE3 MET 120 7.923 16.284 -3.563 246 H LEU 121 HN LEU 121 12.871 19.394 -5.281 247 HA LEU 121 HA LEU 121 14.351 16.887 -4.769 248 HB2 LEU 121 HB2 LEU 121 13.248 18.399 -7.123 249 HB3 LEU 121 HB1 LEU 121 14.426 17.114 -7.392 250 HG LEU 121 HG LEU 121 12.070 16.595 -5.606 251 HD11 LEU 121 HD11 LEU 121 11.928 16.053 -8.560 252 HD12 LEU 121 HD12 LEU 121 11.432 17.625 -7.933 253 HD13 LEU 121 HD13 LEU 121 10.616 16.160 -7.387 254 HD21 LEU 121 HD21 LEU 121 13.086 14.628 -7.575 255 HD22 LEU 121 HD22 LEU 121 12.689 14.410 -5.871 256 HD23 LEU 121 HD23 LEU 121 14.241 15.110 -6.332 257 H GLN 122 HN GLN 122 15.015 20.240 -5.403 258 HA GLN 122 HA GLN 122 17.405 20.376 -6.755 259 HB2 GLN 122 HB2 GLN 122 16.108 21.778 -4.519 260 HB3 GLN 122 HB1 GLN 122 17.857 21.995 -4.561 261 HG2 GLN 122 HG2 GLN 122 17.249 22.305 -7.201 262 HG3 GLN 122 HG1 GLN 122 15.793 22.959 -6.448 263 HE21 GLN 122 HE21 GLN 122 17.130 24.917 -7.666 264 HE22 GLN 122 HE22 GLN 122 18.079 25.835 -6.600 265 H ALA 123 HN ALA 123 17.253 19.789 -3.212 266 HA ALA 123 HA ALA 123 19.912 19.291 -2.637 267 HB1 ALA 123 HB1 ALA 123 17.786 17.409 -1.649 268 HB2 ALA 123 HB2 ALA 123 17.659 19.127 -1.272 269 HB3 ALA 123 HB3 ALA 123 19.068 18.210 -0.740 270 H THR 124 HN THR 124 17.760 17.294 -4.555 271 HA THR 124 HA THR 124 19.623 14.995 -4.550 272 HB THR 124 HB THR 124 17.053 15.513 -6.080 273 HG1 THR 124 HG1 THR 124 16.440 15.572 -4.021 274 HG21 THR 124 HG21 THR 124 17.387 12.791 -5.436 275 HG22 THR 124 HG22 THR 124 18.957 13.339 -6.024 276 HG23 THR 124 HG23 THR 124 17.521 13.532 -7.031 277 H GLY 125 HN GLY 125 20.122 17.798 -5.842 278 HA2 GLY 125 HA2 GLY 125 21.477 18.433 -7.672 279 HA3 GLY 125 HA1 GLY 125 21.455 16.756 -8.221 280 H GLU 126 HN GLU 126 18.483 18.458 -7.514 281 HA GLU 126 HA GLU 126 17.567 18.036 -10.278 282 HB2 GLU 126 HB2 GLU 126 16.003 17.553 -8.564 283 HB3 GLU 126 HB1 GLU 126 16.400 19.024 -7.676 284 HG2 GLU 126 HG2 GLU 126 14.850 20.204 -8.804 285 HG3 GLU 126 HG1 GLU 126 15.502 19.668 -10.354 286 H THR 127 HN THR 127 19.077 19.613 -11.321 287 HA THR 127 HA THR 127 18.331 22.469 -10.792 288 HB THR 127 HB THR 127 20.588 22.556 -12.305 289 HG1 THR 127 HG1 THR 127 21.443 20.660 -12.377 290 HG21 THR 127 HG21 THR 127 21.825 22.693 -10.128 291 HG22 THR 127 HG22 THR 127 20.376 22.100 -9.317 292 HG23 THR 127 HG23 THR 127 20.345 23.653 -10.153 293 H ILE 128 HN ILE 128 16.471 22.489 -12.174 294 HA ILE 128 HA ILE 128 17.113 22.368 -15.095 295 HB ILE 128 HB ILE 128 16.007 20.278 -14.256 296 HG12 ILE 128 HG12 ILE 128 13.908 21.637 -15.883 297 HG13 ILE 128 HG11 ILE 128 15.540 21.601 -16.553 298 HG21 ILE 128 HG21 ILE 128 14.438 20.552 -12.659 299 HG22 ILE 128 HG22 ILE 128 13.360 21.127 -13.932 300 HG23 ILE 128 HG23 ILE 128 14.312 22.279 -12.995 301 HD11 ILE 128 HD11 ILE 128 14.064 19.157 -15.537 302 HD12 ILE 128 HD12 ILE 128 15.622 19.179 -16.362 303 HD13 ILE 128 HD13 ILE 128 14.156 19.627 -17.234 304 H THR 129 HN THR 129 15.240 23.468 -16.357 305 HA THR 129 HA THR 129 14.870 26.141 -15.442 306 HB THR 129 HB THR 129 14.780 25.404 -17.791 307 HG1 THR 129 HG1 THR 129 13.528 27.255 -16.982 308 HG21 THR 129 HG21 THR 129 13.064 24.015 -18.647 309 HG22 THR 129 HG22 THR 129 12.079 24.199 -17.196 310 HG23 THR 129 HG23 THR 129 13.555 23.235 -17.144 311 H GLU 130 HN GLU 130 12.399 26.992 -15.426 312 HA GLU 130 HA GLU 130 11.157 25.701 -13.079 313 HB2 GLU 130 HB2 GLU 130 11.348 28.060 -12.987 314 HB3 GLU 130 HB1 GLU 130 10.810 28.252 -14.656 315 HG2 GLU 130 HG2 GLU 130 8.556 27.445 -14.006 316 HG3 GLU 130 HG1 GLU 130 9.100 27.315 -12.333 317 H ASP 131 HN ASP 131 10.437 26.249 -16.508 318 HA ASP 131 HA ASP 131 7.684 25.417 -16.430 319 HB2 ASP 131 HB2 ASP 131 9.734 26.204 -18.318 320 HB3 ASP 131 HB1 ASP 131 8.805 24.848 -18.957 321 H ASP 132 HN ASP 132 10.568 23.626 -16.043 322 HA ASP 132 HA ASP 132 9.439 21.120 -17.162 323 HB2 ASP 132 HB2 ASP 132 12.047 22.234 -16.361 324 HB3 ASP 132 HB1 ASP 132 11.841 20.530 -15.951 325 H ILE 133 HN ILE 133 9.642 22.764 -14.130 326 HA ILE 133 HA ILE 133 9.659 20.450 -12.388 327 HB ILE 133 HB ILE 133 8.650 23.278 -11.953 328 HG12 ILE 133 HG12 ILE 133 10.912 23.392 -12.773 329 HG13 ILE 133 HG11 ILE 133 10.994 23.588 -11.022 330 HG21 ILE 133 HG21 ILE 133 8.649 22.831 -9.695 331 HG22 ILE 133 HG22 ILE 133 9.940 21.637 -9.824 332 HG23 ILE 133 HG23 ILE 133 8.292 21.207 -10.280 333 HD11 ILE 133 HD11 ILE 133 11.206 20.924 -11.117 334 HD12 ILE 133 HD12 ILE 133 12.617 21.971 -11.275 335 HD13 ILE 133 HD13 ILE 133 11.860 21.287 -12.714 336 H GLU 134 HN GLU 134 7.000 22.750 -13.133 337 HA GLU 134 HA GLU 134 4.856 21.503 -11.935 338 HB2 GLU 134 HB2 GLU 134 3.595 22.346 -14.050 339 HB3 GLU 134 HB1 GLU 134 4.494 23.527 -13.098 340 HG2 GLU 134 HG2 GLU 134 5.999 23.894 -14.755 341 HG3 GLU 134 HG1 GLU 134 6.104 22.182 -15.165 342 H GLU 135 HN GLU 135 6.566 20.383 -14.815 343 HA GLU 135 HA GLU 135 4.824 18.589 -16.002 344 HB2 GLU 135 HB2 GLU 135 7.201 19.037 -16.606 345 HB3 GLU 135 HB1 GLU 135 7.713 18.076 -15.218 346 HG2 GLU 135 HG2 GLU 135 6.598 16.099 -16.141 347 HG3 GLU 135 HG1 GLU 135 6.009 17.047 -17.507 348 H LEU 136 HN LEU 136 6.353 18.280 -12.835 349 HA LEU 136 HA LEU 136 5.366 15.510 -12.489 350 HB2 LEU 136 HB2 LEU 136 6.887 17.454 -10.721 351 HB3 LEU 136 HB1 LEU 136 6.570 15.768 -10.311 352 HG LEU 136 HG LEU 136 7.798 16.286 -12.972 353 HD11 LEU 136 HD11 LEU 136 9.094 16.907 -10.341 354 HD12 LEU 136 HD12 LEU 136 9.283 17.714 -11.898 355 HD13 LEU 136 HD13 LEU 136 10.066 16.161 -11.609 356 HD21 LEU 136 HD21 LEU 136 7.852 14.036 -12.713 357 HD22 LEU 136 HD22 LEU 136 7.532 14.153 -10.983 358 HD23 LEU 136 HD23 LEU 136 9.182 14.310 -11.587 359 H MET 137 HN MET 137 4.739 18.780 -11.226 360 HA MET 137 HA MET 137 3.012 18.333 -9.110 361 HB2 MET 137 HB2 MET 137 3.733 20.423 -10.769 362 HB3 MET 137 HB1 MET 137 2.000 20.284 -11.066 363 HG2 MET 137 HG2 MET 137 2.620 20.039 -8.231 364 HG3 MET 137 HG1 MET 137 3.201 21.567 -8.894 365 HE1 MET 137 HE1 MET 137 1.781 21.929 -6.914 366 HE2 MET 137 HE2 MET 137 0.145 21.300 -6.742 367 HE3 MET 137 HE3 MET 137 0.390 22.960 -7.278 368 H LYS 138 HN LYS 138 2.334 17.839 -12.550 369 HA LYS 138 HA LYS 138 -0.452 17.621 -12.597 370 HB2 LYS 138 HB2 LYS 138 1.833 16.241 -13.973 371 HB3 LYS 138 HB1 LYS 138 0.187 15.703 -14.305 372 HG2 LYS 138 HG2 LYS 138 0.190 18.554 -14.366 373 HG3 LYS 138 HG1 LYS 138 1.542 17.995 -15.352 374 HD2 LYS 138 HD2 LYS 138 -0.172 17.912 -16.914 375 HD3 LYS 138 HD1 LYS 138 -0.258 16.275 -16.262 376 HE2 LYS 138 HE2 LYS 138 -1.945 17.242 -14.551 377 HE3 LYS 138 HE1 LYS 138 -2.056 18.626 -15.656 378 HZ1 LYS 138 HZ1 LYS 138 -2.353 15.789 -16.485 379 HZ2 LYS 138 HZ2 LYS 138 -2.574 17.160 -17.462 380 HZ3 LYS 138 HZ3 LYS 138 -3.656 16.834 -16.193 381 H ASP 139 HN ASP 139 1.729 14.801 -12.145 382 HA ASP 139 HA ASP 139 -0.254 12.954 -11.343 383 HB2 ASP 139 HB2 ASP 139 2.684 13.297 -11.141 384 HB3 ASP 139 HB1 ASP 139 1.980 12.151 -10.000 385 H GLY 140 HN GLY 140 1.239 15.562 -9.554 386 HA2 GLY 140 HA2 GLY 140 0.473 14.531 -6.929 387 HA3 GLY 140 HA1 GLY 140 1.119 16.138 -7.262 388 H ASP 141 HN ASP 141 -0.578 17.405 -8.807 389 HA ASP 141 HA ASP 141 -3.117 17.408 -7.250 390 HB2 ASP 141 HB2 ASP 141 -1.343 19.358 -8.026 391 HB3 ASP 141 HB1 ASP 141 -2.590 19.494 -9.267 392 H LYS 142 HN LYS 142 -3.042 15.267 -9.029 393 HA LYS 142 HA LYS 142 -3.871 15.640 -11.682 394 HB2 LYS 142 HB2 LYS 142 -3.962 13.610 -9.608 395 HB3 LYS 142 HB1 LYS 142 -5.408 13.533 -10.616 396 HG2 LYS 142 HG2 LYS 142 -2.861 13.914 -12.080 397 HG3 LYS 142 HG1 LYS 142 -3.052 12.350 -11.286 398 HD2 LYS 142 HD2 LYS 142 -5.542 12.832 -12.459 399 HD3 LYS 142 HD1 LYS 142 -4.378 13.379 -13.667 400 HE2 LYS 142 HE2 LYS 142 -3.633 10.828 -12.387 401 HE3 LYS 142 HE1 LYS 142 -5.129 10.754 -13.340 402 HZ1 LYS 142 HZ1 LYS 142 -2.454 11.682 -14.212 403 HZ2 LYS 142 HZ2 LYS 142 -3.868 12.068 -15.071 404 HZ3 LYS 142 HZ3 LYS 142 -3.400 10.445 -14.883 405 H ASN 143 HN ASN 143 -5.670 16.148 -8.702 406 HA ASN 143 HA ASN 143 -8.303 16.293 -9.910 407 HB2 ASN 143 HB2 ASN 143 -8.142 15.843 -7.580 408 HB3 ASN 143 HB1 ASN 143 -7.018 17.177 -7.320 409 HD21 ASN 143 HD21 ASN 143 -8.180 18.606 -5.987 410 HD22 ASN 143 HD22 ASN 143 -9.730 19.199 -6.344 411 H ASN 144 HN ASN 144 -5.635 18.527 -9.505 412 HA ASN 144 HA ASN 144 -5.330 20.693 -10.413 413 HB2 ASN 144 HB2 ASN 144 -7.019 19.348 -12.099 414 HB3 ASN 144 HB1 ASN 144 -8.014 20.736 -11.656 415 HD21 ASN 144 HD21 ASN 144 -7.592 21.241 -14.088 416 HD22 ASN 144 HD22 ASN 144 -6.193 22.132 -14.451 417 H ASP 145 HN ASP 145 -5.806 21.049 -7.938 418 HA ASP 145 HA ASP 145 -8.281 22.722 -7.643 419 HB2 ASP 145 HB2 ASP 145 -8.312 22.001 -5.357 420 HB3 ASP 145 HB1 ASP 145 -7.978 20.555 -6.311 421 H GLY 146 HN GLY 146 -4.837 22.680 -7.592 422 HA2 GLY 146 HA2 GLY 146 -3.606 24.791 -7.683 423 HA3 GLY 146 HA1 GLY 146 -4.840 25.507 -6.645 424 H ARG 147 HN ARG 147 -4.235 22.448 -5.488 425 HA ARG 147 HA ARG 147 -1.851 23.155 -3.883 426 HB2 ARG 147 HB2 ARG 147 -4.680 22.909 -2.837 427 HB3 ARG 147 HB1 ARG 147 -3.275 22.732 -1.783 428 HG2 ARG 147 HG2 ARG 147 -2.478 24.981 -2.671 429 HG3 ARG 147 HG1 ARG 147 -4.070 25.158 -3.409 430 HD2 ARG 147 HD2 ARG 147 -4.798 25.984 -1.430 431 HD3 ARG 147 HD1 ARG 147 -4.551 24.370 -0.733 432 HE ARG 147 HE ARG 147 -2.010 25.350 -0.725 433 HH11 ARG 147 HH21 ARG 147 -5.048 26.679 0.258 434 HH12 ARG 147 HH22 ARG 147 -4.351 27.696 1.473 435 HH21 ARG 147 HH11 ARG 147 -1.100 26.670 0.858 436 HH22 ARG 147 HH12 ARG 147 -2.122 27.690 1.814 437 H ILE 148 HN ILE 148 -0.936 21.288 -2.857 438 HA ILE 148 HA ILE 148 -2.089 18.688 -3.802 439 HB ILE 148 HB ILE 148 0.743 19.379 -2.963 440 HG12 ILE 148 HG12 ILE 148 -0.647 19.519 -5.648 441 HG13 ILE 148 HG11 ILE 148 0.282 20.781 -4.839 442 HG21 ILE 148 HG21 ILE 148 -0.171 17.170 -4.805 443 HG22 ILE 148 HG22 ILE 148 -0.134 16.941 -3.056 444 HG23 ILE 148 HG23 ILE 148 1.355 17.310 -3.929 445 HD11 ILE 148 HD11 ILE 148 1.624 19.788 -6.632 446 HD12 ILE 148 HD12 ILE 148 1.388 18.181 -5.944 447 HD13 ILE 148 HD13 ILE 148 2.329 19.386 -5.066 448 H ASP 149 HN ASP 149 -3.271 17.860 -2.085 449 HA ASP 149 HA ASP 149 -2.354 18.237 0.698 450 HB2 ASP 149 HB2 ASP 149 -4.776 18.179 -0.470 451 HB3 ASP 149 HB1 ASP 149 -4.635 16.468 -0.065 452 H TYR 150 HN TYR 150 -2.611 16.071 2.075 453 HA TYR 150 HA TYR 150 -0.546 14.254 1.217 454 HB2 TYR 150 HB2 TYR 150 -0.998 14.714 3.557 455 HB3 TYR 150 HB1 TYR 150 -2.663 14.156 3.388 456 HD1 TYR 150 HD1 TYR 150 0.212 12.533 1.731 457 HD2 TYR 150 HD2 TYR 150 -2.530 12.375 5.034 458 HE1 TYR 150 HE1 TYR 150 0.937 10.214 2.222 459 HE2 TYR 150 HE2 TYR 150 -1.804 10.055 5.526 460 HH TYR 150 HH TYR 150 0.734 8.736 4.815 461 H ASP 151 HN ASP 151 -4.071 13.725 1.673 462 HA ASP 151 HA ASP 151 -4.274 11.104 0.720 463 HB2 ASP 151 HB2 ASP 151 -6.000 12.839 1.653 464 HB3 ASP 151 HB1 ASP 151 -6.255 13.241 -0.046 465 H GLU 152 HN GLU 152 -3.563 14.005 -1.086 466 HA GLU 152 HA GLU 152 -4.115 12.677 -3.688 467 HB2 GLU 152 HB2 GLU 152 -3.307 15.459 -2.802 468 HB3 GLU 152 HB1 GLU 152 -3.452 15.003 -4.499 469 HG2 GLU 152 HG2 GLU 152 -5.818 14.068 -3.550 470 HG3 GLU 152 HG1 GLU 152 -5.570 15.443 -2.473 471 H PHE 153 HN PHE 153 -1.404 13.956 -1.771 472 HA PHE 153 HA PHE 153 0.700 13.783 -3.620 473 HB2 PHE 153 HB2 PHE 153 0.802 14.656 -1.297 474 HB3 PHE 153 HB1 PHE 153 0.671 13.007 -0.684 475 HD1 PHE 153 HD1 PHE 153 2.709 14.960 -3.165 476 HD2 PHE 153 HD2 PHE 153 2.644 11.890 -0.161 477 HE1 PHE 153 HE1 PHE 153 5.160 14.671 -3.407 478 HE2 PHE 153 HE2 PHE 153 5.095 11.601 -0.404 479 HZ PHE 153 HZ PHE 153 6.353 12.991 -2.027 480 H LEU 154 HN LEU 154 -0.915 11.178 -1.841 481 HA LEU 154 HA LEU 154 0.949 9.079 -2.341 482 HB2 LEU 154 HB2 LEU 154 -2.076 9.078 -2.070 483 HB3 LEU 154 HB1 LEU 154 -1.049 7.654 -1.902 484 HG LEU 154 HG LEU 154 -1.092 10.117 -0.144 485 HD11 LEU 154 HD11 LEU 154 -1.760 7.200 0.166 486 HD12 LEU 154 HD12 LEU 154 -2.700 8.610 0.652 487 HD13 LEU 154 HD13 LEU 154 -1.269 8.146 1.572 488 HD21 LEU 154 HD21 LEU 154 1.211 9.713 -0.278 489 HD22 LEU 154 HD22 LEU 154 0.992 7.980 -0.516 490 HD23 LEU 154 HD23 LEU 154 0.747 8.688 1.080 491 H GLU 155 HN GLU 155 -1.685 10.400 -4.326 492 HA GLU 155 HA GLU 155 -1.666 8.354 -6.347 493 HB2 GLU 155 HB2 GLU 155 -2.797 11.010 -5.832 494 HB3 GLU 155 HB1 GLU 155 -2.474 10.728 -7.544 495 HG2 GLU 155 HG2 GLU 155 -4.656 9.877 -7.242 496 HG3 GLU 155 HG1 GLU 155 -3.634 8.441 -7.178 497 H PHE 156 HN PHE 156 0.603 10.795 -5.573 498 HA PHE 156 HA PHE 156 1.665 11.032 -8.328 499 HB2 PHE 156 HB2 PHE 156 1.647 13.045 -7.074 500 HB3 PHE 156 HB1 PHE 156 2.242 12.243 -5.621 501 HD1 PHE 156 HD1 PHE 156 4.611 11.409 -5.540 502 HD2 PHE 156 HD2 PHE 156 3.148 13.868 -8.743 503 HE1 PHE 156 HE1 PHE 156 6.942 11.936 -6.199 504 HE2 PHE 156 HE2 PHE 156 5.480 14.396 -9.402 505 HZ PHE 156 HZ PHE 156 7.377 13.430 -8.130 506 H MET 157 HN MET 157 2.640 9.709 -5.159 507 HA MET 157 HA MET 157 5.211 8.728 -6.113 508 HB2 MET 157 HB2 MET 157 3.496 8.154 -3.675 509 HB3 MET 157 HB1 MET 157 5.160 7.602 -3.866 510 HG2 MET 157 HG2 MET 157 4.225 10.487 -3.848 511 HG3 MET 157 HG1 MET 157 5.128 9.676 -2.569 512 HE1 MET 157 HE1 MET 157 8.490 10.099 -3.119 513 HE2 MET 157 HE2 MET 157 7.032 9.990 -2.135 514 HE3 MET 157 HE3 MET 157 7.515 11.544 -2.813 515 H LYS 158 HN LYS 158 2.066 7.701 -6.693 516 HA LYS 158 HA LYS 158 2.399 4.824 -6.493 517 HB2 LYS 158 HB2 LYS 158 0.317 6.511 -6.681 518 HB3 LYS 158 HB1 LYS 158 0.470 6.091 -8.387 519 HG2 LYS 158 HG2 LYS 158 0.625 3.820 -6.488 520 HG3 LYS 158 HG1 LYS 158 -0.950 4.605 -6.616 521 HD2 LYS 158 HD2 LYS 158 -1.145 4.124 -8.908 522 HD3 LYS 158 HD1 LYS 158 0.589 3.859 -9.095 523 HE2 LYS 158 HE2 LYS 158 0.276 1.647 -8.736 524 HE3 LYS 158 HE1 LYS 158 -0.390 2.008 -7.132 525 HZ1 LYS 158 HZ1 LYS 158 -1.908 0.912 -8.902 526 HZ2 LYS 158 HZ2 LYS 158 -2.017 2.484 -9.539 527 HZ3 LYS 158 HZ3 LYS 158 -2.524 2.171 -7.948 528 H GLY 159 HN GLY 159 3.591 7.146 -8.693 529 HA2 GLY 159 HA2 GLY 159 3.732 5.194 -10.930 530 HA3 GLY 159 HA1 GLY 159 4.110 6.912 -11.048 531 H VAL 160 HN VAL 160 5.501 5.905 -8.235 532 HA VAL 160 HA VAL 160 8.178 5.815 -9.477 533 HB VAL 160 HB VAL 160 7.258 5.714 -6.585 534 HG11 VAL 160 HG11 VAL 160 9.538 4.994 -6.729 535 HG12 VAL 160 HG12 VAL 160 9.589 6.689 -6.243 536 HG13 VAL 160 HG13 VAL 160 9.925 6.240 -7.915 537 HG21 VAL 160 HG21 VAL 160 8.214 8.225 -6.972 538 HG22 VAL 160 HG22 VAL 160 6.509 7.808 -7.131 539 HG23 VAL 160 HG23 VAL 160 7.529 7.909 -8.566 540 H GLU 161 HN GLU 161 6.032 3.511 -9.424 541 HA GLU 161 HA GLU 161 7.996 1.388 -8.660 542 HB2 GLU 161 HB2 GLU 161 5.209 1.906 -7.677 543 HB3 GLU 161 HB1 GLU 161 5.754 0.234 -7.818 544 HG2 GLU 161 HG2 GLU 161 7.708 0.738 -6.410 545 HG3 GLU 161 HG1 GLU 161 7.190 2.419 -6.280 546 HO1 KDH 1 H1 KDH 1 11.542 8.313 -10.526 547 H21 KDH 1 H21 KDH 1 11.489 8.364 -3.788 548 H33 KDH 1 H33 KDH 1 9.301 12.903 -6.942 549 H4 KDH 1 H4 KDH 1 11.099 9.016 -8.014 550 HO7 KDH 1 H7 KDH 1 8.507 7.889 -11.739 551 H01 KDH 1 H01 KDH 1 10.949 13.676 -5.129 552 H01A KDH 1 H02 KDH 1 9.425 12.848 -4.617 553 HO03 KDH 1 H03 KDH 1 12.805 13.947 -3.653 554 HO10 KDH 1 H10 KDH 1 6.361 10.026 -11.104 555 H12 KDH 1 H12 KDH 1 7.464 11.505 -7.985 556 H15 KDH 1 H15 KDH 1 8.639 10.867 -6.022 557 H26 KDH 1 H26 KDH 1 13.108 11.669 -1.399 558 H39 KDH 1 H39 KDH 1 13.644 12.952 -9.451 559 H41 KDH 1 H41 KDH 1 9.471 11.784 -10.182 560 HO02 KDH 1 H42 KDH 1 12.973 9.385 -0.734 561 HO44 KDH 1 H44 KDH 1 10.314 9.983 -13.068 562 HO47 KDH 1 H47 KDH 1 11.913 11.106 -14.130 563 HO50 KDH 1 H50 KDH 1 15.120 11.483 -11.265 Start of MODEL 9 1 H1 MET 90 HT1 MET 90 13.174 6.900 0.509 2 H2 MET 90 HT2 MET 90 14.705 7.371 1.077 3 H3 MET 90 HT3 MET 90 13.583 8.545 0.577 4 HA MET 90 HA MET 90 13.588 6.927 3.048 5 HB2 MET 90 HB2 MET 90 13.588 9.780 2.126 6 HB3 MET 90 HB1 MET 90 12.889 9.409 3.703 7 HG2 MET 90 HG2 MET 90 14.912 8.706 4.590 8 HG3 MET 90 HG1 MET 90 15.559 8.241 3.017 9 HE1 MET 90 HE1 MET 90 15.201 11.215 5.645 10 HE2 MET 90 HE2 MET 90 13.793 11.145 4.588 11 HE3 MET 90 HE3 MET 90 14.888 12.522 4.495 12 H GLY 91 HN GLY 91 11.684 5.773 3.229 13 HA2 GLY 91 HA2 GLY 91 9.244 6.524 3.883 14 HA3 GLY 91 HA1 GLY 91 9.178 6.987 2.182 15 H LYS 92 HN LYS 92 7.331 5.269 2.476 16 HA LYS 92 HA LYS 92 8.222 2.829 1.163 17 HB2 LYS 92 HB2 LYS 92 8.315 2.974 3.993 18 HB3 LYS 92 HB1 LYS 92 6.931 1.955 3.592 19 HG2 LYS 92 HG2 LYS 92 8.324 0.528 2.197 20 HG3 LYS 92 HG1 LYS 92 9.712 1.589 2.442 21 HD2 LYS 92 HD2 LYS 92 9.305 1.143 4.978 22 HD3 LYS 92 HD1 LYS 92 8.374 -0.245 4.417 23 HE2 LYS 92 HE2 LYS 92 10.332 -1.077 3.166 24 HE3 LYS 92 HE1 LYS 92 11.276 0.324 3.712 25 HZ1 LYS 92 HZ1 LYS 92 11.149 -0.340 5.917 26 HZ2 LYS 92 HZ2 LYS 92 11.383 -1.814 5.106 27 HZ3 LYS 92 HZ3 LYS 92 9.833 -1.375 5.646 28 H SER 93 HN SER 93 5.566 3.540 3.460 29 HA SER 93 HA SER 93 3.639 3.392 1.174 30 HB2 SER 93 HB2 SER 93 4.146 1.331 2.912 31 HB3 SER 93 HB1 SER 93 2.817 2.149 3.728 32 HG SER 93 HG SER 93 2.900 0.839 1.267 33 H GLU 94 HN GLU 94 1.300 3.779 2.481 34 HA GLU 94 HA GLU 94 1.165 6.525 3.076 35 HB2 GLU 94 HB2 GLU 94 -0.540 4.224 4.088 36 HB3 GLU 94 HB1 GLU 94 -1.042 5.914 4.031 37 HG2 GLU 94 HG2 GLU 94 -1.335 5.893 1.761 38 HG3 GLU 94 HG1 GLU 94 0.009 4.782 1.496 39 H GLU 95 HN GLU 95 2.190 3.877 5.105 40 HA GLU 95 HA GLU 95 1.753 5.048 7.686 41 HB2 GLU 95 HB2 GLU 95 2.243 2.693 7.364 42 HB3 GLU 95 HB1 GLU 95 3.781 3.075 6.589 43 HG2 GLU 95 HG2 GLU 95 4.532 2.629 8.730 44 HG3 GLU 95 HG1 GLU 95 4.211 4.357 8.885 45 H GLU 96 HN GLU 96 4.689 4.969 5.628 46 HA GLU 96 HA GLU 96 5.953 7.035 7.341 47 HB2 GLU 96 HB2 GLU 96 6.881 4.797 6.147 48 HB3 GLU 96 HB1 GLU 96 7.229 5.963 4.870 49 HG2 GLU 96 HG2 GLU 96 9.176 6.000 6.209 50 HG3 GLU 96 HG1 GLU 96 8.267 7.411 6.750 51 H LEU 97 HN LEU 97 4.348 6.705 4.253 52 HA LEU 97 HA LEU 97 5.364 8.846 2.753 53 HB2 LEU 97 HB2 LEU 97 2.910 7.273 2.988 54 HB3 LEU 97 HB1 LEU 97 2.590 8.910 2.416 55 HG LEU 97 HG LEU 97 3.026 7.526 0.482 56 HD11 LEU 97 HD11 LEU 97 4.573 8.906 -0.546 57 HD12 LEU 97 HD12 LEU 97 5.685 8.853 0.822 58 HD13 LEU 97 HD13 LEU 97 4.241 9.862 0.899 59 HD21 LEU 97 HD21 LEU 97 5.169 6.481 2.249 60 HD22 LEU 97 HD22 LEU 97 5.590 6.630 0.542 61 HD23 LEU 97 HD23 LEU 97 4.210 5.645 1.027 62 H SER 98 HN SER 98 3.019 8.922 5.429 63 HA SER 98 HA SER 98 2.370 11.714 5.254 64 HB2 SER 98 HB2 SER 98 1.422 9.591 6.587 65 HB3 SER 98 HB1 SER 98 2.441 10.253 7.863 66 HG SER 98 HG SER 98 1.341 12.230 7.610 67 H ASP 99 HN ASP 99 4.935 9.926 6.931 68 HA ASP 99 HA ASP 99 5.930 12.152 8.482 69 HB2 ASP 99 HB2 ASP 99 6.578 9.367 7.843 70 HB3 ASP 99 HB1 ASP 99 8.019 10.362 8.054 71 H LEU 100 HN LEU 100 5.988 11.537 5.154 72 HA LEU 100 HA LEU 100 8.592 12.890 4.683 73 HB2 LEU 100 HB2 LEU 100 6.967 10.923 3.417 74 HB3 LEU 100 HB1 LEU 100 7.061 12.300 2.319 75 HG LEU 100 HG LEU 100 9.501 12.276 2.439 76 HD11 LEU 100 HD11 LEU 100 9.058 10.940 4.862 77 HD12 LEU 100 HD12 LEU 100 10.623 11.263 4.115 78 HD13 LEU 100 HD13 LEU 100 9.802 9.731 3.816 79 HD21 LEU 100 HD21 LEU 100 9.779 10.478 1.013 80 HD22 LEU 100 HD22 LEU 100 8.017 10.541 1.040 81 HD23 LEU 100 HD23 LEU 100 8.873 9.379 2.053 82 H PHE 101 HN PHE 101 5.109 13.366 4.167 83 HA PHE 101 HA PHE 101 5.131 15.695 2.580 84 HB2 PHE 101 HB2 PHE 101 3.212 14.212 3.396 85 HB3 PHE 101 HB1 PHE 101 3.264 15.135 4.898 86 HD1 PHE 101 HD1 PHE 101 2.548 15.272 1.283 87 HD2 PHE 101 HD2 PHE 101 2.576 17.467 4.975 88 HE1 PHE 101 HE1 PHE 101 1.197 17.064 0.228 89 HE2 PHE 101 HE2 PHE 101 1.227 19.260 3.920 90 HZ PHE 101 HZ PHE 101 0.537 19.059 1.546 91 H ARG 102 HN ARG 102 5.825 15.310 6.012 92 HA ARG 102 HA ARG 102 5.551 18.063 6.794 93 HB2 ARG 102 HB2 ARG 102 6.861 17.294 8.742 94 HB3 ARG 102 HB1 ARG 102 5.628 16.107 8.313 95 HG2 ARG 102 HG2 ARG 102 7.329 14.833 7.028 96 HG3 ARG 102 HG1 ARG 102 8.556 15.995 7.533 97 HD2 ARG 102 HD2 ARG 102 7.284 15.236 9.921 98 HD3 ARG 102 HD1 ARG 102 7.493 13.728 9.007 99 HE ARG 102 HE ARG 102 9.881 15.256 8.747 100 HH11 ARG 102 HH21 ARG 102 8.020 13.544 11.100 101 HH12 ARG 102 HH22 ARG 102 9.391 13.135 12.075 102 HH21 ARG 102 HH11 ARG 102 11.676 14.729 10.012 103 HH22 ARG 102 HH12 ARG 102 11.458 13.806 11.461 104 H MET 103 HN MET 103 8.248 16.199 5.422 105 HA MET 103 HA MET 103 10.237 18.280 5.799 106 HB2 MET 103 HB2 MET 103 10.383 15.683 5.380 107 HB3 MET 103 HB1 MET 103 10.348 16.151 3.679 108 HG2 MET 103 HG2 MET 103 12.442 17.043 3.751 109 HG3 MET 103 HG1 MET 103 12.199 17.728 5.358 110 HE1 MET 103 HE1 MET 103 15.381 15.707 5.655 111 HE2 MET 103 HE2 MET 103 14.539 16.764 6.785 112 HE3 MET 103 HE3 MET 103 14.621 17.197 5.080 113 H PHE 104 HN PHE 104 8.472 17.114 2.900 114 HA PHE 104 HA PHE 104 9.444 18.959 1.016 115 HB2 PHE 104 HB2 PHE 104 6.615 17.902 1.315 116 HB3 PHE 104 HB1 PHE 104 7.383 18.423 -0.184 117 HD1 PHE 104 HD2 PHE 104 10.106 17.285 0.137 118 HD2 PHE 104 HD1 PHE 104 6.256 15.585 0.997 119 HE1 PHE 104 HE2 PHE 104 11.040 15.010 -0.178 120 HE2 PHE 104 HE1 PHE 104 7.191 13.310 0.682 121 HZ PHE 104 HZ PHE 104 9.583 13.022 0.094 122 H ASP 105 HN ASP 105 7.029 19.423 3.553 123 HA ASP 105 HA ASP 105 5.953 21.916 2.586 124 HB2 ASP 105 HB2 ASP 105 4.911 20.391 4.256 125 HB3 ASP 105 HB1 ASP 105 6.192 20.797 5.398 126 H LYS 106 HN LYS 106 8.492 22.489 2.080 127 HA LYS 106 HA LYS 106 9.938 23.628 4.356 128 HB2 LYS 106 HB2 LYS 106 10.920 22.619 2.247 129 HB3 LYS 106 HB1 LYS 106 10.342 24.042 1.378 130 HG2 LYS 106 HG2 LYS 106 11.672 25.500 2.844 131 HG3 LYS 106 HG1 LYS 106 12.232 24.093 3.750 132 HD2 LYS 106 HD2 LYS 106 12.618 24.035 0.797 133 HD3 LYS 106 HD1 LYS 106 13.646 25.134 1.718 134 HE2 LYS 106 HE2 LYS 106 13.735 22.836 3.253 135 HE3 LYS 106 HE1 LYS 106 13.713 22.198 1.596 136 HZ1 LYS 106 HZ1 LYS 106 15.532 23.527 0.990 137 HZ2 LYS 106 HZ2 LYS 106 15.964 22.877 2.499 138 HZ3 LYS 106 HZ3 LYS 106 15.422 24.483 2.386 139 H ASN 107 HN ASN 107 7.333 24.655 2.433 140 HA ASN 107 HA ASN 107 7.982 27.534 2.554 141 HB2 ASN 107 HB2 ASN 107 5.491 26.049 1.659 142 HB3 ASN 107 HB1 ASN 107 5.896 27.725 1.288 143 HD21 ASN 107 HD21 ASN 107 6.860 24.350 0.654 144 HD22 ASN 107 HD22 ASN 107 7.770 24.698 -0.736 145 H ALA 108 HN ALA 108 6.360 25.162 4.466 146 HA ALA 108 HA ALA 108 5.274 25.378 6.558 147 HB1 ALA 108 HB1 ALA 108 5.542 28.322 6.599 148 HB2 ALA 108 HB2 ALA 108 7.058 27.454 6.355 149 HB3 ALA 108 HB3 ALA 108 6.076 27.130 7.784 150 H ASP 109 HN ASP 109 3.131 24.935 6.008 151 HA ASP 109 HA ASP 109 1.190 27.038 6.040 152 HB2 ASP 109 HB2 ASP 109 0.541 26.728 3.560 153 HB3 ASP 109 HB1 ASP 109 1.992 27.673 3.893 154 H GLY 110 HN GLY 110 2.031 23.744 5.085 155 HA2 GLY 110 HA2 GLY 110 0.731 21.896 6.100 156 HA3 GLY 110 HA1 GLY 110 -0.711 22.898 5.923 157 H TYR 111 HN TYR 111 0.441 23.737 3.194 158 HA TYR 111 HA TYR 111 -0.316 21.242 1.708 159 HB2 TYR 111 HB2 TYR 111 -0.952 24.125 1.005 160 HB3 TYR 111 HB1 TYR 111 -1.570 22.682 0.199 161 HD1 TYR 111 HD1 TYR 111 -1.585 24.572 3.405 162 HD2 TYR 111 HD2 TYR 111 -3.435 21.477 1.071 163 HE1 TYR 111 HE1 TYR 111 -3.456 24.465 5.029 164 HE2 TYR 111 HE2 TYR 111 -5.305 21.369 2.697 165 HH TYR 111 HH TYR 111 -5.572 23.684 5.346 166 H ILE 112 HN ILE 112 0.502 21.340 -0.622 167 HA ILE 112 HA ILE 112 3.164 22.723 -0.719 168 HB ILE 112 HB ILE 112 2.193 20.033 -1.713 169 HG12 ILE 112 HG12 ILE 112 4.404 20.868 0.194 170 HG13 ILE 112 HG11 ILE 112 2.854 20.167 0.663 171 HG21 ILE 112 HG21 ILE 112 4.446 19.732 -2.662 172 HG22 ILE 112 HG22 ILE 112 4.868 21.380 -2.199 173 HG23 ILE 112 HG23 ILE 112 3.630 21.098 -3.423 174 HD11 ILE 112 HD11 ILE 112 4.393 18.644 -1.364 175 HD12 ILE 112 HD12 ILE 112 3.458 18.061 0.014 176 HD13 ILE 112 HD13 ILE 112 5.090 18.685 0.256 177 H ASP 113 HN ASP 113 2.784 24.486 -2.061 178 HA ASP 113 HA ASP 113 0.958 24.342 -4.345 179 HB2 ASP 113 HB2 ASP 113 2.744 26.319 -2.992 180 HB3 ASP 113 HB1 ASP 113 2.286 26.654 -4.662 181 H LEU 114 HN LEU 114 2.078 25.393 -6.481 182 HA LEU 114 HA LEU 114 3.842 23.374 -7.539 183 HB2 LEU 114 HB2 LEU 114 3.095 26.156 -8.500 184 HB3 LEU 114 HB1 LEU 114 3.853 24.915 -9.497 185 HG LEU 114 HG LEU 114 1.641 23.657 -8.296 186 HD11 LEU 114 HD11 LEU 114 1.207 26.485 -8.463 187 HD12 LEU 114 HD12 LEU 114 0.068 25.232 -7.970 188 HD13 LEU 114 HD13 LEU 114 0.192 25.694 -9.668 189 HD21 LEU 114 HD21 LEU 114 2.211 24.768 -11.053 190 HD22 LEU 114 HD22 LEU 114 0.765 23.821 -10.704 191 HD23 LEU 114 HD23 LEU 114 2.361 23.099 -10.503 192 H ASP 115 HN ASP 115 4.374 26.596 -6.168 193 HA ASP 115 HA ASP 115 7.099 26.918 -7.023 194 HB2 ASP 115 HB2 ASP 115 5.126 28.165 -5.261 195 HB3 ASP 115 HB1 ASP 115 6.768 28.302 -4.630 196 H GLU 116 HN GLU 116 5.645 25.023 -4.477 197 HA GLU 116 HA GLU 116 8.078 24.804 -2.863 198 HB2 GLU 116 HB2 GLU 116 5.613 23.039 -2.903 199 HB3 GLU 116 HB1 GLU 116 6.721 23.299 -1.554 200 HG2 GLU 116 HG2 GLU 116 6.065 25.805 -1.796 201 HG3 GLU 116 HG1 GLU 116 4.680 25.191 -2.701 202 H LEU 117 HN LEU 117 6.317 22.654 -5.121 203 HA LEU 117 HA LEU 117 8.011 20.396 -4.987 204 HB2 LEU 117 HB2 LEU 117 6.511 21.619 -7.328 205 HB3 LEU 117 HB1 LEU 117 7.082 19.952 -7.257 206 HG LEU 117 HG LEU 117 5.235 21.130 -5.170 207 HD11 LEU 117 HD11 LEU 117 4.033 19.237 -7.033 208 HD12 LEU 117 HD12 LEU 117 4.586 20.698 -7.851 209 HD13 LEU 117 HD13 LEU 117 3.446 20.816 -6.511 210 HD21 LEU 117 HD21 LEU 117 6.231 18.379 -5.905 211 HD22 LEU 117 HD22 LEU 117 4.726 18.583 -5.009 212 HD23 LEU 117 HD23 LEU 117 6.244 19.169 -4.329 213 H LYS 118 HN LYS 118 8.625 23.540 -6.306 214 HA LYS 118 HA LYS 118 10.632 22.837 -8.259 215 HB2 LYS 118 HB2 LYS 118 9.311 24.995 -7.995 216 HB3 LYS 118 HB1 LYS 118 10.360 25.380 -6.630 217 HG2 LYS 118 HG2 LYS 118 11.897 24.543 -8.958 218 HG3 LYS 118 HG1 LYS 118 10.880 25.939 -9.317 219 HD2 LYS 118 HD2 LYS 118 11.799 26.802 -6.987 220 HD3 LYS 118 HD1 LYS 118 13.116 25.682 -7.338 221 HE2 LYS 118 HE2 LYS 118 12.258 27.498 -9.553 222 HE3 LYS 118 HE1 LYS 118 13.186 28.211 -8.219 223 HZ1 LYS 118 HZ1 LYS 118 13.934 25.778 -9.754 224 HZ2 LYS 118 HZ2 LYS 118 14.802 26.417 -8.441 225 HZ3 LYS 118 HZ3 LYS 118 14.675 27.297 -9.889 226 H ILE 119 HN ILE 119 10.844 23.928 -4.853 227 HA ILE 119 HA ILE 119 13.760 23.439 -4.821 228 HB ILE 119 HB ILE 119 11.815 24.328 -2.667 229 HG12 ILE 119 HG12 ILE 119 13.367 26.493 -3.555 230 HG13 ILE 119 HG11 ILE 119 12.859 25.667 -5.028 231 HG21 ILE 119 HG21 ILE 119 14.503 25.359 -2.469 232 HG22 ILE 119 HG22 ILE 119 14.546 23.598 -2.558 233 HG23 ILE 119 HG23 ILE 119 13.601 24.394 -1.300 234 HD11 ILE 119 HD11 ILE 119 10.911 26.800 -4.781 235 HD12 ILE 119 HD12 ILE 119 11.257 27.195 -3.097 236 HD13 ILE 119 HD13 ILE 119 10.557 25.630 -3.509 237 H MET 120 HN MET 120 10.782 21.976 -3.612 238 HA MET 120 HA MET 120 11.807 20.230 -1.644 239 HB2 MET 120 HB2 MET 120 9.448 20.519 -1.996 240 HB3 MET 120 HB1 MET 120 9.573 19.995 -3.676 241 HG2 MET 120 HG2 MET 120 10.633 18.017 -1.795 242 HG3 MET 120 HG1 MET 120 8.924 18.365 -1.529 243 HE1 MET 120 HE1 MET 120 8.067 16.496 -1.853 244 HE2 MET 120 HE2 MET 120 9.005 15.255 -2.679 245 HE3 MET 120 HE3 MET 120 7.509 15.844 -3.400 246 H LEU 121 HN LEU 121 11.964 20.009 -5.165 247 HA LEU 121 HA LEU 121 12.968 17.231 -5.084 248 HB2 LEU 121 HB2 LEU 121 11.627 18.936 -6.895 249 HB3 LEU 121 HB1 LEU 121 13.197 18.594 -7.624 250 HG LEU 121 HG LEU 121 12.707 16.123 -6.957 251 HD11 LEU 121 HD11 LEU 121 10.705 15.685 -6.027 252 HD12 LEU 121 HD12 LEU 121 9.882 16.440 -7.392 253 HD13 LEU 121 HD13 LEU 121 10.362 17.415 -6.004 254 HD21 LEU 121 HD21 LEU 121 10.792 16.852 -9.076 255 HD22 LEU 121 HD22 LEU 121 12.223 15.824 -9.160 256 HD23 LEU 121 HD23 LEU 121 12.387 17.577 -9.273 257 H GLN 122 HN GLN 122 14.280 20.437 -5.042 258 HA GLN 122 HA GLN 122 16.708 20.265 -6.398 259 HB2 GLN 122 HB2 GLN 122 15.491 21.821 -4.352 260 HB3 GLN 122 HB1 GLN 122 17.120 21.433 -3.800 261 HG2 GLN 122 HG2 GLN 122 17.950 22.168 -6.085 262 HG3 GLN 122 HG1 GLN 122 16.326 22.787 -6.388 263 HE21 GLN 122 HE21 GLN 122 15.662 24.716 -5.260 264 HE22 GLN 122 HE22 GLN 122 16.732 25.626 -4.308 265 H ALA 123 HN ALA 123 15.735 18.490 -3.552 266 HA ALA 123 HA ALA 123 18.192 17.823 -2.351 267 HB1 ALA 123 HB1 ALA 123 15.613 16.319 -2.832 268 HB2 ALA 123 HB2 ALA 123 16.124 17.156 -1.367 269 HB3 ALA 123 HB3 ALA 123 16.908 15.649 -1.840 270 H THR 124 HN THR 124 16.917 16.851 -5.453 271 HA THR 124 HA THR 124 19.153 14.873 -5.754 272 HB THR 124 HB THR 124 16.762 14.090 -5.913 273 HG1 THR 124 HG1 THR 124 17.263 12.784 -7.542 274 HG21 THR 124 HG21 THR 124 16.169 14.980 -8.537 275 HG22 THR 124 HG22 THR 124 16.610 16.410 -7.604 276 HG23 THR 124 HG23 THR 124 15.303 15.363 -7.050 277 H GLY 125 HN GLY 125 18.723 17.992 -6.319 278 HA2 GLY 125 HA2 GLY 125 19.822 19.454 -7.807 279 HA3 GLY 125 HA1 GLY 125 20.494 18.043 -8.626 280 H GLU 126 HN GLU 126 17.048 18.603 -8.073 281 HA GLU 126 HA GLU 126 16.207 17.936 -10.673 282 HB2 GLU 126 HB2 GLU 126 14.127 19.051 -9.998 283 HB3 GLU 126 HB1 GLU 126 14.809 18.188 -8.620 284 HG2 GLU 126 HG2 GLU 126 14.698 20.132 -7.484 285 HG3 GLU 126 HG1 GLU 126 16.011 20.707 -8.511 286 H THR 127 HN THR 127 17.573 18.966 -12.258 287 HA THR 127 HA THR 127 17.306 21.947 -12.432 288 HB THR 127 HB THR 127 19.352 21.628 -13.935 289 HG1 THR 127 HG1 THR 127 19.649 19.143 -12.702 290 HG21 THR 127 HG21 THR 127 19.846 20.505 -11.189 291 HG22 THR 127 HG22 THR 127 19.286 22.166 -11.387 292 HG23 THR 127 HG23 THR 127 20.816 21.659 -12.104 293 H ILE 128 HN ILE 128 15.288 21.936 -13.567 294 HA ILE 128 HA ILE 128 15.496 20.979 -16.391 295 HB ILE 128 HB ILE 128 13.012 20.333 -16.024 296 HG12 ILE 128 HG12 ILE 128 14.001 20.513 -13.161 297 HG13 ILE 128 HG11 ILE 128 12.704 21.470 -13.877 298 HG21 ILE 128 HG21 ILE 128 14.528 18.564 -16.364 299 HG22 ILE 128 HG22 ILE 128 13.784 18.174 -14.814 300 HG23 ILE 128 HG23 ILE 128 15.391 18.898 -14.864 301 HD11 ILE 128 HD11 ILE 128 12.410 19.022 -12.570 302 HD12 ILE 128 HD12 ILE 128 12.287 18.613 -14.281 303 HD13 ILE 128 HD13 ILE 128 11.201 19.813 -13.581 304 H THR 129 HN THR 129 13.660 22.017 -17.723 305 HA THR 129 HA THR 129 13.716 24.883 -17.376 306 HB THR 129 HB THR 129 11.993 24.670 -19.282 307 HG1 THR 129 HG1 THR 129 11.183 22.657 -18.813 308 HG21 THR 129 HG21 THR 129 14.801 24.130 -19.163 309 HG22 THR 129 HG22 THR 129 13.877 24.823 -20.495 310 HG23 THR 129 HG23 THR 129 14.082 23.075 -20.379 311 H GLU 130 HN GLU 130 11.856 26.263 -16.939 312 HA GLU 130 HA GLU 130 10.306 25.618 -14.679 313 HB2 GLU 130 HB2 GLU 130 9.010 27.616 -15.350 314 HB3 GLU 130 HB1 GLU 130 10.738 27.879 -15.593 315 HG2 GLU 130 HG2 GLU 130 10.181 26.890 -18.006 316 HG3 GLU 130 HG1 GLU 130 8.574 27.508 -17.621 317 H ASP 131 HN ASP 131 9.603 25.090 -18.112 318 HA ASP 131 HA ASP 131 6.825 24.443 -17.865 319 HB2 ASP 131 HB2 ASP 131 7.757 24.917 -20.006 320 HB3 ASP 131 HB1 ASP 131 9.045 23.732 -19.789 321 H ASP 132 HN ASP 132 9.700 22.672 -17.033 322 HA ASP 132 HA ASP 132 8.502 20.014 -17.144 323 HB2 ASP 132 HB2 ASP 132 11.045 21.277 -16.723 324 HB3 ASP 132 HB1 ASP 132 10.753 20.151 -15.396 325 H ILE 133 HN ILE 133 8.335 22.635 -14.928 326 HA ILE 133 HA ILE 133 8.103 21.203 -12.443 327 HB ILE 133 HB ILE 133 6.898 23.836 -13.360 328 HG12 ILE 133 HG12 ILE 133 9.313 23.768 -13.757 329 HG13 ILE 133 HG11 ILE 133 8.975 24.803 -12.369 330 HG21 ILE 133 HG21 ILE 133 6.117 22.735 -11.153 331 HG22 ILE 133 HG22 ILE 133 6.696 24.399 -11.070 332 HG23 ILE 133 HG23 ILE 133 7.745 23.075 -10.565 333 HD11 ILE 133 HD11 ILE 133 9.310 22.619 -10.973 334 HD12 ILE 133 HD12 ILE 133 10.733 23.466 -11.581 335 HD13 ILE 133 HD13 ILE 133 10.140 22.029 -12.414 336 H GLU 134 HN GLU 134 5.484 22.765 -14.333 337 HA GLU 134 HA GLU 134 3.280 21.619 -13.040 338 HB2 GLU 134 HB2 GLU 134 3.791 22.336 -15.942 339 HB3 GLU 134 HB1 GLU 134 2.187 21.966 -15.310 340 HG2 GLU 134 HG2 GLU 134 2.079 23.903 -14.056 341 HG3 GLU 134 HG1 GLU 134 3.830 23.995 -13.855 342 H GLU 135 HN GLU 135 5.588 20.092 -15.149 343 HA GLU 135 HA GLU 135 4.132 17.926 -16.214 344 HB2 GLU 135 HB2 GLU 135 6.619 18.766 -16.409 345 HB3 GLU 135 HB1 GLU 135 6.909 17.615 -15.104 346 HG2 GLU 135 HG2 GLU 135 5.283 16.625 -17.384 347 HG3 GLU 135 HG1 GLU 135 6.991 16.918 -17.714 348 H LEU 136 HN LEU 136 5.566 18.296 -12.970 349 HA LEU 136 HA LEU 136 4.731 15.573 -12.187 350 HB2 LEU 136 HB2 LEU 136 6.016 17.886 -10.699 351 HB3 LEU 136 HB1 LEU 136 5.823 16.256 -10.053 352 HG LEU 136 HG LEU 136 7.108 16.438 -12.718 353 HD11 LEU 136 HD11 LEU 136 8.888 17.699 -12.141 354 HD12 LEU 136 HD12 LEU 136 9.077 16.839 -10.613 355 HD13 LEU 136 HD13 LEU 136 7.967 18.206 -10.725 356 HD21 LEU 136 HD21 LEU 136 7.678 14.350 -12.089 357 HD22 LEU 136 HD22 LEU 136 6.843 14.602 -10.556 358 HD23 LEU 136 HD23 LEU 136 8.557 14.992 -10.701 359 H MET 137 HN MET 137 3.632 18.892 -11.823 360 HA MET 137 HA MET 137 1.943 18.741 -9.590 361 HB2 MET 137 HB2 MET 137 2.545 20.574 -11.453 362 HB3 MET 137 HB1 MET 137 0.966 20.084 -12.071 363 HG2 MET 137 HG2 MET 137 0.673 21.947 -10.525 364 HG3 MET 137 HG1 MET 137 -0.003 20.486 -9.806 365 HE1 MET 137 HE1 MET 137 0.159 20.691 -7.258 366 HE2 MET 137 HE2 MET 137 0.092 22.337 -7.882 367 HE3 MET 137 HE3 MET 137 1.212 21.941 -6.581 368 H LYS 138 HN LYS 138 1.597 17.170 -12.685 369 HA LYS 138 HA LYS 138 -1.269 16.700 -12.528 370 HB2 LYS 138 HB2 LYS 138 0.941 16.291 -14.306 371 HB3 LYS 138 HB1 LYS 138 0.098 14.754 -14.112 372 HG2 LYS 138 HG2 LYS 138 -1.337 15.559 -15.674 373 HG3 LYS 138 HG1 LYS 138 -1.994 16.528 -14.355 374 HD2 LYS 138 HD2 LYS 138 0.404 17.557 -15.826 375 HD3 LYS 138 HD1 LYS 138 -1.179 17.685 -16.596 376 HE2 LYS 138 HE2 LYS 138 -1.508 18.496 -13.882 377 HE3 LYS 138 HE1 LYS 138 -0.091 19.349 -14.527 378 HZ1 LYS 138 HZ1 LYS 138 -1.358 19.975 -16.464 379 HZ2 LYS 138 HZ2 LYS 138 -2.182 20.491 -15.071 380 HZ3 LYS 138 HZ3 LYS 138 -2.710 19.112 -15.912 381 H ASP 139 HN ASP 139 1.625 14.720 -11.819 382 HA ASP 139 HA ASP 139 0.173 12.370 -11.000 383 HB2 ASP 139 HB2 ASP 139 2.943 13.479 -10.837 384 HB3 ASP 139 HB1 ASP 139 2.551 12.118 -9.786 385 H GLY 140 HN GLY 140 1.212 15.293 -9.314 386 HA2 GLY 140 HA2 GLY 140 0.275 14.141 -6.731 387 HA3 GLY 140 HA1 GLY 140 1.264 15.593 -6.897 388 H ASP 141 HN ASP 141 -0.605 16.378 -9.219 389 HA ASP 141 HA ASP 141 -3.003 17.154 -7.608 390 HB2 ASP 141 HB2 ASP 141 -0.831 18.783 -8.025 391 HB3 ASP 141 HB1 ASP 141 -1.870 19.224 -9.382 392 H LYS 142 HN LYS 142 -3.832 15.371 -9.130 393 HA LYS 142 HA LYS 142 -3.959 15.819 -11.978 394 HB2 LYS 142 HB2 LYS 142 -4.731 13.890 -10.024 395 HB3 LYS 142 HB1 LYS 142 -6.168 14.282 -10.969 396 HG2 LYS 142 HG2 LYS 142 -5.059 13.742 -13.034 397 HG3 LYS 142 HG1 LYS 142 -3.497 13.608 -12.225 398 HD2 LYS 142 HD2 LYS 142 -5.512 11.880 -11.009 399 HD3 LYS 142 HD1 LYS 142 -5.265 11.513 -12.717 400 HE2 LYS 142 HE2 LYS 142 -3.013 10.955 -12.409 401 HE3 LYS 142 HE1 LYS 142 -2.876 11.920 -10.925 402 HZ1 LYS 142 HZ1 LYS 142 -3.222 9.321 -10.833 403 HZ2 LYS 142 HZ2 LYS 142 -4.855 9.766 -10.980 404 HZ3 LYS 142 HZ3 LYS 142 -3.925 10.349 -9.683 405 H ASN 143 HN ASN 143 -5.631 17.200 -9.301 406 HA ASN 143 HA ASN 143 -8.023 17.969 -10.854 407 HB2 ASN 143 HB2 ASN 143 -7.143 18.893 -8.109 408 HB3 ASN 143 HB1 ASN 143 -8.787 18.786 -8.738 409 HD21 ASN 143 HD21 ASN 143 -7.154 17.339 -6.441 410 HD22 ASN 143 HD22 ASN 143 -7.587 15.713 -6.657 411 H ASN 144 HN ASN 144 -4.865 19.165 -10.334 412 HA ASN 144 HA ASN 144 -3.849 21.225 -10.895 413 HB2 ASN 144 HB2 ASN 144 -5.662 20.481 -12.827 414 HB3 ASN 144 HB1 ASN 144 -6.200 22.115 -12.436 415 HD21 ASN 144 HD21 ASN 144 -4.720 23.896 -12.877 416 HD22 ASN 144 HD22 ASN 144 -3.338 23.683 -13.839 417 H ASP 145 HN ASP 145 -6.036 21.001 -8.663 418 HA ASP 145 HA ASP 145 -7.452 23.465 -8.473 419 HB2 ASP 145 HB2 ASP 145 -6.252 21.745 -6.277 420 HB3 ASP 145 HB1 ASP 145 -7.618 22.848 -6.106 421 H GLY 146 HN GLY 146 -4.079 22.751 -8.094 422 HA2 GLY 146 HA2 GLY 146 -2.389 24.476 -8.047 423 HA3 GLY 146 HA1 GLY 146 -3.587 25.593 -7.391 424 H ARG 147 HN ARG 147 -3.438 22.411 -6.031 425 HA ARG 147 HA ARG 147 -1.594 23.182 -3.861 426 HB2 ARG 147 HB2 ARG 147 -4.272 23.897 -3.724 427 HB3 ARG 147 HB1 ARG 147 -4.218 22.390 -2.809 428 HG2 ARG 147 HG2 ARG 147 -2.451 23.256 -1.384 429 HG3 ARG 147 HG1 ARG 147 -2.337 24.723 -2.356 430 HD2 ARG 147 HD2 ARG 147 -4.891 23.889 -0.946 431 HD3 ARG 147 HD1 ARG 147 -3.698 24.988 -0.226 432 HE ARG 147 HE ARG 147 -4.468 25.727 -2.950 433 HH11 ARG 147 HH21 ARG 147 -5.148 25.964 0.431 434 HH12 ARG 147 HH22 ARG 147 -6.003 27.462 0.284 435 HH21 ARG 147 HH11 ARG 147 -5.586 27.681 -3.149 436 HH22 ARG 147 HH12 ARG 147 -6.252 28.432 -1.737 437 H ILE 148 HN ILE 148 -0.592 21.326 -3.159 438 HA ILE 148 HA ILE 148 -1.787 18.704 -3.953 439 HB ILE 148 HB ILE 148 1.013 19.454 -3.052 440 HG12 ILE 148 HG12 ILE 148 -0.163 19.127 -5.831 441 HG13 ILE 148 HG11 ILE 148 0.431 20.628 -5.121 442 HG21 ILE 148 HG21 ILE 148 1.195 17.227 -4.642 443 HG22 ILE 148 HG22 ILE 148 -0.334 16.941 -3.810 444 HG23 ILE 148 HG23 ILE 148 1.143 17.190 -2.880 445 HD11 ILE 148 HD11 ILE 148 2.682 19.846 -5.095 446 HD12 ILE 148 HD12 ILE 148 2.050 19.402 -6.681 447 HD13 ILE 148 HD13 ILE 148 2.185 18.184 -5.413 448 H ASP 149 HN ASP 149 -2.996 17.868 -2.270 449 HA ASP 149 HA ASP 149 -2.240 18.411 0.535 450 HB2 ASP 149 HB2 ASP 149 -4.395 17.465 1.004 451 HB3 ASP 149 HB1 ASP 149 -4.594 18.412 -0.471 452 H TYR 150 HN TYR 150 -2.801 16.119 1.862 453 HA TYR 150 HA TYR 150 -0.482 14.463 1.429 454 HB2 TYR 150 HB2 TYR 150 -1.491 14.813 3.619 455 HB3 TYR 150 HB1 TYR 150 -3.018 14.128 3.062 456 HD1 TYR 150 HD1 TYR 150 0.363 12.863 2.192 457 HD2 TYR 150 HD2 TYR 150 -3.179 12.248 4.544 458 HE1 TYR 150 HE1 TYR 150 1.158 10.593 2.796 459 HE2 TYR 150 HE2 TYR 150 -2.383 9.978 5.148 460 HH TYR 150 HH TYR 150 0.761 8.959 4.720 461 H ASP 151 HN ASP 151 -3.936 13.505 1.296 462 HA ASP 151 HA ASP 151 -3.730 11.004 0.133 463 HB2 ASP 151 HB2 ASP 151 -5.733 12.604 0.807 464 HB3 ASP 151 HB1 ASP 151 -5.752 12.956 -0.921 465 H GLU 152 HN GLU 152 -3.573 14.138 -1.564 466 HA GLU 152 HA GLU 152 -3.413 13.007 -4.222 467 HB2 GLU 152 HB2 GLU 152 -3.278 15.594 -2.852 468 HB3 GLU 152 HB1 GLU 152 -2.216 15.516 -4.259 469 HG2 GLU 152 HG2 GLU 152 -4.113 14.728 -5.639 470 HG3 GLU 152 HG1 GLU 152 -5.173 14.844 -4.234 471 H PHE 153 HN PHE 153 -1.062 13.670 -1.700 472 HA PHE 153 HA PHE 153 1.300 13.636 -3.362 473 HB2 PHE 153 HB2 PHE 153 1.140 14.585 -1.078 474 HB3 PHE 153 HB1 PHE 153 0.868 12.967 -0.431 475 HD1 PHE 153 HD1 PHE 153 3.214 14.189 -3.082 476 HD2 PHE 153 HD2 PHE 153 2.781 12.374 0.787 477 HE1 PHE 153 HE1 PHE 153 5.663 13.808 -2.987 478 HE2 PHE 153 HE2 PHE 153 5.230 11.992 0.882 479 HZ PHE 153 HZ PHE 153 6.670 12.709 -1.007 480 H LEU 154 HN LEU 154 -0.411 11.125 -1.486 481 HA LEU 154 HA LEU 154 1.277 8.947 -1.644 482 HB2 LEU 154 HB2 LEU 154 -1.533 9.490 -1.410 483 HB3 LEU 154 HB1 LEU 154 -1.319 8.079 -2.447 484 HG LEU 154 HG LEU 154 -1.472 7.437 -0.058 485 HD11 LEU 154 HD11 LEU 154 1.370 6.877 -0.516 486 HD12 LEU 154 HD12 LEU 154 0.371 6.580 -1.939 487 HD13 LEU 154 HD13 LEU 154 0.008 5.761 -0.420 488 HD21 LEU 154 HD21 LEU 154 -0.096 8.312 1.582 489 HD22 LEU 154 HD22 LEU 154 -0.190 9.712 0.514 490 HD23 LEU 154 HD23 LEU 154 1.214 8.648 0.451 491 H GLU 155 HN GLU 155 -0.941 9.998 -4.258 492 HA GLU 155 HA GLU 155 -0.078 8.013 -6.158 493 HB2 GLU 155 HB2 GLU 155 -1.769 10.417 -6.005 494 HB3 GLU 155 HB1 GLU 155 -1.055 10.159 -7.598 495 HG2 GLU 155 HG2 GLU 155 -2.193 8.188 -7.945 496 HG3 GLU 155 HG1 GLU 155 -2.225 7.782 -6.229 497 H PHE 156 HN PHE 156 1.193 11.140 -5.209 498 HA PHE 156 HA PHE 156 2.686 11.925 -7.451 499 HB2 PHE 156 HB2 PHE 156 2.400 13.112 -5.260 500 HB3 PHE 156 HB1 PHE 156 3.537 11.972 -4.538 501 HD1 PHE 156 HD2 PHE 156 5.900 11.856 -5.401 502 HD2 PHE 156 HD1 PHE 156 3.160 14.943 -6.591 503 HE1 PHE 156 HE2 PHE 156 7.799 13.229 -6.211 504 HE2 PHE 156 HE1 PHE 156 5.059 16.316 -7.402 505 HZ PHE 156 HZ PHE 156 7.379 15.459 -7.212 506 H MET 157 HN MET 157 3.501 9.475 -4.993 507 HA MET 157 HA MET 157 6.164 8.945 -5.981 508 HB2 MET 157 HB2 MET 157 4.305 7.094 -4.467 509 HB3 MET 157 HB1 MET 157 6.067 7.134 -4.403 510 HG2 MET 157 HG2 MET 157 5.233 9.747 -3.766 511 HG3 MET 157 HG1 MET 157 4.158 8.676 -2.867 512 HE1 MET 157 HE1 MET 157 8.098 10.047 -1.608 513 HE2 MET 157 HE2 MET 157 6.543 10.797 -1.957 514 HE3 MET 157 HE3 MET 157 7.555 10.227 -3.283 515 H LYS 158 HN LYS 158 3.080 7.146 -6.348 516 HA LYS 158 HA LYS 158 2.380 5.680 -8.068 517 HB2 LYS 158 HB2 LYS 158 3.211 7.752 -9.335 518 HB3 LYS 158 HB1 LYS 158 4.705 6.855 -9.609 519 HG2 LYS 158 HG2 LYS 158 3.578 6.176 -11.490 520 HG3 LYS 158 HG1 LYS 158 2.938 4.972 -10.371 521 HD2 LYS 158 HD2 LYS 158 1.528 7.594 -10.478 522 HD3 LYS 158 HD1 LYS 158 1.333 6.523 -11.867 523 HE2 LYS 158 HE2 LYS 158 0.677 4.678 -10.292 524 HE3 LYS 158 HE1 LYS 158 0.720 5.857 -8.966 525 HZ1 LYS 158 HZ1 LYS 158 -0.756 6.465 -11.443 526 HZ2 LYS 158 HZ2 LYS 158 -0.985 7.091 -9.880 527 HZ3 LYS 158 HZ3 LYS 158 -1.483 5.508 -10.246 528 H GLY 159 HN GLY 159 4.861 5.169 -6.197 529 HA2 GLY 159 HA2 GLY 159 5.558 2.753 -6.020 530 HA3 GLY 159 HA1 GLY 159 5.891 2.827 -7.751 531 H VAL 160 HN VAL 160 7.481 4.691 -8.343 532 HA VAL 160 HA VAL 160 9.691 5.509 -8.157 533 HB VAL 160 HB VAL 160 8.874 5.577 -5.234 534 HG11 VAL 160 HG11 VAL 160 10.430 7.502 -5.145 535 HG12 VAL 160 HG12 VAL 160 10.844 7.236 -6.838 536 HG13 VAL 160 HG13 VAL 160 11.264 6.025 -5.627 537 HG21 VAL 160 HG21 VAL 160 7.147 6.730 -6.338 538 HG22 VAL 160 HG22 VAL 160 8.227 7.335 -7.594 539 HG23 VAL 160 HG23 VAL 160 8.294 8.018 -5.970 540 H GLU 161 HN GLU 161 10.349 3.185 -8.683 541 HA GLU 161 HA GLU 161 11.606 1.229 -8.216 542 HB2 GLU 161 HB2 GLU 161 13.179 3.174 -7.979 543 HB3 GLU 161 HB1 GLU 161 12.842 3.180 -6.247 544 HG2 GLU 161 HG2 GLU 161 13.526 0.513 -7.211 545 HG3 GLU 161 HG1 GLU 161 14.813 1.678 -7.527 546 HO1 KDH 1 H1 KDH 1 6.193 10.938 -10.007 547 H21 KDH 1 H21 KDH 1 11.979 7.879 -4.090 548 H33 KDH 1 H33 KDH 1 9.342 12.634 -6.537 549 H4 KDH 1 H4 KDH 1 7.737 11.580 -8.004 550 HO7 KDH 1 H7 KDH 1 9.401 8.791 -12.208 551 H01 KDH 1 H01 KDH 1 10.973 13.262 -4.687 552 H01A KDH 1 H02 KDH 1 9.558 12.231 -4.232 553 HO03 KDH 1 H03 KDH 1 11.559 13.520 -2.984 554 HO10 KDH 1 H10 KDH 1 10.631 7.872 -11.310 555 H12 KDH 1 H12 KDH 1 11.048 8.675 -7.844 556 H15 KDH 1 H15 KDH 1 8.779 10.481 -5.858 557 H26 KDH 1 H26 KDH 1 13.660 11.003 -1.511 558 H39 KDH 1 H39 KDH 1 11.117 13.895 -10.807 559 H41 KDH 1 H41 KDH 1 12.869 10.799 -8.214 560 HO02 KDH 1 H42 KDH 1 14.474 8.867 -1.650 561 HO44 KDH 1 H44 KDH 1 15.377 10.067 -10.559 562 HO47 KDH 1 H47 KDH 1 14.368 11.799 -13.280 563 HO50 KDH 1 H50 KDH 1 13.181 13.960 -13.020 Start of MODEL 10 1 H1 MET 90 HT1 MET 90 11.711 4.969 2.744 2 H2 MET 90 HT2 MET 90 12.605 6.399 2.536 3 H3 MET 90 HT3 MET 90 13.309 4.893 2.182 4 HA MET 90 HA MET 90 12.439 6.350 0.239 5 HB2 MET 90 HB2 MET 90 11.851 4.145 -0.869 6 HB3 MET 90 HB1 MET 90 13.373 4.128 0.022 7 HG2 MET 90 HG2 MET 90 12.226 3.128 1.967 8 HG3 MET 90 HG1 MET 90 10.706 3.137 1.073 9 HE1 MET 90 HE1 MET 90 12.052 -0.489 1.587 10 HE2 MET 90 HE2 MET 90 11.758 0.972 2.525 11 HE3 MET 90 HE3 MET 90 13.406 0.536 2.082 12 H GLY 91 HN GLY 91 10.419 6.150 -1.208 13 HA2 GLY 91 HA2 GLY 91 8.102 7.007 0.269 14 HA3 GLY 91 HA1 GLY 91 8.137 6.654 -1.459 15 H LYS 92 HN LYS 92 6.943 5.605 1.506 16 HA LYS 92 HA LYS 92 6.106 3.013 0.278 17 HB2 LYS 92 HB2 LYS 92 8.151 3.188 2.069 18 HB3 LYS 92 HB1 LYS 92 6.784 3.014 3.170 19 HG2 LYS 92 HG2 LYS 92 6.149 1.108 1.359 20 HG3 LYS 92 HG1 LYS 92 7.908 1.067 1.229 21 HD2 LYS 92 HD2 LYS 92 8.153 0.639 3.584 22 HD3 LYS 92 HD1 LYS 92 6.442 0.950 3.877 23 HE2 LYS 92 HE2 LYS 92 5.774 -1.062 2.796 24 HE3 LYS 92 HE1 LYS 92 7.361 -1.267 2.028 25 HZ1 LYS 92 HZ1 LYS 92 8.357 -1.473 4.223 26 HZ2 LYS 92 HZ2 LYS 92 7.168 -2.665 3.998 27 HZ3 LYS 92 HZ3 LYS 92 6.836 -1.301 4.955 28 H SER 93 HN SER 93 4.967 2.327 2.992 29 HA SER 93 HA SER 93 2.322 3.245 2.695 30 HB2 SER 93 HB2 SER 93 2.906 1.383 4.116 31 HB3 SER 93 HB1 SER 93 3.951 2.397 5.108 32 HG SER 93 HG SER 93 2.157 2.474 6.256 33 H GLU 94 HN GLU 94 1.241 4.649 4.561 34 HA GLU 94 HA GLU 94 2.093 7.349 4.281 35 HB2 GLU 94 HB2 GLU 94 0.435 6.015 6.449 36 HB3 GLU 94 HB1 GLU 94 0.420 7.735 6.058 37 HG2 GLU 94 HG2 GLU 94 -1.274 7.225 4.642 38 HG3 GLU 94 HG1 GLU 94 -0.019 6.559 3.597 39 H GLU 95 HN GLU 95 3.342 4.841 6.263 40 HA GLU 95 HA GLU 95 4.218 6.254 8.573 41 HB2 GLU 95 HB2 GLU 95 4.197 3.767 8.105 42 HB3 GLU 95 HB1 GLU 95 5.626 4.009 7.099 43 HG2 GLU 95 HG2 GLU 95 6.939 4.725 8.948 44 HG3 GLU 95 HG1 GLU 95 5.517 4.944 9.969 45 H GLU 96 HN GLU 96 5.830 5.752 5.418 46 HA GLU 96 HA GLU 96 8.052 7.540 6.247 47 HB2 GLU 96 HB2 GLU 96 7.645 5.299 4.509 48 HB3 GLU 96 HB1 GLU 96 8.213 6.654 3.532 49 HG2 GLU 96 HG2 GLU 96 10.199 5.608 4.293 50 HG3 GLU 96 HG1 GLU 96 9.995 6.994 5.365 51 H LEU 97 HN LEU 97 5.333 7.422 3.968 52 HA LEU 97 HA LEU 97 6.016 9.784 2.473 53 HB2 LEU 97 HB2 LEU 97 3.351 8.460 3.085 54 HB3 LEU 97 HB1 LEU 97 3.633 9.620 1.786 55 HG LEU 97 HG LEU 97 4.837 6.858 2.081 56 HD11 LEU 97 HD11 LEU 97 2.790 6.599 1.000 57 HD12 LEU 97 HD12 LEU 97 3.863 6.878 -0.372 58 HD13 LEU 97 HD13 LEU 97 2.868 8.194 0.252 59 HD21 LEU 97 HD21 LEU 97 6.679 7.961 1.220 60 HD22 LEU 97 HD22 LEU 97 5.706 9.248 0.507 61 HD23 LEU 97 HD23 LEU 97 5.796 7.672 -0.279 62 H SER 98 HN SER 98 4.770 9.338 5.664 63 HA SER 98 HA SER 98 3.322 11.848 5.888 64 HB2 SER 98 HB2 SER 98 2.657 10.389 7.528 65 HB3 SER 98 HB1 SER 98 4.224 9.586 7.581 66 HG SER 98 HG SER 98 4.560 10.741 9.296 67 H ASP 99 HN ASP 99 6.418 10.798 7.379 68 HA ASP 99 HA ASP 99 7.229 13.392 8.235 69 HB2 ASP 99 HB2 ASP 99 9.493 12.260 8.293 70 HB3 ASP 99 HB1 ASP 99 8.211 11.347 9.091 71 H LEU 100 HN LEU 100 7.402 11.825 5.105 72 HA LEU 100 HA LEU 100 9.420 13.577 3.966 73 HB2 LEU 100 HB2 LEU 100 7.560 11.422 3.147 74 HB3 LEU 100 HB1 LEU 100 7.999 12.555 1.868 75 HG LEU 100 HG LEU 100 9.928 11.006 3.622 76 HD11 LEU 100 HD11 LEU 100 10.294 10.616 0.815 77 HD12 LEU 100 HD12 LEU 100 8.585 10.370 1.177 78 HD13 LEU 100 HD13 LEU 100 9.811 9.426 2.024 79 HD21 LEU 100 HD21 LEU 100 10.243 13.481 2.230 80 HD22 LEU 100 HD22 LEU 100 11.138 12.250 1.340 81 HD23 LEU 100 HD23 LEU 100 11.485 12.531 3.046 82 H PHE 101 HN PHE 101 5.846 13.461 3.831 83 HA PHE 101 HA PHE 101 5.457 15.687 2.099 84 HB2 PHE 101 HB2 PHE 101 3.805 13.934 2.953 85 HB3 PHE 101 HB1 PHE 101 3.721 14.871 4.446 86 HD1 PHE 101 HD1 PHE 101 3.467 15.317 0.729 87 HD2 PHE 101 HD2 PHE 101 2.162 16.601 4.615 88 HE1 PHE 101 HE1 PHE 101 1.844 16.866 -0.328 89 HE2 PHE 101 HE2 PHE 101 0.539 18.150 3.558 90 HZ PHE 101 HZ PHE 101 0.380 18.282 1.086 91 H ARG 102 HN ARG 102 6.248 15.496 5.514 92 HA ARG 102 HA ARG 102 5.528 18.141 6.325 93 HB2 ARG 102 HB2 ARG 102 6.863 15.823 7.316 94 HB3 ARG 102 HB1 ARG 102 7.923 17.201 7.610 95 HG2 ARG 102 HG2 ARG 102 6.319 18.317 8.922 96 HG3 ARG 102 HG1 ARG 102 4.989 17.357 8.273 97 HD2 ARG 102 HD2 ARG 102 5.335 15.652 9.759 98 HD3 ARG 102 HD1 ARG 102 7.101 15.795 9.651 99 HE ARG 102 HE ARG 102 7.020 17.288 11.477 100 HH11 ARG 102 HH21 ARG 102 3.963 17.047 9.888 101 HH12 ARG 102 HH22 ARG 102 3.143 18.053 11.034 102 HH21 ARG 102 HH11 ARG 102 5.960 18.602 12.977 103 HH22 ARG 102 HH12 ARG 102 4.271 18.932 12.780 104 H MET 103 HN MET 103 8.537 16.817 4.943 105 HA MET 103 HA MET 103 9.796 19.486 4.870 106 HB2 MET 103 HB2 MET 103 10.761 17.031 5.280 107 HB3 MET 103 HB1 MET 103 10.892 17.045 3.521 108 HG2 MET 103 HG2 MET 103 11.841 19.523 4.783 109 HG3 MET 103 HG1 MET 103 12.764 18.095 5.254 110 HE1 MET 103 HE1 MET 103 12.263 20.729 2.245 111 HE2 MET 103 HE2 MET 103 14.015 20.557 2.194 112 HE3 MET 103 HE3 MET 103 13.202 20.760 3.744 113 H PHE 104 HN PHE 104 8.451 17.091 2.601 114 HA PHE 104 HA PHE 104 9.172 18.110 0.120 115 HB2 PHE 104 HB2 PHE 104 6.805 16.754 1.307 116 HB3 PHE 104 HB1 PHE 104 6.567 17.471 -0.287 117 HD1 PHE 104 HD2 PHE 104 9.716 16.053 1.105 118 HD2 PHE 104 HD1 PHE 104 6.496 15.554 -1.693 119 HE1 PHE 104 HE2 PHE 104 10.914 14.146 0.066 120 HE2 PHE 104 HE1 PHE 104 7.694 13.647 -2.732 121 HZ PHE 104 HZ PHE 104 9.903 12.943 -1.852 122 H ASP 105 HN ASP 105 7.063 19.566 2.499 123 HA ASP 105 HA ASP 105 6.172 21.656 0.568 124 HB2 ASP 105 HB2 ASP 105 4.543 20.470 2.023 125 HB3 ASP 105 HB1 ASP 105 5.409 21.050 3.445 126 H LYS 106 HN LYS 106 7.890 23.121 0.391 127 HA LYS 106 HA LYS 106 9.699 23.847 2.477 128 HB2 LYS 106 HB2 LYS 106 8.829 24.861 -0.188 129 HB3 LYS 106 HB1 LYS 106 9.734 25.980 0.832 130 HG2 LYS 106 HG2 LYS 106 10.859 23.260 0.760 131 HG3 LYS 106 HG1 LYS 106 10.874 24.081 -0.801 132 HD2 LYS 106 HD2 LYS 106 12.365 25.674 -0.105 133 HD3 LYS 106 HD1 LYS 106 11.724 25.704 1.538 134 HE2 LYS 106 HE2 LYS 106 12.752 23.196 1.514 135 HE3 LYS 106 HE1 LYS 106 13.864 23.992 0.383 136 HZ1 LYS 106 HZ1 LYS 106 13.115 25.498 2.761 137 HZ2 LYS 106 HZ2 LYS 106 14.609 25.415 1.955 138 HZ3 LYS 106 HZ3 LYS 106 14.140 24.171 3.014 139 H ASN 107 HN ASN 107 6.581 25.249 1.474 140 HA ASN 107 HA ASN 107 6.778 27.469 3.384 141 HB2 ASN 107 HB2 ASN 107 5.627 27.653 1.213 142 HB3 ASN 107 HB1 ASN 107 4.515 26.368 1.686 143 HD21 ASN 107 HD21 ASN 107 2.563 27.575 1.838 144 HD22 ASN 107 HD22 ASN 107 2.352 28.879 2.905 145 H ALA 108 HN ALA 108 5.660 24.190 3.430 146 HA ALA 108 HA ALA 108 4.465 22.949 5.055 147 HB1 ALA 108 HB1 ALA 108 5.095 24.141 7.412 148 HB2 ALA 108 HB2 ALA 108 6.280 24.910 6.356 149 HB3 ALA 108 HB3 ALA 108 6.237 23.153 6.501 150 H ASP 109 HN ASP 109 2.257 23.385 4.634 151 HA ASP 109 HA ASP 109 0.921 25.168 6.556 152 HB2 ASP 109 HB2 ASP 109 0.038 26.675 4.925 153 HB3 ASP 109 HB1 ASP 109 1.753 26.528 4.543 154 H GLY 110 HN GLY 110 1.000 22.268 5.462 155 HA2 GLY 110 HA2 GLY 110 -0.765 20.650 5.676 156 HA3 GLY 110 HA1 GLY 110 -1.944 21.940 5.434 157 H TYR 111 HN TYR 111 0.025 22.752 3.108 158 HA TYR 111 HA TYR 111 -0.746 20.641 1.146 159 HB2 TYR 111 HB2 TYR 111 -1.283 23.574 0.650 160 HB3 TYR 111 HB1 TYR 111 -1.957 22.183 -0.197 161 HD1 TYR 111 HD1 TYR 111 -2.104 24.230 2.861 162 HD2 TYR 111 HD2 TYR 111 -3.776 20.870 0.771 163 HE1 TYR 111 HE1 TYR 111 -4.029 24.214 4.425 164 HE2 TYR 111 HE2 TYR 111 -5.700 20.855 2.335 165 HH TYR 111 HH TYR 111 -6.864 22.459 3.829 166 H ILE 112 HN ILE 112 0.203 21.435 -1.123 167 HA ILE 112 HA ILE 112 2.888 22.685 -0.640 168 HB ILE 112 HB ILE 112 2.060 20.168 -2.086 169 HG12 ILE 112 HG12 ILE 112 4.143 20.862 0.004 170 HG13 ILE 112 HG11 ILE 112 2.687 19.895 0.240 171 HG21 ILE 112 HG21 ILE 112 4.726 21.588 -2.342 172 HG22 ILE 112 HG22 ILE 112 3.489 21.558 -3.599 173 HG23 ILE 112 HG23 ILE 112 4.274 20.060 -3.098 174 HD11 ILE 112 HD11 ILE 112 4.715 18.478 -0.020 175 HD12 ILE 112 HD12 ILE 112 4.965 19.168 -1.624 176 HD13 ILE 112 HD13 ILE 112 3.535 18.189 -1.299 177 H ASP 113 HN ASP 113 3.702 23.925 -2.404 178 HA ASP 113 HA ASP 113 1.666 24.613 -4.497 179 HB2 ASP 113 HB2 ASP 113 3.871 26.157 -3.104 180 HB3 ASP 113 HB1 ASP 113 3.023 26.783 -4.519 181 H LEU 114 HN LEU 114 2.560 25.097 -6.656 182 HA LEU 114 HA LEU 114 4.392 23.171 -7.645 183 HB2 LEU 114 HB2 LEU 114 3.500 25.882 -8.671 184 HB3 LEU 114 HB1 LEU 114 4.369 24.702 -9.653 185 HG LEU 114 HG LEU 114 1.999 23.663 -8.210 186 HD11 LEU 114 HD11 LEU 114 1.781 26.099 -9.643 187 HD12 LEU 114 HD12 LEU 114 0.467 25.078 -9.058 188 HD13 LEU 114 HD13 LEU 114 1.110 24.844 -10.684 189 HD21 LEU 114 HD21 LEU 114 2.795 23.462 -11.125 190 HD22 LEU 114 HD22 LEU 114 1.767 22.360 -10.209 191 HD23 LEU 114 HD23 LEU 114 3.497 22.435 -9.874 192 H ASP 115 HN ASP 115 4.964 26.240 -6.101 193 HA ASP 115 HA ASP 115 7.704 26.532 -7.131 194 HB2 ASP 115 HB2 ASP 115 6.298 28.471 -6.639 195 HB3 ASP 115 HB1 ASP 115 6.085 27.927 -4.975 196 H GLU 116 HN GLU 116 6.102 25.224 -4.279 197 HA GLU 116 HA GLU 116 8.481 25.056 -2.625 198 HB2 GLU 116 HB2 GLU 116 5.830 23.578 -2.566 199 HB3 GLU 116 HB1 GLU 116 6.980 23.665 -1.231 200 HG2 GLU 116 HG2 GLU 116 6.707 26.074 -1.080 201 HG3 GLU 116 HG1 GLU 116 5.685 26.085 -2.518 202 H LEU 117 HN LEU 117 6.780 22.784 -4.789 203 HA LEU 117 HA LEU 117 8.334 20.459 -4.172 204 HB2 LEU 117 HB2 LEU 117 6.955 21.323 -6.737 205 HB3 LEU 117 HB1 LEU 117 7.403 19.668 -6.323 206 HG LEU 117 HG LEU 117 5.784 21.116 -4.302 207 HD11 LEU 117 HD11 LEU 117 4.398 21.868 -5.994 208 HD12 LEU 117 HD12 LEU 117 3.740 20.246 -5.778 209 HD13 LEU 117 HD13 LEU 117 4.866 20.573 -7.096 210 HD21 LEU 117 HD21 LEU 117 4.602 18.768 -4.564 211 HD22 LEU 117 HD22 LEU 117 6.163 18.881 -3.752 212 HD23 LEU 117 HD23 LEU 117 6.079 18.349 -5.431 213 H LYS 118 HN LYS 118 8.678 22.853 -6.814 214 HA LYS 118 HA LYS 118 10.953 21.781 -8.086 215 HB2 LYS 118 HB2 LYS 118 9.764 23.567 -9.092 216 HB3 LYS 118 HB1 LYS 118 9.873 24.565 -7.642 217 HG2 LYS 118 HG2 LYS 118 12.295 24.797 -7.956 218 HG3 LYS 118 HG1 LYS 118 12.223 23.755 -9.378 219 HD2 LYS 118 HD2 LYS 118 11.038 25.351 -10.640 220 HD3 LYS 118 HD1 LYS 118 10.533 26.243 -9.205 221 HE2 LYS 118 HE2 LYS 118 12.527 27.384 -9.049 222 HE3 LYS 118 HE1 LYS 118 13.472 26.014 -9.668 223 HZ1 LYS 118 HZ1 LYS 118 12.837 28.135 -11.154 224 HZ2 LYS 118 HZ2 LYS 118 11.509 27.131 -11.493 225 HZ3 LYS 118 HZ3 LYS 118 13.089 26.586 -11.799 226 H ILE 119 HN ILE 119 11.078 24.554 -5.810 227 HA ILE 119 HA ILE 119 13.848 24.585 -5.380 228 HB ILE 119 HB ILE 119 11.494 25.198 -3.575 229 HG12 ILE 119 HG12 ILE 119 13.313 27.212 -4.849 230 HG13 ILE 119 HG11 ILE 119 12.100 26.418 -5.853 231 HG21 ILE 119 HG21 ILE 119 13.322 24.935 -2.073 232 HG22 ILE 119 HG22 ILE 119 13.239 26.668 -2.391 233 HG23 ILE 119 HG23 ILE 119 14.455 25.680 -3.201 234 HD11 ILE 119 HD11 ILE 119 11.698 28.204 -3.467 235 HD12 ILE 119 HD12 ILE 119 10.459 27.031 -3.912 236 HD13 ILE 119 HD13 ILE 119 10.934 28.287 -5.054 237 H MET 120 HN MET 120 11.523 22.249 -4.256 238 HA MET 120 HA MET 120 13.171 21.257 -2.043 239 HB2 MET 120 HB2 MET 120 10.613 21.224 -2.331 240 HB3 MET 120 HB1 MET 120 10.873 19.874 -3.438 241 HG2 MET 120 HG2 MET 120 12.312 19.665 -0.864 242 HG3 MET 120 HG1 MET 120 10.554 19.589 -0.741 243 HE1 MET 120 HE1 MET 120 9.290 18.672 -2.550 244 HE2 MET 120 HE2 MET 120 9.152 17.003 -2.004 245 HE3 MET 120 HE3 MET 120 9.726 17.343 -3.634 246 H LEU 121 HN LEU 121 12.974 20.707 -5.469 247 HA LEU 121 HA LEU 121 14.101 18.012 -5.433 248 HB2 LEU 121 HB2 LEU 121 13.678 20.158 -7.530 249 HB3 LEU 121 HB1 LEU 121 14.347 18.571 -7.912 250 HG LEU 121 HG LEU 121 11.697 18.973 -6.501 251 HD11 LEU 121 HD11 LEU 121 10.689 19.284 -8.496 252 HD12 LEU 121 HD12 LEU 121 11.562 17.927 -9.210 253 HD13 LEU 121 HD13 LEU 121 12.293 19.532 -9.187 254 HD21 LEU 121 HD21 LEU 121 12.671 16.798 -6.078 255 HD22 LEU 121 HD22 LEU 121 13.083 16.599 -7.781 256 HD23 LEU 121 HD23 LEU 121 11.393 16.585 -7.275 257 H GLN 122 HN GLN 122 15.385 21.107 -4.902 258 HA GLN 122 HA GLN 122 17.884 21.157 -6.175 259 HB2 GLN 122 HB2 GLN 122 16.855 22.038 -3.480 260 HB3 GLN 122 HB1 GLN 122 18.521 22.364 -3.960 261 HG2 GLN 122 HG2 GLN 122 17.587 23.403 -6.083 262 HG3 GLN 122 HG1 GLN 122 15.991 23.291 -5.340 263 HE21 GLN 122 HE21 GLN 122 16.174 24.151 -2.832 264 HE22 GLN 122 HE22 GLN 122 16.925 25.667 -2.698 265 H ALA 123 HN ALA 123 16.763 18.975 -3.716 266 HA ALA 123 HA ALA 123 19.212 18.228 -2.469 267 HB1 ALA 123 HB1 ALA 123 17.860 16.011 -2.230 268 HB2 ALA 123 HB2 ALA 123 16.579 16.886 -3.070 269 HB3 ALA 123 HB3 ALA 123 17.184 17.478 -1.523 270 H THR 124 HN THR 124 17.805 17.312 -5.581 271 HA THR 124 HA THR 124 20.127 15.476 -6.063 272 HB THR 124 HB THR 124 17.722 14.649 -6.159 273 HG1 THR 124 HG1 THR 124 18.174 13.931 -8.528 274 HG21 THR 124 HG21 THR 124 17.140 16.935 -7.396 275 HG22 THR 124 HG22 THR 124 16.226 15.461 -7.718 276 HG23 THR 124 HG23 THR 124 17.499 15.970 -8.828 277 H GLY 125 HN GLY 125 19.811 18.557 -6.404 278 HA2 GLY 125 HA2 GLY 125 21.166 19.879 -7.917 279 HA3 GLY 125 HA1 GLY 125 20.983 18.614 -9.135 280 H GLU 126 HN GLU 126 18.037 18.458 -8.441 281 HA GLU 126 HA GLU 126 16.080 19.313 -9.469 282 HB2 GLU 126 HB2 GLU 126 16.585 20.759 -7.455 283 HB3 GLU 126 HB1 GLU 126 17.364 21.901 -8.549 284 HG2 GLU 126 HG2 GLU 126 14.686 21.061 -9.429 285 HG3 GLU 126 HG1 GLU 126 14.691 21.931 -7.894 286 H THR 127 HN THR 127 17.826 18.791 -11.498 287 HA THR 127 HA THR 127 17.952 21.307 -13.122 288 HB THR 127 HB THR 127 19.398 19.355 -14.437 289 HG1 THR 127 HG1 THR 127 20.146 19.024 -11.773 290 HG21 THR 127 HG21 THR 127 21.381 20.459 -13.397 291 HG22 THR 127 HG22 THR 127 20.299 21.259 -12.258 292 HG23 THR 127 HG23 THR 127 20.185 21.616 -13.981 293 H ILE 128 HN ILE 128 15.764 21.237 -13.865 294 HA ILE 128 HA ILE 128 15.228 19.080 -15.865 295 HB ILE 128 HB ILE 128 12.900 19.012 -14.977 296 HG12 ILE 128 HG12 ILE 128 14.077 20.965 -12.981 297 HG13 ILE 128 HG11 ILE 128 12.692 21.223 -14.043 298 HG21 ILE 128 HG21 ILE 128 14.609 17.423 -14.145 299 HG22 ILE 128 HG22 ILE 128 13.437 17.828 -12.889 300 HG23 ILE 128 HG23 ILE 128 15.039 18.567 -12.872 301 HD11 ILE 128 HD11 ILE 128 11.379 19.588 -12.846 302 HD12 ILE 128 HD12 ILE 128 12.073 20.689 -11.655 303 HD13 ILE 128 HD13 ILE 128 12.778 19.090 -11.894 304 H THR 129 HN THR 129 13.668 19.786 -17.530 305 HA THR 129 HA THR 129 14.051 22.505 -18.392 306 HB THR 129 HB THR 129 11.835 20.625 -19.234 307 HG1 THR 129 HG1 THR 129 13.347 19.251 -19.655 308 HG21 THR 129 HG21 THR 129 11.792 22.767 -20.335 309 HG22 THR 129 HG22 THR 129 12.448 21.599 -21.482 310 HG23 THR 129 HG23 THR 129 13.529 22.706 -20.635 311 H GLU 130 HN GLU 130 12.676 24.300 -18.158 312 HA GLU 130 HA GLU 130 11.027 24.587 -15.899 313 HB2 GLU 130 HB2 GLU 130 10.177 26.588 -17.159 314 HB3 GLU 130 HB1 GLU 130 11.935 26.440 -17.198 315 HG2 GLU 130 HG2 GLU 130 11.023 24.928 -19.385 316 HG3 GLU 130 HG1 GLU 130 10.054 26.402 -19.404 317 H ASP 131 HN ASP 131 10.315 22.996 -18.897 318 HA ASP 131 HA ASP 131 7.402 23.248 -18.685 319 HB2 ASP 131 HB2 ASP 131 9.437 22.304 -20.532 320 HB3 ASP 131 HB1 ASP 131 8.110 21.148 -20.414 321 H ASP 132 HN ASP 132 9.842 21.102 -17.430 322 HA ASP 132 HA ASP 132 7.936 18.893 -16.947 323 HB2 ASP 132 HB2 ASP 132 10.868 19.439 -16.632 324 HB3 ASP 132 HB1 ASP 132 10.155 18.120 -15.703 325 H ILE 133 HN ILE 133 8.887 21.771 -15.381 326 HA ILE 133 HA ILE 133 8.929 21.082 -12.636 327 HB ILE 133 HB ILE 133 7.822 23.518 -14.070 328 HG12 ILE 133 HG12 ILE 133 10.231 22.779 -14.523 329 HG13 ILE 133 HG11 ILE 133 10.032 24.419 -13.907 330 HG21 ILE 133 HG21 ILE 133 7.059 23.681 -11.833 331 HG22 ILE 133 HG22 ILE 133 8.556 24.613 -11.849 332 HG23 ILE 133 HG23 ILE 133 8.542 22.978 -11.188 333 HD11 ILE 133 HD11 ILE 133 10.608 23.712 -11.662 334 HD12 ILE 133 HD12 ILE 133 11.857 23.122 -12.758 335 HD13 ILE 133 HD13 ILE 133 10.622 22.018 -12.153 336 H GLU 134 HN GLU 134 6.147 21.816 -14.753 337 HA GLU 134 HA GLU 134 4.211 21.435 -12.586 338 HB2 GLU 134 HB2 GLU 134 4.086 21.862 -15.580 339 HB3 GLU 134 HB1 GLU 134 2.636 21.667 -14.594 340 HG2 GLU 134 HG2 GLU 134 3.632 23.543 -13.114 341 HG3 GLU 134 HG1 GLU 134 4.695 23.867 -14.484 342 H GLU 135 HN GLU 135 5.822 19.407 -14.886 343 HA GLU 135 HA GLU 135 3.869 17.353 -15.257 344 HB2 GLU 135 HB2 GLU 135 6.451 17.933 -16.053 345 HB3 GLU 135 HB1 GLU 135 6.681 16.512 -15.033 346 HG2 GLU 135 HG2 GLU 135 4.394 16.371 -16.912 347 HG3 GLU 135 HG1 GLU 135 5.993 16.370 -17.659 348 H LEU 136 HN LEU 136 6.130 18.025 -12.627 349 HA LEU 136 HA LEU 136 5.723 15.464 -11.284 350 HB2 LEU 136 HB2 LEU 136 6.984 18.128 -10.610 351 HB3 LEU 136 HB1 LEU 136 6.927 16.807 -9.442 352 HG LEU 136 HG LEU 136 7.922 16.196 -12.192 353 HD11 LEU 136 HD11 LEU 136 9.956 17.117 -10.238 354 HD12 LEU 136 HD12 LEU 136 8.979 18.383 -10.982 355 HD13 LEU 136 HD13 LEU 136 9.922 17.288 -11.994 356 HD21 LEU 136 HD21 LEU 136 7.760 14.359 -10.660 357 HD22 LEU 136 HD22 LEU 136 8.512 15.287 -9.364 358 HD23 LEU 136 HD23 LEU 136 9.473 14.768 -10.749 359 H MET 137 HN MET 137 4.539 18.806 -10.806 360 HA MET 137 HA MET 137 3.001 18.265 -8.442 361 HB2 MET 137 HB2 MET 137 3.706 20.426 -10.056 362 HB3 MET 137 HB1 MET 137 1.953 20.332 -10.226 363 HG2 MET 137 HG2 MET 137 2.822 19.941 -7.463 364 HG3 MET 137 HG1 MET 137 3.319 21.506 -8.107 365 HE1 MET 137 HE1 MET 137 1.837 22.751 -6.358 366 HE2 MET 137 HE2 MET 137 1.436 21.168 -5.696 367 HE3 MET 137 HE3 MET 137 0.152 22.332 -6.018 368 H LYS 138 HN LYS 138 2.332 17.847 -11.876 369 HA LYS 138 HA LYS 138 -0.452 17.731 -11.987 370 HB2 LYS 138 HB2 LYS 138 1.788 16.186 -13.275 371 HB3 LYS 138 HB1 LYS 138 0.113 15.802 -13.674 372 HG2 LYS 138 HG2 LYS 138 -0.303 17.989 -14.509 373 HG3 LYS 138 HG1 LYS 138 1.173 18.629 -13.784 374 HD2 LYS 138 HD2 LYS 138 2.141 18.276 -15.796 375 HD3 LYS 138 HD1 LYS 138 2.100 16.561 -15.386 376 HE2 LYS 138 HE2 LYS 138 -0.200 18.002 -16.752 377 HE3 LYS 138 HE1 LYS 138 1.042 17.077 -17.620 378 HZ1 LYS 138 HZ1 LYS 138 0.526 15.233 -15.981 379 HZ2 LYS 138 HZ2 LYS 138 -0.648 15.534 -17.171 380 HZ3 LYS 138 HZ3 LYS 138 -0.876 16.101 -15.586 381 H ASP 139 HN ASP 139 1.547 14.785 -11.549 382 HA ASP 139 HA ASP 139 -0.477 13.021 -10.768 383 HB2 ASP 139 HB2 ASP 139 2.402 13.243 -10.684 384 HB3 ASP 139 HB1 ASP 139 1.824 12.443 -9.221 385 H GLY 140 HN GLY 140 1.210 15.436 -8.791 386 HA2 GLY 140 HA2 GLY 140 0.016 14.509 -6.295 387 HA3 GLY 140 HA1 GLY 140 0.932 16.001 -6.511 388 H ASP 141 HN ASP 141 -0.655 17.076 -8.653 389 HA ASP 141 HA ASP 141 -3.244 17.576 -7.218 390 HB2 ASP 141 HB2 ASP 141 -1.052 19.294 -7.906 391 HB3 ASP 141 HB1 ASP 141 -2.459 19.790 -8.848 392 H LYS 142 HN LYS 142 -3.294 15.572 -9.071 393 HA LYS 142 HA LYS 142 -3.586 16.147 -11.802 394 HB2 LYS 142 HB2 LYS 142 -3.966 14.019 -10.115 395 HB3 LYS 142 HB1 LYS 142 -5.623 14.364 -10.613 396 HG2 LYS 142 HG2 LYS 142 -3.843 14.521 -12.889 397 HG3 LYS 142 HG1 LYS 142 -3.672 12.960 -12.084 398 HD2 LYS 142 HD2 LYS 142 -5.519 12.368 -13.264 399 HD3 LYS 142 HD1 LYS 142 -6.400 13.313 -12.064 400 HE2 LYS 142 HE2 LYS 142 -7.116 14.609 -13.788 401 HE3 LYS 142 HE1 LYS 142 -5.451 15.213 -13.909 402 HZ1 LYS 142 HZ1 LYS 142 -5.571 14.254 -15.940 403 HZ2 LYS 142 HZ2 LYS 142 -6.800 13.171 -15.490 404 HZ3 LYS 142 HZ3 LYS 142 -5.185 12.848 -15.074 405 H ASN 143 HN ASN 143 -5.597 17.132 -9.142 406 HA ASN 143 HA ASN 143 -7.983 17.681 -10.747 407 HB2 ASN 143 HB2 ASN 143 -7.262 18.814 -8.037 408 HB3 ASN 143 HB1 ASN 143 -8.864 18.433 -8.665 409 HD21 ASN 143 HD21 ASN 143 -7.250 17.368 -6.235 410 HD22 ASN 143 HD22 ASN 143 -7.353 15.681 -6.398 411 H ASN 144 HN ASN 144 -4.979 19.167 -10.493 412 HA ASN 144 HA ASN 144 -4.189 21.297 -11.140 413 HB2 ASN 144 HB2 ASN 144 -5.412 20.697 -13.162 414 HB3 ASN 144 HB1 ASN 144 -6.932 21.215 -12.435 415 HD21 ASN 144 HD21 ASN 144 -4.191 23.200 -11.642 416 HD22 ASN 144 HD22 ASN 144 -4.550 24.477 -12.700 417 H ASP 145 HN ASP 145 -5.255 21.200 -8.537 418 HA ASP 145 HA ASP 145 -7.061 23.539 -8.252 419 HB2 ASP 145 HB2 ASP 145 -5.826 21.706 -6.172 420 HB3 ASP 145 HB1 ASP 145 -7.226 22.758 -5.959 421 H GLY 146 HN GLY 146 -3.704 22.781 -8.167 422 HA2 GLY 146 HA2 GLY 146 -1.965 24.426 -8.037 423 HA3 GLY 146 HA1 GLY 146 -3.106 25.538 -7.280 424 H ARG 147 HN ARG 147 -3.818 22.980 -5.563 425 HA ARG 147 HA ARG 147 -1.539 23.325 -3.638 426 HB2 ARG 147 HB2 ARG 147 -3.239 23.271 -1.874 427 HB3 ARG 147 HB1 ARG 147 -3.656 24.518 -3.050 428 HG2 ARG 147 HG2 ARG 147 -4.949 22.443 -4.171 429 HG3 ARG 147 HG1 ARG 147 -4.996 21.917 -2.488 430 HD2 ARG 147 HD2 ARG 147 -5.634 24.706 -2.534 431 HD3 ARG 147 HD1 ARG 147 -6.644 23.889 -3.743 432 HE ARG 147 HE ARG 147 -6.689 22.185 -1.544 433 HH11 ARG 147 HH21 ARG 147 -7.399 25.507 -2.166 434 HH12 ARG 147 HH22 ARG 147 -8.629 25.606 -0.952 435 HH21 ARG 147 HH11 ARG 147 -8.294 22.302 0.041 436 HH22 ARG 147 HH12 ARG 147 -9.137 23.794 0.295 437 H ILE 148 HN ILE 148 -0.588 21.413 -3.052 438 HA ILE 148 HA ILE 148 -1.993 18.863 -3.743 439 HB ILE 148 HB ILE 148 0.873 19.758 -3.446 440 HG12 ILE 148 HG12 ILE 148 -0.711 18.334 -5.606 441 HG13 ILE 148 HG11 ILE 148 -0.150 20.007 -5.643 442 HG21 ILE 148 HG21 ILE 148 1.439 17.744 -2.604 443 HG22 ILE 148 HG22 ILE 148 0.893 17.032 -4.123 444 HG23 ILE 148 HG23 ILE 148 -0.217 17.156 -2.758 445 HD11 ILE 148 HD11 ILE 148 1.576 17.516 -5.618 446 HD12 ILE 148 HD12 ILE 148 2.206 19.155 -5.460 447 HD13 ILE 148 HD13 ILE 148 1.393 18.662 -6.946 448 H ASP 149 HN ASP 149 -2.959 17.914 -1.985 449 HA ASP 149 HA ASP 149 -1.900 18.472 0.741 450 HB2 ASP 149 HB2 ASP 149 -4.073 17.686 1.452 451 HB3 ASP 149 HB1 ASP 149 -4.329 18.742 0.063 452 H TYR 150 HN TYR 150 -1.947 16.503 2.257 453 HA TYR 150 HA TYR 150 -0.123 14.510 1.460 454 HB2 TYR 150 HB2 TYR 150 -0.802 15.149 3.777 455 HB3 TYR 150 HB1 TYR 150 -2.348 14.341 3.520 456 HD1 TYR 150 HD2 TYR 150 1.331 13.804 3.661 457 HD2 TYR 150 HD1 TYR 150 -2.554 11.972 3.692 458 HE1 TYR 150 HE2 TYR 150 2.358 11.636 4.293 459 HE2 TYR 150 HE1 TYR 150 -1.527 9.805 4.323 460 HH TYR 150 HH TYR 150 0.862 8.742 4.003 461 H ASP 151 HN ASP 151 -3.674 14.124 1.825 462 HA ASP 151 HA ASP 151 -4.010 11.525 0.905 463 HB2 ASP 151 HB2 ASP 151 -5.546 14.065 0.872 464 HB3 ASP 151 HB1 ASP 151 -6.138 12.802 -0.208 465 H GLU 152 HN GLU 152 -3.041 14.325 -0.957 466 HA GLU 152 HA GLU 152 -3.518 12.941 -3.539 467 HB2 GLU 152 HB2 GLU 152 -3.216 15.647 -2.516 468 HB3 GLU 152 HB1 GLU 152 -2.179 15.382 -3.917 469 HG2 GLU 152 HG2 GLU 152 -4.036 14.706 -5.276 470 HG3 GLU 152 HG1 GLU 152 -5.107 14.618 -3.877 471 H PHE 153 HN PHE 153 -0.904 13.744 -1.336 472 HA PHE 153 HA PHE 153 1.315 13.485 -3.122 473 HB2 PHE 153 HB2 PHE 153 1.344 14.431 -0.822 474 HB3 PHE 153 HB1 PHE 153 1.062 12.816 -0.171 475 HD1 PHE 153 HD1 PHE 153 3.359 14.506 -2.620 476 HD2 PHE 153 HD2 PHE 153 2.925 11.618 0.531 477 HE1 PHE 153 HE1 PHE 153 5.793 14.040 -2.712 478 HE2 PHE 153 HE2 PHE 153 5.360 11.152 0.440 479 HZ PHE 153 HZ PHE 153 6.794 12.364 -1.182 480 H LEU 154 HN LEU 154 -0.752 11.098 -1.603 481 HA LEU 154 HA LEU 154 0.925 8.808 -1.676 482 HB2 LEU 154 HB2 LEU 154 -1.982 9.450 -1.693 483 HB3 LEU 154 HB1 LEU 154 -1.541 7.811 -2.175 484 HG LEU 154 HG LEU 154 -1.943 7.994 0.274 485 HD11 LEU 154 HD11 LEU 154 0.942 7.540 0.318 486 HD12 LEU 154 HD12 LEU 154 0.165 6.746 -1.052 487 HD13 LEU 154 HD13 LEU 154 -0.375 6.399 0.590 488 HD21 LEU 154 HD21 LEU 154 -0.998 10.408 0.290 489 HD22 LEU 154 HD22 LEU 154 0.586 9.640 0.397 490 HD23 LEU 154 HD23 LEU 154 -0.612 9.372 1.664 491 H GLU 155 HN GLU 155 -1.588 9.653 -4.098 492 HA GLU 155 HA GLU 155 -0.930 7.798 -6.077 493 HB2 GLU 155 HB2 GLU 155 -2.785 9.608 -5.891 494 HB3 GLU 155 HB1 GLU 155 -1.628 10.670 -6.693 495 HG2 GLU 155 HG2 GLU 155 -1.398 8.711 -8.408 496 HG3 GLU 155 HG1 GLU 155 -2.944 8.179 -7.747 497 H PHE 156 HN PHE 156 0.844 10.668 -5.134 498 HA PHE 156 HA PHE 156 2.447 10.875 -7.552 499 HB2 PHE 156 HB2 PHE 156 2.002 12.727 -5.961 500 HB3 PHE 156 HB1 PHE 156 2.900 11.860 -4.715 501 HD1 PHE 156 HD2 PHE 156 3.503 12.494 -8.367 502 HD2 PHE 156 HD1 PHE 156 4.976 12.857 -4.348 503 HE1 PHE 156 HE2 PHE 156 5.625 13.443 -9.230 504 HE2 PHE 156 HE1 PHE 156 7.099 13.805 -5.212 505 HZ PHE 156 HZ PHE 156 7.424 14.098 -7.653 506 H MET 157 HN MET 157 3.285 9.805 -4.225 507 HA MET 157 HA MET 157 5.812 8.646 -5.038 508 HB2 MET 157 HB2 MET 157 4.119 8.114 -2.577 509 HB3 MET 157 HB1 MET 157 5.865 7.913 -2.721 510 HG2 MET 157 HG2 MET 157 4.309 10.509 -2.828 511 HG3 MET 157 HG1 MET 157 5.476 10.013 -1.602 512 HE1 MET 157 HE1 MET 157 8.330 11.414 -2.203 513 HE2 MET 157 HE2 MET 157 8.632 9.789 -2.813 514 HE3 MET 157 HE3 MET 157 7.468 10.031 -1.513 515 H LYS 158 HN LYS 158 2.621 7.603 -5.468 516 HA LYS 158 HA LYS 158 2.935 4.755 -5.049 517 HB2 LYS 158 HB2 LYS 158 0.961 6.680 -5.900 518 HB3 LYS 158 HB1 LYS 158 0.957 5.306 -7.006 519 HG2 LYS 158 HG2 LYS 158 1.123 4.642 -4.118 520 HG3 LYS 158 HG1 LYS 158 -0.409 5.321 -4.667 521 HD2 LYS 158 HD2 LYS 158 -0.776 3.572 -6.203 522 HD3 LYS 158 HD1 LYS 158 0.918 3.081 -6.185 523 HE2 LYS 158 HE2 LYS 158 0.244 1.491 -4.690 524 HE3 LYS 158 HE1 LYS 158 0.172 2.823 -3.520 525 HZ1 LYS 158 HZ1 LYS 158 -1.965 1.667 -3.692 526 HZ2 LYS 158 HZ2 LYS 158 -2.032 2.029 -5.351 527 HZ3 LYS 158 HZ3 LYS 158 -2.089 3.280 -4.203 528 H GLY 159 HN GLY 159 5.176 4.864 -6.261 529 HA2 GLY 159 HA2 GLY 159 5.442 3.300 -8.389 530 HA3 GLY 159 HA1 GLY 159 4.842 4.742 -9.208 531 H VAL 160 HN VAL 160 7.029 4.646 -6.414 532 HA VAL 160 HA VAL 160 9.068 6.051 -8.103 533 HB VAL 160 HB VAL 160 8.596 6.054 -5.103 534 HG11 VAL 160 HG11 VAL 160 10.740 6.817 -5.144 535 HG12 VAL 160 HG12 VAL 160 10.013 8.313 -5.730 536 HG13 VAL 160 HG13 VAL 160 10.687 7.153 -6.874 537 HG21 VAL 160 HG21 VAL 160 7.806 7.977 -7.308 538 HG22 VAL 160 HG22 VAL 160 7.820 8.427 -5.602 539 HG23 VAL 160 HG23 VAL 160 6.741 7.152 -6.170 540 H GLU 161 HN GLU 161 8.429 3.045 -6.929 541 HA GLU 161 HA GLU 161 11.030 2.372 -5.765 542 HB2 GLU 161 HB2 GLU 161 8.396 1.205 -6.198 543 HB3 GLU 161 HB1 GLU 161 9.676 0.048 -6.568 544 HG2 GLU 161 HG2 GLU 161 10.694 0.999 -4.294 545 HG3 GLU 161 HG1 GLU 161 8.997 1.357 -3.969 546 HO1 KDH 1 H1 KDH 1 7.090 10.082 -9.125 547 H21 KDH 1 H21 KDH 1 13.544 9.997 -2.938 548 H33 KDH 1 H33 KDH 1 9.782 13.426 -6.034 549 H4 KDH 1 H4 KDH 1 8.382 11.682 -7.098 550 HO7 KDH 1 H7 KDH 1 9.025 8.224 -10.395 551 H01 KDH 1 H01 KDH 1 11.359 14.784 -4.567 552 H01A KDH 1 H02 KDH 1 10.265 13.601 -3.745 553 HO03 KDH 1 H03 KDH 1 12.238 15.554 -2.211 554 HO10 KDH 1 H10 KDH 1 12.796 8.164 -8.305 555 H12 KDH 1 H12 KDH 1 12.311 9.725 -6.695 556 H15 KDH 1 H15 KDH 1 9.783 11.394 -4.931 557 H26 KDH 1 H26 KDH 1 14.775 13.926 -1.419 558 H39 KDH 1 H39 KDH 1 12.184 11.342 -8.686 559 H41 KDH 1 H41 KDH 1 12.111 15.608 -9.755 560 HO02 KDH 1 H42 KDH 1 15.056 10.368 -1.191 561 HO44 KDH 1 H44 KDH 1 13.141 15.339 -12.718 562 HO47 KDH 1 H47 KDH 1 14.027 12.860 -13.253 563 HO50 KDH 1 H50 KDH 1 13.947 10.136 -9.895 Start of MODEL 11 1 H1 MET 90 HT1 MET 90 14.658 7.319 1.183 2 H2 MET 90 HT2 MET 90 13.340 6.687 2.048 3 H3 MET 90 HT3 MET 90 13.722 8.338 2.165 4 HA MET 90 HA MET 90 12.960 8.808 0.016 5 HB2 MET 90 HB2 MET 90 13.543 5.882 -0.228 6 HB3 MET 90 HB1 MET 90 12.355 6.579 -1.330 7 HG2 MET 90 HG2 MET 90 13.921 7.805 -2.453 8 HG3 MET 90 HG1 MET 90 14.847 8.145 -0.992 9 HE1 MET 90 HE1 MET 90 17.504 5.785 -0.698 10 HE2 MET 90 HE2 MET 90 16.491 7.073 -0.049 11 HE3 MET 90 HE3 MET 90 17.456 7.364 -1.494 12 H GLY 91 HN GLY 91 10.679 8.349 -0.941 13 HA2 GLY 91 HA2 GLY 91 8.833 7.969 1.318 14 HA3 GLY 91 HA1 GLY 91 8.391 8.514 -0.300 15 H LYS 92 HN LYS 92 7.513 6.196 1.600 16 HA LYS 92 HA LYS 92 7.592 4.077 -0.523 17 HB2 LYS 92 HB2 LYS 92 7.820 3.909 2.496 18 HB3 LYS 92 HB1 LYS 92 7.565 2.497 1.469 19 HG2 LYS 92 HG2 LYS 92 9.671 3.842 0.238 20 HG3 LYS 92 HG1 LYS 92 10.015 4.002 1.960 21 HD2 LYS 92 HD2 LYS 92 10.794 1.891 1.931 22 HD3 LYS 92 HD1 LYS 92 9.145 1.348 1.616 23 HE2 LYS 92 HE2 LYS 92 11.055 2.238 -0.573 24 HE3 LYS 92 HE1 LYS 92 10.805 0.544 -0.108 25 HZ1 LYS 92 HZ1 LYS 92 8.870 2.449 -1.264 26 HZ2 LYS 92 HZ2 LYS 92 8.324 1.145 -0.322 27 HZ3 LYS 92 HZ3 LYS 92 9.212 0.858 -1.742 28 H SER 93 HN SER 93 5.898 4.133 2.589 29 HA SER 93 HA SER 93 3.299 4.121 1.086 30 HB2 SER 93 HB2 SER 93 4.352 2.609 3.472 31 HB3 SER 93 HB1 SER 93 2.617 2.788 3.227 32 HG SER 93 HG SER 93 4.323 1.115 2.031 33 H GLU 94 HN GLU 94 1.441 4.818 2.650 34 HA GLU 94 HA GLU 94 1.605 7.477 3.395 35 HB2 GLU 94 HB2 GLU 94 0.092 5.205 4.724 36 HB3 GLU 94 HB1 GLU 94 -0.294 6.914 4.928 37 HG2 GLU 94 HG2 GLU 94 -1.254 7.072 2.873 38 HG3 GLU 94 HG1 GLU 94 -0.032 6.047 2.120 39 H GLU 95 HN GLU 95 2.889 4.716 5.138 40 HA GLU 95 HA GLU 95 3.192 5.815 7.738 41 HB2 GLU 95 HB2 GLU 95 4.593 3.775 6.035 42 HB3 GLU 95 HB1 GLU 95 5.284 4.201 7.601 43 HG2 GLU 95 HG2 GLU 95 2.422 3.803 7.828 44 HG3 GLU 95 HG1 GLU 95 3.193 2.381 7.123 45 H GLU 96 HN GLU 96 5.748 5.607 5.227 46 HA GLU 96 HA GLU 96 7.349 7.663 6.566 47 HB2 GLU 96 HB2 GLU 96 7.539 6.096 3.980 48 HB3 GLU 96 HB1 GLU 96 8.769 7.256 4.482 49 HG2 GLU 96 HG2 GLU 96 9.539 5.915 6.175 50 HG3 GLU 96 HG1 GLU 96 7.942 5.247 6.512 51 H LEU 97 HN LEU 97 5.234 7.461 3.723 52 HA LEU 97 HA LEU 97 5.864 9.931 2.478 53 HB2 LEU 97 HB2 LEU 97 3.268 8.383 2.767 54 HB3 LEU 97 HB1 LEU 97 3.504 9.700 1.618 55 HG LEU 97 HG LEU 97 4.928 7.033 1.698 56 HD11 LEU 97 HD11 LEU 97 4.074 7.814 -0.890 57 HD12 LEU 97 HD12 LEU 97 2.740 8.172 0.208 58 HD13 LEU 97 HD13 LEU 97 3.399 6.538 0.123 59 HD21 LEU 97 HD21 LEU 97 6.036 8.181 -0.436 60 HD22 LEU 97 HD22 LEU 97 6.742 8.377 1.169 61 HD23 LEU 97 HD23 LEU 97 5.730 9.652 0.488 62 H SER 98 HN SER 98 4.199 9.271 5.463 63 HA SER 98 HA SER 98 2.595 11.623 5.702 64 HB2 SER 98 HB2 SER 98 2.084 10.403 7.535 65 HB3 SER 98 HB1 SER 98 3.487 9.376 7.257 66 HG SER 98 HG SER 98 3.104 11.304 9.103 67 H ASP 99 HN ASP 99 5.814 10.993 7.169 68 HA ASP 99 HA ASP 99 6.238 13.753 7.910 69 HB2 ASP 99 HB2 ASP 99 7.251 11.516 8.780 70 HB3 ASP 99 HB1 ASP 99 8.386 11.686 7.440 71 H LEU 100 HN LEU 100 6.954 11.850 5.032 72 HA LEU 100 HA LEU 100 8.950 13.360 3.773 73 HB2 LEU 100 HB2 LEU 100 6.875 11.463 3.109 74 HB3 LEU 100 HB1 LEU 100 7.008 12.667 1.828 75 HG LEU 100 HG LEU 100 9.603 12.248 2.144 76 HD11 LEU 100 HD11 LEU 100 9.763 9.652 2.537 77 HD12 LEU 100 HD12 LEU 100 8.256 9.885 3.423 78 HD13 LEU 100 HD13 LEU 100 9.715 10.739 3.925 79 HD21 LEU 100 HD21 LEU 100 8.012 11.733 0.164 80 HD22 LEU 100 HD22 LEU 100 8.000 10.082 0.781 81 HD23 LEU 100 HD23 LEU 100 9.516 10.816 0.259 82 H PHE 101 HN PHE 101 5.435 13.811 3.201 83 HA PHE 101 HA PHE 101 5.527 16.200 1.750 84 HB2 PHE 101 HB2 PHE 101 3.585 14.643 2.447 85 HB3 PHE 101 HB1 PHE 101 3.497 15.619 3.913 86 HD1 PHE 101 HD1 PHE 101 3.300 18.184 3.627 87 HD2 PHE 101 HD2 PHE 101 2.540 15.373 0.469 88 HE1 PHE 101 HE1 PHE 101 2.011 19.911 2.400 89 HE2 PHE 101 HE2 PHE 101 1.251 17.099 -0.758 90 HZ PHE 101 HZ PHE 101 0.987 19.368 0.207 91 H ARG 102 HN ARG 102 5.578 15.784 5.293 92 HA ARG 102 HA ARG 102 5.344 18.422 6.176 93 HB2 ARG 102 HB2 ARG 102 6.328 15.890 7.098 94 HB3 ARG 102 HB1 ARG 102 7.457 17.145 7.612 95 HG2 ARG 102 HG2 ARG 102 5.366 18.453 8.375 96 HG3 ARG 102 HG1 ARG 102 4.511 16.917 8.220 97 HD2 ARG 102 HD2 ARG 102 5.970 15.858 9.838 98 HD3 ARG 102 HD1 ARG 102 7.027 17.283 9.883 99 HE ARG 102 HE ARG 102 4.326 18.071 10.449 100 HH11 ARG 102 HH21 ARG 102 7.052 16.407 11.763 101 HH12 ARG 102 HH22 ARG 102 6.641 16.767 13.406 102 HH21 ARG 102 HH11 ARG 102 3.783 18.546 12.589 103 HH22 ARG 102 HH12 ARG 102 4.795 17.976 13.874 104 H MET 103 HN MET 103 8.314 16.788 5.029 105 HA MET 103 HA MET 103 9.992 19.133 5.354 106 HB2 MET 103 HB2 MET 103 10.186 16.462 3.958 107 HB3 MET 103 HB1 MET 103 11.490 17.645 3.855 108 HG2 MET 103 HG2 MET 103 10.869 17.598 6.565 109 HG3 MET 103 HG1 MET 103 10.738 15.907 6.082 110 HE1 MET 103 HE1 MET 103 14.314 18.691 6.129 111 HE2 MET 103 HE2 MET 103 13.292 18.362 7.526 112 HE3 MET 103 HE3 MET 103 12.590 19.085 6.081 113 H PHE 104 HN PHE 104 8.577 17.522 2.476 114 HA PHE 104 HA PHE 104 9.500 19.207 0.451 115 HB2 PHE 104 HB2 PHE 104 6.694 18.091 0.763 116 HB3 PHE 104 HB1 PHE 104 7.515 18.457 -0.754 117 HD1 PHE 104 HD2 PHE 104 10.274 17.435 0.565 118 HD2 PHE 104 HD1 PHE 104 6.373 15.744 -0.051 119 HE1 PHE 104 HE2 PHE 104 11.261 15.160 0.556 120 HE2 PHE 104 HE1 PHE 104 7.361 13.470 -0.060 121 HZ PHE 104 HZ PHE 104 9.805 13.177 0.244 122 H ASP 105 HN ASP 105 6.666 19.719 2.567 123 HA ASP 105 HA ASP 105 5.895 22.230 1.349 124 HB2 ASP 105 HB2 ASP 105 4.367 20.766 2.591 125 HB3 ASP 105 HB1 ASP 105 5.329 20.975 4.055 126 H LYS 106 HN LYS 106 8.071 23.305 1.366 127 HA LYS 106 HA LYS 106 9.249 24.044 3.950 128 HB2 LYS 106 HB2 LYS 106 10.419 23.631 1.706 129 HB3 LYS 106 HB1 LYS 106 9.786 25.198 1.200 130 HG2 LYS 106 HG2 LYS 106 11.112 26.375 2.700 131 HG3 LYS 106 HG1 LYS 106 11.240 25.013 3.814 132 HD2 LYS 106 HD2 LYS 106 12.563 23.840 1.931 133 HD3 LYS 106 HD1 LYS 106 12.704 25.443 1.211 134 HE2 LYS 106 HE2 LYS 106 14.084 26.233 2.904 135 HE3 LYS 106 HE1 LYS 106 13.401 25.127 4.114 136 HZ1 LYS 106 HZ1 LYS 106 14.426 23.274 3.003 137 HZ2 LYS 106 HZ2 LYS 106 15.624 24.430 3.347 138 HZ3 LYS 106 HZ3 LYS 106 15.015 24.276 1.768 139 H ASN 107 HN ASN 107 6.662 25.174 2.056 140 HA ASN 107 HA ASN 107 6.905 28.024 2.601 141 HB2 ASN 107 HB2 ASN 107 5.685 26.959 0.690 142 HB3 ASN 107 HB1 ASN 107 4.510 26.320 1.839 143 HD21 ASN 107 HD21 ASN 107 2.846 27.671 0.709 144 HD22 ASN 107 HD22 ASN 107 2.749 29.332 1.045 145 H ALA 108 HN ALA 108 6.095 25.357 4.537 146 HA ALA 108 HA ALA 108 5.178 25.219 6.713 147 HB1 ALA 108 HB1 ALA 108 5.788 27.019 8.022 148 HB2 ALA 108 HB2 ALA 108 5.121 28.195 6.890 149 HB3 ALA 108 HB3 ALA 108 6.687 27.451 6.567 150 H ASP 109 HN ASP 109 3.336 25.160 4.579 151 HA ASP 109 HA ASP 109 1.038 26.760 5.660 152 HB2 ASP 109 HB2 ASP 109 1.508 27.586 3.506 153 HB3 ASP 109 HB1 ASP 109 1.963 25.997 2.897 154 H GLY 110 HN GLY 110 2.241 23.623 4.684 155 HA2 GLY 110 HA2 GLY 110 1.280 21.579 5.581 156 HA3 GLY 110 HA1 GLY 110 -0.275 22.402 5.701 157 H TYR 111 HN TYR 111 1.313 23.108 2.791 158 HA TYR 111 HA TYR 111 0.059 20.832 1.337 159 HB2 TYR 111 HB2 TYR 111 -0.596 23.775 1.098 160 HB3 TYR 111 HB1 TYR 111 -0.963 22.633 -0.195 161 HD1 TYR 111 HD2 TYR 111 -1.625 23.475 3.360 162 HD2 TYR 111 HD1 TYR 111 -2.758 21.053 -0.002 163 HE1 TYR 111 HE2 TYR 111 -3.669 22.756 4.566 164 HE2 TYR 111 HE1 TYR 111 -4.801 20.334 1.205 165 HH TYR 111 HH TYR 111 -5.263 20.926 4.549 166 H ILE 112 HN ILE 112 0.583 21.197 -1.144 167 HA ILE 112 HA ILE 112 3.319 22.392 -1.418 168 HB ILE 112 HB ILE 112 2.256 19.645 -2.057 169 HG12 ILE 112 HG12 ILE 112 4.858 20.618 -0.838 170 HG13 ILE 112 HG11 ILE 112 3.445 20.113 0.091 171 HG21 ILE 112 HG21 ILE 112 4.509 21.129 -3.412 172 HG22 ILE 112 HG22 ILE 112 3.216 20.184 -4.151 173 HG23 ILE 112 HG23 ILE 112 4.518 19.370 -3.284 174 HD11 ILE 112 HD11 ILE 112 3.937 18.067 -1.808 175 HD12 ILE 112 HD12 ILE 112 4.151 17.983 -0.059 176 HD13 ILE 112 HD13 ILE 112 5.496 18.473 -1.089 177 H ASP 113 HN ASP 113 3.116 23.980 -2.948 178 HA ASP 113 HA ASP 113 1.050 23.725 -5.071 179 HB2 ASP 113 HB2 ASP 113 1.603 25.760 -3.500 180 HB3 ASP 113 HB1 ASP 113 2.909 26.053 -4.649 181 H LEU 114 HN LEU 114 2.123 25.069 -7.161 182 HA LEU 114 HA LEU 114 3.978 23.166 -8.327 183 HB2 LEU 114 HB2 LEU 114 2.643 25.750 -9.094 184 HB3 LEU 114 HB1 LEU 114 3.921 25.100 -10.122 185 HG LEU 114 HG LEU 114 1.923 23.108 -9.265 186 HD11 LEU 114 HD11 LEU 114 0.530 24.169 -11.343 187 HD12 LEU 114 HD12 LEU 114 1.136 25.643 -10.587 188 HD13 LEU 114 HD13 LEU 114 0.159 24.510 -9.653 189 HD21 LEU 114 HD21 LEU 114 2.146 22.431 -11.601 190 HD22 LEU 114 HD22 LEU 114 3.750 22.738 -10.935 191 HD23 LEU 114 HD23 LEU 114 2.987 23.932 -11.986 192 H ASP 115 HN ASP 115 4.312 26.206 -6.629 193 HA ASP 115 HA ASP 115 7.080 26.649 -7.556 194 HB2 ASP 115 HB2 ASP 115 5.225 27.997 -5.570 195 HB3 ASP 115 HB1 ASP 115 6.855 28.574 -5.919 196 H GLU 116 HN GLU 116 5.481 24.896 -5.076 197 HA GLU 116 HA GLU 116 7.812 24.963 -3.233 198 HB2 GLU 116 HB2 GLU 116 5.217 23.414 -3.012 199 HB3 GLU 116 HB1 GLU 116 6.288 23.916 -1.703 200 HG2 GLU 116 HG2 GLU 116 5.808 26.329 -2.483 201 HG3 GLU 116 HG1 GLU 116 4.466 25.631 -3.391 202 H LEU 117 HN LEU 117 6.266 22.900 -5.606 203 HA LEU 117 HA LEU 117 7.360 20.370 -4.860 204 HB2 LEU 117 HB2 LEU 117 6.482 21.654 -7.456 205 HB3 LEU 117 HB1 LEU 117 6.994 19.968 -7.378 206 HG LEU 117 HG LEU 117 4.947 20.944 -5.418 207 HD11 LEU 117 HD11 LEU 117 3.624 19.786 -7.665 208 HD12 LEU 117 HD12 LEU 117 4.633 21.103 -8.262 209 HD13 LEU 117 HD13 LEU 117 3.428 21.413 -7.012 210 HD21 LEU 117 HD21 LEU 117 6.127 18.590 -5.616 211 HD22 LEU 117 HD22 LEU 117 4.958 18.337 -6.913 212 HD23 LEU 117 HD23 LEU 117 4.398 18.679 -5.275 213 H LYS 118 HN LYS 118 8.843 23.176 -6.264 214 HA LYS 118 HA LYS 118 11.137 21.642 -7.347 215 HB2 LYS 118 HB2 LYS 118 11.792 23.859 -8.197 216 HB3 LYS 118 HB1 LYS 118 10.098 23.538 -8.568 217 HG2 LYS 118 HG2 LYS 118 9.367 24.902 -6.703 218 HG3 LYS 118 HG1 LYS 118 11.028 25.104 -6.146 219 HD2 LYS 118 HD2 LYS 118 10.447 25.897 -8.957 220 HD3 LYS 118 HD1 LYS 118 9.802 26.935 -7.684 221 HE2 LYS 118 HE2 LYS 118 12.281 26.650 -6.708 222 HE3 LYS 118 HE1 LYS 118 12.647 26.404 -8.427 223 HZ1 LYS 118 HZ1 LYS 118 11.315 28.717 -7.148 224 HZ2 LYS 118 HZ2 LYS 118 11.150 28.405 -8.810 225 HZ3 LYS 118 HZ3 LYS 118 12.684 28.715 -8.149 226 H ILE 119 HN ILE 119 10.251 23.296 -4.441 227 HA ILE 119 HA ILE 119 13.051 23.849 -3.657 228 HB ILE 119 HB ILE 119 10.427 24.141 -2.161 229 HG12 ILE 119 HG12 ILE 119 11.979 26.217 -3.740 230 HG13 ILE 119 HG11 ILE 119 10.541 25.392 -4.342 231 HG21 ILE 119 HG21 ILE 119 12.645 24.149 -0.875 232 HG22 ILE 119 HG22 ILE 119 11.622 25.571 -0.673 233 HG23 ILE 119 HG23 ILE 119 13.022 25.637 -1.744 234 HD11 ILE 119 HD11 ILE 119 10.626 27.719 -2.746 235 HD12 ILE 119 HD12 ILE 119 10.047 26.430 -1.690 236 HD13 ILE 119 HD13 ILE 119 9.197 26.786 -3.193 237 H MET 120 HN MET 120 10.459 21.552 -2.922 238 HA MET 120 HA MET 120 11.460 20.370 -0.561 239 HB2 MET 120 HB2 MET 120 10.082 18.474 -1.248 240 HB3 MET 120 HB1 MET 120 9.266 19.972 -1.698 241 HG2 MET 120 HG2 MET 120 10.327 19.742 -3.989 242 HG3 MET 120 HG1 MET 120 10.849 18.128 -3.504 243 HE1 MET 120 HE1 MET 120 9.753 16.248 -3.436 244 HE2 MET 120 HE2 MET 120 8.047 15.886 -3.682 245 HE3 MET 120 HE3 MET 120 8.593 16.504 -2.125 246 H LEU 121 HN LEU 121 12.648 20.122 -3.846 247 HA LEU 121 HA LEU 121 14.256 17.715 -3.297 248 HB2 LEU 121 HB2 LEU 121 13.987 19.647 -5.617 249 HB3 LEU 121 HB1 LEU 121 15.037 18.230 -5.652 250 HG LEU 121 HG LEU 121 12.454 17.431 -4.699 251 HD11 LEU 121 HD11 LEU 121 11.462 19.304 -5.818 252 HD12 LEU 121 HD12 LEU 121 11.227 17.915 -6.877 253 HD13 LEU 121 HD13 LEU 121 12.494 19.089 -7.231 254 HD21 LEU 121 HD21 LEU 121 14.512 16.519 -6.367 255 HD22 LEU 121 HD22 LEU 121 13.113 16.664 -7.431 256 HD23 LEU 121 HD23 LEU 121 13.019 15.659 -5.985 257 H GLN 122 HN GLN 122 14.587 21.050 -2.718 258 HA GLN 122 HA GLN 122 17.217 21.748 -3.285 259 HB2 GLN 122 HB2 GLN 122 15.546 22.175 -0.790 260 HB3 GLN 122 HB1 GLN 122 17.028 23.067 -1.136 261 HG2 GLN 122 HG2 GLN 122 15.210 23.052 -3.418 262 HG3 GLN 122 HG1 GLN 122 14.467 23.763 -1.985 263 HE21 GLN 122 HE21 GLN 122 14.658 25.861 -3.274 264 HE22 GLN 122 HE22 GLN 122 16.135 26.697 -3.229 265 H ALA 123 HN ALA 123 16.100 19.311 -1.039 266 HA ALA 123 HA ALA 123 18.693 19.110 0.352 267 HB1 ALA 123 HB1 ALA 123 17.057 18.524 1.835 268 HB2 ALA 123 HB2 ALA 123 17.190 16.937 1.077 269 HB3 ALA 123 HB3 ALA 123 15.936 18.062 0.555 270 H THR 124 HN THR 124 17.174 17.755 -2.451 271 HA THR 124 HA THR 124 19.182 15.531 -2.503 272 HB THR 124 HB THR 124 16.641 15.132 -2.550 273 HG1 THR 124 HG1 THR 124 17.733 14.117 -4.896 274 HG21 THR 124 HG21 THR 124 16.556 15.539 -5.440 275 HG22 THR 124 HG22 THR 124 16.763 17.051 -4.556 276 HG23 THR 124 HG23 THR 124 15.385 16.008 -4.207 277 H GLY 125 HN GLY 125 19.591 18.417 -3.327 278 HA2 GLY 125 HA2 GLY 125 21.104 19.213 -5.012 279 HA3 GLY 125 HA1 GLY 125 20.697 17.814 -6.005 280 H GLU 126 HN GLU 126 17.764 18.323 -5.468 281 HA GLU 126 HA GLU 126 16.045 19.342 -6.748 282 HB2 GLU 126 HB2 GLU 126 16.788 20.961 -4.918 283 HB3 GLU 126 HB1 GLU 126 17.728 21.790 -6.158 284 HG2 GLU 126 HG2 GLU 126 15.439 21.745 -7.481 285 HG3 GLU 126 HG1 GLU 126 14.753 21.576 -5.865 286 H THR 127 HN THR 127 18.084 18.281 -8.444 287 HA THR 127 HA THR 127 18.571 20.443 -10.446 288 HB THR 127 HB THR 127 20.463 19.064 -9.666 289 HG1 THR 127 HG1 THR 127 20.868 18.067 -11.862 290 HG21 THR 127 HG21 THR 127 20.212 16.866 -9.271 291 HG22 THR 127 HG22 THR 127 19.762 16.585 -10.953 292 HG23 THR 127 HG23 THR 127 18.525 17.004 -9.769 293 H ILE 128 HN ILE 128 16.450 20.537 -11.373 294 HA ILE 128 HA ILE 128 15.779 18.186 -13.093 295 HB ILE 128 HB ILE 128 14.417 18.154 -11.028 296 HG12 ILE 128 HG12 ILE 128 12.461 19.162 -13.029 297 HG13 ILE 128 HG11 ILE 128 13.512 17.848 -13.559 298 HG21 ILE 128 HG21 ILE 128 14.529 20.932 -11.291 299 HG22 ILE 128 HG22 ILE 128 13.575 20.035 -10.110 300 HG23 ILE 128 HG23 ILE 128 12.847 20.532 -11.638 301 HD11 ILE 128 HD11 ILE 128 12.800 16.437 -11.751 302 HD12 ILE 128 HD12 ILE 128 11.339 17.108 -12.476 303 HD13 ILE 128 HD13 ILE 128 11.958 17.772 -10.963 304 H THR 129 HN THR 129 14.298 18.864 -14.913 305 HA THR 129 HA THR 129 15.174 21.403 -16.058 306 HB THR 129 HB THR 129 13.135 20.410 -17.632 307 HG1 THR 129 HG1 THR 129 13.159 18.226 -17.443 308 HG21 THR 129 HG21 THR 129 15.718 19.001 -17.902 309 HG22 THR 129 HG22 THR 129 15.834 20.759 -17.817 310 HG23 THR 129 HG23 THR 129 14.852 20.000 -19.070 311 H GLU 130 HN GLU 130 14.003 23.322 -16.111 312 HA GLU 130 HA GLU 130 11.962 23.885 -14.243 313 HB2 GLU 130 HB2 GLU 130 11.697 25.945 -15.589 314 HB3 GLU 130 HB1 GLU 130 13.402 25.529 -15.408 315 HG2 GLU 130 HG2 GLU 130 12.917 24.170 -17.659 316 HG3 GLU 130 HG1 GLU 130 11.668 25.403 -17.833 317 H ASP 131 HN ASP 131 11.756 22.378 -17.377 318 HA ASP 131 HA ASP 131 8.912 22.904 -17.795 319 HB2 ASP 131 HB2 ASP 131 10.516 22.529 -19.623 320 HB3 ASP 131 HB1 ASP 131 10.870 20.918 -18.998 321 H ASP 132 HN ASP 132 10.700 20.750 -15.829 322 HA ASP 132 HA ASP 132 8.615 18.642 -15.813 323 HB2 ASP 132 HB2 ASP 132 11.408 19.048 -14.883 324 HB3 ASP 132 HB1 ASP 132 10.422 17.959 -13.907 325 H ILE 133 HN ILE 133 9.629 21.424 -13.955 326 HA ILE 133 HA ILE 133 8.732 20.931 -11.370 327 HB ILE 133 HB ILE 133 8.307 23.377 -13.120 328 HG12 ILE 133 HG12 ILE 133 10.648 22.681 -13.017 329 HG13 ILE 133 HG11 ILE 133 10.427 24.126 -12.029 330 HG21 ILE 133 HG21 ILE 133 6.937 23.491 -11.088 331 HG22 ILE 133 HG22 ILE 133 8.295 24.609 -10.960 332 HG23 ILE 133 HG23 ILE 133 8.337 23.070 -10.101 333 HD11 ILE 133 HD11 ILE 133 11.582 22.831 -10.511 334 HD12 ILE 133 HD12 ILE 133 10.976 21.317 -11.183 335 HD13 ILE 133 HD13 ILE 133 9.943 22.295 -10.140 336 H GLU 134 HN GLU 134 6.758 21.633 -14.242 337 HA GLU 134 HA GLU 134 4.260 21.466 -12.654 338 HB2 GLU 134 HB2 GLU 134 4.664 21.834 -15.635 339 HB3 GLU 134 HB1 GLU 134 3.252 22.291 -14.682 340 HG2 GLU 134 HG2 GLU 134 4.169 24.303 -14.277 341 HG3 GLU 134 HG1 GLU 134 5.541 23.518 -13.494 342 H GLU 135 HN GLU 135 6.251 19.475 -14.699 343 HA GLU 135 HA GLU 135 4.320 17.637 -15.711 344 HB2 GLU 135 HB2 GLU 135 6.811 17.937 -16.241 345 HB3 GLU 135 HB1 GLU 135 7.131 16.992 -14.785 346 HG2 GLU 135 HG2 GLU 135 6.787 15.099 -15.947 347 HG3 GLU 135 HG1 GLU 135 5.133 15.614 -16.281 348 H LEU 136 HN LEU 136 6.152 17.653 -12.646 349 HA LEU 136 HA LEU 136 5.264 15.160 -11.614 350 HB2 LEU 136 HB2 LEU 136 5.899 17.772 -10.201 351 HB3 LEU 136 HB1 LEU 136 5.920 16.174 -9.455 352 HG LEU 136 HG LEU 136 7.509 16.309 -11.915 353 HD11 LEU 136 HD11 LEU 136 9.297 17.686 -11.050 354 HD12 LEU 136 HD12 LEU 136 8.460 17.892 -9.511 355 HD13 LEU 136 HD13 LEU 136 7.812 18.635 -10.974 356 HD21 LEU 136 HD21 LEU 136 8.720 14.739 -10.790 357 HD22 LEU 136 HD22 LEU 136 7.344 14.718 -9.688 358 HD23 LEU 136 HD23 LEU 136 8.761 15.697 -9.310 359 H MET 137 HN MET 137 3.870 18.431 -11.181 360 HA MET 137 HA MET 137 1.762 17.962 -9.459 361 HB2 MET 137 HB2 MET 137 2.200 20.135 -10.385 362 HB3 MET 137 HB1 MET 137 1.921 19.558 -12.028 363 HG2 MET 137 HG2 MET 137 -0.322 19.799 -11.846 364 HG3 MET 137 HG1 MET 137 -0.351 19.065 -10.243 365 HE1 MET 137 HE1 MET 137 0.156 21.665 -7.742 366 HE2 MET 137 HE2 MET 137 1.668 21.134 -8.473 367 HE3 MET 137 HE3 MET 137 0.351 19.984 -8.257 368 H LYS 138 HN LYS 138 1.964 16.983 -12.862 369 HA LYS 138 HA LYS 138 -0.725 16.236 -13.325 370 HB2 LYS 138 HB2 LYS 138 1.889 15.008 -14.261 371 HB3 LYS 138 HB1 LYS 138 0.321 14.728 -15.021 372 HG2 LYS 138 HG2 LYS 138 1.098 17.568 -14.601 373 HG3 LYS 138 HG1 LYS 138 1.996 16.681 -15.833 374 HD2 LYS 138 HD2 LYS 138 0.206 16.564 -17.229 375 HD3 LYS 138 HD1 LYS 138 -0.918 16.242 -15.908 376 HE2 LYS 138 HE2 LYS 138 0.113 18.941 -15.686 377 HE3 LYS 138 HE1 LYS 138 -0.616 18.683 -17.284 378 HZ1 LYS 138 HZ1 LYS 138 -2.616 18.019 -16.365 379 HZ2 LYS 138 HZ2 LYS 138 -2.150 19.270 -15.313 380 HZ3 LYS 138 HZ3 LYS 138 -1.932 17.648 -14.857 381 H ASP 139 HN ASP 139 1.950 14.270 -11.977 382 HA ASP 139 HA ASP 139 0.146 12.003 -11.454 383 HB2 ASP 139 HB2 ASP 139 3.056 12.614 -10.850 384 HB3 ASP 139 HB1 ASP 139 2.290 11.060 -10.520 385 H GLY 140 HN GLY 140 1.671 14.627 -9.630 386 HA2 GLY 140 HA2 GLY 140 0.702 13.500 -7.073 387 HA3 GLY 140 HA1 GLY 140 1.706 14.939 -7.251 388 H ASP 141 HN ASP 141 -0.813 15.059 -9.475 389 HA ASP 141 HA ASP 141 -2.917 16.056 -7.728 390 HB2 ASP 141 HB2 ASP 141 -0.784 17.727 -8.015 391 HB3 ASP 141 HB1 ASP 141 -1.791 18.253 -9.365 392 H LYS 142 HN LYS 142 -3.126 14.216 -9.783 393 HA LYS 142 HA LYS 142 -3.641 15.169 -12.396 394 HB2 LYS 142 HB2 LYS 142 -3.900 12.808 -10.917 395 HB3 LYS 142 HB1 LYS 142 -5.542 13.157 -11.461 396 HG2 LYS 142 HG2 LYS 142 -4.691 13.424 -13.782 397 HG3 LYS 142 HG1 LYS 142 -3.077 12.985 -13.220 398 HD2 LYS 142 HD2 LYS 142 -5.253 11.114 -12.470 399 HD3 LYS 142 HD1 LYS 142 -4.853 11.177 -14.186 400 HE2 LYS 142 HE2 LYS 142 -2.804 10.778 -11.976 401 HE3 LYS 142 HE1 LYS 142 -3.486 9.472 -12.966 402 HZ1 LYS 142 HZ1 LYS 142 -2.834 11.294 -14.825 403 HZ2 LYS 142 HZ2 LYS 142 -1.833 9.996 -14.375 404 HZ3 LYS 142 HZ3 LYS 142 -1.590 11.535 -13.698 405 H ASN 143 HN ASN 143 -5.381 15.681 -9.444 406 HA ASN 143 HA ASN 143 -7.956 16.343 -10.651 407 HB2 ASN 143 HB2 ASN 143 -7.974 15.593 -8.403 408 HB3 ASN 143 HB1 ASN 143 -6.618 16.629 -7.958 409 HD21 ASN 143 HD21 ASN 143 -7.666 17.884 -6.329 410 HD22 ASN 143 HD22 ASN 143 -8.996 18.890 -6.646 411 H ASN 144 HN ASN 144 -4.975 18.030 -9.923 412 HA ASN 144 HA ASN 144 -4.318 20.266 -10.295 413 HB2 ASN 144 HB2 ASN 144 -5.941 19.276 -12.430 414 HB3 ASN 144 HB1 ASN 144 -6.334 20.980 -12.196 415 HD21 ASN 144 HD21 ASN 144 -5.167 21.127 -14.413 416 HD22 ASN 144 HD22 ASN 144 -3.480 21.313 -14.386 417 H ASP 145 HN ASP 145 -5.021 21.024 -8.188 418 HA ASP 145 HA ASP 145 -7.572 22.602 -8.282 419 HB2 ASP 145 HB2 ASP 145 -7.896 21.977 -5.952 420 HB3 ASP 145 HB1 ASP 145 -7.602 20.506 -6.880 421 H GLY 146 HN GLY 146 -4.280 22.842 -8.245 422 HA2 GLY 146 HA2 GLY 146 -3.154 24.980 -8.065 423 HA3 GLY 146 HA1 GLY 146 -4.405 25.509 -6.940 424 H ARG 147 HN ARG 147 -3.653 22.414 -6.054 425 HA ARG 147 HA ARG 147 -1.192 22.958 -4.549 426 HB2 ARG 147 HB2 ARG 147 -3.838 23.560 -3.519 427 HB3 ARG 147 HB1 ARG 147 -3.041 22.346 -2.516 428 HG2 ARG 147 HG2 ARG 147 -1.622 23.875 -1.666 429 HG3 ARG 147 HG1 ARG 147 -1.183 24.442 -3.277 430 HD2 ARG 147 HD2 ARG 147 -3.462 25.679 -3.259 431 HD3 ARG 147 HD1 ARG 147 -3.437 25.398 -1.506 432 HE ARG 147 HE ARG 147 -0.876 26.365 -2.271 433 HH11 ARG 147 HH21 ARG 147 -4.176 27.367 -2.079 434 HH12 ARG 147 HH22 ARG 147 -3.787 29.034 -1.815 435 HH21 ARG 147 HH11 ARG 147 -0.359 28.530 -1.929 436 HH22 ARG 147 HH12 ARG 147 -1.627 29.692 -1.730 437 H ILE 148 HN ILE 148 -0.348 21.024 -3.620 438 HA ILE 148 HA ILE 148 -1.746 18.528 -4.485 439 HB ILE 148 HB ILE 148 1.122 19.017 -3.620 440 HG12 ILE 148 HG12 ILE 148 -0.114 18.911 -6.391 441 HG13 ILE 148 HG11 ILE 148 0.589 20.335 -5.622 442 HG21 ILE 148 HG21 ILE 148 -0.442 16.670 -4.523 443 HG22 ILE 148 HG22 ILE 148 1.015 16.738 -3.533 444 HG23 ILE 148 HG23 ILE 148 1.135 16.866 -5.288 445 HD11 ILE 148 HD11 ILE 148 2.277 17.876 -5.811 446 HD12 ILE 148 HD12 ILE 148 2.756 19.572 -5.870 447 HD13 ILE 148 HD13 ILE 148 2.019 18.815 -7.282 448 H ASP 149 HN ASP 149 -3.159 18.284 -2.654 449 HA ASP 149 HA ASP 149 -2.281 18.491 0.083 450 HB2 ASP 149 HB2 ASP 149 -4.456 17.481 0.528 451 HB3 ASP 149 HB1 ASP 149 -4.628 18.620 -0.809 452 H TYR 150 HN TYR 150 -1.880 16.714 1.565 453 HA TYR 150 HA TYR 150 -0.088 14.716 0.700 454 HB2 TYR 150 HB2 TYR 150 -0.210 15.355 2.996 455 HB3 TYR 150 HB1 TYR 150 -1.936 15.002 3.077 456 HD1 TYR 150 HD2 TYR 150 0.872 13.009 1.614 457 HD2 TYR 150 HD1 TYR 150 -2.180 13.253 4.627 458 HE1 TYR 150 HE2 TYR 150 1.376 10.683 2.313 459 HE2 TYR 150 HE1 TYR 150 -1.676 10.928 5.326 460 HH TYR 150 HH TYR 150 -0.259 9.210 5.103 461 H ASP 151 HN ASP 151 -3.625 14.597 1.015 462 HA ASP 151 HA ASP 151 -4.020 11.800 0.718 463 HB2 ASP 151 HB2 ASP 151 -5.509 14.213 0.807 464 HB3 ASP 151 HB1 ASP 151 -6.037 13.352 -0.639 465 H GLU 152 HN GLU 152 -3.673 14.349 -1.761 466 HA GLU 152 HA GLU 152 -4.001 12.418 -3.959 467 HB2 GLU 152 HB2 GLU 152 -3.602 15.363 -3.586 468 HB3 GLU 152 HB1 GLU 152 -3.241 14.667 -5.166 469 HG2 GLU 152 HG2 GLU 152 -5.495 13.689 -5.268 470 HG3 GLU 152 HG1 GLU 152 -5.863 14.351 -3.675 471 H PHE 153 HN PHE 153 -1.393 13.726 -2.078 472 HA PHE 153 HA PHE 153 0.785 13.666 -3.868 473 HB2 PHE 153 HB2 PHE 153 0.639 14.400 -1.430 474 HB3 PHE 153 HB1 PHE 153 0.790 12.697 -0.997 475 HD1 PHE 153 HD1 PHE 153 2.441 15.257 -3.192 476 HD2 PHE 153 HD2 PHE 153 2.923 11.828 -0.650 477 HE1 PHE 153 HE1 PHE 153 4.902 15.408 -3.456 478 HE2 PHE 153 HE2 PHE 153 5.384 11.979 -0.913 479 HZ PHE 153 HZ PHE 153 6.374 13.768 -2.315 480 H LEU 154 HN LEU 154 -0.858 10.991 -2.226 481 HA LEU 154 HA LEU 154 1.020 8.916 -2.646 482 HB2 LEU 154 HB2 LEU 154 -1.808 9.280 -2.027 483 HB3 LEU 154 HB1 LEU 154 -1.528 7.811 -2.963 484 HG LEU 154 HG LEU 154 0.045 6.980 -1.359 485 HD11 LEU 154 HD11 LEU 154 -0.091 9.791 -0.262 486 HD12 LEU 154 HD12 LEU 154 1.330 8.890 -0.791 487 HD13 LEU 154 HD13 LEU 154 0.516 8.450 0.711 488 HD21 LEU 154 HD21 LEU 154 -2.573 7.260 -0.786 489 HD22 LEU 154 HD22 LEU 154 -1.897 8.191 0.551 490 HD23 LEU 154 HD23 LEU 154 -1.441 6.501 0.334 491 H GLU 155 HN GLU 155 -1.445 10.237 -4.852 492 HA GLU 155 HA GLU 155 -1.238 8.269 -6.906 493 HB2 GLU 155 HB2 GLU 155 -2.793 10.389 -6.424 494 HB3 GLU 155 HB1 GLU 155 -1.672 11.158 -7.549 495 HG2 GLU 155 HG2 GLU 155 -2.383 9.904 -9.331 496 HG3 GLU 155 HG1 GLU 155 -2.703 8.483 -8.336 497 H PHE 156 HN PHE 156 1.072 10.550 -5.836 498 HA PHE 156 HA PHE 156 2.409 10.846 -8.452 499 HB2 PHE 156 HB2 PHE 156 2.391 12.743 -6.990 500 HB3 PHE 156 HB1 PHE 156 2.921 11.772 -5.616 501 HD1 PHE 156 HD2 PHE 156 4.155 11.890 -9.147 502 HD2 PHE 156 HD1 PHE 156 5.042 12.565 -4.999 503 HE1 PHE 156 HE2 PHE 156 6.519 12.361 -9.730 504 HE2 PHE 156 HE1 PHE 156 7.407 13.035 -5.581 505 HZ PHE 156 HZ PHE 156 8.145 12.933 -7.947 506 H MET 157 HN MET 157 2.892 9.120 -5.379 507 HA MET 157 HA MET 157 5.455 7.981 -6.313 508 HB2 MET 157 HB2 MET 157 3.848 7.361 -3.822 509 HB3 MET 157 HB1 MET 157 5.585 7.162 -4.058 510 HG2 MET 157 HG2 MET 157 4.067 9.785 -3.971 511 HG3 MET 157 HG1 MET 157 5.195 9.183 -2.756 512 HE1 MET 157 HE1 MET 157 6.891 11.206 -2.772 513 HE2 MET 157 HE2 MET 157 8.335 10.666 -3.624 514 HE3 MET 157 HE3 MET 157 7.429 9.526 -2.632 515 H LYS 158 HN LYS 158 2.153 7.230 -6.603 516 HA LYS 158 HA LYS 158 2.231 4.356 -6.376 517 HB2 LYS 158 HB2 LYS 158 0.248 5.977 -6.365 518 HB3 LYS 158 HB1 LYS 158 0.417 6.041 -8.120 519 HG2 LYS 158 HG2 LYS 158 -1.099 4.299 -7.930 520 HG3 LYS 158 HG1 LYS 158 0.415 3.395 -7.873 521 HD2 LYS 158 HD2 LYS 158 0.356 3.411 -5.417 522 HD3 LYS 158 HD1 LYS 158 -1.134 4.354 -5.449 523 HE2 LYS 158 HE2 LYS 158 -1.424 2.013 -7.129 524 HE3 LYS 158 HE1 LYS 158 -0.931 1.540 -5.490 525 HZ1 LYS 158 HZ1 LYS 158 -2.647 2.954 -4.580 526 HZ2 LYS 158 HZ2 LYS 158 -3.346 1.846 -5.661 527 HZ3 LYS 158 HZ3 LYS 158 -3.108 3.462 -6.131 528 H GLY 159 HN GLY 159 3.600 6.468 -8.664 529 HA2 GLY 159 HA2 GLY 159 3.758 4.242 -10.659 530 HA3 GLY 159 HA1 GLY 159 3.651 5.934 -11.144 531 H VAL 160 HN VAL 160 5.458 6.643 -8.789 532 HA VAL 160 HA VAL 160 7.939 6.709 -10.205 533 HB VAL 160 HB VAL 160 7.274 6.942 -7.251 534 HG11 VAL 160 HG11 VAL 160 9.702 6.524 -7.762 535 HG12 VAL 160 HG12 VAL 160 9.395 8.095 -7.021 536 HG13 VAL 160 HG13 VAL 160 9.693 7.981 -8.755 537 HG21 VAL 160 HG21 VAL 160 6.184 8.497 -9.031 538 HG22 VAL 160 HG22 VAL 160 7.798 9.188 -9.197 539 HG23 VAL 160 HG23 VAL 160 6.968 9.251 -7.642 540 H GLU 161 HN GLU 161 6.583 4.363 -7.939 541 HA GLU 161 HA GLU 161 9.134 2.879 -7.745 542 HB2 GLU 161 HB2 GLU 161 7.365 3.297 -5.908 543 HB3 GLU 161 HB1 GLU 161 6.404 2.069 -6.732 544 HG2 GLU 161 HG2 GLU 161 7.627 0.884 -5.070 545 HG3 GLU 161 HG1 GLU 161 8.480 0.568 -6.581 546 HO1 KDH 1 H1 KDH 1 14.141 9.374 -9.740 547 H21 KDH 1 H21 KDH 1 13.476 9.524 -3.713 548 H33 KDH 1 H33 KDH 1 9.716 13.000 -6.749 549 H4 KDH 1 H4 KDH 1 13.204 10.559 -7.850 550 HO7 KDH 1 H7 KDH 1 12.135 9.704 -12.232 551 H01 KDH 1 H01 KDH 1 10.626 14.140 -4.639 552 H01A KDH 1 H02 KDH 1 9.617 12.652 -4.444 553 HO03 KDH 1 H03 KDH 1 10.982 14.227 -1.484 554 HO10 KDH 1 H10 KDH 1 8.190 11.137 -10.659 555 H12 KDH 1 H12 KDH 1 8.843 11.081 -8.194 556 H15 KDH 1 H15 KDH 1 9.966 10.769 -6.129 557 H26 KDH 1 H26 KDH 1 13.106 12.798 -0.817 558 H39 KDH 1 H39 KDH 1 13.943 14.404 -8.732 559 H41 KDH 1 H41 KDH 1 9.888 13.216 -9.951 560 HO02 KDH 1 H42 KDH 1 14.780 9.748 -1.867 561 HO44 KDH 1 H44 KDH 1 10.657 13.293 -13.290 562 HO47 KDH 1 H47 KDH 1 12.629 12.325 -13.520 563 HO50 KDH 1 H50 KDH 1 15.257 13.295 -11.944 Start of MODEL 12 1 H1 MET 90 HT1 MET 90 12.859 5.743 2.553 2 H2 MET 90 HT2 MET 90 12.112 4.303 3.057 3 H3 MET 90 HT3 MET 90 13.322 5.015 4.014 4 HA MET 90 HA MET 90 10.848 5.342 4.672 5 HB2 MET 90 HB2 MET 90 11.580 7.538 5.588 6 HB3 MET 90 HB1 MET 90 12.846 6.318 5.727 7 HG2 MET 90 HG2 MET 90 13.047 7.629 3.166 8 HG3 MET 90 HG1 MET 90 13.026 8.837 4.451 9 HE1 MET 90 HE1 MET 90 16.191 9.186 5.596 10 HE2 MET 90 HE2 MET 90 14.726 9.772 4.812 11 HE3 MET 90 HE3 MET 90 16.117 9.314 3.833 12 H GLY 91 HN GLY 91 9.392 5.315 2.805 13 HA2 GLY 91 HA2 GLY 91 8.036 7.569 2.131 14 HA3 GLY 91 HA1 GLY 91 9.392 7.642 1.004 15 H LYS 92 HN LYS 92 6.961 5.272 2.158 16 HA LYS 92 HA LYS 92 6.712 4.345 -0.686 17 HB2 LYS 92 HB2 LYS 92 6.697 2.782 1.915 18 HB3 LYS 92 HB1 LYS 92 6.357 2.081 0.333 19 HG2 LYS 92 HG2 LYS 92 8.643 3.110 -0.365 20 HG3 LYS 92 HG1 LYS 92 8.948 3.215 1.369 21 HD2 LYS 92 HD2 LYS 92 8.072 0.658 0.008 22 HD3 LYS 92 HD1 LYS 92 9.767 1.081 0.258 23 HE2 LYS 92 HE2 LYS 92 9.496 0.007 2.263 24 HE3 LYS 92 HE1 LYS 92 8.702 1.512 2.766 25 HZ1 LYS 92 HZ1 LYS 92 6.611 0.631 1.870 26 HZ2 LYS 92 HZ2 LYS 92 7.216 -0.342 3.124 27 HZ3 LYS 92 HZ3 LYS 92 7.382 -0.835 1.506 28 H SER 93 HN SER 93 4.983 3.632 2.362 29 HA SER 93 HA SER 93 2.424 4.309 0.961 30 HB2 SER 93 HB2 SER 93 3.214 2.019 2.173 31 HB3 SER 93 HB1 SER 93 2.487 2.843 3.549 32 HG SER 93 HG SER 93 1.255 1.542 1.646 33 H GLU 94 HN GLU 94 0.696 5.117 2.599 34 HA GLU 94 HA GLU 94 1.253 7.639 3.601 35 HB2 GLU 94 HB2 GLU 94 -0.618 5.503 4.676 36 HB3 GLU 94 HB1 GLU 94 -0.749 7.222 5.049 37 HG2 GLU 94 HG2 GLU 94 -1.429 7.780 2.903 38 HG3 GLU 94 HG1 GLU 94 -0.618 6.393 2.175 39 H GLU 95 HN GLU 95 1.957 4.541 5.122 40 HA GLU 95 HA GLU 95 2.381 5.295 7.803 41 HB2 GLU 95 HB2 GLU 95 2.474 3.015 6.616 42 HB3 GLU 95 HB1 GLU 95 4.145 3.417 6.217 43 HG2 GLU 95 HG2 GLU 95 4.450 3.887 8.729 44 HG3 GLU 95 HG1 GLU 95 2.917 3.044 8.950 45 H GLU 96 HN GLU 96 4.891 5.128 5.239 46 HA GLU 96 HA GLU 96 6.730 6.732 6.897 47 HB2 GLU 96 HB2 GLU 96 6.777 4.999 4.508 48 HB3 GLU 96 HB1 GLU 96 7.907 6.352 4.444 49 HG2 GLU 96 HG2 GLU 96 9.256 5.416 5.991 50 HG3 GLU 96 HG1 GLU 96 7.900 5.076 7.066 51 H LEU 97 HN LEU 97 4.925 7.070 3.838 52 HA LEU 97 HA LEU 97 5.930 9.504 2.886 53 HB2 LEU 97 HB2 LEU 97 3.074 8.478 2.989 54 HB3 LEU 97 HB1 LEU 97 3.652 9.738 1.899 55 HG LEU 97 HG LEU 97 4.622 6.865 1.992 56 HD11 LEU 97 HD11 LEU 97 3.766 7.311 -0.538 57 HD12 LEU 97 HD12 LEU 97 2.677 8.385 0.340 58 HD13 LEU 97 HD13 LEU 97 2.721 6.666 0.729 59 HD21 LEU 97 HD21 LEU 97 6.463 8.398 1.468 60 HD22 LEU 97 HD22 LEU 97 5.469 9.209 0.257 61 HD23 LEU 97 HD23 LEU 97 5.974 7.537 0.009 62 H SER 98 HN SER 98 3.876 8.923 5.680 63 HA SER 98 HA SER 98 2.785 11.516 6.071 64 HB2 SER 98 HB2 SER 98 2.531 9.170 7.276 65 HB3 SER 98 HB1 SER 98 3.763 9.826 8.351 66 HG SER 98 HG SER 98 2.368 11.244 9.091 67 H ASP 99 HN ASP 99 5.638 10.176 7.797 68 HA ASP 99 HA ASP 99 6.563 12.615 8.886 69 HB2 ASP 99 HB2 ASP 99 7.558 9.899 8.328 70 HB3 ASP 99 HB1 ASP 99 8.834 11.115 8.403 71 H LEU 100 HN LEU 100 7.273 11.116 5.734 72 HA LEU 100 HA LEU 100 9.276 12.941 4.849 73 HB2 LEU 100 HB2 LEU 100 8.412 10.685 3.914 74 HB3 LEU 100 HB1 LEU 100 7.176 11.648 3.104 75 HG LEU 100 HG LEU 100 9.308 13.097 2.397 76 HD11 LEU 100 HD11 LEU 100 11.315 12.058 2.554 77 HD12 LEU 100 HD12 LEU 100 10.645 10.511 2.036 78 HD13 LEU 100 HD13 LEU 100 10.531 10.999 3.727 79 HD21 LEU 100 HD21 LEU 100 7.836 12.191 0.748 80 HD22 LEU 100 HD22 LEU 100 8.276 10.534 1.163 81 HD23 LEU 100 HD23 LEU 100 9.437 11.574 0.338 82 H PHE 101 HN PHE 101 5.815 12.908 3.893 83 HA PHE 101 HA PHE 101 5.668 15.341 2.550 84 HB2 PHE 101 HB2 PHE 101 3.869 13.633 2.884 85 HB3 PHE 101 HB1 PHE 101 3.665 14.216 4.536 86 HD1 PHE 101 HD2 PHE 101 3.003 16.635 4.916 87 HD2 PHE 101 HD1 PHE 101 2.885 14.772 1.047 88 HE1 PHE 101 HE2 PHE 101 1.508 18.435 4.096 89 HE2 PHE 101 HE1 PHE 101 1.390 16.573 0.226 90 HZ PHE 101 HZ PHE 101 0.701 18.404 1.751 91 H ARG 102 HN ARG 102 5.789 14.796 6.043 92 HA ARG 102 HA ARG 102 5.028 17.305 7.048 93 HB2 ARG 102 HB2 ARG 102 6.364 14.936 7.885 94 HB3 ARG 102 HB1 ARG 102 7.339 16.300 8.434 95 HG2 ARG 102 HG2 ARG 102 5.691 17.097 9.831 96 HG3 ARG 102 HG1 ARG 102 4.386 16.492 8.809 97 HD2 ARG 102 HD2 ARG 102 4.194 14.711 10.196 98 HD3 ARG 102 HD1 ARG 102 5.833 14.216 9.729 99 HE ARG 102 HE ARG 102 5.992 16.378 11.607 100 HH11 ARG 102 HH21 ARG 102 5.198 13.027 11.330 101 HH12 ARG 102 HH22 ARG 102 5.639 12.656 12.962 102 HH21 ARG 102 HH11 ARG 102 6.568 15.903 13.739 103 HH22 ARG 102 HH12 ARG 102 6.409 14.281 14.325 104 H MET 103 HN MET 103 8.405 16.305 6.340 105 HA MET 103 HA MET 103 9.366 19.062 6.480 106 HB2 MET 103 HB2 MET 103 10.389 16.480 6.705 107 HB3 MET 103 HB1 MET 103 11.084 17.071 5.195 108 HG2 MET 103 HG2 MET 103 12.234 18.797 6.238 109 HG3 MET 103 HG1 MET 103 11.098 18.879 7.584 110 HE1 MET 103 HE1 MET 103 14.480 17.549 6.333 111 HE2 MET 103 HE2 MET 103 13.297 16.413 5.689 112 HE3 MET 103 HE3 MET 103 14.474 15.867 6.881 113 H PHE 104 HN PHE 104 8.670 16.718 3.892 114 HA PHE 104 HA PHE 104 9.752 17.916 1.640 115 HB2 PHE 104 HB2 PHE 104 7.335 16.331 2.311 116 HB3 PHE 104 HB1 PHE 104 7.301 17.138 0.743 117 HD1 PHE 104 HD2 PHE 104 10.345 15.942 2.500 118 HD2 PHE 104 HD1 PHE 104 7.563 15.242 -0.697 119 HE1 PHE 104 HE2 PHE 104 11.850 14.203 1.571 120 HE2 PHE 104 HE1 PHE 104 9.069 13.502 -1.626 121 HZ PHE 104 HZ PHE 104 11.212 12.983 -0.491 122 H ASP 105 HN ASP 105 6.420 18.612 2.778 123 HA ASP 105 HA ASP 105 5.787 20.751 1.111 124 HB2 ASP 105 HB2 ASP 105 4.451 19.538 2.944 125 HB3 ASP 105 HB1 ASP 105 5.179 20.681 4.073 126 H LYS 106 HN LYS 106 7.258 22.385 0.670 127 HA LYS 106 HA LYS 106 9.174 23.460 2.498 128 HB2 LYS 106 HB2 LYS 106 8.172 23.871 -0.187 129 HB3 LYS 106 HB1 LYS 106 8.455 25.426 0.598 130 HG2 LYS 106 HG2 LYS 106 10.555 23.355 0.975 131 HG3 LYS 106 HG1 LYS 106 10.417 24.048 -0.641 132 HD2 LYS 106 HD2 LYS 106 11.791 25.648 0.252 133 HD3 LYS 106 HD1 LYS 106 10.262 26.310 0.829 134 HE2 LYS 106 HE2 LYS 106 10.828 25.918 2.990 135 HE3 LYS 106 HE1 LYS 106 11.286 24.242 2.625 136 HZ1 LYS 106 HZ1 LYS 106 13.164 25.761 3.310 137 HZ2 LYS 106 HZ2 LYS 106 12.948 26.563 1.827 138 HZ3 LYS 106 HZ3 LYS 106 13.388 24.922 1.852 139 H ASN 107 HN ASN 107 5.925 24.624 1.550 140 HA ASN 107 HA ASN 107 5.991 26.928 3.315 141 HB2 ASN 107 HB2 ASN 107 4.604 26.922 1.349 142 HB3 ASN 107 HB1 ASN 107 3.833 25.408 1.825 143 HD21 ASN 107 HD21 ASN 107 1.745 26.690 1.659 144 HD22 ASN 107 HD22 ASN 107 1.279 27.658 2.974 145 H ALA 108 HN ALA 108 5.342 23.560 3.761 146 HA ALA 108 HA ALA 108 4.550 22.341 5.627 147 HB1 ALA 108 HB1 ALA 108 6.562 23.636 6.450 148 HB2 ALA 108 HB2 ALA 108 5.403 23.225 7.714 149 HB3 ALA 108 HB3 ALA 108 5.446 24.861 7.056 150 H ASP 109 HN ASP 109 2.319 22.997 4.578 151 HA ASP 109 HA ASP 109 0.707 24.331 6.716 152 HB2 ASP 109 HB2 ASP 109 -0.566 25.414 4.808 153 HB3 ASP 109 HB1 ASP 109 1.092 25.985 4.995 154 H GLY 110 HN GLY 110 1.255 21.535 5.166 155 HA2 GLY 110 HA2 GLY 110 -0.227 19.625 5.480 156 HA3 GLY 110 HA1 GLY 110 -1.605 20.720 5.357 157 H TYR 111 HN TYR 111 -0.310 22.105 3.021 158 HA TYR 111 HA TYR 111 -0.782 19.972 0.962 159 HB2 TYR 111 HB2 TYR 111 -1.588 22.900 0.988 160 HB3 TYR 111 HB1 TYR 111 -1.893 21.777 -0.338 161 HD1 TYR 111 HD2 TYR 111 -2.683 22.554 3.200 162 HD2 TYR 111 HD1 TYR 111 -3.648 20.132 -0.215 163 HE1 TYR 111 HE2 TYR 111 -4.747 21.779 4.333 164 HE2 TYR 111 HE1 TYR 111 -5.713 19.357 0.920 165 HH TYR 111 HH TYR 111 -7.256 20.554 2.945 166 H ILE 112 HN ILE 112 0.082 20.888 -1.273 167 HA ILE 112 HA ILE 112 2.680 22.317 -0.822 168 HB ILE 112 HB ILE 112 2.172 19.886 -2.569 169 HG12 ILE 112 HG12 ILE 112 3.705 20.022 0.041 170 HG13 ILE 112 HG11 ILE 112 2.019 19.513 -0.055 171 HG21 ILE 112 HG21 ILE 112 4.365 20.022 -3.224 172 HG22 ILE 112 HG22 ILE 112 4.890 20.700 -1.683 173 HG23 ILE 112 HG23 ILE 112 4.119 21.735 -2.884 174 HD11 ILE 112 HD11 ILE 112 2.529 17.545 -1.155 175 HD12 ILE 112 HD12 ILE 112 4.002 17.739 -0.204 176 HD13 ILE 112 HD13 ILE 112 3.979 18.215 -1.902 177 H ASP 113 HN ASP 113 3.236 23.760 -2.482 178 HA ASP 113 HA ASP 113 1.221 24.066 -4.683 179 HB2 ASP 113 HB2 ASP 113 2.188 25.812 -2.693 180 HB3 ASP 113 HB1 ASP 113 2.947 26.348 -4.193 181 H LEU 114 HN LEU 114 2.133 24.835 -6.768 182 HA LEU 114 HA LEU 114 4.189 23.309 -7.849 183 HB2 LEU 114 HB2 LEU 114 3.341 26.153 -8.484 184 HB3 LEU 114 HB1 LEU 114 4.268 25.121 -9.573 185 HG LEU 114 HG LEU 114 2.066 23.570 -8.739 186 HD11 LEU 114 HD11 LEU 114 1.138 25.864 -8.052 187 HD12 LEU 114 HD12 LEU 114 0.140 24.909 -9.149 188 HD13 LEU 114 HD13 LEU 114 1.108 26.245 -9.774 189 HD21 LEU 114 HD21 LEU 114 2.405 23.123 -10.925 190 HD22 LEU 114 HD22 LEU 114 3.268 24.643 -11.157 191 HD23 LEU 114 HD23 LEU 114 1.510 24.597 -11.293 192 H ASP 115 HN ASP 115 4.602 26.743 -6.879 193 HA ASP 115 HA ASP 115 7.354 27.003 -7.147 194 HB2 ASP 115 HB2 ASP 115 5.244 28.091 -5.343 195 HB3 ASP 115 HB1 ASP 115 6.917 28.419 -4.893 196 H GLU 116 HN GLU 116 5.598 25.263 -4.624 197 HA GLU 116 HA GLU 116 7.921 24.878 -2.904 198 HB2 GLU 116 HB2 GLU 116 5.340 23.297 -3.025 199 HB3 GLU 116 HB1 GLU 116 6.377 23.556 -1.621 200 HG2 GLU 116 HG2 GLU 116 5.877 26.125 -2.261 201 HG3 GLU 116 HG1 GLU 116 4.396 25.388 -2.876 202 H LEU 117 HN LEU 117 6.168 22.839 -5.269 203 HA LEU 117 HA LEU 117 7.606 20.431 -4.926 204 HB2 LEU 117 HB2 LEU 117 6.379 21.769 -7.356 205 HB3 LEU 117 HB1 LEU 117 6.924 20.091 -7.346 206 HG LEU 117 HG LEU 117 4.981 21.146 -5.288 207 HD11 LEU 117 HD11 LEU 117 4.542 20.409 -8.128 208 HD12 LEU 117 HD12 LEU 117 3.578 21.441 -7.071 209 HD13 LEU 117 HD13 LEU 117 3.427 19.687 -6.967 210 HD21 LEU 117 HD21 LEU 117 5.685 18.388 -6.339 211 HD22 LEU 117 HD22 LEU 117 4.413 18.714 -5.162 212 HD23 LEU 117 HD23 LEU 117 6.098 19.039 -4.753 213 H LYS 118 HN LYS 118 8.507 23.386 -6.638 214 HA LYS 118 HA LYS 118 10.793 22.232 -8.018 215 HB2 LYS 118 HB2 LYS 118 9.816 24.151 -8.979 216 HB3 LYS 118 HB1 LYS 118 9.699 24.979 -7.426 217 HG2 LYS 118 HG2 LYS 118 12.095 25.305 -7.346 218 HG3 LYS 118 HG1 LYS 118 12.325 24.301 -8.778 219 HD2 LYS 118 HD2 LYS 118 11.550 25.932 -10.218 220 HD3 LYS 118 HD1 LYS 118 10.492 26.649 -9.002 221 HE2 LYS 118 HE2 LYS 118 12.633 27.392 -7.788 222 HE3 LYS 118 HE1 LYS 118 13.487 26.981 -9.289 223 HZ1 LYS 118 HZ1 LYS 118 11.050 28.664 -9.263 224 HZ2 LYS 118 HZ2 LYS 118 12.176 28.468 -10.521 225 HZ3 LYS 118 HZ3 LYS 118 12.602 29.333 -9.122 226 H ILE 119 HN ILE 119 10.451 24.343 -5.138 227 HA ILE 119 HA ILE 119 13.286 24.306 -4.517 228 HB ILE 119 HB ILE 119 10.760 25.059 -3.024 229 HG12 ILE 119 HG12 ILE 119 12.779 27.088 -3.709 230 HG13 ILE 119 HG11 ILE 119 12.079 26.288 -5.116 231 HG21 ILE 119 HG21 ILE 119 12.258 24.617 -1.264 232 HG22 ILE 119 HG22 ILE 119 12.504 26.336 -1.572 233 HG23 ILE 119 HG23 ILE 119 13.655 25.154 -2.196 234 HD11 ILE 119 HD11 ILE 119 9.903 26.769 -3.416 235 HD12 ILE 119 HD12 ILE 119 10.298 27.651 -4.891 236 HD13 ILE 119 HD13 ILE 119 10.874 28.239 -3.332 237 H MET 120 HN MET 120 10.702 22.081 -3.953 238 HA MET 120 HA MET 120 11.702 20.895 -1.500 239 HB2 MET 120 HB2 MET 120 9.499 20.680 -3.308 240 HB3 MET 120 HB1 MET 120 10.184 19.068 -3.098 241 HG2 MET 120 HG2 MET 120 10.092 19.379 -0.631 242 HG3 MET 120 HG1 MET 120 9.323 20.947 -0.879 243 HE1 MET 120 HE1 MET 120 7.624 16.785 -1.803 244 HE2 MET 120 HE2 MET 120 9.100 17.166 -0.919 245 HE3 MET 120 HE3 MET 120 9.023 17.452 -2.656 246 H LEU 121 HN LEU 121 12.523 20.578 -4.870 247 HA LEU 121 HA LEU 121 13.742 17.935 -4.668 248 HB2 LEU 121 HB2 LEU 121 13.242 20.057 -6.631 249 HB3 LEU 121 HB1 LEU 121 14.788 19.247 -6.878 250 HG LEU 121 HG LEU 121 12.855 18.163 -8.082 251 HD11 LEU 121 HD11 LEU 121 14.763 16.791 -7.706 252 HD12 LEU 121 HD12 LEU 121 13.393 15.834 -7.142 253 HD13 LEU 121 HD13 LEU 121 14.427 16.664 -5.979 254 HD21 LEU 121 HD21 LEU 121 11.604 18.517 -5.595 255 HD22 LEU 121 HD22 LEU 121 11.875 16.779 -5.718 256 HD23 LEU 121 HD23 LEU 121 10.965 17.621 -6.972 257 H GLN 122 HN GLN 122 14.707 21.107 -3.765 258 HA GLN 122 HA GLN 122 17.423 21.326 -4.237 259 HB2 GLN 122 HB2 GLN 122 15.556 22.007 -2.026 260 HB3 GLN 122 HB1 GLN 122 17.276 22.116 -1.649 261 HG2 GLN 122 HG2 GLN 122 16.594 23.267 -4.260 262 HG3 GLN 122 HG1 GLN 122 15.796 24.080 -2.913 263 HE21 GLN 122 HE21 GLN 122 19.040 22.520 -3.013 264 HE22 GLN 122 HE22 GLN 122 19.893 23.925 -2.590 265 H ALA 123 HN ALA 123 15.837 19.012 -2.102 266 HA ALA 123 HA ALA 123 18.083 18.176 -0.562 267 HB1 ALA 123 HB1 ALA 123 16.698 16.124 -0.269 268 HB2 ALA 123 HB2 ALA 123 15.658 16.665 -1.586 269 HB3 ALA 123 HB3 ALA 123 15.745 17.598 -0.092 270 H THR 124 HN THR 124 17.500 17.840 -3.925 271 HA THR 124 HA THR 124 19.658 15.760 -4.088 272 HB THR 124 HB THR 124 17.489 14.752 -4.546 273 HG1 THR 124 HG1 THR 124 19.220 14.189 -5.934 274 HG21 THR 124 HG21 THR 124 16.238 15.730 -6.612 275 HG22 THR 124 HG22 THR 124 17.154 17.197 -6.268 276 HG23 THR 124 HG23 THR 124 16.056 16.539 -5.055 277 H GLY 125 HN GLY 125 19.559 18.819 -4.381 278 HA2 GLY 125 HA2 GLY 125 21.079 20.148 -5.690 279 HA3 GLY 125 HA1 GLY 125 21.070 18.893 -6.929 280 H GLU 126 HN GLU 126 18.056 18.770 -6.741 281 HA GLU 126 HA GLU 126 16.238 19.737 -7.893 282 HB2 GLU 126 HB2 GLU 126 17.179 21.503 -6.075 283 HB3 GLU 126 HB1 GLU 126 17.417 22.445 -7.547 284 HG2 GLU 126 HG2 GLU 126 14.833 21.264 -6.504 285 HG3 GLU 126 HG1 GLU 126 15.210 22.965 -6.779 286 H THR 127 HN THR 127 18.054 18.774 -9.673 287 HA THR 127 HA THR 127 18.542 20.996 -11.622 288 HB THR 127 HB THR 127 20.525 19.762 -10.969 289 HG1 THR 127 HG1 THR 127 20.914 18.644 -13.055 290 HG21 THR 127 HG21 THR 127 18.649 17.494 -11.133 291 HG22 THR 127 HG22 THR 127 20.076 17.705 -10.118 292 HG23 THR 127 HG23 THR 127 20.253 17.162 -11.787 293 H ILE 128 HN ILE 128 16.435 21.039 -12.569 294 HA ILE 128 HA ILE 128 15.780 18.631 -14.223 295 HB ILE 128 HB ILE 128 14.336 18.518 -12.317 296 HG12 ILE 128 HG12 ILE 128 12.786 20.039 -14.435 297 HG13 ILE 128 HG11 ILE 128 13.228 18.338 -14.575 298 HG21 ILE 128 HG21 ILE 128 13.042 20.495 -11.548 299 HG22 ILE 128 HG22 ILE 128 13.861 21.482 -12.759 300 HG23 ILE 128 HG23 ILE 128 14.781 20.764 -11.436 301 HD11 ILE 128 HD11 ILE 128 10.900 19.215 -13.453 302 HD12 ILE 128 HD12 ILE 128 11.927 19.079 -12.026 303 HD13 ILE 128 HD13 ILE 128 11.662 17.674 -13.059 304 H THR 129 HN THR 129 14.132 19.285 -15.977 305 HA THR 129 HA THR 129 15.101 21.619 -17.397 306 HB THR 129 HB THR 129 12.517 20.305 -18.094 307 HG1 THR 129 HG1 THR 129 13.324 18.367 -18.187 308 HG21 THR 129 HG21 THR 129 14.548 20.103 -20.082 309 HG22 THR 129 HG22 THR 129 14.648 21.718 -19.380 310 HG23 THR 129 HG23 THR 129 13.131 21.153 -20.080 311 H GLU 130 HN GLU 130 13.657 23.425 -18.082 312 HA GLU 130 HA GLU 130 12.310 24.664 -15.863 313 HB2 GLU 130 HB2 GLU 130 13.296 26.068 -17.484 314 HB3 GLU 130 HB1 GLU 130 12.598 25.159 -18.824 315 HG2 GLU 130 HG2 GLU 130 10.391 26.011 -18.350 316 HG3 GLU 130 HG1 GLU 130 10.941 26.742 -16.842 317 H ASP 131 HN ASP 131 11.105 23.046 -18.813 318 HA ASP 131 HA ASP 131 8.302 23.478 -18.155 319 HB2 ASP 131 HB2 ASP 131 9.091 23.249 -20.447 320 HB3 ASP 131 HB1 ASP 131 9.768 21.659 -20.091 321 H ASP 132 HN ASP 132 10.651 20.889 -17.593 322 HA ASP 132 HA ASP 132 8.819 18.809 -16.882 323 HB2 ASP 132 HB2 ASP 132 11.692 19.509 -16.408 324 HB3 ASP 132 HB1 ASP 132 10.993 18.195 -15.460 325 H ILE 133 HN ILE 133 9.640 21.736 -15.267 326 HA ILE 133 HA ILE 133 9.436 21.046 -12.529 327 HB ILE 133 HB ILE 133 8.490 23.504 -14.040 328 HG12 ILE 133 HG12 ILE 133 10.818 23.096 -14.504 329 HG13 ILE 133 HG11 ILE 133 10.759 24.362 -13.276 330 HG21 ILE 133 HG21 ILE 133 9.499 23.643 -11.244 331 HG22 ILE 133 HG22 ILE 133 7.889 22.957 -11.466 332 HG23 ILE 133 HG23 ILE 133 8.238 24.591 -12.033 333 HD11 ILE 133 HD11 ILE 133 11.359 21.424 -12.872 334 HD12 ILE 133 HD12 ILE 133 10.991 22.516 -11.537 335 HD13 ILE 133 HD13 ILE 133 12.415 22.797 -12.540 336 H GLU 134 HN GLU 134 6.773 22.669 -14.273 337 HA GLU 134 HA GLU 134 4.739 21.809 -12.460 338 HB2 GLU 134 HB2 GLU 134 4.691 22.723 -15.353 339 HB3 GLU 134 HB1 GLU 134 3.254 22.591 -14.338 340 HG2 GLU 134 HG2 GLU 134 4.264 24.178 -12.723 341 HG3 GLU 134 HG1 GLU 134 5.670 24.338 -13.778 342 H GLU 135 HN GLU 135 6.297 20.172 -15.096 343 HA GLU 135 HA GLU 135 4.294 18.372 -15.968 344 HB2 GLU 135 HB2 GLU 135 7.246 18.548 -15.861 345 HB3 GLU 135 HB1 GLU 135 6.606 16.914 -16.047 346 HG2 GLU 135 HG2 GLU 135 5.062 18.060 -17.860 347 HG3 GLU 135 HG1 GLU 135 6.347 19.268 -17.884 348 H LEU 136 HN LEU 136 6.336 18.289 -13.068 349 HA LEU 136 HA LEU 136 5.545 15.591 -12.293 350 HB2 LEU 136 HB2 LEU 136 6.816 17.894 -10.774 351 HB3 LEU 136 HB1 LEU 136 6.767 16.218 -10.225 352 HG LEU 136 HG LEU 136 7.790 16.407 -12.941 353 HD11 LEU 136 HD11 LEU 136 8.488 18.654 -11.763 354 HD12 LEU 136 HD12 LEU 136 9.696 17.725 -12.650 355 HD13 LEU 136 HD13 LEU 136 9.622 17.621 -10.891 356 HD21 LEU 136 HD21 LEU 136 9.564 15.026 -11.982 357 HD22 LEU 136 HD22 LEU 136 8.005 14.477 -11.366 358 HD23 LEU 136 HD23 LEU 136 9.057 15.462 -10.350 359 H MET 137 HN MET 137 4.190 18.771 -11.915 360 HA MET 137 HA MET 137 2.669 18.356 -9.513 361 HB2 MET 137 HB2 MET 137 3.205 20.380 -11.337 362 HB3 MET 137 HB1 MET 137 1.479 20.086 -11.559 363 HG2 MET 137 HG2 MET 137 2.350 20.143 -8.741 364 HG3 MET 137 HG1 MET 137 2.532 21.677 -9.592 365 HE1 MET 137 HE1 MET 137 -0.769 21.554 -7.343 366 HE2 MET 137 HE2 MET 137 0.525 22.678 -7.750 367 HE3 MET 137 HE3 MET 137 0.922 21.068 -7.157 368 H LYS 138 HN LYS 138 1.846 17.908 -12.969 369 HA LYS 138 HA LYS 138 -0.877 17.206 -12.690 370 HB2 LYS 138 HB2 LYS 138 1.350 16.763 -14.601 371 HB3 LYS 138 HB1 LYS 138 -0.025 15.669 -14.766 372 HG2 LYS 138 HG2 LYS 138 -1.489 17.792 -14.666 373 HG3 LYS 138 HG1 LYS 138 0.005 18.680 -14.970 374 HD2 LYS 138 HD2 LYS 138 0.335 17.034 -16.948 375 HD3 LYS 138 HD1 LYS 138 -1.380 16.674 -16.744 376 HE2 LYS 138 HE2 LYS 138 -2.039 18.857 -17.322 377 HE3 LYS 138 HE1 LYS 138 -0.440 19.536 -16.956 378 HZ1 LYS 138 HZ1 LYS 138 -0.738 19.261 -19.346 379 HZ2 LYS 138 HZ2 LYS 138 -1.042 17.602 -19.133 380 HZ3 LYS 138 HZ3 LYS 138 0.490 18.243 -18.771 381 H ASP 139 HN ASP 139 2.019 15.120 -12.490 382 HA ASP 139 HA ASP 139 0.566 12.658 -12.110 383 HB2 ASP 139 HB2 ASP 139 3.380 13.568 -11.434 384 HB3 ASP 139 HB1 ASP 139 2.844 11.889 -11.358 385 H GLY 140 HN GLY 140 1.478 15.260 -9.957 386 HA2 GLY 140 HA2 GLY 140 0.830 13.577 -7.587 387 HA3 GLY 140 HA1 GLY 140 1.649 15.137 -7.529 388 H ASP 141 HN ASP 141 -0.435 16.132 -9.567 389 HA ASP 141 HA ASP 141 -2.806 16.283 -7.749 390 HB2 ASP 141 HB2 ASP 141 -0.952 18.172 -7.632 391 HB3 ASP 141 HB1 ASP 141 -1.741 18.742 -9.102 392 H LYS 142 HN LYS 142 -3.213 14.714 -9.796 393 HA LYS 142 HA LYS 142 -3.622 15.684 -12.403 394 HB2 LYS 142 HB2 LYS 142 -4.173 13.400 -10.881 395 HB3 LYS 142 HB1 LYS 142 -5.752 13.922 -11.469 396 HG2 LYS 142 HG2 LYS 142 -4.893 13.987 -13.771 397 HG3 LYS 142 HG1 LYS 142 -3.295 13.508 -13.200 398 HD2 LYS 142 HD2 LYS 142 -5.837 11.870 -12.948 399 HD3 LYS 142 HD1 LYS 142 -4.505 11.551 -14.060 400 HE2 LYS 142 HE2 LYS 142 -3.248 11.758 -11.573 401 HE3 LYS 142 HE1 LYS 142 -4.737 10.853 -11.235 402 HZ1 LYS 142 HZ1 LYS 142 -2.646 10.249 -13.245 403 HZ2 LYS 142 HZ2 LYS 142 -4.203 9.574 -13.337 404 HZ3 LYS 142 HZ3 LYS 142 -3.214 9.254 -11.994 405 H ASN 143 HN ASN 143 -5.483 16.270 -9.487 406 HA ASN 143 HA ASN 143 -7.749 17.456 -10.969 407 HB2 ASN 143 HB2 ASN 143 -8.154 16.126 -8.967 408 HB3 ASN 143 HB1 ASN 143 -7.049 17.135 -8.033 409 HD21 ASN 143 HD21 ASN 143 -7.895 19.046 -7.106 410 HD22 ASN 143 HD22 ASN 143 -9.474 19.609 -7.376 411 H ASN 144 HN ASN 144 -4.692 18.455 -9.969 412 HA ASN 144 HA ASN 144 -3.687 20.579 -9.808 413 HB2 ASN 144 HB2 ASN 144 -4.850 20.762 -11.984 414 HB3 ASN 144 HB1 ASN 144 -6.298 21.338 -11.161 415 HD21 ASN 144 HD21 ASN 144 -2.832 22.160 -11.653 416 HD22 ASN 144 HD22 ASN 144 -3.046 23.834 -11.468 417 H ASP 145 HN ASP 145 -6.905 22.003 -9.579 418 HA ASP 145 HA ASP 145 -7.941 23.166 -7.806 419 HB2 ASP 145 HB2 ASP 145 -8.227 21.035 -6.823 420 HB3 ASP 145 HB1 ASP 145 -6.503 20.846 -6.522 421 H GLY 146 HN GLY 146 -4.885 23.584 -8.592 422 HA2 GLY 146 HA2 GLY 146 -3.163 25.024 -7.913 423 HA3 GLY 146 HA1 GLY 146 -4.442 25.936 -7.112 424 H ARG 147 HN ARG 147 -3.994 22.633 -6.152 425 HA ARG 147 HA ARG 147 -2.150 23.275 -3.950 426 HB2 ARG 147 HB2 ARG 147 -4.917 23.745 -3.695 427 HB3 ARG 147 HB1 ARG 147 -4.612 22.250 -2.810 428 HG2 ARG 147 HG2 ARG 147 -3.507 23.336 -1.167 429 HG3 ARG 147 HG1 ARG 147 -2.548 24.260 -2.323 430 HD2 ARG 147 HD2 ARG 147 -4.742 25.626 -2.709 431 HD3 ARG 147 HD1 ARG 147 -5.243 24.936 -1.151 432 HE ARG 147 HE ARG 147 -3.630 26.306 -0.109 433 HH11 ARG 147 HH21 ARG 147 -2.956 25.868 -3.469 434 HH12 ARG 147 HH22 ARG 147 -1.590 26.931 -3.464 435 HH21 ARG 147 HH11 ARG 147 -1.848 27.689 -0.091 436 HH22 ARG 147 HH12 ARG 147 -0.960 27.958 -1.553 437 H ILE 148 HN ILE 148 -1.301 21.379 -3.019 438 HA ILE 148 HA ILE 148 -2.285 18.795 -4.188 439 HB ILE 148 HB ILE 148 0.458 19.780 -3.343 440 HG12 ILE 148 HG12 ILE 148 -0.855 19.102 -5.985 441 HG13 ILE 148 HG11 ILE 148 -0.108 20.625 -5.504 442 HG21 ILE 148 HG21 ILE 148 -0.406 17.196 -3.079 443 HG22 ILE 148 HG22 ILE 148 1.267 17.653 -3.401 444 HG23 ILE 148 HG23 ILE 148 0.209 17.186 -4.732 445 HD11 ILE 148 HD11 ILE 148 1.330 19.255 -7.040 446 HD12 ILE 148 HD12 ILE 148 1.400 18.010 -5.793 447 HD13 ILE 148 HD13 ILE 148 2.096 19.602 -5.490 448 H ASP 149 HN ASP 149 -3.181 17.449 -2.667 449 HA ASP 149 HA ASP 149 -2.618 17.976 0.214 450 HB2 ASP 149 HB2 ASP 149 -4.728 16.910 0.578 451 HB3 ASP 149 HB1 ASP 149 -4.945 17.918 -0.853 452 H TYR 150 HN TYR 150 -3.351 15.452 1.200 453 HA TYR 150 HA TYR 150 -0.861 13.979 0.934 454 HB2 TYR 150 HB2 TYR 150 -2.670 14.304 2.868 455 HB3 TYR 150 HB1 TYR 150 -3.347 12.840 2.154 456 HD1 TYR 150 HD2 TYR 150 -0.620 11.755 1.154 457 HD2 TYR 150 HD1 TYR 150 -1.958 13.265 4.946 458 HE1 TYR 150 HE2 TYR 150 1.102 10.390 2.305 459 HE2 TYR 150 HE1 TYR 150 -0.237 11.901 6.098 460 HH TYR 150 HH TYR 150 1.550 9.447 4.476 461 H ASP 151 HN ASP 151 -4.229 12.861 0.411 462 HA ASP 151 HA ASP 151 -3.802 10.472 -0.897 463 HB2 ASP 151 HB2 ASP 151 -5.929 11.965 -0.351 464 HB3 ASP 151 HB1 ASP 151 -5.774 12.419 -2.049 465 H GLU 152 HN GLU 152 -3.617 13.717 -2.359 466 HA GLU 152 HA GLU 152 -3.070 12.777 -5.046 467 HB2 GLU 152 HB2 GLU 152 -3.152 15.301 -3.490 468 HB3 GLU 152 HB1 GLU 152 -2.117 15.330 -4.917 469 HG2 GLU 152 HG2 GLU 152 -3.917 14.785 -6.368 470 HG3 GLU 152 HG1 GLU 152 -4.948 14.284 -5.027 471 H PHE 153 HN PHE 153 -1.118 13.366 -2.203 472 HA PHE 153 HA PHE 153 1.445 13.677 -3.471 473 HB2 PHE 153 HB2 PHE 153 0.710 14.192 -1.085 474 HB3 PHE 153 HB1 PHE 153 0.807 12.459 -0.771 475 HD1 PHE 153 HD1 PHE 153 2.867 15.178 -2.347 476 HD2 PHE 153 HD2 PHE 153 2.808 11.624 0.065 477 HE1 PHE 153 HE1 PHE 153 5.314 15.376 -1.995 478 HE2 PHE 153 HE2 PHE 153 5.255 11.821 0.417 479 HZ PHE 153 HZ PHE 153 6.508 13.697 -0.614 480 H LEU 154 HN LEU 154 -0.619 10.950 -3.093 481 HA LEU 154 HA LEU 154 1.455 8.897 -3.041 482 HB2 LEU 154 HB2 LEU 154 -1.501 9.140 -3.170 483 HB3 LEU 154 HB1 LEU 154 -0.829 7.665 -3.863 484 HG LEU 154 HG LEU 154 -1.331 7.352 -1.471 485 HD11 LEU 154 HD11 LEU 154 1.259 7.018 -2.720 486 HD12 LEU 154 HD12 LEU 154 0.429 5.952 -1.586 487 HD13 LEU 154 HD13 LEU 154 1.444 7.262 -0.983 488 HD21 LEU 154 HD21 LEU 154 -0.721 9.933 -1.124 489 HD22 LEU 154 HD22 LEU 154 0.853 9.249 -0.717 490 HD23 LEU 154 HD23 LEU 154 -0.580 8.769 0.193 491 H GLU 155 HN GLU 155 -1.063 9.488 -5.518 492 HA GLU 155 HA GLU 155 0.001 8.084 -7.651 493 HB2 GLU 155 HB2 GLU 155 -1.946 10.056 -7.179 494 HB3 GLU 155 HB1 GLU 155 -0.957 10.699 -8.491 495 HG2 GLU 155 HG2 GLU 155 -2.149 9.371 -9.875 496 HG3 GLU 155 HG1 GLU 155 -1.283 8.012 -9.157 497 H PHE 156 HN PHE 156 1.231 11.069 -6.283 498 HA PHE 156 HA PHE 156 2.806 12.004 -8.474 499 HB2 PHE 156 HB2 PHE 156 2.236 13.245 -6.399 500 HB3 PHE 156 HB1 PHE 156 3.282 12.164 -5.479 501 HD1 PHE 156 HD1 PHE 156 3.282 14.592 -8.322 502 HD2 PHE 156 HD2 PHE 156 5.602 12.564 -5.328 503 HE1 PHE 156 HE1 PHE 156 5.244 15.999 -8.888 504 HE2 PHE 156 HE2 PHE 156 7.564 13.972 -5.896 505 HZ PHE 156 HZ PHE 156 7.384 15.689 -7.675 506 H MET 157 HN MET 157 4.028 10.285 -5.565 507 HA MET 157 HA MET 157 6.367 9.356 -7.150 508 HB2 MET 157 HB2 MET 157 7.175 8.736 -4.848 509 HB3 MET 157 HB1 MET 157 6.756 10.443 -5.004 510 HG2 MET 157 HG2 MET 157 4.398 8.973 -4.279 511 HG3 MET 157 HG1 MET 157 5.696 8.558 -3.159 512 HE1 MET 157 HE1 MET 157 7.066 12.172 -2.436 513 HE2 MET 157 HE2 MET 157 7.511 10.704 -3.303 514 HE3 MET 157 HE3 MET 157 7.040 10.609 -1.608 515 H LYS 158 HN LYS 158 3.308 8.234 -6.379 516 HA LYS 158 HA LYS 158 3.394 5.642 -5.481 517 HB2 LYS 158 HB2 LYS 158 1.419 6.901 -6.321 518 HB3 LYS 158 HB1 LYS 158 1.975 6.634 -7.973 519 HG2 LYS 158 HG2 LYS 158 0.597 4.809 -7.820 520 HG3 LYS 158 HG1 LYS 158 2.024 4.087 -7.076 521 HD2 LYS 158 HD2 LYS 158 1.173 4.299 -4.915 522 HD3 LYS 158 HD1 LYS 158 0.082 5.611 -5.365 523 HE2 LYS 158 HE2 LYS 158 -1.266 3.615 -5.031 524 HE3 LYS 158 HE1 LYS 158 -1.195 3.916 -6.779 525 HZ1 LYS 158 HZ1 LYS 158 0.486 2.037 -5.210 526 HZ2 LYS 158 HZ2 LYS 158 0.810 2.463 -6.822 527 HZ3 LYS 158 HZ3 LYS 158 -0.625 1.644 -6.430 528 H GLY 159 HN GLY 159 4.704 6.793 -8.551 529 HA2 GLY 159 HA2 GLY 159 5.406 3.981 -9.269 530 HA3 GLY 159 HA1 GLY 159 5.339 5.319 -10.414 531 H VAL 160 HN VAL 160 6.828 5.686 -7.260 532 HA VAL 160 HA VAL 160 9.480 5.942 -8.638 533 HB VAL 160 HB VAL 160 8.239 7.251 -6.203 534 HG11 VAL 160 HG11 VAL 160 11.093 7.129 -7.146 535 HG12 VAL 160 HG12 VAL 160 10.462 7.014 -5.503 536 HG13 VAL 160 HG13 VAL 160 10.498 8.573 -6.327 537 HG21 VAL 160 HG21 VAL 160 9.478 8.636 -8.567 538 HG22 VAL 160 HG22 VAL 160 8.199 9.202 -7.492 539 HG23 VAL 160 HG23 VAL 160 7.849 7.973 -8.707 540 H GLU 161 HN GLU 161 11.309 4.979 -7.612 541 HA GLU 161 HA GLU 161 10.729 2.603 -6.008 542 HB2 GLU 161 HB2 GLU 161 12.531 3.184 -7.883 543 HB3 GLU 161 HB1 GLU 161 13.482 3.683 -6.483 544 HG2 GLU 161 HG2 GLU 161 14.002 1.375 -6.845 545 HG3 GLU 161 HG1 GLU 161 12.918 1.420 -5.453 546 HO1 KDH 1 H1 KDH 1 7.930 11.025 -11.300 547 H21 KDH 1 H21 KDH 1 13.687 10.373 -4.056 548 H33 KDH 1 H33 KDH 1 9.335 13.718 -6.386 549 H4 KDH 1 H4 KDH 1 8.215 12.042 -7.803 550 HO7 KDH 1 H7 KDH 1 9.973 9.046 -11.578 551 H01 KDH 1 H01 KDH 1 10.614 14.915 -4.538 552 H01A KDH 1 H02 KDH 1 9.704 13.419 -4.087 553 HO03 KDH 1 H03 KDH 1 12.217 15.362 -1.576 554 HO10 KDH 1 H10 KDH 1 12.432 10.130 -11.222 555 H12 KDH 1 H12 KDH 1 12.467 10.884 -7.794 556 H15 KDH 1 H15 KDH 1 9.656 11.512 -5.723 557 H26 KDH 1 H26 KDH 1 13.930 13.808 -1.339 558 H39 KDH 1 H39 KDH 1 12.710 16.430 -8.988 559 H41 KDH 1 H41 KDH 1 10.180 12.917 -9.778 560 HO02 KDH 1 H42 KDH 1 14.809 10.498 -1.829 561 HO44 KDH 1 H44 KDH 1 12.038 11.851 -12.384 562 HO47 KDH 1 H47 KDH 1 12.576 14.476 -13.731 563 HO50 KDH 1 H50 KDH 1 13.648 17.255 -11.326 Start of MODEL 13 1 H1 MET 90 HT1 MET 90 14.453 6.078 3.782 2 H2 MET 90 HT2 MET 90 14.684 6.616 2.187 3 H3 MET 90 HT3 MET 90 13.389 5.581 2.559 4 HA MET 90 HA MET 90 12.541 7.400 4.084 5 HB2 MET 90 HB2 MET 90 14.911 8.403 3.968 6 HB3 MET 90 HB1 MET 90 14.440 9.034 2.389 7 HG2 MET 90 HG2 MET 90 12.337 9.601 4.249 8 HG3 MET 90 HG1 MET 90 13.863 10.133 4.955 9 HE1 MET 90 HE1 MET 90 11.543 11.983 4.341 10 HE2 MET 90 HE2 MET 90 12.245 13.362 3.499 11 HE3 MET 90 HE3 MET 90 13.076 12.671 4.891 12 H GLY 91 HN GLY 91 10.779 8.593 3.171 13 HA2 GLY 91 HA2 GLY 91 9.124 8.989 1.554 14 HA3 GLY 91 HA1 GLY 91 10.471 9.382 0.484 15 H LYS 92 HN LYS 92 8.493 6.690 1.683 16 HA LYS 92 HA LYS 92 8.865 5.337 -0.941 17 HB2 LYS 92 HB2 LYS 92 10.261 4.690 1.435 18 HB3 LYS 92 HB1 LYS 92 9.043 3.432 1.225 19 HG2 LYS 92 HG2 LYS 92 9.997 3.749 -1.341 20 HG3 LYS 92 HG1 LYS 92 11.450 3.991 -0.369 21 HD2 LYS 92 HD2 LYS 92 9.848 1.762 0.615 22 HD3 LYS 92 HD1 LYS 92 10.336 1.531 -1.065 23 HE2 LYS 92 HE2 LYS 92 12.254 2.299 1.165 24 HE3 LYS 92 HE1 LYS 92 12.042 0.649 0.548 25 HZ1 LYS 92 HZ1 LYS 92 12.274 2.033 -1.725 26 HZ2 LYS 92 HZ2 LYS 92 13.585 1.286 -0.944 27 HZ3 LYS 92 HZ3 LYS 92 13.290 2.944 -0.718 28 H SER 93 HN SER 93 7.598 4.160 2.169 29 HA SER 93 HA SER 93 4.908 3.891 0.871 30 HB2 SER 93 HB2 SER 93 6.244 2.355 3.122 31 HB3 SER 93 HB1 SER 93 4.636 2.020 2.485 32 HG SER 93 HG SER 93 6.869 2.149 0.773 33 H GLU 94 HN GLU 94 3.063 4.050 2.480 34 HA GLU 94 HA GLU 94 2.752 6.475 3.723 35 HB2 GLU 94 HB2 GLU 94 1.621 3.792 3.919 36 HB3 GLU 94 HB1 GLU 94 1.461 4.686 5.431 37 HG2 GLU 94 HG2 GLU 94 -0.221 5.886 4.546 38 HG3 GLU 94 HG1 GLU 94 0.869 6.483 3.294 39 H GLU 95 HN GLU 95 4.568 3.730 4.990 40 HA GLU 95 HA GLU 95 4.834 4.303 7.703 41 HB2 GLU 95 HB2 GLU 95 6.280 2.939 5.601 42 HB3 GLU 95 HB1 GLU 95 7.420 3.706 6.708 43 HG2 GLU 95 HG2 GLU 95 5.094 2.045 7.693 44 HG3 GLU 95 HG1 GLU 95 6.667 1.337 7.327 45 H GLU 96 HN GLU 96 7.201 5.467 5.274 46 HA GLU 96 HA GLU 96 7.912 7.719 7.071 47 HB2 GLU 96 HB2 GLU 96 9.736 7.989 5.378 48 HB3 GLU 96 HB1 GLU 96 9.671 6.354 6.039 49 HG2 GLU 96 HG2 GLU 96 7.902 6.459 3.801 50 HG3 GLU 96 HG1 GLU 96 9.442 7.163 3.305 51 H LEU 97 HN LEU 97 6.011 7.054 4.264 52 HA LEU 97 HA LEU 97 6.023 9.378 2.738 53 HB2 LEU 97 HB2 LEU 97 4.387 7.128 3.201 54 HB3 LEU 97 HB1 LEU 97 3.318 8.521 3.340 55 HG LEU 97 HG LEU 97 3.544 7.593 0.998 56 HD11 LEU 97 HD11 LEU 97 4.629 10.404 1.178 57 HD12 LEU 97 HD12 LEU 97 2.978 10.023 1.668 58 HD13 LEU 97 HD13 LEU 97 3.491 9.739 0.005 59 HD21 LEU 97 HD21 LEU 97 6.234 8.939 0.927 60 HD22 LEU 97 HD22 LEU 97 5.570 7.727 -0.168 61 HD23 LEU 97 HD23 LEU 97 6.115 7.256 1.442 62 H SER 98 HN SER 98 4.305 8.852 5.827 63 HA SER 98 HA SER 98 2.938 11.326 5.999 64 HB2 SER 98 HB2 SER 98 2.488 10.575 8.133 65 HB3 SER 98 HB1 SER 98 3.142 9.079 7.473 66 HG SER 98 HG SER 98 4.777 9.279 8.770 67 H ASP 99 HN ASP 99 6.302 10.501 6.781 68 HA ASP 99 HA ASP 99 6.887 13.111 7.967 69 HB2 ASP 99 HB2 ASP 99 8.494 10.708 7.064 70 HB3 ASP 99 HB1 ASP 99 9.254 12.139 7.762 71 H LEU 100 HN LEU 100 7.044 11.655 4.771 72 HA LEU 100 HA LEU 100 8.877 13.438 3.507 73 HB2 LEU 100 HB2 LEU 100 7.119 11.311 2.860 74 HB3 LEU 100 HB1 LEU 100 6.691 12.646 1.789 75 HG LEU 100 HG LEU 100 9.457 11.466 2.173 76 HD11 LEU 100 HD11 LEU 100 9.231 10.687 -0.090 77 HD12 LEU 100 HD12 LEU 100 7.733 11.592 -0.314 78 HD13 LEU 100 HD13 LEU 100 7.767 10.195 0.763 79 HD21 LEU 100 HD21 LEU 100 10.089 13.066 0.357 80 HD22 LEU 100 HD22 LEU 100 9.605 13.883 1.843 81 HD23 LEU 100 HD23 LEU 100 8.487 13.792 0.482 82 H PHE 101 HN PHE 101 5.286 13.557 3.477 83 HA PHE 101 HA PHE 101 4.891 15.993 2.181 84 HB2 PHE 101 HB2 PHE 101 3.243 14.268 3.153 85 HB3 PHE 101 HB1 PHE 101 3.398 15.149 4.674 86 HD1 PHE 101 HD2 PHE 101 3.052 16.060 1.042 87 HD2 PHE 101 HD1 PHE 101 1.683 16.662 5.069 88 HE1 PHE 101 HE2 PHE 101 1.421 17.744 0.235 89 HE2 PHE 101 HE1 PHE 101 0.051 18.346 4.262 90 HZ PHE 101 HZ PHE 101 -0.080 18.888 1.846 91 H ARG 102 HN ARG 102 5.669 15.478 5.627 92 HA ARG 102 HA ARG 102 5.421 18.047 6.667 93 HB2 ARG 102 HB2 ARG 102 6.941 15.612 7.163 94 HB3 ARG 102 HB1 ARG 102 7.839 17.044 7.669 95 HG2 ARG 102 HG2 ARG 102 6.131 17.732 9.154 96 HG3 ARG 102 HG1 ARG 102 4.936 16.674 8.403 97 HD2 ARG 102 HD2 ARG 102 5.517 15.506 10.379 98 HD3 ARG 102 HD1 ARG 102 6.551 14.743 9.154 99 HE ARG 102 HE ARG 102 7.872 17.058 10.223 100 HH11 ARG 102 HH21 ARG 102 6.924 13.823 10.980 101 HH12 ARG 102 HH22 ARG 102 8.220 13.568 12.099 102 HH21 ARG 102 HH11 ARG 102 9.568 16.735 11.680 103 HH22 ARG 102 HH12 ARG 102 9.716 15.213 12.494 104 H MET 103 HN MET 103 8.550 16.803 5.423 105 HA MET 103 HA MET 103 9.687 19.452 5.167 106 HB2 MET 103 HB2 MET 103 10.386 16.643 4.330 107 HB3 MET 103 HB1 MET 103 11.376 17.998 3.785 108 HG2 MET 103 HG2 MET 103 10.858 18.333 6.581 109 HG3 MET 103 HG1 MET 103 11.443 16.689 6.317 110 HE1 MET 103 HE1 MET 103 11.909 20.385 6.003 111 HE2 MET 103 HE2 MET 103 12.209 20.060 4.298 112 HE3 MET 103 HE3 MET 103 13.519 20.647 5.319 113 H PHE 104 HN PHE 104 7.804 17.389 3.060 114 HA PHE 104 HA PHE 104 8.495 18.374 0.501 115 HB2 PHE 104 HB2 PHE 104 6.680 16.637 1.617 116 HB3 PHE 104 HB1 PHE 104 5.626 17.923 1.029 117 HD1 PHE 104 HD2 PHE 104 7.037 18.892 -1.349 118 HD2 PHE 104 HD1 PHE 104 6.489 14.876 0.072 119 HE1 PHE 104 HE2 PHE 104 7.282 18.039 -3.665 120 HE2 PHE 104 HE1 PHE 104 6.733 14.023 -2.244 121 HZ PHE 104 HZ PHE 104 7.129 15.605 -4.112 122 H ASP 105 HN ASP 105 6.458 19.792 3.023 123 HA ASP 105 HA ASP 105 5.502 21.959 1.276 124 HB2 ASP 105 HB2 ASP 105 4.360 20.744 3.291 125 HB3 ASP 105 HB1 ASP 105 5.320 21.842 4.283 126 H LYS 106 HN LYS 106 8.027 22.389 0.906 127 HA LYS 106 HA LYS 106 9.786 23.496 2.730 128 HB2 LYS 106 HB2 LYS 106 10.164 23.208 0.301 129 HB3 LYS 106 HB1 LYS 106 9.056 24.542 -0.028 130 HG2 LYS 106 HG2 LYS 106 10.991 25.767 -0.019 131 HG3 LYS 106 HG1 LYS 106 10.720 25.758 1.724 132 HD2 LYS 106 HD2 LYS 106 12.179 23.434 0.551 133 HD3 LYS 106 HD1 LYS 106 13.045 24.966 0.662 134 HE2 LYS 106 HE2 LYS 106 12.301 25.067 3.109 135 HE3 LYS 106 HE1 LYS 106 11.802 23.375 2.922 136 HZ1 LYS 106 HZ1 LYS 106 14.314 24.154 3.501 137 HZ2 LYS 106 HZ2 LYS 106 14.398 23.993 1.811 138 HZ3 LYS 106 HZ3 LYS 106 13.914 22.677 2.772 139 H ASN 107 HN ASN 107 6.770 24.875 1.582 140 HA ASN 107 HA ASN 107 7.316 27.531 2.746 141 HB2 ASN 107 HB2 ASN 107 6.082 27.326 0.659 142 HB3 ASN 107 HB1 ASN 107 4.928 26.221 1.407 143 HD21 ASN 107 HD21 ASN 107 3.165 27.767 0.902 144 HD22 ASN 107 HD22 ASN 107 2.966 29.170 1.836 145 H ALA 108 HN ALA 108 5.754 24.536 3.647 146 HA ALA 108 HA ALA 108 4.749 23.885 5.685 147 HB1 ALA 108 HB1 ALA 108 5.681 26.535 6.778 148 HB2 ALA 108 HB2 ALA 108 6.852 25.286 6.354 149 HB3 ALA 108 HB3 ALA 108 5.629 24.968 7.585 150 H ASP 109 HN ASP 109 2.604 24.202 4.682 151 HA ASP 109 HA ASP 109 1.041 26.280 6.080 152 HB2 ASP 109 HB2 ASP 109 0.262 27.311 4.015 153 HB3 ASP 109 HB1 ASP 109 2.026 27.323 4.012 154 H GLY 110 HN GLY 110 1.269 23.197 5.500 155 HA2 GLY 110 HA2 GLY 110 -0.410 21.532 5.745 156 HA3 GLY 110 HA1 GLY 110 -1.637 22.768 5.468 157 H TYR 111 HN TYR 111 0.440 23.313 3.027 158 HA TYR 111 HA TYR 111 -0.482 21.109 1.260 159 HB2 TYR 111 HB2 TYR 111 -1.089 24.040 0.756 160 HB3 TYR 111 HB1 TYR 111 -1.593 22.678 -0.245 161 HD1 TYR 111 HD2 TYR 111 -3.259 21.038 0.606 162 HD2 TYR 111 HD1 TYR 111 -2.223 24.573 2.816 163 HE1 TYR 111 HE2 TYR 111 -5.277 20.747 2.017 164 HE2 TYR 111 HE1 TYR 111 -4.241 24.281 4.228 165 HH TYR 111 HH TYR 111 -6.283 21.413 3.941 166 H ILE 112 HN ILE 112 0.486 21.454 -1.009 167 HA ILE 112 HA ILE 112 3.181 22.755 -0.761 168 HB ILE 112 HB ILE 112 2.227 20.290 -2.252 169 HG12 ILE 112 HG12 ILE 112 3.985 20.751 0.170 170 HG13 ILE 112 HG11 ILE 112 2.498 19.807 0.080 171 HG21 ILE 112 HG21 ILE 112 4.465 20.025 -3.066 172 HG22 ILE 112 HG22 ILE 112 5.057 21.347 -2.060 173 HG23 ILE 112 HG23 ILE 112 4.002 21.687 -3.432 174 HD11 ILE 112 HD11 ILE 112 5.219 18.980 -0.488 175 HD12 ILE 112 HD12 ILE 112 4.178 18.712 -1.887 176 HD13 ILE 112 HD13 ILE 112 3.766 17.993 -0.330 177 H ASP 113 HN ASP 113 3.634 24.307 -2.290 178 HA ASP 113 HA ASP 113 1.607 24.862 -4.379 179 HB2 ASP 113 HB2 ASP 113 2.564 26.603 -2.847 180 HB3 ASP 113 HB1 ASP 113 4.143 26.328 -3.583 181 H LEU 114 HN LEU 114 2.205 25.028 -6.632 182 HA LEU 114 HA LEU 114 3.807 22.988 -7.717 183 HB2 LEU 114 HB2 LEU 114 2.822 25.670 -8.678 184 HB3 LEU 114 HB1 LEU 114 3.770 24.631 -9.742 185 HG LEU 114 HG LEU 114 1.813 22.984 -8.508 186 HD11 LEU 114 HD11 LEU 114 0.558 25.043 -8.008 187 HD12 LEU 114 HD12 LEU 114 -0.262 24.107 -9.258 188 HD13 LEU 114 HD13 LEU 114 0.676 25.534 -9.697 189 HD21 LEU 114 HD21 LEU 114 1.012 23.519 -11.139 190 HD22 LEU 114 HD22 LEU 114 2.102 22.234 -10.619 191 HD23 LEU 114 HD23 LEU 114 2.755 23.786 -11.144 192 H ASP 115 HN ASP 115 4.764 26.110 -6.470 193 HA ASP 115 HA ASP 115 7.416 26.045 -7.759 194 HB2 ASP 115 HB2 ASP 115 5.974 27.850 -5.804 195 HB3 ASP 115 HB1 ASP 115 7.647 28.134 -6.286 196 H GLU 116 HN GLU 116 5.999 24.753 -4.916 197 HA GLU 116 HA GLU 116 8.541 24.772 -3.385 198 HB2 GLU 116 HB2 GLU 116 5.767 23.681 -2.811 199 HB3 GLU 116 HB1 GLU 116 7.088 23.757 -1.644 200 HG2 GLU 116 HG2 GLU 116 7.148 26.183 -1.794 201 HG3 GLU 116 HG1 GLU 116 5.938 26.167 -3.078 202 H LEU 117 HN LEU 117 7.058 22.847 -5.734 203 HA LEU 117 HA LEU 117 8.016 20.259 -4.677 204 HB2 LEU 117 HB2 LEU 117 6.708 21.101 -7.287 205 HB3 LEU 117 HB1 LEU 117 6.959 19.433 -6.770 206 HG LEU 117 HG LEU 117 5.614 21.125 -4.767 207 HD11 LEU 117 HD11 LEU 117 4.014 21.990 -6.094 208 HD12 LEU 117 HD12 LEU 117 3.547 20.353 -6.554 209 HD13 LEU 117 HD13 LEU 117 4.743 21.231 -7.508 210 HD21 LEU 117 HD21 LEU 117 5.599 18.856 -4.247 211 HD22 LEU 117 HD22 LEU 117 5.422 18.367 -5.932 212 HD23 LEU 117 HD23 LEU 117 4.037 19.013 -5.051 213 H LYS 118 HN LYS 118 9.246 22.842 -6.567 214 HA LYS 118 HA LYS 118 11.137 21.139 -8.089 215 HB2 LYS 118 HB2 LYS 118 11.756 23.394 -9.038 216 HB3 LYS 118 HB1 LYS 118 10.047 22.993 -9.215 217 HG2 LYS 118 HG2 LYS 118 9.376 24.535 -7.626 218 HG3 LYS 118 HG1 LYS 118 10.903 24.451 -6.748 219 HD2 LYS 118 HD2 LYS 118 11.709 26.215 -7.886 220 HD3 LYS 118 HD1 LYS 118 11.374 25.420 -9.424 221 HE2 LYS 118 HE2 LYS 118 9.167 26.317 -9.532 222 HE3 LYS 118 HE1 LYS 118 9.200 26.797 -7.823 223 HZ1 LYS 118 HZ1 LYS 118 9.784 28.756 -8.847 224 HZ2 LYS 118 HZ2 LYS 118 10.618 27.985 -10.111 225 HZ3 LYS 118 HZ3 LYS 118 11.314 28.082 -8.564 226 H ILE 119 HN ILE 119 11.030 22.847 -5.103 227 HA ILE 119 HA ILE 119 13.943 23.341 -5.000 228 HB ILE 119 HB ILE 119 11.582 23.777 -3.160 229 HG12 ILE 119 HG12 ILE 119 13.366 25.987 -3.967 230 HG13 ILE 119 HG11 ILE 119 12.507 25.220 -5.303 231 HG21 ILE 119 HG21 ILE 119 13.864 25.180 -2.222 232 HG22 ILE 119 HG22 ILE 119 14.359 23.503 -2.452 233 HG23 ILE 119 HG23 ILE 119 12.990 23.883 -1.407 234 HD11 ILE 119 HD11 ILE 119 10.775 26.561 -4.721 235 HD12 ILE 119 HD12 ILE 119 11.465 26.909 -3.136 236 HD13 ILE 119 HD13 ILE 119 10.536 25.431 -3.388 237 H MET 120 HN MET 120 11.557 21.102 -3.622 238 HA MET 120 HA MET 120 13.334 19.868 -1.713 239 HB2 MET 120 HB2 MET 120 10.710 19.877 -2.073 240 HB3 MET 120 HB1 MET 120 11.051 18.436 -3.033 241 HG2 MET 120 HG2 MET 120 12.499 18.428 -0.500 242 HG3 MET 120 HG1 MET 120 10.754 18.521 -0.264 243 HE1 MET 120 HE1 MET 120 9.289 15.578 -0.635 244 HE2 MET 120 HE2 MET 120 9.194 16.212 -2.275 245 HE3 MET 120 HE3 MET 120 9.189 17.323 -0.908 246 H LEU 121 HN LEU 121 13.104 19.650 -5.142 247 HA LEU 121 HA LEU 121 14.094 16.918 -5.413 248 HB2 LEU 121 HB2 LEU 121 13.978 19.280 -7.319 249 HB3 LEU 121 HB1 LEU 121 14.262 17.603 -7.791 250 HG LEU 121 HG LEU 121 11.768 18.728 -6.488 251 HD11 LEU 121 HD11 LEU 121 10.686 18.032 -8.559 252 HD12 LEU 121 HD12 LEU 121 12.196 17.337 -9.150 253 HD13 LEU 121 HD13 LEU 121 12.049 19.083 -8.947 254 HD21 LEU 121 HD21 LEU 121 12.648 15.886 -7.045 255 HD22 LEU 121 HD22 LEU 121 10.954 16.325 -6.822 256 HD23 LEU 121 HD23 LEU 121 12.109 16.572 -5.512 257 H GLN 122 HN GLN 122 15.540 20.001 -4.785 258 HA GLN 122 HA GLN 122 18.065 19.878 -5.976 259 HB2 GLN 122 HB2 GLN 122 16.913 20.912 -3.423 260 HB3 GLN 122 HB1 GLN 122 18.671 20.902 -3.571 261 HG2 GLN 122 HG2 GLN 122 18.193 21.974 -5.925 262 HG3 GLN 122 HG1 GLN 122 16.645 22.406 -5.199 263 HE21 GLN 122 HE21 GLN 122 16.688 24.427 -4.222 264 HE22 GLN 122 HE22 GLN 122 18.053 25.142 -3.510 265 H ALA 123 HN ALA 123 16.799 17.927 -3.338 266 HA ALA 123 HA ALA 123 19.235 16.927 -2.252 267 HB1 ALA 123 HB1 ALA 123 16.479 16.588 -1.952 268 HB2 ALA 123 HB2 ALA 123 17.729 15.784 -1.002 269 HB3 ALA 123 HB3 ALA 123 17.056 14.990 -2.425 270 H THR 124 HN THR 124 17.776 16.409 -5.326 271 HA THR 124 HA THR 124 19.598 14.075 -5.823 272 HB THR 124 HB THR 124 17.858 13.350 -7.432 273 HG1 THR 124 HG1 THR 124 16.098 15.258 -6.438 274 HG21 THR 124 HG21 THR 124 17.720 13.268 -4.665 275 HG22 THR 124 HG22 THR 124 16.729 12.317 -5.771 276 HG23 THR 124 HG23 THR 124 16.119 13.843 -5.132 277 H GLY 125 HN GLY 125 19.678 17.209 -6.241 278 HA2 GLY 125 HA2 GLY 125 21.219 18.248 -7.817 279 HA3 GLY 125 HA1 GLY 125 20.784 17.014 -8.999 280 H GLU 126 HN GLU 126 17.870 17.447 -8.067 281 HA GLU 126 HA GLU 126 16.050 18.589 -9.085 282 HB2 GLU 126 HB2 GLU 126 16.654 19.997 -7.186 283 HB3 GLU 126 HB1 GLU 126 17.919 20.783 -8.131 284 HG2 GLU 126 HG2 GLU 126 15.538 20.999 -9.648 285 HG3 GLU 126 HG1 GLU 126 15.117 21.431 -7.990 286 H THR 127 HN THR 127 17.740 17.702 -11.108 287 HA THR 127 HA THR 127 18.070 20.084 -12.897 288 HB THR 127 HB THR 127 19.788 18.794 -13.975 289 HG1 THR 127 HG1 THR 127 19.187 16.583 -12.344 290 HG21 THR 127 HG21 THR 127 20.088 19.638 -11.487 291 HG22 THR 127 HG22 THR 127 21.338 18.660 -12.256 292 HG23 THR 127 HG23 THR 127 20.193 17.911 -11.143 293 H ILE 128 HN ILE 128 15.888 20.115 -13.674 294 HA ILE 128 HA ILE 128 15.218 17.830 -15.482 295 HB ILE 128 HB ILE 128 12.826 18.205 -14.631 296 HG12 ILE 128 HG12 ILE 128 14.355 19.623 -12.427 297 HG13 ILE 128 HG11 ILE 128 13.295 20.418 -13.593 298 HG21 ILE 128 HG21 ILE 128 13.781 17.211 -12.228 299 HG22 ILE 128 HG22 ILE 128 15.095 16.868 -13.354 300 HG23 ILE 128 HG23 ILE 128 13.473 16.258 -13.679 301 HD11 ILE 128 HD11 ILE 128 11.439 18.888 -12.799 302 HD12 ILE 128 HD12 ILE 128 11.998 20.053 -11.598 303 HD13 ILE 128 HD13 ILE 128 12.516 18.370 -11.502 304 H THR 129 HN THR 129 13.430 18.537 -17.059 305 HA THR 129 HA THR 129 14.177 20.888 -18.475 306 HB THR 129 HB THR 129 11.379 19.941 -18.704 307 HG1 THR 129 HG1 THR 129 12.086 17.905 -19.473 308 HG21 THR 129 HG21 THR 129 11.839 20.035 -20.994 309 HG22 THR 129 HG22 THR 129 13.557 19.711 -20.761 310 HG23 THR 129 HG23 THR 129 12.895 21.295 -20.355 311 H GLU 130 HN GLU 130 12.710 22.813 -18.844 312 HA GLU 130 HA GLU 130 12.043 24.103 -16.347 313 HB2 GLU 130 HB2 GLU 130 11.206 25.868 -17.938 314 HB3 GLU 130 HB1 GLU 130 12.842 25.314 -18.300 315 HG2 GLU 130 HG2 GLU 130 12.186 24.171 -20.201 316 HG3 GLU 130 HG1 GLU 130 10.553 23.889 -19.595 317 H ASP 131 HN ASP 131 10.202 22.242 -18.689 318 HA ASP 131 HA ASP 131 7.601 23.108 -17.591 319 HB2 ASP 131 HB2 ASP 131 8.679 21.516 -19.861 320 HB3 ASP 131 HB1 ASP 131 7.068 21.074 -19.295 321 H ASP 132 HN ASP 132 9.816 20.371 -17.355 322 HA ASP 132 HA ASP 132 8.061 18.433 -16.224 323 HB2 ASP 132 HB2 ASP 132 10.780 18.756 -16.846 324 HB3 ASP 132 HB1 ASP 132 10.752 18.416 -15.115 325 H ILE 133 HN ILE 133 9.203 21.407 -14.935 326 HA ILE 133 HA ILE 133 9.432 20.897 -12.166 327 HB ILE 133 HB ILE 133 8.273 23.261 -13.678 328 HG12 ILE 133 HG12 ILE 133 10.577 22.590 -14.335 329 HG13 ILE 133 HG11 ILE 133 10.556 24.153 -13.518 330 HG21 ILE 133 HG21 ILE 133 8.923 22.788 -10.806 331 HG22 ILE 133 HG22 ILE 133 7.688 23.823 -11.523 332 HG23 ILE 133 HG23 ILE 133 9.370 24.353 -11.485 333 HD11 ILE 133 HD11 ILE 133 12.122 23.293 -12.134 334 HD12 ILE 133 HD12 ILE 133 11.820 21.647 -12.692 335 HD13 ILE 133 HD13 ILE 133 10.813 22.348 -11.426 336 H GLU 134 HN GLU 134 6.500 22.261 -13.723 337 HA GLU 134 HA GLU 134 4.822 21.470 -11.471 338 HB2 GLU 134 HB2 GLU 134 3.041 22.383 -13.017 339 HB3 GLU 134 HB1 GLU 134 4.379 23.495 -12.728 340 HG2 GLU 134 HG2 GLU 134 5.116 21.865 -14.935 341 HG3 GLU 134 HG1 GLU 134 3.466 22.418 -15.225 342 H GLU 135 HN GLU 135 5.866 19.965 -14.412 343 HA GLU 135 HA GLU 135 3.718 18.267 -15.082 344 HB2 GLU 135 HB2 GLU 135 5.768 18.466 -16.384 345 HB3 GLU 135 HB1 GLU 135 6.719 17.809 -15.052 346 HG2 GLU 135 HG2 GLU 135 6.084 15.658 -15.482 347 HG3 GLU 135 HG1 GLU 135 4.450 16.128 -15.951 348 H LEU 136 HN LEU 136 6.007 18.070 -12.403 349 HA LEU 136 HA LEU 136 5.365 15.359 -11.607 350 HB2 LEU 136 HB2 LEU 136 6.557 17.759 -10.180 351 HB3 LEU 136 HB1 LEU 136 6.541 16.126 -9.515 352 HG LEU 136 HG LEU 136 7.637 16.539 -12.272 353 HD11 LEU 136 HD11 LEU 136 8.675 18.289 -10.799 354 HD12 LEU 136 HD12 LEU 136 9.830 17.096 -11.391 355 HD13 LEU 136 HD13 LEU 136 9.233 16.998 -9.735 356 HD21 LEU 136 HD21 LEU 136 7.656 14.525 -10.129 357 HD22 LEU 136 HD22 LEU 136 9.245 14.808 -10.841 358 HD23 LEU 136 HD23 LEU 136 7.894 14.320 -11.864 359 H MET 137 HN MET 137 3.854 18.465 -11.136 360 HA MET 137 HA MET 137 2.322 17.727 -8.765 361 HB2 MET 137 HB2 MET 137 3.050 20.038 -10.009 362 HB3 MET 137 HB1 MET 137 1.389 19.879 -10.580 363 HG2 MET 137 HG2 MET 137 1.364 19.232 -7.819 364 HG3 MET 137 HG1 MET 137 2.319 20.704 -7.986 365 HE1 MET 137 HE1 MET 137 -0.860 21.601 -6.552 366 HE2 MET 137 HE2 MET 137 0.079 22.931 -7.226 367 HE3 MET 137 HE3 MET 137 0.908 21.549 -6.515 368 H LYS 138 HN LYS 138 1.929 17.357 -12.220 369 HA LYS 138 HA LYS 138 -0.786 17.227 -12.687 370 HB2 LYS 138 HB2 LYS 138 1.640 15.835 -13.608 371 HB3 LYS 138 HB1 LYS 138 0.153 14.930 -13.896 372 HG2 LYS 138 HG2 LYS 138 -0.345 17.665 -14.553 373 HG3 LYS 138 HG1 LYS 138 1.154 17.180 -15.347 374 HD2 LYS 138 HD2 LYS 138 -0.500 14.985 -15.728 375 HD3 LYS 138 HD1 LYS 138 -1.599 16.354 -15.907 376 HE2 LYS 138 HE2 LYS 138 -0.618 15.851 -18.091 377 HE3 LYS 138 HE1 LYS 138 0.072 17.380 -17.512 378 HZ1 LYS 138 HZ1 LYS 138 2.012 16.311 -17.873 379 HZ2 LYS 138 HZ2 LYS 138 1.319 14.764 -17.762 380 HZ3 LYS 138 HZ3 LYS 138 1.701 15.630 -16.351 381 H ASP 139 HN ASP 139 1.163 14.737 -11.030 382 HA ASP 139 HA ASP 139 -1.194 13.052 -10.527 383 HB2 ASP 139 HB2 ASP 139 1.514 12.667 -10.797 384 HB3 ASP 139 HB1 ASP 139 1.318 12.586 -9.046 385 H GLY 140 HN GLY 140 1.008 15.120 -8.616 386 HA2 GLY 140 HA2 GLY 140 -0.236 14.635 -6.083 387 HA3 GLY 140 HA1 GLY 140 0.746 16.049 -6.475 388 H ASP 141 HN ASP 141 -1.103 16.642 -8.794 389 HA ASP 141 HA ASP 141 -3.524 17.547 -7.285 390 HB2 ASP 141 HB2 ASP 141 -1.367 19.146 -7.799 391 HB3 ASP 141 HB1 ASP 141 -2.338 19.428 -9.245 392 H LYS 142 HN LYS 142 -3.602 15.368 -8.987 393 HA LYS 142 HA LYS 142 -3.972 15.690 -11.734 394 HB2 LYS 142 HB2 LYS 142 -5.256 14.025 -9.585 395 HB3 LYS 142 HB1 LYS 142 -5.838 13.893 -11.244 396 HG2 LYS 142 HG2 LYS 142 -3.271 13.677 -11.809 397 HG3 LYS 142 HG1 LYS 142 -3.150 13.183 -10.120 398 HD2 LYS 142 HD2 LYS 142 -4.719 11.381 -10.459 399 HD3 LYS 142 HD1 LYS 142 -5.093 11.946 -12.088 400 HE2 LYS 142 HE2 LYS 142 -2.218 11.494 -11.670 401 HE3 LYS 142 HE1 LYS 142 -3.197 10.024 -11.496 402 HZ1 LYS 142 HZ1 LYS 142 -2.532 10.647 -13.845 403 HZ2 LYS 142 HZ2 LYS 142 -3.615 11.950 -13.707 404 HZ3 LYS 142 HZ3 LYS 142 -4.182 10.353 -13.585 405 H ASN 143 HN ASN 143 -5.960 16.919 -9.139 406 HA ASN 143 HA ASN 143 -8.268 17.477 -10.889 407 HB2 ASN 143 HB2 ASN 143 -8.791 16.860 -8.666 408 HB3 ASN 143 HB1 ASN 143 -7.521 17.881 -7.993 409 HD21 ASN 143 HD21 ASN 143 -8.528 19.548 -6.865 410 HD22 ASN 143 HD22 ASN 143 -9.850 20.448 -7.434 411 H ASN 144 HN ASN 144 -5.309 18.862 -10.648 412 HA ASN 144 HA ASN 144 -4.466 21.066 -10.924 413 HB2 ASN 144 HB2 ASN 144 -5.797 20.205 -13.036 414 HB3 ASN 144 HB1 ASN 144 -6.929 21.484 -12.593 415 HD21 ASN 144 HD21 ASN 144 -5.901 23.731 -12.305 416 HD22 ASN 144 HD22 ASN 144 -4.585 24.129 -13.302 417 H ASP 145 HN ASP 145 -5.490 21.237 -8.513 418 HA ASP 145 HA ASP 145 -7.546 23.414 -8.509 419 HB2 ASP 145 HB2 ASP 145 -8.357 21.693 -7.181 420 HB3 ASP 145 HB1 ASP 145 -6.746 21.157 -6.713 421 H GLY 146 HN GLY 146 -4.216 22.830 -8.112 422 HA2 GLY 146 HA2 GLY 146 -2.545 24.472 -7.689 423 HA3 GLY 146 HA1 GLY 146 -3.807 25.576 -7.141 424 H ARG 147 HN ARG 147 -4.153 22.516 -5.733 425 HA ARG 147 HA ARG 147 -2.473 23.245 -3.373 426 HB2 ARG 147 HB2 ARG 147 -5.365 23.368 -3.664 427 HB3 ARG 147 HB1 ARG 147 -4.905 22.269 -2.363 428 HG2 ARG 147 HG2 ARG 147 -3.877 23.939 -1.125 429 HG3 ARG 147 HG1 ARG 147 -3.524 24.919 -2.548 430 HD2 ARG 147 HD2 ARG 147 -6.376 24.448 -1.657 431 HD3 ARG 147 HD1 ARG 147 -5.403 25.777 -0.993 432 HE ARG 147 HE ARG 147 -5.299 25.599 -3.911 433 HH11 ARG 147 HH21 ARG 147 -6.939 26.833 -1.132 434 HH12 ARG 147 HH22 ARG 147 -7.629 28.177 -1.978 435 HH21 ARG 147 HH11 ARG 147 -6.192 27.347 -5.022 436 HH22 ARG 147 HH12 ARG 147 -7.207 28.468 -4.178 437 H ILE 148 HN ILE 148 -1.644 21.436 -2.311 438 HA ILE 148 HA ILE 148 -2.476 18.754 -3.376 439 HB ILE 148 HB ILE 148 0.217 19.523 -2.228 440 HG12 ILE 148 HG12 ILE 148 -0.793 19.769 -5.076 441 HG13 ILE 148 HG11 ILE 148 -0.132 21.053 -4.063 442 HG21 ILE 148 HG21 ILE 148 0.951 17.608 -3.643 443 HG22 ILE 148 HG22 ILE 148 -0.729 17.337 -4.105 444 HG23 ILE 148 HG23 ILE 148 -0.231 17.129 -2.426 445 HD11 ILE 148 HD11 ILE 148 1.904 19.236 -3.984 446 HD12 ILE 148 HD12 ILE 148 1.819 20.570 -5.134 447 HD13 ILE 148 HD13 ILE 148 1.273 18.962 -5.608 448 H ASP 149 HN ASP 149 -3.905 18.138 -1.696 449 HA ASP 149 HA ASP 149 -3.266 18.600 1.118 450 HB2 ASP 149 HB2 ASP 149 -5.383 17.519 1.474 451 HB3 ASP 149 HB1 ASP 149 -5.557 18.463 -0.006 452 H TYR 150 HN TYR 150 -3.881 16.215 2.353 453 HA TYR 150 HA TYR 150 -1.419 14.668 1.964 454 HB2 TYR 150 HB2 TYR 150 -2.637 15.356 4.137 455 HB3 TYR 150 HB1 TYR 150 -3.757 14.044 3.773 456 HD1 TYR 150 HD1 TYR 150 -0.263 14.892 4.620 457 HD2 TYR 150 HD2 TYR 150 -3.073 11.719 3.920 458 HE1 TYR 150 HE1 TYR 150 1.344 13.259 5.568 459 HE2 TYR 150 HE2 TYR 150 -1.465 10.086 4.868 460 HH TYR 150 HH TYR 150 1.558 10.415 5.114 461 H ASP 151 HN ASP 151 -4.726 14.444 0.930 462 HA ASP 151 HA ASP 151 -4.707 11.541 0.508 463 HB2 ASP 151 HB2 ASP 151 -6.602 13.463 0.871 464 HB3 ASP 151 HB1 ASP 151 -6.648 13.300 -0.884 465 H GLU 152 HN GLU 152 -4.561 14.442 -1.582 466 HA GLU 152 HA GLU 152 -4.286 12.960 -4.048 467 HB2 GLU 152 HB2 GLU 152 -3.920 15.789 -3.097 468 HB3 GLU 152 HB1 GLU 152 -3.415 15.349 -4.728 469 HG2 GLU 152 HG2 GLU 152 -5.646 14.572 -5.273 470 HG3 GLU 152 HG1 GLU 152 -6.177 14.804 -3.607 471 H PHE 153 HN PHE 153 -2.009 14.143 -1.632 472 HA PHE 153 HA PHE 153 0.386 14.070 -3.180 473 HB2 PHE 153 HB2 PHE 153 0.206 15.093 -0.971 474 HB3 PHE 153 HB1 PHE 153 -0.169 13.529 -0.245 475 HD1 PHE 153 HD1 PHE 153 2.366 14.466 -2.837 476 HD2 PHE 153 HD2 PHE 153 1.654 12.968 1.125 477 HE1 PHE 153 HE1 PHE 153 4.788 14.000 -2.578 478 HE2 PHE 153 HE2 PHE 153 4.077 12.502 1.384 479 HZ PHE 153 HZ PHE 153 5.643 13.019 -0.468 480 H LEU 154 HN LEU 154 -1.225 11.521 -1.254 481 HA LEU 154 HA LEU 154 0.662 9.462 -1.444 482 HB2 LEU 154 HB2 LEU 154 -2.243 9.778 -1.118 483 HB3 LEU 154 HB1 LEU 154 -1.783 8.214 -1.792 484 HG LEU 154 HG LEU 154 -1.838 8.177 0.694 485 HD11 LEU 154 HD11 LEU 154 0.122 6.916 0.908 486 HD12 LEU 154 HD12 LEU 154 1.049 8.002 -0.128 487 HD13 LEU 154 HD13 LEU 154 -0.132 6.902 -0.837 488 HD21 LEU 154 HD21 LEU 154 -0.252 10.605 0.272 489 HD22 LEU 154 HD22 LEU 154 0.497 9.495 1.420 490 HD23 LEU 154 HD23 LEU 154 -1.141 10.083 1.703 491 H GLU 155 HN GLU 155 -1.525 10.692 -3.931 492 HA GLU 155 HA GLU 155 -1.017 8.519 -5.816 493 HB2 GLU 155 HB2 GLU 155 -2.660 10.893 -5.525 494 HB3 GLU 155 HB1 GLU 155 -1.957 10.826 -7.142 495 HG2 GLU 155 HG2 GLU 155 -4.100 9.625 -7.098 496 HG3 GLU 155 HG1 GLU 155 -2.774 8.499 -7.386 497 H PHE 156 HN PHE 156 0.593 11.449 -4.909 498 HA PHE 156 HA PHE 156 1.967 11.997 -7.389 499 HB2 PHE 156 HB2 PHE 156 1.698 13.656 -5.636 500 HB3 PHE 156 HB1 PHE 156 2.527 12.621 -4.474 501 HD1 PHE 156 HD2 PHE 156 3.019 14.396 -7.729 502 HD2 PHE 156 HD1 PHE 156 4.863 12.732 -4.225 503 HE1 PHE 156 HE2 PHE 156 5.197 15.362 -8.417 504 HE2 PHE 156 HE1 PHE 156 7.041 13.698 -4.912 505 HZ PHE 156 HZ PHE 156 7.209 15.013 -7.008 506 H MET 157 HN MET 157 2.846 10.147 -4.459 507 HA MET 157 HA MET 157 5.439 9.344 -5.593 508 HB2 MET 157 HB2 MET 157 4.005 8.253 -3.160 509 HB3 MET 157 HB1 MET 157 5.743 8.338 -3.443 510 HG2 MET 157 HG2 MET 157 5.241 10.938 -3.646 511 HG3 MET 157 HG1 MET 157 3.842 10.513 -2.660 512 HE1 MET 157 HE1 MET 157 8.272 10.133 -1.791 513 HE2 MET 157 HE2 MET 157 7.415 10.065 -3.328 514 HE3 MET 157 HE3 MET 157 7.525 8.621 -2.324 515 H LYS 158 HN LYS 158 2.542 7.543 -4.476 516 HA LYS 158 HA LYS 158 1.593 5.537 -5.287 517 HB2 LYS 158 HB2 LYS 158 1.765 7.004 -7.370 518 HB3 LYS 158 HB1 LYS 158 3.252 6.134 -7.750 519 HG2 LYS 158 HG2 LYS 158 1.200 4.235 -7.073 520 HG3 LYS 158 HG1 LYS 158 0.589 5.330 -8.314 521 HD2 LYS 158 HD2 LYS 158 3.329 4.585 -8.885 522 HD3 LYS 158 HD1 LYS 158 2.324 3.147 -8.698 523 HE2 LYS 158 HE2 LYS 158 0.633 4.472 -10.231 524 HE3 LYS 158 HE1 LYS 158 2.091 5.362 -10.716 525 HZ1 LYS 158 HZ1 LYS 158 1.857 2.400 -10.654 526 HZ2 LYS 158 HZ2 LYS 158 3.198 3.294 -11.190 527 HZ3 LYS 158 HZ3 LYS 158 1.738 3.342 -12.059 528 H GLY 159 HN GLY 159 4.597 5.802 -4.257 529 HA2 GLY 159 HA2 GLY 159 5.553 3.590 -3.453 530 HA3 GLY 159 HA1 GLY 159 5.398 3.053 -5.126 531 H VAL 160 HN VAL 160 6.425 4.984 -6.644 532 HA VAL 160 HA VAL 160 8.483 5.890 -7.379 533 HB VAL 160 HB VAL 160 8.551 6.403 -4.388 534 HG11 VAL 160 HG11 VAL 160 10.596 7.314 -4.625 535 HG12 VAL 160 HG12 VAL 160 10.037 8.299 -5.977 536 HG13 VAL 160 HG13 VAL 160 10.650 6.671 -6.267 537 HG21 VAL 160 HG21 VAL 160 7.377 8.333 -4.825 538 HG22 VAL 160 HG22 VAL 160 6.786 7.374 -6.182 539 HG23 VAL 160 HG23 VAL 160 8.095 8.530 -6.423 540 H GLU 161 HN GLU 161 9.245 3.674 -7.915 541 HA GLU 161 HA GLU 161 10.700 2.051 -6.022 542 HB2 GLU 161 HB2 GLU 161 9.596 1.364 -8.195 543 HB3 GLU 161 HB1 GLU 161 10.926 2.154 -9.044 544 HG2 GLU 161 HG2 GLU 161 12.539 0.656 -8.106 545 HG3 GLU 161 HG1 GLU 161 11.372 0.022 -6.945 546 HO1 KDH 1 H1 KDH 1 10.853 8.188 -9.445 547 H21 KDH 1 H21 KDH 1 11.368 8.523 -3.257 548 H33 KDH 1 H33 KDH 1 9.103 13.381 -5.829 549 H4 KDH 1 H4 KDH 1 10.917 9.584 -7.317 550 HO7 KDH 1 H7 KDH 1 8.665 9.188 -11.366 551 H01 KDH 1 H01 KDH 1 10.815 13.952 -4.010 552 H01A KDH 1 H02 KDH 1 9.329 13.039 -3.535 553 HO03 KDH 1 H03 KDH 1 12.891 14.011 -2.754 554 HO10 KDH 1 H10 KDH 1 5.800 11.493 -9.165 555 H12 KDH 1 H12 KDH 1 7.268 12.038 -7.086 556 H15 KDH 1 H15 KDH 1 8.455 11.256 -5.201 557 H26 KDH 1 H26 KDH 1 13.220 11.569 -0.697 558 H39 KDH 1 H39 KDH 1 12.172 11.358 -7.973 559 H41 KDH 1 H41 KDH 1 11.436 15.399 -9.548 560 HO02 KDH 1 H42 KDH 1 13.944 9.044 -1.182 561 HO44 KDH 1 H44 KDH 1 12.449 15.106 -12.345 562 HO47 KDH 1 H47 KDH 1 14.089 11.875 -12.330 563 HO50 KDH 1 H50 KDH 1 14.161 10.324 -9.058 Start of MODEL 14 1 H1 MET 90 HT1 MET 90 11.918 6.747 5.144 2 H2 MET 90 HT2 MET 90 10.825 7.892 5.760 3 H3 MET 90 HT3 MET 90 12.420 7.837 6.342 4 HA MET 90 HA MET 90 11.957 9.689 4.727 5 HB2 MET 90 HB2 MET 90 14.052 7.555 4.628 6 HB3 MET 90 HB1 MET 90 14.094 8.803 3.382 7 HG2 MET 90 HG2 MET 90 15.018 10.243 4.840 8 HG3 MET 90 HG1 MET 90 13.616 10.077 5.897 9 HE1 MET 90 HE1 MET 90 15.261 10.257 8.309 10 HE2 MET 90 HE2 MET 90 16.066 10.901 6.880 11 HE3 MET 90 HE3 MET 90 16.938 9.816 7.959 12 H GLY 91 HN GLY 91 9.768 8.431 3.845 13 HA2 GLY 91 HA2 GLY 91 8.608 8.219 1.790 14 HA3 GLY 91 HA1 GLY 91 10.151 8.345 0.943 15 H LYS 92 HN LYS 92 8.022 6.123 2.677 16 HA LYS 92 HA LYS 92 9.347 3.864 1.225 17 HB2 LYS 92 HB2 LYS 92 10.228 3.875 3.473 18 HB3 LYS 92 HB1 LYS 92 8.619 4.109 4.158 19 HG2 LYS 92 HG2 LYS 92 8.116 1.903 4.022 20 HG3 LYS 92 HG1 LYS 92 8.816 1.755 2.410 21 HD2 LYS 92 HD2 LYS 92 11.097 2.031 3.728 22 HD3 LYS 92 HD1 LYS 92 10.133 1.444 5.083 23 HE2 LYS 92 HE2 LYS 92 10.869 -0.583 4.188 24 HE3 LYS 92 HE1 LYS 92 9.363 -0.373 3.273 25 HZ1 LYS 92 HZ1 LYS 92 10.466 0.343 1.422 26 HZ2 LYS 92 HZ2 LYS 92 11.634 -0.726 2.036 27 HZ3 LYS 92 HZ3 LYS 92 11.790 0.946 2.293 28 H SER 93 HN SER 93 6.644 4.282 3.539 29 HA SER 93 HA SER 93 4.782 3.226 1.444 30 HB2 SER 93 HB2 SER 93 5.786 1.691 3.426 31 HB3 SER 93 HB1 SER 93 4.423 2.402 4.286 32 HG SER 93 HG SER 93 3.156 1.747 2.394 33 H GLU 94 HN GLU 94 2.423 3.544 2.291 34 HA GLU 94 HA GLU 94 1.730 6.202 2.578 35 HB2 GLU 94 HB2 GLU 94 0.452 3.751 3.835 36 HB3 GLU 94 HB1 GLU 94 -0.367 5.296 3.597 37 HG2 GLU 94 HG2 GLU 94 0.696 4.795 1.099 38 HG3 GLU 94 HG1 GLU 94 0.234 3.183 1.648 39 H GLU 95 HN GLU 95 2.932 4.047 5.095 40 HA GLU 95 HA GLU 95 2.209 5.550 7.407 41 HB2 GLU 95 HB2 GLU 95 3.640 3.249 6.739 42 HB3 GLU 95 HB1 GLU 95 4.848 4.289 7.495 43 HG2 GLU 95 HG2 GLU 95 2.607 4.596 9.117 44 HG3 GLU 95 HG1 GLU 95 2.602 2.879 8.714 45 H GLU 96 HN GLU 96 5.415 5.501 5.791 46 HA GLU 96 HA GLU 96 6.206 8.007 7.086 47 HB2 GLU 96 HB2 GLU 96 7.471 6.379 4.855 48 HB3 GLU 96 HB1 GLU 96 8.283 7.597 5.838 49 HG2 GLU 96 HG2 GLU 96 6.910 5.290 7.184 50 HG3 GLU 96 HG1 GLU 96 8.510 5.057 6.477 51 H LEU 97 HN LEU 97 4.805 7.036 4.029 52 HA LEU 97 HA LEU 97 5.485 9.088 2.269 53 HB2 LEU 97 HB2 LEU 97 3.347 7.175 2.698 54 HB3 LEU 97 HB1 LEU 97 2.708 8.668 2.009 55 HG LEU 97 HG LEU 97 3.381 7.184 0.198 56 HD11 LEU 97 HD11 LEU 97 3.984 9.094 -0.830 57 HD12 LEU 97 HD12 LEU 97 5.637 8.806 -0.288 58 HD13 LEU 97 HD13 LEU 97 4.546 9.785 0.692 59 HD21 LEU 97 HD21 LEU 97 4.976 5.736 1.178 60 HD22 LEU 97 HD22 LEU 97 5.952 7.077 1.776 61 HD23 LEU 97 HD23 LEU 97 5.926 6.706 0.052 62 H SER 98 HN SER 98 2.866 9.165 4.708 63 HA SER 98 HA SER 98 2.217 11.957 4.174 64 HB2 SER 98 HB2 SER 98 0.387 10.863 5.018 65 HB3 SER 98 HB1 SER 98 1.371 9.716 5.921 66 HG SER 98 HG SER 98 0.279 11.136 7.318 67 H ASP 99 HN ASP 99 4.463 10.272 6.244 68 HA ASP 99 HA ASP 99 4.790 12.380 8.216 69 HB2 ASP 99 HB2 ASP 99 6.350 9.941 7.338 70 HB3 ASP 99 HB1 ASP 99 6.922 10.991 8.635 71 H LEU 100 HN LEU 100 6.354 11.560 5.137 72 HA LEU 100 HA LEU 100 8.385 13.681 5.464 73 HB2 LEU 100 HB2 LEU 100 9.207 12.784 3.351 74 HB3 LEU 100 HB1 LEU 100 8.790 11.434 4.408 75 HG LEU 100 HG LEU 100 6.402 11.864 3.159 76 HD11 LEU 100 HD11 LEU 100 7.033 12.047 0.703 77 HD12 LEU 100 HD12 LEU 100 8.630 12.576 1.233 78 HD13 LEU 100 HD13 LEU 100 7.206 13.537 1.630 79 HD21 LEU 100 HD21 LEU 100 7.045 9.659 3.149 80 HD22 LEU 100 HD22 LEU 100 8.722 10.044 2.764 81 HD23 LEU 100 HD23 LEU 100 7.503 10.042 1.489 82 H PHE 101 HN PHE 101 5.258 13.234 3.980 83 HA PHE 101 HA PHE 101 5.289 15.181 1.928 84 HB2 PHE 101 HB2 PHE 101 3.429 13.730 2.123 85 HB3 PHE 101 HB1 PHE 101 3.216 14.094 3.835 86 HD1 PHE 101 HD2 PHE 101 2.276 16.281 4.550 87 HD2 PHE 101 HD1 PHE 101 2.508 15.158 0.411 88 HE1 PHE 101 HE2 PHE 101 0.669 18.079 3.972 89 HE2 PHE 101 HE1 PHE 101 0.901 16.956 -0.167 90 HZ PHE 101 HZ PHE 101 -0.018 18.417 1.613 91 H ARG 102 HN ARG 102 4.543 15.580 5.407 92 HA ARG 102 HA ARG 102 4.186 18.478 5.141 93 HB2 ARG 102 HB2 ARG 102 3.717 18.328 7.504 94 HB3 ARG 102 HB1 ARG 102 3.014 16.897 6.749 95 HG2 ARG 102 HG2 ARG 102 5.560 16.033 7.291 96 HG3 ARG 102 HG1 ARG 102 5.252 17.104 8.658 97 HD2 ARG 102 HD2 ARG 102 3.497 14.785 7.770 98 HD3 ARG 102 HD1 ARG 102 4.474 14.867 9.250 99 HE ARG 102 HE ARG 102 1.932 16.243 8.808 100 HH11 ARG 102 HH21 ARG 102 4.976 16.224 10.441 101 HH12 ARG 102 HH22 ARG 102 4.416 17.187 11.766 102 HH21 ARG 102 HH11 ARG 102 1.193 17.496 10.534 103 HH22 ARG 102 HH12 ARG 102 2.277 17.901 11.822 104 H MET 103 HN MET 103 6.857 16.349 5.579 105 HA MET 103 HA MET 103 8.548 18.254 7.041 106 HB2 MET 103 HB2 MET 103 8.747 15.824 7.315 107 HB3 MET 103 HB1 MET 103 9.083 15.641 5.593 108 HG2 MET 103 HG2 MET 103 11.096 17.117 5.897 109 HG3 MET 103 HG1 MET 103 10.798 17.080 7.634 110 HE1 MET 103 HE1 MET 103 12.741 14.284 8.788 111 HE2 MET 103 HE2 MET 103 11.331 15.261 9.189 112 HE3 MET 103 HE3 MET 103 12.783 16.038 8.563 113 H PHE 104 HN PHE 104 7.558 17.924 3.811 114 HA PHE 104 HA PHE 104 10.081 19.127 2.752 115 HB2 PHE 104 HB2 PHE 104 7.796 17.516 1.685 116 HB3 PHE 104 HB1 PHE 104 8.640 18.591 0.569 117 HD1 PHE 104 HD1 PHE 104 11.399 18.518 1.571 118 HD2 PHE 104 HD2 PHE 104 8.537 15.343 1.154 119 HE1 PHE 104 HE1 PHE 104 13.248 16.876 1.383 120 HE2 PHE 104 HE2 PHE 104 10.385 13.701 0.965 121 HZ PHE 104 HZ PHE 104 12.741 14.467 1.080 122 H ASP 105 HN ASP 105 6.736 19.833 3.448 123 HA ASP 105 HA ASP 105 6.302 22.024 1.662 124 HB2 ASP 105 HB2 ASP 105 4.496 20.983 2.869 125 HB3 ASP 105 HB1 ASP 105 5.270 21.311 4.421 126 H LYS 106 HN LYS 106 8.571 22.986 1.855 127 HA LYS 106 HA LYS 106 9.524 24.231 4.243 128 HB2 LYS 106 HB2 LYS 106 9.900 24.910 1.307 129 HB3 LYS 106 HB1 LYS 106 10.927 25.497 2.615 130 HG2 LYS 106 HG2 LYS 106 10.979 22.834 3.134 131 HG3 LYS 106 HG1 LYS 106 10.797 22.806 1.379 132 HD2 LYS 106 HD2 LYS 106 12.768 24.153 1.072 133 HD3 LYS 106 HD1 LYS 106 12.881 24.481 2.801 134 HE2 LYS 106 HE2 LYS 106 14.118 22.609 3.089 135 HE3 LYS 106 HE1 LYS 106 12.820 21.625 2.385 136 HZ1 LYS 106 HZ1 LYS 106 15.035 23.010 1.000 137 HZ2 LYS 106 HZ2 LYS 106 13.612 22.587 0.173 138 HZ3 LYS 106 HZ3 LYS 106 14.573 21.382 0.886 139 H ASN 107 HN ASN 107 7.021 25.144 2.003 140 HA ASN 107 HA ASN 107 7.009 27.988 2.507 141 HB2 ASN 107 HB2 ASN 107 5.969 26.687 0.592 142 HB3 ASN 107 HB1 ASN 107 4.713 26.172 1.717 143 HD21 ASN 107 HD21 ASN 107 2.886 27.457 1.505 144 HD22 ASN 107 HD22 ASN 107 2.892 29.123 1.180 145 H ALA 108 HN ALA 108 6.279 25.377 4.525 146 HA ALA 108 HA ALA 108 5.161 25.228 6.603 147 HB1 ALA 108 HB1 ALA 108 5.818 26.978 7.925 148 HB2 ALA 108 HB2 ALA 108 5.108 28.180 6.847 149 HB3 ALA 108 HB3 ALA 108 6.688 27.488 6.477 150 H ASP 109 HN ASP 109 3.052 24.565 6.046 151 HA ASP 109 HA ASP 109 0.886 26.399 6.456 152 HB2 ASP 109 HB2 ASP 109 0.099 26.477 4.075 153 HB3 ASP 109 HB1 ASP 109 1.646 27.291 4.308 154 H GLY 110 HN GLY 110 2.003 23.404 4.933 155 HA2 GLY 110 HA2 GLY 110 1.026 21.293 5.852 156 HA3 GLY 110 HA1 GLY 110 -0.540 22.106 5.828 157 H TYR 111 HN TYR 111 1.163 23.080 3.132 158 HA TYR 111 HA TYR 111 0.211 20.802 1.450 159 HB2 TYR 111 HB2 TYR 111 -0.401 23.749 1.040 160 HB3 TYR 111 HB1 TYR 111 -0.909 22.438 -0.024 161 HD1 TYR 111 HD2 TYR 111 -1.341 23.953 3.324 162 HD2 TYR 111 HD1 TYR 111 -2.717 20.954 0.575 163 HE1 TYR 111 HE2 TYR 111 -3.344 23.577 4.737 164 HE2 TYR 111 HE1 TYR 111 -4.721 20.578 1.987 165 HH TYR 111 HH TYR 111 -4.980 21.692 5.141 166 H ILE 112 HN ILE 112 0.992 21.270 -0.928 167 HA ILE 112 HA ILE 112 3.663 22.627 -0.873 168 HB ILE 112 HB ILE 112 2.841 19.851 -1.703 169 HG12 ILE 112 HG12 ILE 112 5.171 21.015 -0.146 170 HG13 ILE 112 HG11 ILE 112 3.781 20.168 0.534 171 HG21 ILE 112 HG21 ILE 112 5.155 19.713 -2.780 172 HG22 ILE 112 HG22 ILE 112 5.161 21.477 -2.764 173 HG23 ILE 112 HG23 ILE 112 3.936 20.607 -3.688 174 HD11 ILE 112 HD11 ILE 112 6.049 18.877 0.059 175 HD12 ILE 112 HD12 ILE 112 5.396 18.789 -1.577 176 HD13 ILE 112 HD13 ILE 112 4.493 18.098 -0.228 177 H ASP 113 HN ASP 113 3.400 24.318 -2.296 178 HA ASP 113 HA ASP 113 1.504 24.224 -4.513 179 HB2 ASP 113 HB2 ASP 113 2.181 26.499 -4.805 180 HB3 ASP 113 HB1 ASP 113 2.242 26.210 -3.066 181 H LEU 114 HN LEU 114 2.994 25.534 -6.529 182 HA LEU 114 HA LEU 114 4.402 23.245 -7.718 183 HB2 LEU 114 HB2 LEU 114 3.381 25.939 -8.516 184 HB3 LEU 114 HB1 LEU 114 4.647 25.223 -9.513 185 HG LEU 114 HG LEU 114 2.041 23.860 -8.770 186 HD11 LEU 114 HD11 LEU 114 1.138 24.625 -10.716 187 HD12 LEU 114 HD12 LEU 114 2.664 24.487 -11.590 188 HD13 LEU 114 HD13 LEU 114 2.353 25.896 -10.574 189 HD21 LEU 114 HD21 LEU 114 3.221 22.632 -10.989 190 HD22 LEU 114 HD22 LEU 114 3.185 21.996 -9.345 191 HD23 LEU 114 HD23 LEU 114 4.570 22.939 -9.896 192 H ASP 115 HN ASP 115 5.238 26.564 -6.686 193 HA ASP 115 HA ASP 115 7.964 26.563 -7.496 194 HB2 ASP 115 HB2 ASP 115 6.562 28.494 -6.726 195 HB3 ASP 115 HB1 ASP 115 6.679 27.873 -5.079 196 H GLU 116 HN GLU 116 6.528 25.671 -4.334 197 HA GLU 116 HA GLU 116 8.909 25.028 -2.958 198 HB2 GLU 116 HB2 GLU 116 6.143 23.781 -2.839 199 HB3 GLU 116 HB1 GLU 116 7.369 23.640 -1.577 200 HG2 GLU 116 HG2 GLU 116 7.222 25.898 -0.994 201 HG3 GLU 116 HG1 GLU 116 6.556 26.361 -2.561 202 H LEU 117 HN LEU 117 6.976 23.036 -5.195 203 HA LEU 117 HA LEU 117 8.211 20.527 -4.781 204 HB2 LEU 117 HB2 LEU 117 7.121 21.889 -7.263 205 HB3 LEU 117 HB1 LEU 117 7.516 20.171 -7.189 206 HG LEU 117 HG LEU 117 5.622 21.501 -5.240 207 HD11 LEU 117 HD11 LEU 117 5.152 21.211 -7.953 208 HD12 LEU 117 HD12 LEU 117 3.907 21.311 -6.708 209 HD13 LEU 117 HD13 LEU 117 4.462 19.736 -7.276 210 HD21 LEU 117 HD21 LEU 117 4.863 19.033 -5.120 211 HD22 LEU 117 HD22 LEU 117 6.404 19.439 -4.364 212 HD23 LEU 117 HD23 LEU 117 6.376 18.662 -5.947 213 H LYS 118 HN LYS 118 9.243 23.261 -6.824 214 HA LYS 118 HA LYS 118 11.376 22.122 -8.232 215 HB2 LYS 118 HB2 LYS 118 10.336 24.537 -8.075 216 HB3 LYS 118 HB1 LYS 118 11.625 24.808 -6.903 217 HG2 LYS 118 HG2 LYS 118 13.007 23.577 -8.911 218 HG3 LYS 118 HG1 LYS 118 11.788 24.458 -9.833 219 HD2 LYS 118 HD2 LYS 118 13.101 26.279 -9.597 220 HD3 LYS 118 HD1 LYS 118 12.615 26.289 -7.901 221 HE2 LYS 118 HE2 LYS 118 15.044 26.290 -7.964 222 HE3 LYS 118 HE1 LYS 118 14.534 24.665 -7.461 223 HZ1 LYS 118 HZ1 LYS 118 14.821 23.829 -9.611 224 HZ2 LYS 118 HZ2 LYS 118 16.191 24.803 -9.368 225 HZ3 LYS 118 HZ3 LYS 118 14.897 25.372 -10.310 226 H ILE 119 HN ILE 119 11.903 24.012 -5.234 227 HA ILE 119 HA ILE 119 14.516 23.027 -4.714 228 HB ILE 119 HB ILE 119 12.328 24.036 -2.865 229 HG12 ILE 119 HG12 ILE 119 14.326 25.972 -3.275 230 HG13 ILE 119 HG11 ILE 119 14.018 25.285 -4.870 231 HG21 ILE 119 HG21 ILE 119 14.340 22.789 -1.830 232 HG22 ILE 119 HG22 ILE 119 13.994 24.409 -1.223 233 HG23 ILE 119 HG23 ILE 119 15.305 24.161 -2.377 234 HD11 ILE 119 HD11 ILE 119 11.770 26.133 -3.039 235 HD12 ILE 119 HD12 ILE 119 11.705 25.822 -4.774 236 HD13 ILE 119 HD13 ILE 119 12.531 27.257 -4.166 237 H MET 120 HN MET 120 11.432 21.519 -4.310 238 HA MET 120 HA MET 120 12.070 19.703 -2.164 239 HB2 MET 120 HB2 MET 120 9.900 20.413 -3.802 240 HB3 MET 120 HB1 MET 120 10.183 18.706 -4.140 241 HG2 MET 120 HG2 MET 120 10.370 18.526 -1.515 242 HG3 MET 120 HG1 MET 120 9.440 20.025 -1.551 243 HE1 MET 120 HE1 MET 120 9.770 16.675 -1.448 244 HE2 MET 120 HE2 MET 120 8.479 15.807 -2.276 245 HE3 MET 120 HE3 MET 120 8.179 16.516 -0.691 246 H LEU 121 HN LEU 121 12.681 19.682 -5.627 247 HA LEU 121 HA LEU 121 13.472 16.834 -5.636 248 HB2 LEU 121 HB2 LEU 121 13.127 19.081 -7.593 249 HB3 LEU 121 HB1 LEU 121 14.111 17.696 -8.066 250 HG LEU 121 HG LEU 121 12.288 16.172 -7.708 251 HD11 LEU 121 HD11 LEU 121 10.021 17.313 -7.011 252 HD12 LEU 121 HD12 LEU 121 11.076 18.544 -6.318 253 HD13 LEU 121 HD13 LEU 121 11.193 16.873 -5.768 254 HD21 LEU 121 HD21 LEU 121 11.274 18.689 -9.072 255 HD22 LEU 121 HD22 LEU 121 10.578 17.080 -9.262 256 HD23 LEU 121 HD23 LEU 121 12.212 17.408 -9.839 257 H GLN 122 HN GLN 122 14.937 19.809 -4.879 258 HA GLN 122 HA GLN 122 17.483 19.859 -5.927 259 HB2 GLN 122 HB2 GLN 122 16.552 21.397 -4.227 260 HB3 GLN 122 HB1 GLN 122 16.700 20.131 -3.008 261 HG2 GLN 122 HG2 GLN 122 18.973 20.360 -2.848 262 HG3 GLN 122 HG1 GLN 122 19.158 20.736 -4.561 263 HE21 GLN 122 HE21 GLN 122 17.168 22.341 -2.018 264 HE22 GLN 122 HE22 GLN 122 17.858 23.876 -2.239 265 H ALA 123 HN ALA 123 16.184 17.426 -3.762 266 HA ALA 123 HA ALA 123 18.354 16.213 -2.582 267 HB1 ALA 123 HB1 ALA 123 16.877 14.132 -3.789 268 HB2 ALA 123 HB2 ALA 123 15.746 15.471 -3.597 269 HB3 ALA 123 HB3 ALA 123 16.606 14.835 -2.195 270 H THR 124 HN THR 124 17.690 16.365 -6.037 271 HA THR 124 HA THR 124 20.217 14.818 -6.517 272 HB THR 124 HB THR 124 18.112 13.598 -7.070 273 HG1 THR 124 HG1 THR 124 19.811 14.438 -9.166 274 HG21 THR 124 HG21 THR 124 16.435 14.529 -8.279 275 HG22 THR 124 HG22 THR 124 17.552 15.277 -9.420 276 HG23 THR 124 HG23 THR 124 17.207 16.064 -7.880 277 H GLY 125 HN GLY 125 19.307 17.848 -6.444 278 HA2 GLY 125 HA2 GLY 125 20.675 19.567 -7.529 279 HA3 GLY 125 HA1 GLY 125 20.751 18.541 -8.962 280 H GLU 126 HN GLU 126 17.744 18.005 -8.422 281 HA GLU 126 HA GLU 126 15.823 18.788 -9.593 282 HB2 GLU 126 HB2 GLU 126 15.023 20.823 -8.470 283 HB3 GLU 126 HB1 GLU 126 15.797 19.750 -7.307 284 HG2 GLU 126 HG2 GLU 126 17.802 21.068 -7.291 285 HG3 GLU 126 HG1 GLU 126 17.264 22.013 -8.678 286 H THR 127 HN THR 127 17.833 18.979 -11.433 287 HA THR 127 HA THR 127 17.653 21.772 -12.508 288 HB THR 127 HB THR 127 19.921 21.089 -12.140 289 HG1 THR 127 HG1 THR 127 20.438 20.466 -14.527 290 HG21 THR 127 HG21 THR 127 20.047 18.832 -11.785 291 HG22 THR 127 HG22 THR 127 20.529 18.827 -13.482 292 HG23 THR 127 HG23 THR 127 18.861 18.465 -13.037 293 H ILE 128 HN ILE 128 15.623 21.503 -13.570 294 HA ILE 128 HA ILE 128 15.715 19.695 -15.952 295 HB ILE 128 HB ILE 128 13.278 19.233 -15.408 296 HG12 ILE 128 HG12 ILE 128 14.080 20.530 -12.783 297 HG13 ILE 128 HG11 ILE 128 12.943 21.207 -13.950 298 HG21 ILE 128 HG21 ILE 128 15.182 18.434 -13.195 299 HG22 ILE 128 HG22 ILE 128 15.228 17.722 -14.808 300 HG23 ILE 128 HG23 ILE 128 13.795 17.526 -13.800 301 HD11 ILE 128 HD11 ILE 128 12.568 18.477 -12.701 302 HD12 ILE 128 HD12 ILE 128 11.386 19.421 -13.607 303 HD13 ILE 128 HD13 ILE 128 11.890 19.946 -12.001 304 H THR 129 HN THR 129 13.997 20.387 -17.580 305 HA THR 129 HA THR 129 14.204 23.154 -18.226 306 HB THR 129 HB THR 129 11.922 22.202 -19.487 307 HG1 THR 129 HG1 THR 129 11.873 20.151 -19.129 308 HG21 THR 129 HG21 THR 129 14.655 21.401 -20.441 309 HG22 THR 129 HG22 THR 129 14.235 23.110 -20.321 310 HG23 THR 129 HG23 THR 129 13.298 22.043 -21.366 311 H GLU 130 HN GLU 130 12.910 24.911 -17.679 312 HA GLU 130 HA GLU 130 11.316 24.948 -15.361 313 HB2 GLU 130 HB2 GLU 130 12.145 26.980 -16.271 314 HB3 GLU 130 HB1 GLU 130 11.447 26.647 -17.857 315 HG2 GLU 130 HG2 GLU 130 9.183 26.893 -16.934 316 HG3 GLU 130 HG1 GLU 130 9.858 27.181 -15.329 317 H ASP 131 HN ASP 131 10.518 23.779 -18.523 318 HA ASP 131 HA ASP 131 7.617 24.054 -18.238 319 HB2 ASP 131 HB2 ASP 131 9.499 23.594 -20.261 320 HB3 ASP 131 HB1 ASP 131 8.590 22.085 -20.154 321 H ASP 132 HN ASP 132 10.043 21.727 -17.324 322 HA ASP 132 HA ASP 132 8.271 19.425 -17.131 323 HB2 ASP 132 HB2 ASP 132 11.061 20.202 -16.519 324 HB3 ASP 132 HB1 ASP 132 10.406 18.922 -15.497 325 H ILE 133 HN ILE 133 9.239 22.049 -14.980 326 HA ILE 133 HA ILE 133 8.577 21.046 -12.451 327 HB ILE 133 HB ILE 133 8.061 23.766 -13.697 328 HG12 ILE 133 HG12 ILE 133 10.414 22.884 -13.775 329 HG13 ILE 133 HG11 ILE 133 10.245 24.340 -12.794 330 HG21 ILE 133 HG21 ILE 133 7.504 22.708 -11.042 331 HG22 ILE 133 HG22 ILE 133 7.064 24.268 -11.736 332 HG23 ILE 133 HG23 ILE 133 8.641 24.054 -10.975 333 HD11 ILE 133 HD11 ILE 133 11.215 23.191 -11.112 334 HD12 ILE 133 HD12 ILE 133 11.079 21.668 -11.991 335 HD13 ILE 133 HD13 ILE 133 9.729 22.246 -11.015 336 H GLU 134 HN GLU 134 6.385 22.292 -14.970 337 HA GLU 134 HA GLU 134 4.006 21.949 -13.284 338 HB2 GLU 134 HB2 GLU 134 4.642 22.777 -16.110 339 HB3 GLU 134 HB1 GLU 134 2.971 22.466 -15.636 340 HG2 GLU 134 HG2 GLU 134 3.708 24.025 -13.570 341 HG3 GLU 134 HG1 GLU 134 4.799 24.662 -14.801 342 H GLU 135 HN GLU 135 5.941 19.872 -15.158 343 HA GLU 135 HA GLU 135 3.780 18.121 -16.103 344 HB2 GLU 135 HB2 GLU 135 6.280 18.657 -16.940 345 HB3 GLU 135 HB1 GLU 135 6.628 17.248 -15.936 346 HG2 GLU 135 HG2 GLU 135 5.302 15.827 -17.236 347 HG3 GLU 135 HG1 GLU 135 4.347 17.158 -17.892 348 H LEU 136 HN LEU 136 5.928 18.322 -13.320 349 HA LEU 136 HA LEU 136 5.440 15.589 -12.408 350 HB2 LEU 136 HB2 LEU 136 6.772 18.090 -11.417 351 HB3 LEU 136 HB1 LEU 136 6.452 16.789 -10.270 352 HG LEU 136 HG LEU 136 7.732 16.124 -12.899 353 HD11 LEU 136 HD11 LEU 136 8.874 17.833 -10.806 354 HD12 LEU 136 HD12 LEU 136 9.455 17.522 -12.443 355 HD13 LEU 136 HD13 LEU 136 9.852 16.403 -11.138 356 HD21 LEU 136 HD21 LEU 136 8.858 14.811 -10.636 357 HD22 LEU 136 HD22 LEU 136 7.812 14.118 -11.876 358 HD23 LEU 136 HD23 LEU 136 7.108 14.817 -10.418 359 H MET 137 HN MET 137 4.036 18.779 -11.807 360 HA MET 137 HA MET 137 2.536 18.226 -9.463 361 HB2 MET 137 HB2 MET 137 2.977 20.402 -10.793 362 HB3 MET 137 HB1 MET 137 1.594 19.923 -11.778 363 HG2 MET 137 HG2 MET 137 0.892 21.421 -9.947 364 HG3 MET 137 HG1 MET 137 0.185 19.816 -9.755 365 HE1 MET 137 HE1 MET 137 1.502 22.163 -6.737 366 HE2 MET 137 HE2 MET 137 0.209 20.980 -6.561 367 HE3 MET 137 HE3 MET 137 0.265 22.004 -7.993 368 H LYS 138 HN LYS 138 1.855 17.504 -12.868 369 HA LYS 138 HA LYS 138 -0.866 16.847 -12.792 370 HB2 LYS 138 HB2 LYS 138 1.560 15.852 -14.252 371 HB3 LYS 138 HB1 LYS 138 0.026 15.014 -14.494 372 HG2 LYS 138 HG2 LYS 138 0.331 18.014 -14.772 373 HG3 LYS 138 HG1 LYS 138 0.478 16.899 -16.131 374 HD2 LYS 138 HD2 LYS 138 -1.794 16.059 -15.708 375 HD3 LYS 138 HD1 LYS 138 -1.946 17.143 -14.324 376 HE2 LYS 138 HE2 LYS 138 -3.010 18.335 -16.080 377 HE3 LYS 138 HE1 LYS 138 -1.377 19.032 -16.051 378 HZ1 LYS 138 HZ1 LYS 138 -0.889 16.984 -17.590 379 HZ2 LYS 138 HZ2 LYS 138 -1.509 18.428 -18.237 380 HZ3 LYS 138 HZ3 LYS 138 -2.544 17.114 -17.939 381 H ASP 139 HN ASP 139 1.867 15.078 -11.450 382 HA ASP 139 HA ASP 139 0.177 12.719 -10.823 383 HB2 ASP 139 HB2 ASP 139 3.098 13.368 -10.300 384 HB3 ASP 139 HB1 ASP 139 2.346 11.785 -10.104 385 H GLY 140 HN GLY 140 1.661 15.507 -9.263 386 HA2 GLY 140 HA2 GLY 140 1.080 14.492 -6.563 387 HA3 GLY 140 HA1 GLY 140 1.802 16.054 -6.949 388 H ASP 141 HN ASP 141 -0.643 16.095 -9.006 389 HA ASP 141 HA ASP 141 -2.951 16.484 -7.275 390 HB2 ASP 141 HB2 ASP 141 -1.052 18.446 -7.135 391 HB3 ASP 141 HB1 ASP 141 -2.081 19.067 -8.428 392 H LYS 142 HN LYS 142 -3.420 15.031 -9.283 393 HA LYS 142 HA LYS 142 -3.548 16.030 -11.931 394 HB2 LYS 142 HB2 LYS 142 -4.137 13.716 -10.623 395 HB3 LYS 142 HB1 LYS 142 -5.764 14.308 -10.960 396 HG2 LYS 142 HG2 LYS 142 -4.657 14.761 -13.367 397 HG3 LYS 142 HG1 LYS 142 -3.644 13.412 -12.851 398 HD2 LYS 142 HD2 LYS 142 -6.660 13.462 -13.097 399 HD3 LYS 142 HD1 LYS 142 -5.525 12.454 -13.996 400 HE2 LYS 142 HE2 LYS 142 -4.879 11.804 -11.406 401 HE3 LYS 142 HE1 LYS 142 -6.631 12.062 -11.287 402 HZ1 LYS 142 HZ1 LYS 142 -5.309 10.437 -13.394 403 HZ2 LYS 142 HZ2 LYS 142 -6.981 10.625 -13.159 404 HZ3 LYS 142 HZ3 LYS 142 -6.047 9.787 -12.013 405 H ASN 143 HN ASN 143 -5.393 16.889 -9.140 406 HA ASN 143 HA ASN 143 -7.620 18.054 -10.726 407 HB2 ASN 143 HB2 ASN 143 -8.305 16.911 -8.765 408 HB3 ASN 143 HB1 ASN 143 -6.979 17.578 -7.814 409 HD21 ASN 143 HD21 ASN 143 -7.388 19.498 -6.666 410 HD22 ASN 143 HD22 ASN 143 -8.798 20.428 -6.837 411 H ASN 144 HN ASN 144 -4.576 19.003 -10.199 412 HA ASN 144 HA ASN 144 -3.501 21.105 -10.081 413 HB2 ASN 144 HB2 ASN 144 -6.311 21.796 -10.985 414 HB3 ASN 144 HB1 ASN 144 -5.001 22.976 -10.942 415 HD21 ASN 144 HD21 ASN 144 -3.500 22.950 -12.669 416 HD22 ASN 144 HD22 ASN 144 -3.514 21.798 -13.915 417 H ASP 145 HN ASP 145 -6.573 22.558 -9.227 418 HA ASP 145 HA ASP 145 -7.365 23.454 -7.185 419 HB2 ASP 145 HB2 ASP 145 -6.226 20.984 -6.655 420 HB3 ASP 145 HB1 ASP 145 -5.404 22.050 -5.514 421 H GLY 146 HN GLY 146 -3.800 23.002 -6.977 422 HA2 GLY 146 HA2 GLY 146 -2.352 25.020 -7.143 423 HA3 GLY 146 HA1 GLY 146 -3.602 25.895 -6.252 424 H ARG 147 HN ARG 147 -3.104 22.676 -5.236 425 HA ARG 147 HA ARG 147 -1.007 23.232 -3.267 426 HB2 ARG 147 HB2 ARG 147 -2.666 22.860 -1.362 427 HB3 ARG 147 HB1 ARG 147 -2.835 24.395 -2.214 428 HG2 ARG 147 HG2 ARG 147 -4.733 23.650 -3.418 429 HG3 ARG 147 HG1 ARG 147 -4.412 21.958 -3.038 430 HD2 ARG 147 HD2 ARG 147 -5.155 22.189 -0.807 431 HD3 ARG 147 HD1 ARG 147 -4.991 23.956 -0.844 432 HE ARG 147 HE ARG 147 -6.842 22.949 -2.861 433 HH11 ARG 147 HH21 ARG 147 -6.407 23.908 0.429 434 HH12 ARG 147 HH22 ARG 147 -8.067 24.346 0.654 435 HH21 ARG 147 HH11 ARG 147 -9.007 23.518 -2.578 436 HH22 ARG 147 HH12 ARG 147 -9.537 24.127 -1.046 437 H ILE 148 HN ILE 148 -0.026 21.270 -2.882 438 HA ILE 148 HA ILE 148 -1.381 18.802 -3.807 439 HB ILE 148 HB ILE 148 1.418 19.382 -2.790 440 HG12 ILE 148 HG12 ILE 148 0.276 19.158 -5.592 441 HG13 ILE 148 HG11 ILE 148 0.912 20.620 -4.837 442 HG21 ILE 148 HG21 ILE 148 2.024 17.223 -3.484 443 HG22 ILE 148 HG22 ILE 148 0.593 17.047 -4.499 444 HG23 ILE 148 HG23 ILE 148 0.445 16.961 -2.744 445 HD11 ILE 148 HD11 ILE 148 2.348 18.430 -6.134 446 HD12 ILE 148 HD12 ILE 148 2.972 18.779 -4.521 447 HD13 ILE 148 HD13 ILE 148 2.906 20.055 -5.737 448 H ASP 149 HN ASP 149 -2.598 17.718 -2.311 449 HA ASP 149 HA ASP 149 -1.964 17.981 0.582 450 HB2 ASP 149 HB2 ASP 149 -4.256 18.349 -0.236 451 HB3 ASP 149 HB1 ASP 149 -4.268 16.740 -0.958 452 H TYR 150 HN TYR 150 -2.109 15.900 1.886 453 HA TYR 150 HA TYR 150 -0.190 13.984 1.111 454 HB2 TYR 150 HB2 TYR 150 -0.862 14.239 3.398 455 HB3 TYR 150 HB1 TYR 150 -2.553 13.925 3.004 456 HD1 TYR 150 HD1 TYR 150 0.564 12.152 1.930 457 HD2 TYR 150 HD2 TYR 150 -3.137 11.930 4.100 458 HE1 TYR 150 HE1 TYR 150 0.924 9.726 2.297 459 HE2 TYR 150 HE2 TYR 150 -2.776 9.504 4.467 460 HH TYR 150 HH TYR 150 -0.278 7.998 4.464 461 H ASP 151 HN ASP 151 -3.761 13.772 0.879 462 HA ASP 151 HA ASP 151 -3.980 11.169 -0.187 463 HB2 ASP 151 HB2 ASP 151 -5.529 13.684 -0.108 464 HB3 ASP 151 HB1 ASP 151 -5.974 12.594 -1.422 465 H GLU 152 HN GLU 152 -3.293 14.242 -1.850 466 HA GLU 152 HA GLU 152 -3.231 12.935 -4.492 467 HB2 GLU 152 HB2 GLU 152 -2.845 15.707 -3.369 468 HB3 GLU 152 HB1 GLU 152 -2.435 15.359 -5.049 469 HG2 GLU 152 HG2 GLU 152 -4.635 14.956 -5.650 470 HG3 GLU 152 HG1 GLU 152 -5.096 14.451 -4.024 471 H PHE 153 HN PHE 153 -1.007 13.710 -1.936 472 HA PHE 153 HA PHE 153 1.410 13.841 -3.531 473 HB2 PHE 153 HB2 PHE 153 1.176 14.796 -1.277 474 HB3 PHE 153 HB1 PHE 153 0.892 13.187 -0.612 475 HD1 PHE 153 HD1 PHE 153 3.385 14.911 -2.835 476 HD2 PHE 153 HD2 PHE 153 2.715 12.111 0.353 477 HE1 PHE 153 HE1 PHE 153 5.832 14.566 -2.624 478 HE2 PHE 153 HE2 PHE 153 5.161 11.766 0.564 479 HZ PHE 153 HZ PHE 153 6.720 12.993 -0.924 480 H LEU 154 HN LEU 154 -0.614 11.244 -2.501 481 HA LEU 154 HA LEU 154 1.399 9.162 -2.343 482 HB2 LEU 154 HB2 LEU 154 -1.457 9.532 -2.091 483 HB3 LEU 154 HB1 LEU 154 -1.122 8.095 -3.057 484 HG LEU 154 HG LEU 154 -1.184 7.430 -0.730 485 HD11 LEU 154 HD11 LEU 154 1.213 7.287 -2.355 486 HD12 LEU 154 HD12 LEU 154 0.511 6.058 -1.303 487 HD13 LEU 154 HD13 LEU 154 1.624 7.255 -0.640 488 HD21 LEU 154 HD21 LEU 154 1.038 9.412 -0.190 489 HD22 LEU 154 HD22 LEU 154 0.091 8.499 0.985 490 HD23 LEU 154 HD23 LEU 154 -0.660 9.808 0.072 491 H GLU 155 HN GLU 155 -1.215 9.477 -4.771 492 HA GLU 155 HA GLU 155 -0.180 7.797 -6.741 493 HB2 GLU 155 HB2 GLU 155 -2.391 8.862 -6.785 494 HB3 GLU 155 HB1 GLU 155 -1.646 10.443 -7.015 495 HG2 GLU 155 HG2 GLU 155 -0.717 9.722 -9.166 496 HG3 GLU 155 HG1 GLU 155 -1.391 8.109 -8.934 497 H PHE 156 HN PHE 156 0.969 10.949 -5.787 498 HA PHE 156 HA PHE 156 2.311 11.910 -8.043 499 HB2 PHE 156 HB2 PHE 156 2.115 12.977 -5.798 500 HB3 PHE 156 HB1 PHE 156 3.285 11.818 -5.169 501 HD1 PHE 156 HD2 PHE 156 3.106 13.796 -8.354 502 HD2 PHE 156 HD1 PHE 156 5.332 12.872 -4.797 503 HE1 PHE 156 HE2 PHE 156 4.965 15.238 -9.141 504 HE2 PHE 156 HE1 PHE 156 7.189 14.314 -5.585 505 HZ PHE 156 HZ PHE 156 7.006 15.497 -7.757 506 H MET 157 HN MET 157 3.976 10.004 -5.499 507 HA MET 157 HA MET 157 5.936 9.105 -7.551 508 HB2 MET 157 HB2 MET 157 7.363 8.734 -5.685 509 HB3 MET 157 HB1 MET 157 6.471 10.200 -5.278 510 HG2 MET 157 HG2 MET 157 4.892 8.891 -3.927 511 HG3 MET 157 HG1 MET 157 5.731 7.403 -4.366 512 HE1 MET 157 HE1 MET 157 7.883 10.923 -3.162 513 HE2 MET 157 HE2 MET 157 6.779 10.866 -1.790 514 HE3 MET 157 HE3 MET 157 6.135 10.862 -3.429 515 H LYS 158 HN LYS 158 3.084 7.984 -6.181 516 HA LYS 158 HA LYS 158 3.591 5.270 -5.540 517 HB2 LYS 158 HB2 LYS 158 1.403 7.040 -5.997 518 HB3 LYS 158 HB1 LYS 158 1.097 5.575 -6.931 519 HG2 LYS 158 HG2 LYS 158 1.460 4.197 -4.935 520 HG3 LYS 158 HG1 LYS 158 1.833 5.638 -3.989 521 HD2 LYS 158 HD2 LYS 158 -0.378 6.407 -4.042 522 HD3 LYS 158 HD1 LYS 158 -0.779 5.448 -5.467 523 HE2 LYS 158 HE2 LYS 158 -0.049 3.502 -3.639 524 HE3 LYS 158 HE1 LYS 158 -0.899 4.690 -2.631 525 HZ1 LYS 158 HZ1 LYS 158 -1.896 3.106 -4.866 526 HZ2 LYS 158 HZ2 LYS 158 -2.439 4.713 -4.783 527 HZ3 LYS 158 HZ3 LYS 158 -2.708 3.655 -3.482 528 H GLY 159 HN GLY 159 5.254 4.667 -7.168 529 HA2 GLY 159 HA2 GLY 159 4.658 2.887 -9.081 530 HA3 GLY 159 HA1 GLY 159 4.308 4.380 -9.956 531 H VAL 160 HN VAL 160 6.537 5.641 -8.221 532 HA VAL 160 HA VAL 160 8.650 5.397 -10.170 533 HB VAL 160 HB VAL 160 9.804 6.901 -8.650 534 HG11 VAL 160 HG11 VAL 160 6.846 7.476 -8.361 535 HG12 VAL 160 HG12 VAL 160 7.721 7.697 -9.876 536 HG13 VAL 160 HG13 VAL 160 8.166 8.639 -8.454 537 HG21 VAL 160 HG21 VAL 160 7.909 5.687 -6.657 538 HG22 VAL 160 HG22 VAL 160 8.526 7.316 -6.385 539 HG23 VAL 160 HG23 VAL 160 9.646 5.960 -6.516 540 H GLU 161 HN GLU 161 7.784 3.541 -7.382 541 HA GLU 161 HA GLU 161 9.852 1.583 -7.841 542 HB2 GLU 161 HB2 GLU 161 11.055 3.631 -6.863 543 HB3 GLU 161 HB1 GLU 161 10.209 3.275 -5.357 544 HG2 GLU 161 HG2 GLU 161 12.505 2.255 -5.492 545 HG3 GLU 161 HG1 GLU 161 11.218 1.076 -5.237 546 HO1 KDH 1 H1 KDH 1 11.061 8.108 -10.694 547 H21 KDH 1 H21 KDH 1 11.760 9.017 -4.072 548 H33 KDH 1 H33 KDH 1 8.708 13.263 -6.934 549 H4 KDH 1 H4 KDH 1 11.282 9.853 -8.165 550 HO7 KDH 1 H7 KDH 1 8.985 10.549 -12.677 551 H01 KDH 1 H01 KDH 1 10.001 14.166 -4.923 552 H01A KDH 1 H02 KDH 1 8.694 12.956 -4.612 553 HO03 KDH 1 H03 KDH 1 10.313 14.216 -2.038 554 HO10 KDH 1 H10 KDH 1 6.070 10.458 -10.567 555 H12 KDH 1 H12 KDH 1 7.242 11.607 -8.211 556 H15 KDH 1 H15 KDH 1 8.430 11.051 -6.233 557 H26 KDH 1 H26 KDH 1 12.456 12.341 -1.295 558 H39 KDH 1 H39 KDH 1 12.770 15.412 -9.165 559 H41 KDH 1 H41 KDH 1 9.707 12.363 -9.988 560 HO02 KDH 1 H42 KDH 1 12.531 8.946 -1.634 561 HO44 KDH 1 H44 KDH 1 11.036 10.945 -12.362 562 HO47 KDH 1 H47 KDH 1 13.754 13.699 -13.291 563 HO50 KDH 1 H50 KDH 1 13.708 16.058 -11.876 Start of MODEL 15 1 H1 MET 90 HT1 MET 90 14.997 10.685 2.070 2 H2 MET 90 HT2 MET 90 13.411 11.272 2.237 3 H3 MET 90 HT3 MET 90 13.935 10.644 0.748 4 HA MET 90 HA MET 90 14.019 8.436 1.589 5 HB2 MET 90 HB2 MET 90 14.100 10.034 4.088 6 HB3 MET 90 HB1 MET 90 13.246 8.494 4.199 7 HG2 MET 90 HG2 MET 90 16.066 8.863 3.144 8 HG3 MET 90 HG1 MET 90 15.646 8.226 4.734 9 HE1 MET 90 HE1 MET 90 14.916 5.540 5.100 10 HE2 MET 90 HE2 MET 90 13.606 5.112 4.001 11 HE3 MET 90 HE3 MET 90 13.585 6.672 4.821 12 H GLY 91 HN GLY 91 12.107 7.168 1.612 13 HA2 GLY 91 HA2 GLY 91 9.560 8.191 2.517 14 HA3 GLY 91 HA1 GLY 91 9.696 8.294 0.761 15 H LYS 92 HN LYS 92 8.106 6.493 2.701 16 HA LYS 92 HA LYS 92 8.623 3.980 1.189 17 HB2 LYS 92 HB2 LYS 92 9.649 4.429 3.710 18 HB3 LYS 92 HB1 LYS 92 8.127 3.614 4.071 19 HG2 LYS 92 HG2 LYS 92 9.083 2.112 1.978 20 HG3 LYS 92 HG1 LYS 92 10.571 2.552 2.817 21 HD2 LYS 92 HD2 LYS 92 8.144 1.194 4.020 22 HD3 LYS 92 HD1 LYS 92 9.742 0.487 3.781 23 HE2 LYS 92 HE2 LYS 92 10.524 1.403 5.707 24 HE3 LYS 92 HE1 LYS 92 9.848 2.993 5.302 25 HZ1 LYS 92 HZ1 LYS 92 7.801 2.452 6.169 26 HZ2 LYS 92 HZ2 LYS 92 8.829 1.643 7.253 27 HZ3 LYS 92 HZ3 LYS 92 8.045 0.781 6.017 28 H SER 93 HN SER 93 6.810 2.522 3.013 29 HA SER 93 HA SER 93 4.324 2.818 1.796 30 HB2 SER 93 HB2 SER 93 5.191 1.093 3.486 31 HB3 SER 93 HB1 SER 93 4.723 2.235 4.742 32 HG SER 93 HG SER 93 2.626 2.028 4.153 33 H GLU 94 HN GLU 94 2.265 3.688 2.968 34 HA GLU 94 HA GLU 94 2.290 6.481 3.155 35 HB2 GLU 94 HB2 GLU 94 0.551 4.238 4.034 36 HB3 GLU 94 HB1 GLU 94 0.227 5.803 4.782 37 HG2 GLU 94 HG2 GLU 94 0.253 6.787 2.427 38 HG3 GLU 94 HG1 GLU 94 0.224 5.125 1.835 39 H GLU 95 HN GLU 95 3.339 4.141 5.510 40 HA GLU 95 HA GLU 95 3.077 5.551 7.943 41 HB2 GLU 95 HB2 GLU 95 5.430 3.877 7.002 42 HB3 GLU 95 HB1 GLU 95 4.892 4.100 8.667 43 HG2 GLU 95 HG2 GLU 95 2.620 3.216 7.252 44 HG3 GLU 95 HG1 GLU 95 3.952 2.201 6.696 45 H GLU 96 HN GLU 96 6.109 5.408 6.032 46 HA GLU 96 HA GLU 96 7.155 7.831 7.260 47 HB2 GLU 96 HB2 GLU 96 7.918 5.824 5.189 48 HB3 GLU 96 HB1 GLU 96 8.716 7.394 5.098 49 HG2 GLU 96 HG2 GLU 96 9.052 7.042 7.689 50 HG3 GLU 96 HG1 GLU 96 8.827 5.341 7.282 51 H LEU 97 HN LEU 97 5.153 7.086 4.535 52 HA LEU 97 HA LEU 97 5.663 9.419 2.914 53 HB2 LEU 97 HB2 LEU 97 4.053 7.056 2.958 54 HB3 LEU 97 HB1 LEU 97 2.984 8.427 2.664 55 HG LEU 97 HG LEU 97 4.018 7.360 0.591 56 HD11 LEU 97 HD11 LEU 97 4.744 9.699 -0.295 57 HD12 LEU 97 HD12 LEU 97 4.267 10.275 1.302 58 HD13 LEU 97 HD13 LEU 97 3.082 9.488 0.259 59 HD21 LEU 97 HD21 LEU 97 6.276 7.363 0.266 60 HD22 LEU 97 HD22 LEU 97 6.339 7.476 2.025 61 HD23 LEU 97 HD23 LEU 97 6.484 8.933 1.042 62 H SER 98 HN SER 98 3.794 8.845 5.805 63 HA SER 98 HA SER 98 2.006 11.128 5.507 64 HB2 SER 98 HB2 SER 98 2.124 8.848 7.026 65 HB3 SER 98 HB1 SER 98 2.618 10.066 8.199 66 HG SER 98 HG SER 98 0.337 10.284 6.523 67 H ASP 99 HN ASP 99 5.106 10.525 7.143 68 HA ASP 99 HA ASP 99 5.152 13.313 8.175 69 HB2 ASP 99 HB2 ASP 99 6.194 10.732 8.908 70 HB3 ASP 99 HB1 ASP 99 7.535 11.866 8.741 71 H LEU 100 HN LEU 100 6.215 11.543 5.454 72 HA LEU 100 HA LEU 100 8.667 13.065 4.950 73 HB2 LEU 100 HB2 LEU 100 8.524 10.819 4.144 74 HB3 LEU 100 HB1 LEU 100 6.944 11.108 3.414 75 HG LEU 100 HG LEU 100 8.058 12.796 1.895 76 HD11 LEU 100 HD11 LEU 100 10.074 13.389 2.907 77 HD12 LEU 100 HD12 LEU 100 10.624 12.217 1.709 78 HD13 LEU 100 HD13 LEU 100 10.432 11.732 3.394 79 HD21 LEU 100 HD21 LEU 100 7.705 10.873 0.693 80 HD22 LEU 100 HD22 LEU 100 8.491 9.854 1.899 81 HD23 LEU 100 HD23 LEU 100 9.465 10.781 0.758 82 H PHE 101 HN PHE 101 5.265 13.286 4.048 83 HA PHE 101 HA PHE 101 5.630 15.189 1.889 84 HB2 PHE 101 HB2 PHE 101 3.659 13.846 1.947 85 HB3 PHE 101 HB1 PHE 101 3.333 14.270 3.627 86 HD1 PHE 101 HD1 PHE 101 3.928 16.034 0.362 87 HD2 PHE 101 HD2 PHE 101 1.648 15.826 3.996 88 HE1 PHE 101 HE1 PHE 101 2.556 17.960 -0.388 89 HE2 PHE 101 HE2 PHE 101 0.277 17.752 3.247 90 HZ PHE 101 HZ PHE 101 0.731 18.819 1.055 91 H ARG 102 HN ARG 102 4.716 15.492 5.334 92 HA ARG 102 HA ARG 102 4.464 18.384 5.246 93 HB2 ARG 102 HB2 ARG 102 4.306 18.088 7.700 94 HB3 ARG 102 HB1 ARG 102 3.312 16.901 6.855 95 HG2 ARG 102 HG2 ARG 102 4.463 15.216 7.800 96 HG3 ARG 102 HG1 ARG 102 5.974 15.855 7.151 97 HD2 ARG 102 HD2 ARG 102 6.448 16.056 9.413 98 HD3 ARG 102 HD1 ARG 102 5.609 17.603 9.182 99 HE ARG 102 HE ARG 102 3.627 15.630 9.648 100 HH11 ARG 102 HH21 ARG 102 6.283 17.161 11.241 101 HH12 ARG 102 HH22 ARG 102 5.591 17.008 12.821 102 HH21 ARG 102 HH11 ARG 102 2.716 15.427 11.705 103 HH22 ARG 102 HH12 ARG 102 3.575 16.027 13.083 104 H MET 103 HN MET 103 7.158 16.295 5.263 105 HA MET 103 HA MET 103 8.924 18.206 6.696 106 HB2 MET 103 HB2 MET 103 8.809 15.377 6.085 107 HB3 MET 103 HB1 MET 103 10.368 16.043 5.595 108 HG2 MET 103 HG2 MET 103 10.653 17.033 7.836 109 HG3 MET 103 HG1 MET 103 9.096 16.368 8.329 110 HE1 MET 103 HE1 MET 103 8.673 13.823 8.953 111 HE2 MET 103 HE2 MET 103 9.405 14.976 10.065 112 HE3 MET 103 HE3 MET 103 10.031 13.331 9.975 113 H PHE 104 HN PHE 104 7.982 17.368 3.466 114 HA PHE 104 HA PHE 104 10.434 18.351 2.186 115 HB2 PHE 104 HB2 PHE 104 7.938 16.987 1.512 116 HB3 PHE 104 HB1 PHE 104 8.370 18.207 0.312 117 HD1 PHE 104 HD1 PHE 104 9.847 15.384 2.284 118 HD2 PHE 104 HD2 PHE 104 9.989 17.728 -1.312 119 HE1 PHE 104 HE1 PHE 104 11.591 13.876 1.371 120 HE2 PHE 104 HE2 PHE 104 11.733 16.220 -2.226 121 HZ PHE 104 HZ PHE 104 12.534 14.294 -0.884 122 H ASP 105 HN ASP 105 7.218 19.604 2.968 123 HA ASP 105 HA ASP 105 7.264 21.951 1.336 124 HB2 ASP 105 HB2 ASP 105 5.499 20.712 2.962 125 HB3 ASP 105 HB1 ASP 105 6.009 22.016 4.035 126 H LYS 106 HN LYS 106 9.340 22.972 1.493 127 HA LYS 106 HA LYS 106 10.525 23.680 4.057 128 HB2 LYS 106 HB2 LYS 106 11.781 23.273 1.953 129 HB3 LYS 106 HB1 LYS 106 11.010 24.687 1.233 130 HG2 LYS 106 HG2 LYS 106 12.324 26.150 2.385 131 HG3 LYS 106 HG1 LYS 106 12.306 25.166 3.848 132 HD2 LYS 106 HD2 LYS 106 14.448 24.653 3.308 133 HD3 LYS 106 HD1 LYS 106 13.732 23.581 2.104 134 HE2 LYS 106 HE2 LYS 106 15.183 24.877 0.783 135 HE3 LYS 106 HE1 LYS 106 13.667 25.789 0.633 136 HZ1 LYS 106 HZ1 LYS 106 14.313 27.282 2.291 137 HZ2 LYS 106 HZ2 LYS 106 15.720 27.084 1.360 138 HZ3 LYS 106 HZ3 LYS 106 15.563 26.281 2.849 139 H ASN 107 HN ASN 107 8.008 25.003 2.139 140 HA ASN 107 HA ASN 107 8.370 27.804 2.857 141 HB2 ASN 107 HB2 ASN 107 7.059 26.561 0.916 142 HB3 ASN 107 HB1 ASN 107 5.744 26.566 2.091 143 HD21 ASN 107 HD21 ASN 107 4.503 28.160 0.869 144 HD22 ASN 107 HD22 ASN 107 4.992 29.784 0.784 145 H ALA 108 HN ALA 108 7.554 25.140 4.692 146 HA ALA 108 HA ALA 108 6.495 24.886 6.789 147 HB1 ALA 108 HB1 ALA 108 8.039 26.502 7.547 148 HB2 ALA 108 HB2 ALA 108 6.485 27.175 8.041 149 HB3 ALA 108 HB3 ALA 108 7.293 27.787 6.598 150 H ASP 109 HN ASP 109 4.399 24.320 5.887 151 HA ASP 109 HA ASP 109 2.257 26.122 6.643 152 HB2 ASP 109 HB2 ASP 109 2.816 27.315 4.665 153 HB3 ASP 109 HB1 ASP 109 3.107 25.830 3.758 154 H GLY 110 HN GLY 110 3.227 23.347 4.630 155 HA2 GLY 110 HA2 GLY 110 2.345 21.115 5.122 156 HA3 GLY 110 HA1 GLY 110 0.862 21.877 5.700 157 H TYR 111 HN TYR 111 2.173 23.240 2.836 158 HA TYR 111 HA TYR 111 0.417 21.558 1.100 159 HB2 TYR 111 HB2 TYR 111 0.350 24.561 1.501 160 HB3 TYR 111 HB1 TYR 111 -0.442 23.754 0.148 161 HD1 TYR 111 HD2 TYR 111 -2.320 22.188 0.534 162 HD2 TYR 111 HD1 TYR 111 -0.513 24.387 3.753 163 HE1 TYR 111 HE2 TYR 111 -4.262 21.662 1.985 164 HE2 TYR 111 HE1 TYR 111 -2.455 23.860 5.202 165 HH TYR 111 HH TYR 111 -5.277 23.033 4.264 166 H ILE 112 HN ILE 112 1.578 20.996 -0.697 167 HA ILE 112 HA ILE 112 4.031 22.540 -1.372 168 HB ILE 112 HB ILE 112 2.913 19.871 -2.294 169 HG12 ILE 112 HG12 ILE 112 5.084 20.604 -0.304 170 HG13 ILE 112 HG11 ILE 112 3.529 19.860 0.072 171 HG21 ILE 112 HG21 ILE 112 5.213 19.509 -3.170 172 HG22 ILE 112 HG22 ILE 112 5.616 21.173 -2.747 173 HG23 ILE 112 HG23 ILE 112 4.398 20.846 -3.980 174 HD11 ILE 112 HD11 ILE 112 4.720 17.918 -0.071 175 HD12 ILE 112 HD12 ILE 112 5.976 18.644 -1.074 176 HD13 ILE 112 HD13 ILE 112 4.456 18.124 -1.802 177 H ASP 113 HN ASP 113 3.827 24.084 -2.949 178 HA ASP 113 HA ASP 113 1.682 23.730 -5.013 179 HB2 ASP 113 HB2 ASP 113 3.137 26.231 -4.096 180 HB3 ASP 113 HB1 ASP 113 1.705 26.164 -5.124 181 H LEU 114 HN LEU 114 2.402 25.102 -7.091 182 HA LEU 114 HA LEU 114 4.494 23.738 -8.405 183 HB2 LEU 114 HB2 LEU 114 3.020 26.334 -8.768 184 HB3 LEU 114 HB1 LEU 114 4.350 25.939 -9.857 185 HG LEU 114 HG LEU 114 2.121 23.979 -9.301 186 HD11 LEU 114 HD11 LEU 114 1.107 24.775 -11.436 187 HD12 LEU 114 HD12 LEU 114 2.270 26.100 -11.465 188 HD13 LEU 114 HD13 LEU 114 1.071 26.008 -10.175 189 HD21 LEU 114 HD21 LEU 114 4.416 24.246 -11.201 190 HD22 LEU 114 HD22 LEU 114 2.950 23.461 -11.788 191 HD23 LEU 114 HD23 LEU 114 3.798 22.809 -10.386 192 H ASP 115 HN ASP 115 4.572 26.783 -6.567 193 HA ASP 115 HA ASP 115 7.299 27.471 -7.232 194 HB2 ASP 115 HB2 ASP 115 5.588 28.195 -4.830 195 HB3 ASP 115 HB1 ASP 115 6.987 29.094 -5.420 196 H GLU 116 HN GLU 116 5.808 25.496 -4.704 197 HA GLU 116 HA GLU 116 8.411 25.147 -3.321 198 HB2 GLU 116 HB2 GLU 116 5.699 23.924 -2.740 199 HB3 GLU 116 HB1 GLU 116 7.047 24.114 -1.619 200 HG2 GLU 116 HG2 GLU 116 6.856 26.585 -1.849 201 HG3 GLU 116 HG1 GLU 116 5.451 26.356 -2.891 202 H LEU 117 HN LEU 117 6.359 23.517 -5.614 203 HA LEU 117 HA LEU 117 7.051 20.800 -5.211 204 HB2 LEU 117 HB2 LEU 117 6.262 22.544 -7.524 205 HB3 LEU 117 HB1 LEU 117 6.739 20.876 -7.844 206 HG LEU 117 HG LEU 117 4.639 21.656 -5.805 207 HD11 LEU 117 HD11 LEU 117 3.293 20.394 -7.811 208 HD12 LEU 117 HD12 LEU 117 4.507 21.276 -8.738 209 HD13 LEU 117 HD13 LEU 117 3.412 22.147 -7.665 210 HD21 LEU 117 HD21 LEU 117 6.048 19.228 -6.431 211 HD22 LEU 117 HD22 LEU 117 4.346 19.024 -6.847 212 HD23 LEU 117 HD23 LEU 117 4.805 19.489 -5.208 213 H LYS 118 HN LYS 118 8.880 23.439 -6.654 214 HA LYS 118 HA LYS 118 10.958 21.645 -7.734 215 HB2 LYS 118 HB2 LYS 118 11.857 23.701 -8.611 216 HB3 LYS 118 HB1 LYS 118 10.102 23.818 -8.758 217 HG2 LYS 118 HG2 LYS 118 10.157 24.968 -6.457 218 HG3 LYS 118 HG1 LYS 118 11.895 25.131 -6.712 219 HD2 LYS 118 HD2 LYS 118 10.521 25.940 -9.103 220 HD3 LYS 118 HD1 LYS 118 9.833 26.800 -7.725 221 HE2 LYS 118 HE2 LYS 118 11.629 28.181 -7.775 222 HE3 LYS 118 HE1 LYS 118 12.649 26.795 -7.340 223 HZ1 LYS 118 HZ1 LYS 118 11.783 27.537 -10.086 224 HZ2 LYS 118 HZ2 LYS 118 12.688 26.156 -9.686 225 HZ3 LYS 118 HZ3 LYS 118 13.350 27.704 -9.459 226 H ILE 119 HN ILE 119 10.416 23.680 -4.909 227 HA ILE 119 HA ILE 119 13.218 23.534 -4.024 228 HB ILE 119 HB ILE 119 10.631 24.567 -2.823 229 HG12 ILE 119 HG12 ILE 119 13.049 25.967 -4.016 230 HG13 ILE 119 HG11 ILE 119 11.473 25.801 -4.792 231 HG21 ILE 119 HG21 ILE 119 11.738 24.517 -0.851 232 HG22 ILE 119 HG22 ILE 119 12.753 25.796 -1.519 233 HG23 ILE 119 HG23 ILE 119 13.266 24.113 -1.633 234 HD11 ILE 119 HD11 ILE 119 11.980 28.010 -3.519 235 HD12 ILE 119 HD12 ILE 119 11.718 27.052 -2.061 236 HD13 ILE 119 HD13 ILE 119 10.422 27.231 -3.244 237 H MET 120 HN MET 120 10.188 21.838 -3.413 238 HA MET 120 HA MET 120 10.896 20.579 -0.941 239 HB2 MET 120 HB2 MET 120 8.953 19.297 -1.348 240 HB3 MET 120 HB1 MET 120 8.651 20.785 -2.243 241 HG2 MET 120 HG2 MET 120 9.341 19.736 -4.324 242 HG3 MET 120 HG1 MET 120 9.830 18.274 -3.468 243 HE1 MET 120 HE1 MET 120 8.279 16.399 -2.703 244 HE2 MET 120 HE2 MET 120 6.627 16.714 -2.179 245 HE3 MET 120 HE3 MET 120 7.962 17.589 -1.434 246 H LEU 121 HN LEU 121 11.543 19.701 -4.320 247 HA LEU 121 HA LEU 121 12.770 17.134 -3.532 248 HB2 LEU 121 HB2 LEU 121 11.634 18.390 -5.856 249 HB3 LEU 121 HB1 LEU 121 13.254 17.813 -6.247 250 HG LEU 121 HG LEU 121 12.248 15.721 -4.776 251 HD11 LEU 121 HD11 LEU 121 10.000 15.876 -4.714 252 HD12 LEU 121 HD12 LEU 121 10.005 15.688 -6.467 253 HD13 LEU 121 HD13 LEU 121 10.017 17.301 -5.754 254 HD21 LEU 121 HD21 LEU 121 13.337 16.064 -7.215 255 HD22 LEU 121 HD22 LEU 121 11.675 15.727 -7.701 256 HD23 LEU 121 HD23 LEU 121 12.566 14.552 -6.733 257 H GLN 122 HN GLN 122 13.777 20.405 -3.993 258 HA GLN 122 HA GLN 122 16.358 20.255 -5.033 259 HB2 GLN 122 HB2 GLN 122 14.779 22.083 -3.685 260 HB3 GLN 122 HB1 GLN 122 16.140 21.867 -2.584 261 HG2 GLN 122 HG2 GLN 122 17.518 22.064 -4.871 262 HG3 GLN 122 HG1 GLN 122 16.096 22.993 -5.346 263 HE21 GLN 122 HE21 GLN 122 17.477 24.967 -5.328 264 HE22 GLN 122 HE22 GLN 122 17.879 25.704 -3.853 265 H ALA 123 HN ALA 123 15.185 18.967 -2.005 266 HA ALA 123 HA ALA 123 17.729 18.706 -0.660 267 HB1 ALA 123 HB1 ALA 123 16.381 17.078 0.717 268 HB2 ALA 123 HB2 ALA 123 15.068 17.262 -0.446 269 HB3 ALA 123 HB3 ALA 123 15.598 18.645 0.512 270 H THR 124 HN THR 124 16.505 17.194 -3.424 271 HA THR 124 HA THR 124 18.194 14.755 -2.976 272 HB THR 124 HB THR 124 16.661 13.637 -4.455 273 HG1 THR 124 HG1 THR 124 15.419 16.143 -4.893 274 HG21 THR 124 HG21 THR 124 14.526 13.956 -3.318 275 HG22 THR 124 HG22 THR 124 15.047 15.534 -2.728 276 HG23 THR 124 HG23 THR 124 15.837 14.069 -2.144 277 H GLY 125 HN GLY 125 17.985 17.686 -4.689 278 HA2 GLY 125 HA2 GLY 125 19.731 18.485 -6.143 279 HA3 GLY 125 HA1 GLY 125 20.181 16.812 -6.478 280 H GLU 126 HN GLU 126 16.867 18.006 -6.601 281 HA GLU 126 HA GLU 126 16.323 16.876 -9.161 282 HB2 GLU 126 HB2 GLU 126 14.269 18.246 -8.974 283 HB3 GLU 126 HB1 GLU 126 14.655 17.475 -7.435 284 HG2 GLU 126 HG2 GLU 126 14.717 19.496 -6.451 285 HG3 GLU 126 HG1 GLU 126 16.046 19.960 -7.513 286 H THR 127 HN THR 127 17.964 17.589 -10.661 287 HA THR 127 HA THR 127 18.010 20.523 -11.251 288 HB THR 127 HB THR 127 20.159 19.998 -12.309 289 HG1 THR 127 HG1 THR 127 20.658 17.565 -11.741 290 HG21 THR 127 HG21 THR 127 21.282 19.802 -10.333 291 HG22 THR 127 HG22 THR 127 20.398 18.352 -9.859 292 HG23 THR 127 HG23 THR 127 19.667 19.941 -9.639 293 H ILE 128 HN ILE 128 16.127 20.636 -12.585 294 HA ILE 128 HA ILE 128 16.440 19.314 -15.247 295 HB ILE 128 HB ILE 128 14.190 18.554 -15.200 296 HG12 ILE 128 HG12 ILE 128 13.278 20.704 -14.252 297 HG13 ILE 128 HG11 ILE 128 12.539 19.255 -13.572 298 HG21 ILE 128 HG21 ILE 128 14.801 18.150 -12.298 299 HG22 ILE 128 HG22 ILE 128 15.951 17.541 -13.487 300 HG23 ILE 128 HG23 ILE 128 14.279 16.981 -13.510 301 HD11 ILE 128 HD11 ILE 128 14.691 19.662 -11.894 302 HD12 ILE 128 HD12 ILE 128 13.034 20.161 -11.557 303 HD13 ILE 128 HD13 ILE 128 14.176 21.308 -12.259 304 H THR 129 HN THR 129 14.931 20.419 -16.887 305 HA THR 129 HA THR 129 15.381 23.259 -16.882 306 HB THR 129 HB THR 129 13.940 23.121 -18.924 307 HG1 THR 129 HG1 THR 129 13.277 20.746 -17.676 308 HG21 THR 129 HG21 THR 129 16.209 22.595 -19.321 309 HG22 THR 129 HG22 THR 129 15.325 21.243 -20.029 310 HG23 THR 129 HG23 THR 129 16.094 21.064 -18.452 311 H GLU 130 HN GLU 130 13.201 24.627 -17.503 312 HA GLU 130 HA GLU 130 11.588 24.594 -15.036 313 HB2 GLU 130 HB2 GLU 130 12.394 26.704 -15.869 314 HB3 GLU 130 HB1 GLU 130 11.775 26.368 -17.486 315 HG2 GLU 130 HG2 GLU 130 9.470 26.417 -16.634 316 HG3 GLU 130 HG1 GLU 130 10.070 26.707 -15.001 317 H ASP 131 HN ASP 131 11.338 23.378 -18.252 318 HA ASP 131 HA ASP 131 8.414 23.425 -18.404 319 HB2 ASP 131 HB2 ASP 131 9.959 23.515 -20.359 320 HB3 ASP 131 HB1 ASP 131 10.513 21.886 -19.969 321 H ASP 132 HN ASP 132 10.740 21.469 -16.833 322 HA ASP 132 HA ASP 132 9.139 18.990 -16.908 323 HB2 ASP 132 HB2 ASP 132 11.829 19.777 -16.471 324 HB3 ASP 132 HB1 ASP 132 11.273 19.045 -14.966 325 H ILE 133 HN ILE 133 9.577 21.777 -14.844 326 HA ILE 133 HA ILE 133 8.694 20.670 -12.352 327 HB ILE 133 HB ILE 133 8.427 23.460 -13.519 328 HG12 ILE 133 HG12 ILE 133 10.745 22.386 -13.492 329 HG13 ILE 133 HG11 ILE 133 10.596 23.900 -12.600 330 HG21 ILE 133 HG21 ILE 133 8.505 22.515 -10.638 331 HG22 ILE 133 HG22 ILE 133 7.060 23.068 -11.483 332 HG23 ILE 133 HG23 ILE 133 8.385 24.190 -11.177 333 HD11 ILE 133 HD11 ILE 133 9.901 21.695 -10.878 334 HD12 ILE 133 HD12 ILE 133 11.192 22.881 -10.685 335 HD13 ILE 133 HD13 ILE 133 11.481 21.404 -11.604 336 H GLU 134 HN GLU 134 6.931 22.079 -15.105 337 HA GLU 134 HA GLU 134 4.337 22.119 -13.847 338 HB2 GLU 134 HB2 GLU 134 5.238 21.969 -16.742 339 HB3 GLU 134 HB1 GLU 134 3.600 22.369 -16.224 340 HG2 GLU 134 HG2 GLU 134 4.454 24.316 -14.985 341 HG3 GLU 134 HG1 GLU 134 6.100 23.915 -15.478 342 H GLU 135 HN GLU 135 6.203 19.613 -15.453 343 HA GLU 135 HA GLU 135 4.059 17.804 -16.065 344 HB2 GLU 135 HB2 GLU 135 6.517 17.852 -16.825 345 HB3 GLU 135 HB1 GLU 135 6.891 17.081 -15.283 346 HG2 GLU 135 HG2 GLU 135 4.753 15.942 -17.070 347 HG3 GLU 135 HG1 GLU 135 6.451 15.564 -17.360 348 H LEU 136 HN LEU 136 6.124 18.194 -13.181 349 HA LEU 136 HA LEU 136 5.198 15.929 -11.719 350 HB2 LEU 136 HB2 LEU 136 6.327 18.641 -11.009 351 HB3 LEU 136 HB1 LEU 136 5.945 17.451 -9.763 352 HG LEU 136 HG LEU 136 7.421 16.227 -11.942 353 HD11 LEU 136 HD11 LEU 136 8.244 18.890 -11.177 354 HD12 LEU 136 HD12 LEU 136 8.960 17.812 -12.375 355 HD13 LEU 136 HD13 LEU 136 9.467 17.717 -10.688 356 HD21 LEU 136 HD21 LEU 136 8.858 15.520 -10.056 357 HD22 LEU 136 HD22 LEU 136 7.152 15.287 -9.675 358 HD23 LEU 136 HD23 LEU 136 8.028 16.660 -8.998 359 H MET 137 HN MET 137 3.834 19.166 -12.146 360 HA MET 137 HA MET 137 1.921 19.143 -10.035 361 HB2 MET 137 HB2 MET 137 2.660 20.705 -12.287 362 HB3 MET 137 HB1 MET 137 0.927 20.406 -12.432 363 HG2 MET 137 HG2 MET 137 2.348 21.543 -10.006 364 HG3 MET 137 HG1 MET 137 1.301 22.433 -11.112 365 HE1 MET 137 HE1 MET 137 0.608 20.907 -7.366 366 HE2 MET 137 HE2 MET 137 -0.158 22.430 -7.808 367 HE3 MET 137 HE3 MET 137 1.529 22.146 -8.230 368 H LYS 138 HN LYS 138 1.746 17.894 -13.367 369 HA LYS 138 HA LYS 138 -0.991 17.142 -13.419 370 HB2 LYS 138 HB2 LYS 138 1.562 16.220 -14.717 371 HB3 LYS 138 HB1 LYS 138 0.063 15.344 -15.032 372 HG2 LYS 138 HG2 LYS 138 -0.650 18.034 -15.277 373 HG3 LYS 138 HG1 LYS 138 0.932 17.931 -16.051 374 HD2 LYS 138 HD2 LYS 138 -0.006 16.958 -17.846 375 HD3 LYS 138 HD1 LYS 138 -0.574 15.632 -16.830 376 HE2 LYS 138 HE2 LYS 138 -2.068 18.260 -16.927 377 HE3 LYS 138 HE1 LYS 138 -2.383 16.971 -18.107 378 HZ1 LYS 138 HZ1 LYS 138 -3.129 15.549 -16.511 379 HZ2 LYS 138 HZ2 LYS 138 -3.605 17.012 -15.791 380 HZ3 LYS 138 HZ3 LYS 138 -2.183 16.233 -15.281 381 H ASP 139 HN ASP 139 1.734 14.862 -12.958 382 HA ASP 139 HA ASP 139 0.187 12.730 -11.903 383 HB2 ASP 139 HB2 ASP 139 3.072 13.605 -11.659 384 HB3 ASP 139 HB1 ASP 139 2.500 12.102 -10.933 385 H GLY 140 HN GLY 140 2.132 15.177 -10.143 386 HA2 GLY 140 HA2 GLY 140 1.444 14.364 -7.521 387 HA3 GLY 140 HA1 GLY 140 1.899 16.011 -7.961 388 H ASP 141 HN ASP 141 -0.345 16.222 -9.890 389 HA ASP 141 HA ASP 141 -2.765 16.021 -8.198 390 HB2 ASP 141 HB2 ASP 141 -1.112 18.396 -8.520 391 HB3 ASP 141 HB1 ASP 141 -2.759 18.685 -9.082 392 H LYS 142 HN LYS 142 -3.395 14.621 -10.020 393 HA LYS 142 HA LYS 142 -3.436 15.426 -12.753 394 HB2 LYS 142 HB2 LYS 142 -4.498 13.346 -11.014 395 HB3 LYS 142 HB1 LYS 142 -5.647 13.762 -12.287 396 HG2 LYS 142 HG2 LYS 142 -3.761 13.542 -13.949 397 HG3 LYS 142 HG1 LYS 142 -2.760 12.914 -12.640 398 HD2 LYS 142 HD2 LYS 142 -4.273 11.048 -12.301 399 HD3 LYS 142 HD1 LYS 142 -5.416 11.712 -13.469 400 HE2 LYS 142 HE2 LYS 142 -3.401 11.603 -15.140 401 HE3 LYS 142 HE1 LYS 142 -2.729 10.445 -13.975 402 HZ1 LYS 142 HZ1 LYS 142 -5.487 10.301 -15.066 403 HZ2 LYS 142 HZ2 LYS 142 -4.721 9.154 -14.075 404 HZ3 LYS 142 HZ3 LYS 142 -4.185 9.398 -15.668 405 H ASN 143 HN ASN 143 -5.230 16.604 -10.094 406 HA ASN 143 HA ASN 143 -7.398 17.651 -11.871 407 HB2 ASN 143 HB2 ASN 143 -8.401 18.181 -9.541 408 HB3 ASN 143 HB1 ASN 143 -8.294 16.485 -10.009 409 HD21 ASN 143 HD21 ASN 143 -6.919 18.953 -7.871 410 HD22 ASN 143 HD22 ASN 143 -6.018 17.875 -6.918 411 H ASN 144 HN ASN 144 -4.544 18.688 -11.535 412 HA ASN 144 HA ASN 144 -3.453 20.766 -11.222 413 HB2 ASN 144 HB2 ASN 144 -6.204 21.238 -12.312 414 HB3 ASN 144 HB1 ASN 144 -5.214 22.638 -11.901 415 HD21 ASN 144 HD21 ASN 144 -4.058 19.491 -13.178 416 HD22 ASN 144 HD22 ASN 144 -3.415 20.134 -14.611 417 H ASP 145 HN ASP 145 -6.478 22.287 -10.361 418 HA ASP 145 HA ASP 145 -7.261 23.156 -8.299 419 HB2 ASP 145 HB2 ASP 145 -6.149 20.657 -7.784 420 HB3 ASP 145 HB1 ASP 145 -5.339 21.712 -6.626 421 H GLY 146 HN GLY 146 -3.722 22.574 -8.022 422 HA2 GLY 146 HA2 GLY 146 -2.185 24.517 -8.229 423 HA3 GLY 146 HA1 GLY 146 -3.421 25.490 -7.431 424 H ARG 147 HN ARG 147 -3.653 22.707 -5.806 425 HA ARG 147 HA ARG 147 -1.361 23.269 -3.966 426 HB2 ARG 147 HB2 ARG 147 -3.050 23.056 -2.095 427 HB3 ARG 147 HB1 ARG 147 -3.281 24.476 -3.115 428 HG2 ARG 147 HG2 ARG 147 -5.108 23.483 -4.268 429 HG3 ARG 147 HG1 ARG 147 -4.725 21.876 -3.649 430 HD2 ARG 147 HD2 ARG 147 -5.839 22.245 -1.692 431 HD3 ARG 147 HD1 ARG 147 -5.205 23.896 -1.544 432 HE ARG 147 HE ARG 147 -7.697 23.140 -2.871 433 HH11 ARG 147 HH21 ARG 147 -5.073 25.378 -2.685 434 HH12 ARG 147 HH22 ARG 147 -5.973 26.688 -3.372 435 HH21 ARG 147 HH11 ARG 147 -8.879 24.842 -3.767 436 HH22 ARG 147 HH12 ARG 147 -8.125 26.386 -3.981 437 H ILE 148 HN ILE 148 -0.381 21.395 -3.302 438 HA ILE 148 HA ILE 148 -1.739 18.806 -3.934 439 HB ILE 148 HB ILE 148 1.167 19.298 -3.247 440 HG12 ILE 148 HG12 ILE 148 -0.206 19.518 -5.946 441 HG13 ILE 148 HG11 ILE 148 0.606 20.819 -5.076 442 HG21 ILE 148 HG21 ILE 148 -0.155 17.223 -5.017 443 HG22 ILE 148 HG22 ILE 148 0.233 16.958 -3.317 444 HG23 ILE 148 HG23 ILE 148 1.526 17.249 -4.482 445 HD11 ILE 148 HD11 ILE 148 1.760 18.950 -6.886 446 HD12 ILE 148 HD12 ILE 148 2.408 18.599 -5.284 447 HD13 ILE 148 HD13 ILE 148 2.578 20.215 -5.969 448 H ASP 149 HN ASP 149 -2.548 17.692 -2.200 449 HA ASP 149 HA ASP 149 -1.430 18.299 0.516 450 HB2 ASP 149 HB2 ASP 149 -3.725 17.520 1.243 451 HB3 ASP 149 HB1 ASP 149 -3.741 18.967 0.234 452 H TYR 150 HN TYR 150 -1.925 16.302 2.044 453 HA TYR 150 HA TYR 150 -0.320 14.102 1.247 454 HB2 TYR 150 HB2 TYR 150 -0.798 14.699 3.564 455 HB3 TYR 150 HB1 TYR 150 -2.516 14.381 3.323 456 HD1 TYR 150 HD1 TYR 150 0.798 12.668 2.884 457 HD2 TYR 150 HD2 TYR 150 -3.348 12.297 3.946 458 HE1 TYR 150 HE1 TYR 150 1.157 10.280 3.448 459 HE2 TYR 150 HE2 TYR 150 -2.990 9.909 4.510 460 HH TYR 150 HH TYR 150 -1.373 8.096 3.888 461 H ASP 151 HN ASP 151 -3.604 14.842 0.475 462 HA ASP 151 HA ASP 151 -4.537 12.119 0.045 463 HB2 ASP 151 HB2 ASP 151 -5.727 14.486 0.382 464 HB3 ASP 151 HB1 ASP 151 -5.660 14.500 -1.381 465 H GLU 152 HN GLU 152 -3.562 14.754 -2.187 466 HA GLU 152 HA GLU 152 -3.513 12.918 -4.481 467 HB2 GLU 152 HB2 GLU 152 -2.711 15.816 -4.061 468 HB3 GLU 152 HB1 GLU 152 -2.772 15.020 -5.634 469 HG2 GLU 152 HG2 GLU 152 -5.054 15.047 -5.706 470 HG3 GLU 152 HG1 GLU 152 -5.211 14.746 -3.975 471 H PHE 153 HN PHE 153 -1.261 14.154 -2.121 472 HA PHE 153 HA PHE 153 1.196 13.914 -3.530 473 HB2 PHE 153 HB2 PHE 153 0.819 14.959 -1.301 474 HB3 PHE 153 HB1 PHE 153 0.555 13.356 -0.615 475 HD1 PHE 153 HD1 PHE 153 3.055 14.929 -2.940 476 HD2 PHE 153 HD2 PHE 153 2.382 12.509 0.544 477 HE1 PHE 153 HE1 PHE 153 5.503 14.639 -2.668 478 HE2 PHE 153 HE2 PHE 153 4.830 12.220 0.816 479 HZ PHE 153 HZ PHE 153 6.390 13.285 -0.790 480 H LEU 154 HN LEU 154 -0.964 11.475 -2.265 481 HA LEU 154 HA LEU 154 0.971 9.313 -2.140 482 HB2 LEU 154 HB2 LEU 154 -2.052 9.496 -2.284 483 HB3 LEU 154 HB1 LEU 154 -1.195 7.968 -2.078 484 HG LEU 154 HG LEU 154 -1.190 10.352 -0.214 485 HD11 LEU 154 HD11 LEU 154 -1.858 8.511 1.408 486 HD12 LEU 154 HD12 LEU 154 -2.037 7.454 0.008 487 HD13 LEU 154 HD13 LEU 154 -3.053 8.886 0.166 488 HD21 LEU 154 HD21 LEU 154 0.690 8.011 -0.447 489 HD22 LEU 154 HD22 LEU 154 0.352 8.716 1.134 490 HD23 LEU 154 HD23 LEU 154 1.066 9.706 -0.139 491 H GLU 155 HN GLU 155 -1.753 9.860 -4.426 492 HA GLU 155 HA GLU 155 -1.132 7.942 -6.351 493 HB2 GLU 155 HB2 GLU 155 -2.097 10.804 -6.674 494 HB3 GLU 155 HB1 GLU 155 -2.220 9.573 -7.930 495 HG2 GLU 155 HG2 GLU 155 -3.434 8.156 -6.124 496 HG3 GLU 155 HG1 GLU 155 -3.629 9.687 -5.269 497 H PHE 156 HN PHE 156 0.502 10.970 -5.672 498 HA PHE 156 HA PHE 156 2.019 11.271 -8.072 499 HB2 PHE 156 HB2 PHE 156 1.752 12.984 -6.338 500 HB3 PHE 156 HB1 PHE 156 2.598 11.967 -5.174 501 HD1 PHE 156 HD2 PHE 156 3.164 13.160 -8.696 502 HD2 PHE 156 HD1 PHE 156 4.803 12.553 -4.772 503 HE1 PHE 156 HE2 PHE 156 5.336 14.082 -9.460 504 HE2 PHE 156 HE1 PHE 156 6.975 13.476 -5.536 505 HZ PHE 156 HZ PHE 156 7.241 14.241 -7.880 506 H MET 157 HN MET 157 2.724 9.512 -5.043 507 HA MET 157 HA MET 157 5.371 8.667 -5.749 508 HB2 MET 157 HB2 MET 157 3.211 7.567 -3.929 509 HB3 MET 157 HB1 MET 157 4.859 6.939 -3.957 510 HG2 MET 157 HG2 MET 157 5.087 9.754 -3.792 511 HG3 MET 157 HG1 MET 157 3.851 9.287 -2.624 512 HE1 MET 157 HE1 MET 157 6.865 10.280 -3.155 513 HE2 MET 157 HE2 MET 157 7.974 8.917 -3.278 514 HE3 MET 157 HE3 MET 157 7.841 9.801 -1.760 515 H LYS 158 HN LYS 158 2.376 6.689 -5.696 516 HA LYS 158 HA LYS 158 1.773 4.813 -7.002 517 HB2 LYS 158 HB2 LYS 158 2.699 6.955 -8.621 518 HB3 LYS 158 HB1 LYS 158 3.348 5.473 -9.326 519 HG2 LYS 158 HG2 LYS 158 0.545 5.236 -8.471 520 HG3 LYS 158 HG1 LYS 158 0.796 6.431 -9.745 521 HD2 LYS 158 HD2 LYS 158 0.810 4.702 -11.198 522 HD3 LYS 158 HD1 LYS 158 2.385 4.277 -10.526 523 HE2 LYS 158 HE2 LYS 158 1.544 2.463 -9.432 524 HE3 LYS 158 HE1 LYS 158 0.109 3.355 -8.888 525 HZ1 LYS 158 HZ1 LYS 158 -0.989 2.985 -10.858 526 HZ2 LYS 158 HZ2 LYS 158 -0.134 1.525 -10.699 527 HZ3 LYS 158 HZ3 LYS 158 0.435 2.737 -11.745 528 H GLY 159 HN GLY 159 4.571 5.002 -5.560 529 HA2 GLY 159 HA2 GLY 159 5.934 3.035 -5.128 530 HA3 GLY 159 HA1 GLY 159 5.591 2.479 -6.766 531 H VAL 160 HN VAL 160 6.092 5.305 -7.764 532 HA VAL 160 HA VAL 160 7.944 6.354 -8.809 533 HB VAL 160 HB VAL 160 8.996 5.797 -6.015 534 HG11 VAL 160 HG11 VAL 160 10.079 8.151 -6.671 535 HG12 VAL 160 HG12 VAL 160 9.933 7.482 -8.296 536 HG13 VAL 160 HG13 VAL 160 10.872 6.628 -7.071 537 HG21 VAL 160 HG21 VAL 160 6.905 6.936 -5.814 538 HG22 VAL 160 HG22 VAL 160 7.262 7.982 -7.189 539 HG23 VAL 160 HG23 VAL 160 8.140 8.187 -5.672 540 H GLU 161 HN GLU 161 8.428 4.573 -10.292 541 HA GLU 161 HA GLU 161 10.957 3.145 -9.571 542 HB2 GLU 161 HB2 GLU 161 9.095 1.615 -9.214 543 HB3 GLU 161 HB1 GLU 161 8.422 2.010 -10.796 544 HG2 GLU 161 HG2 GLU 161 9.773 0.529 -11.826 545 HG3 GLU 161 HG1 GLU 161 11.198 1.178 -11.015 546 HO1 KDH 1 H1 KDH 1 10.742 8.193 -10.589 547 H21 KDH 1 H21 KDH 1 10.641 8.112 -3.843 548 H33 KDH 1 H33 KDH 1 8.410 13.020 -6.373 549 H4 KDH 1 H4 KDH 1 10.872 9.648 -7.803 550 HO7 KDH 1 H7 KDH 1 8.070 10.570 -12.331 551 H01 KDH 1 H01 KDH 1 9.504 13.491 -4.106 552 H01A KDH 1 H02 KDH 1 8.056 12.410 -4.144 553 HO03 KDH 1 H03 KDH 1 10.376 13.704 -2.497 554 HO10 KDH 1 H10 KDH 1 5.910 11.324 -10.232 555 H12 KDH 1 H12 KDH 1 7.008 11.751 -8.048 556 H15 KDH 1 H15 KDH 1 7.856 10.771 -6.052 557 H26 KDH 1 H26 KDH 1 11.214 10.904 -0.508 558 H39 KDH 1 H39 KDH 1 10.709 14.097 -10.268 559 H41 KDH 1 H41 KDH 1 12.651 11.907 -6.980 560 HO02 KDH 1 H42 KDH 1 11.236 8.444 -0.424 561 HO44 KDH 1 H44 KDH 1 14.970 11.391 -7.474 562 HO47 KDH 1 H47 KDH 1 14.782 12.676 -11.858 563 HO50 KDH 1 H50 KDH 1 12.229 14.473 -12.137 Start of MODEL 16 1 H1 MET 90 HT1 MET 90 13.047 7.502 2.143 2 H2 MET 90 HT2 MET 90 13.863 6.150 1.517 3 H3 MET 90 HT3 MET 90 12.272 5.994 2.092 4 HA MET 90 HA MET 90 12.705 7.932 -0.054 5 HB2 MET 90 HB2 MET 90 12.935 4.918 -0.275 6 HB3 MET 90 HB1 MET 90 12.621 5.962 -1.662 7 HG2 MET 90 HG2 MET 90 14.724 7.275 -0.823 8 HG3 MET 90 HG1 MET 90 15.088 5.787 0.051 9 HE1 MET 90 HE1 MET 90 16.402 4.505 -0.476 10 HE2 MET 90 HE2 MET 90 17.444 4.704 -1.882 11 HE3 MET 90 HE3 MET 90 16.284 3.379 -1.835 12 H GLY 91 HN GLY 91 10.767 7.652 -1.571 13 HA2 GLY 91 HA2 GLY 91 8.332 7.626 -0.083 14 HA3 GLY 91 HA1 GLY 91 8.438 7.576 -1.843 15 H LYS 92 HN LYS 92 7.393 5.853 0.799 16 HA LYS 92 HA LYS 92 7.431 3.298 -0.770 17 HB2 LYS 92 HB2 LYS 92 8.737 3.943 1.685 18 HB3 LYS 92 HB1 LYS 92 7.432 2.817 2.060 19 HG2 LYS 92 HG2 LYS 92 9.557 2.404 -0.066 20 HG3 LYS 92 HG1 LYS 92 9.509 1.604 1.505 21 HD2 LYS 92 HD2 LYS 92 7.277 0.653 0.907 22 HD3 LYS 92 HD1 LYS 92 7.440 1.367 -0.698 23 HE2 LYS 92 HE2 LYS 92 8.404 -0.644 -1.230 24 HE3 LYS 92 HE1 LYS 92 9.839 0.040 -0.442 25 HZ1 LYS 92 HZ1 LYS 92 8.410 -0.751 1.670 26 HZ2 LYS 92 HZ2 LYS 92 9.599 -1.712 0.931 27 HZ3 LYS 92 HZ3 LYS 92 7.960 -1.939 0.547 28 H SER 93 HN SER 93 6.067 4.353 2.361 29 HA SER 93 HA SER 93 3.323 3.907 1.254 30 HB2 SER 93 HB2 SER 93 2.861 2.309 2.868 31 HB3 SER 93 HB1 SER 93 4.589 2.024 2.678 32 HG SER 93 HG SER 93 4.058 2.282 4.864 33 H GLU 94 HN GLU 94 1.688 4.683 3.072 34 HA GLU 94 HA GLU 94 1.944 7.450 3.481 35 HB2 GLU 94 HB2 GLU 94 0.429 5.247 4.893 36 HB3 GLU 94 HB1 GLU 94 0.200 6.944 5.317 37 HG2 GLU 94 HG2 GLU 94 -1.114 7.272 3.520 38 HG3 GLU 94 HG1 GLU 94 0.126 6.624 2.446 39 H GLU 95 HN GLU 95 3.456 4.858 5.225 40 HA GLU 95 HA GLU 95 3.916 6.312 7.708 41 HB2 GLU 95 HB2 GLU 95 3.817 3.821 7.410 42 HB3 GLU 95 HB1 GLU 95 5.331 3.908 6.510 43 HG2 GLU 95 HG2 GLU 95 6.561 4.125 8.397 44 HG3 GLU 95 HG1 GLU 95 5.455 5.322 9.073 45 H GLU 96 HN GLU 96 5.680 5.870 4.668 46 HA GLU 96 HA GLU 96 8.046 7.299 5.759 47 HB2 GLU 96 HB2 GLU 96 7.654 5.194 4.014 48 HB3 GLU 96 HB1 GLU 96 7.976 6.539 2.919 49 HG2 GLU 96 HG2 GLU 96 9.714 5.860 5.306 50 HG3 GLU 96 HG1 GLU 96 10.048 5.315 3.662 51 H LEU 97 HN LEU 97 5.294 7.822 3.644 52 HA LEU 97 HA LEU 97 6.408 10.239 2.405 53 HB2 LEU 97 HB2 LEU 97 3.571 9.165 2.499 54 HB3 LEU 97 HB1 LEU 97 4.229 10.297 1.317 55 HG LEU 97 HG LEU 97 5.067 7.411 1.715 56 HD11 LEU 97 HD11 LEU 97 3.559 8.910 -0.432 57 HD12 LEU 97 HD12 LEU 97 3.048 7.477 0.461 58 HD13 LEU 97 HD13 LEU 97 4.329 7.354 -0.745 59 HD21 LEU 97 HD21 LEU 97 6.399 8.046 -0.459 60 HD22 LEU 97 HD22 LEU 97 7.073 8.458 1.118 61 HD23 LEU 97 HD23 LEU 97 6.258 9.693 0.157 62 H SER 98 HN SER 98 4.702 9.465 5.315 63 HA SER 98 HA SER 98 3.310 11.941 5.751 64 HB2 SER 98 HB2 SER 98 2.848 9.874 6.971 65 HB3 SER 98 HB1 SER 98 4.485 9.859 7.622 66 HG SER 98 HG SER 98 2.604 11.950 8.021 67 H ASP 99 HN ASP 99 6.571 10.822 6.686 68 HA ASP 99 HA ASP 99 7.246 13.295 8.073 69 HB2 ASP 99 HB2 ASP 99 8.808 10.910 7.041 70 HB3 ASP 99 HB1 ASP 99 9.538 12.203 7.993 71 H LEU 100 HN LEU 100 7.198 12.301 4.772 72 HA LEU 100 HA LEU 100 9.274 14.214 3.906 73 HB2 LEU 100 HB2 LEU 100 7.435 12.196 2.626 74 HB3 LEU 100 HB1 LEU 100 8.340 13.338 1.632 75 HG LEU 100 HG LEU 100 9.490 11.339 3.598 76 HD11 LEU 100 HD11 LEU 100 9.077 11.435 0.682 77 HD12 LEU 100 HD12 LEU 100 9.351 10.046 1.734 78 HD13 LEU 100 HD13 LEU 100 10.718 11.003 1.162 79 HD21 LEU 100 HD21 LEU 100 11.666 12.303 2.437 80 HD22 LEU 100 HD22 LEU 100 10.967 13.125 3.832 81 HD23 LEU 100 HD23 LEU 100 10.653 13.728 2.205 82 H PHE 101 HN PHE 101 5.751 13.779 3.385 83 HA PHE 101 HA PHE 101 5.161 16.055 1.893 84 HB2 PHE 101 HB2 PHE 101 3.574 14.290 2.592 85 HB3 PHE 101 HB1 PHE 101 3.641 14.887 4.250 86 HD1 PHE 101 HD1 PHE 101 2.703 17.105 4.832 87 HD2 PHE 101 HD2 PHE 101 2.336 15.464 0.879 88 HE1 PHE 101 HE1 PHE 101 0.937 18.765 4.306 89 HE2 PHE 101 HE2 PHE 101 0.571 17.124 0.354 90 HZ PHE 101 HZ PHE 101 -0.129 18.774 2.068 91 H ARG 102 HN ARG 102 5.217 15.894 5.479 92 HA ARG 102 HA ARG 102 4.816 18.698 5.902 93 HB2 ARG 102 HB2 ARG 102 5.487 18.140 8.182 94 HB3 ARG 102 HB1 ARG 102 4.512 16.820 7.538 95 HG2 ARG 102 HG2 ARG 102 6.318 15.383 7.367 96 HG3 ARG 102 HG1 ARG 102 7.477 16.695 7.156 97 HD2 ARG 102 HD2 ARG 102 6.012 16.406 9.774 98 HD3 ARG 102 HD1 ARG 102 7.459 15.432 9.445 99 HE ARG 102 HE ARG 102 7.449 18.278 9.960 100 HH11 ARG 102 HH21 ARG 102 8.873 15.768 8.061 101 HH12 ARG 102 HH22 ARG 102 10.376 16.602 7.853 102 HH21 ARG 102 HH11 ARG 102 9.405 19.374 9.694 103 HH22 ARG 102 HH12 ARG 102 10.677 18.641 8.775 104 H MET 103 HN MET 103 7.567 16.936 4.813 105 HA MET 103 HA MET 103 9.516 18.969 5.728 106 HB2 MET 103 HB2 MET 103 10.089 16.599 5.805 107 HB3 MET 103 HB1 MET 103 9.708 16.420 4.092 108 HG2 MET 103 HG2 MET 103 11.755 17.140 3.493 109 HG3 MET 103 HG1 MET 103 11.595 18.582 4.496 110 HE1 MET 103 HE1 MET 103 13.944 15.624 4.024 111 HE2 MET 103 HE2 MET 103 12.302 14.997 4.146 112 HE3 MET 103 HE3 MET 103 13.494 14.569 5.371 113 H PHE 104 HN PHE 104 7.986 17.844 2.720 114 HA PHE 104 HA PHE 104 9.543 19.590 0.987 115 HB2 PHE 104 HB2 PHE 104 6.899 18.141 0.623 116 HB3 PHE 104 HB1 PHE 104 7.870 18.825 -0.680 117 HD1 PHE 104 HD2 PHE 104 10.552 18.054 0.877 118 HD2 PHE 104 HD1 PHE 104 7.069 15.885 -0.397 119 HE1 PHE 104 HE2 PHE 104 11.887 15.969 0.780 120 HE2 PHE 104 HE1 PHE 104 8.406 13.799 -0.494 121 HZ PHE 104 HZ PHE 104 10.814 13.841 0.094 122 H ASP 105 HN ASP 105 7.098 20.212 3.221 123 HA ASP 105 HA ASP 105 5.725 22.326 1.702 124 HB2 ASP 105 HB2 ASP 105 4.765 20.764 3.498 125 HB3 ASP 105 HB1 ASP 105 5.644 21.743 4.672 126 H LYS 106 HN LYS 106 7.862 23.489 1.277 127 HA LYS 106 HA LYS 106 9.282 24.734 3.486 128 HB2 LYS 106 HB2 LYS 106 9.786 24.190 0.879 129 HB3 LYS 106 HB1 LYS 106 9.346 25.893 0.749 130 HG2 LYS 106 HG2 LYS 106 11.272 25.016 2.883 131 HG3 LYS 106 HG1 LYS 106 11.844 25.248 1.230 132 HD2 LYS 106 HD2 LYS 106 10.124 27.434 2.128 133 HD3 LYS 106 HD1 LYS 106 11.557 27.247 3.140 134 HE2 LYS 106 HE2 LYS 106 12.630 28.442 1.519 135 HE3 LYS 106 HE1 LYS 106 12.566 26.946 0.565 136 HZ1 LYS 106 HZ1 LYS 106 11.517 28.874 -0.562 137 HZ2 LYS 106 HZ2 LYS 106 10.368 28.941 0.687 138 HZ3 LYS 106 HZ3 LYS 106 10.453 27.576 -0.321 139 H ASN 107 HN ASN 107 6.307 25.400 1.931 140 HA ASN 107 HA ASN 107 6.410 28.312 2.507 141 HB2 ASN 107 HB2 ASN 107 4.293 26.519 1.270 142 HB3 ASN 107 HB1 ASN 107 4.257 28.283 1.292 143 HD21 ASN 107 HD21 ASN 107 6.050 25.488 -0.027 144 HD22 ASN 107 HD22 ASN 107 6.783 26.350 -1.293 145 H ALA 108 HN ALA 108 5.124 25.338 3.812 146 HA ALA 108 HA ALA 108 3.940 24.930 5.819 147 HB1 ALA 108 HB1 ALA 108 5.098 26.160 7.321 148 HB2 ALA 108 HB2 ALA 108 3.979 27.491 7.022 149 HB3 ALA 108 HB3 ALA 108 5.473 27.369 6.092 150 H ASP 109 HN ASP 109 2.163 25.106 3.912 151 HA ASP 109 HA ASP 109 0.151 27.151 4.799 152 HB2 ASP 109 HB2 ASP 109 -0.592 27.103 2.413 153 HB3 ASP 109 HB1 ASP 109 1.084 27.628 2.582 154 H GLY 110 HN GLY 110 0.876 23.824 4.344 155 HA2 GLY 110 HA2 GLY 110 -0.610 22.157 5.372 156 HA3 GLY 110 HA1 GLY 110 -1.982 23.151 4.883 157 H TYR 111 HN TYR 111 -0.077 23.395 2.293 158 HA TYR 111 HA TYR 111 -0.744 20.761 1.082 159 HB2 TYR 111 HB2 TYR 111 -1.668 23.444 -0.001 160 HB3 TYR 111 HB1 TYR 111 -2.002 21.864 -0.710 161 HD1 TYR 111 HD1 TYR 111 -3.551 20.292 0.371 162 HD2 TYR 111 HD2 TYR 111 -2.808 24.190 2.017 163 HE1 TYR 111 HE1 TYR 111 -5.546 20.058 1.825 164 HE2 TYR 111 HE2 TYR 111 -4.803 23.955 3.472 165 HH TYR 111 HH TYR 111 -6.352 21.018 4.006 166 H ILE 112 HN ILE 112 0.093 20.828 -1.317 167 HA ILE 112 HA ILE 112 2.659 22.384 -1.397 168 HB ILE 112 HB ILE 112 1.943 19.523 -2.036 169 HG12 ILE 112 HG12 ILE 112 4.368 20.632 -0.615 170 HG13 ILE 112 HG11 ILE 112 2.842 20.371 0.231 171 HG21 ILE 112 HG21 ILE 112 4.090 19.257 -3.163 172 HG22 ILE 112 HG22 ILE 112 4.463 20.963 -2.916 173 HG23 ILE 112 HG23 ILE 112 3.150 20.495 -3.997 174 HD11 ILE 112 HD11 ILE 112 3.903 18.136 -1.445 175 HD12 ILE 112 HD12 ILE 112 2.978 18.072 0.055 176 HD13 ILE 112 HD13 ILE 112 4.698 18.458 0.096 177 H ASP 113 HN ASP 113 2.285 23.959 -2.943 178 HA ASP 113 HA ASP 113 0.530 23.458 -5.246 179 HB2 ASP 113 HB2 ASP 113 2.193 25.739 -4.179 180 HB3 ASP 113 HB1 ASP 113 1.416 25.847 -5.759 181 H LEU 114 HN LEU 114 1.677 24.546 -7.394 182 HA LEU 114 HA LEU 114 3.632 22.598 -8.262 183 HB2 LEU 114 HB2 LEU 114 2.553 25.195 -9.398 184 HB3 LEU 114 HB1 LEU 114 3.613 24.111 -10.299 185 HG LEU 114 HG LEU 114 1.515 22.546 -9.146 186 HD11 LEU 114 HD11 LEU 114 -0.007 24.097 -10.986 187 HD12 LEU 114 HD12 LEU 114 0.685 25.213 -9.808 188 HD13 LEU 114 HD13 LEU 114 -0.307 23.860 -9.264 189 HD21 LEU 114 HD21 LEU 114 2.054 23.401 -12.009 190 HD22 LEU 114 HD22 LEU 114 1.090 22.010 -11.512 191 HD23 LEU 114 HD23 LEU 114 2.824 22.042 -11.192 192 H ASP 115 HN ASP 115 3.818 26.045 -7.365 193 HA ASP 115 HA ASP 115 6.622 26.362 -7.983 194 HB2 ASP 115 HB2 ASP 115 4.835 28.137 -7.719 195 HB3 ASP 115 HB1 ASP 115 4.898 27.853 -5.979 196 H GLU 116 HN GLU 116 4.838 25.341 -5.096 197 HA GLU 116 HA GLU 116 7.097 25.425 -3.290 198 HB2 GLU 116 HB2 GLU 116 4.555 23.770 -3.196 199 HB3 GLU 116 HB1 GLU 116 5.562 24.228 -1.821 200 HG2 GLU 116 HG2 GLU 116 5.117 26.644 -2.412 201 HG3 GLU 116 HG1 GLU 116 3.940 26.072 -3.595 202 H LEU 117 HN LEU 117 5.745 22.978 -5.464 203 HA LEU 117 HA LEU 117 7.206 20.707 -4.510 204 HB2 LEU 117 HB2 LEU 117 6.089 21.536 -7.204 205 HB3 LEU 117 HB1 LEU 117 6.748 19.929 -6.895 206 HG LEU 117 HG LEU 117 4.665 21.042 -5.043 207 HD11 LEU 117 HD11 LEU 117 4.260 20.751 -7.831 208 HD12 LEU 117 HD12 LEU 117 3.028 20.986 -6.592 209 HD13 LEU 117 HD13 LEU 117 3.496 19.355 -7.071 210 HD21 LEU 117 HD21 LEU 117 4.095 18.502 -5.148 211 HD22 LEU 117 HD22 LEU 117 5.561 18.991 -4.297 212 HD23 LEU 117 HD23 LEU 117 5.666 18.339 -5.933 213 H LYS 118 HN LYS 118 8.173 23.516 -6.275 214 HA LYS 118 HA LYS 118 10.558 22.307 -7.489 215 HB2 LYS 118 HB2 LYS 118 9.573 24.043 -8.728 216 HB3 LYS 118 HB1 LYS 118 9.256 25.015 -7.292 217 HG2 LYS 118 HG2 LYS 118 11.568 25.601 -7.069 218 HG3 LYS 118 HG1 LYS 118 12.052 24.410 -8.278 219 HD2 LYS 118 HD2 LYS 118 11.385 25.726 -10.042 220 HD3 LYS 118 HD1 LYS 118 10.065 26.459 -9.129 221 HE2 LYS 118 HE2 LYS 118 11.614 27.887 -7.914 222 HE3 LYS 118 HE1 LYS 118 13.004 27.068 -8.655 223 HZ1 LYS 118 HZ1 LYS 118 12.593 27.982 -10.683 224 HZ2 LYS 118 HZ2 LYS 118 11.971 29.234 -9.718 225 HZ3 LYS 118 HZ3 LYS 118 10.921 28.104 -10.429 226 H ILE 119 HN ILE 119 9.735 23.574 -4.411 227 HA ILE 119 HA ILE 119 12.494 24.459 -3.785 228 HB ILE 119 HB ILE 119 9.776 24.540 -2.502 229 HG12 ILE 119 HG12 ILE 119 11.125 26.944 -2.154 230 HG13 ILE 119 HG11 ILE 119 11.718 26.369 -3.713 231 HG21 ILE 119 HG21 ILE 119 10.982 23.873 -0.590 232 HG22 ILE 119 HG22 ILE 119 11.051 25.633 -0.512 233 HG23 ILE 119 HG23 ILE 119 12.441 24.722 -1.101 234 HD11 ILE 119 HD11 ILE 119 9.447 27.769 -3.504 235 HD12 ILE 119 HD12 ILE 119 8.788 26.164 -3.197 236 HD13 ILE 119 HD13 ILE 119 9.641 26.492 -4.704 237 H MET 120 HN MET 120 10.158 21.975 -2.667 238 HA MET 120 HA MET 120 11.628 20.678 -0.696 239 HB2 MET 120 HB2 MET 120 10.449 18.602 -1.621 240 HB3 MET 120 HB1 MET 120 9.406 19.984 -1.283 241 HG2 MET 120 HG2 MET 120 8.722 19.959 -3.424 242 HG3 MET 120 HG1 MET 120 10.373 20.315 -3.931 243 HE1 MET 120 HE1 MET 120 8.086 16.510 -3.486 244 HE2 MET 120 HE2 MET 120 8.185 17.887 -2.392 245 HE3 MET 120 HE3 MET 120 9.324 16.553 -2.223 246 H LEU 121 HN LEU 121 12.289 20.791 -4.126 247 HA LEU 121 HA LEU 121 14.025 18.513 -4.343 248 HB2 LEU 121 HB2 LEU 121 13.184 20.874 -5.850 249 HB3 LEU 121 HB1 LEU 121 14.868 20.458 -6.156 250 HG LEU 121 HG LEU 121 13.488 19.246 -7.740 251 HD11 LEU 121 HD11 LEU 121 13.933 16.975 -5.943 252 HD12 LEU 121 HD12 LEU 121 15.314 18.069 -6.016 253 HD13 LEU 121 HD13 LEU 121 14.687 17.342 -7.495 254 HD21 LEU 121 HD21 LEU 121 11.705 19.116 -5.504 255 HD22 LEU 121 HD22 LEU 121 12.055 17.467 -6.023 256 HD23 LEU 121 HD23 LEU 121 11.397 18.633 -7.172 257 H GLN 122 HN GLN 122 14.400 21.437 -2.644 258 HA GLN 122 HA GLN 122 17.079 22.196 -2.953 259 HB2 GLN 122 HB2 GLN 122 14.924 22.628 -1.201 260 HB3 GLN 122 HB1 GLN 122 16.253 22.103 -0.166 261 HG2 GLN 122 HG2 GLN 122 17.010 24.048 -2.257 262 HG3 GLN 122 HG1 GLN 122 15.912 24.674 -1.027 263 HE21 GLN 122 HE21 GLN 122 17.903 26.004 -0.380 264 HE22 GLN 122 HE22 GLN 122 19.034 25.283 0.661 265 H ALA 123 HN ALA 123 15.803 19.260 -1.580 266 HA ALA 123 HA ALA 123 18.302 18.584 -0.162 267 HB1 ALA 123 HB1 ALA 123 16.627 16.356 -0.278 268 HB2 ALA 123 HB2 ALA 123 15.513 17.723 -0.312 269 HB3 ALA 123 HB3 ALA 123 16.662 17.554 1.015 270 H THR 124 HN THR 124 17.282 18.464 -3.359 271 HA THR 124 HA THR 124 19.034 16.093 -3.934 272 HB THR 124 HB THR 124 16.963 17.047 -5.859 273 HG1 THR 124 HG1 THR 124 15.387 16.753 -4.530 274 HG21 THR 124 HG21 THR 124 18.385 15.080 -6.312 275 HG22 THR 124 HG22 THR 124 16.686 14.627 -6.182 276 HG23 THR 124 HG23 THR 124 17.786 14.314 -4.840 277 H GLY 125 HN GLY 125 19.408 19.233 -3.841 278 HA2 GLY 125 HA2 GLY 125 21.075 20.518 -4.970 279 HA3 GLY 125 HA1 GLY 125 21.107 19.303 -6.250 280 H GLU 126 HN GLU 126 17.991 19.557 -6.077 281 HA GLU 126 HA GLU 126 16.321 20.770 -7.212 282 HB2 GLU 126 HB2 GLU 126 18.300 23.055 -7.151 283 HB3 GLU 126 HB1 GLU 126 16.539 23.144 -7.133 284 HG2 GLU 126 HG2 GLU 126 16.545 23.077 -4.889 285 HG3 GLU 126 HG1 GLU 126 17.374 21.521 -4.927 286 H THR 127 HN THR 127 18.406 19.279 -8.710 287 HA THR 127 HA THR 127 18.694 20.969 -11.157 288 HB THR 127 HB THR 127 20.370 19.312 -11.773 289 HG1 THR 127 HG1 THR 127 19.550 17.923 -9.442 290 HG21 THR 127 HG21 THR 127 21.922 19.565 -9.921 291 HG22 THR 127 HG22 THR 127 20.593 19.879 -8.806 292 HG23 THR 127 HG23 THR 127 20.975 21.045 -10.073 293 H ILE 128 HN ILE 128 16.521 20.780 -11.950 294 HA ILE 128 HA ILE 128 15.860 18.077 -13.046 295 HB ILE 128 HB ILE 128 14.637 18.554 -10.918 296 HG12 ILE 128 HG12 ILE 128 12.864 18.639 -13.381 297 HG13 ILE 128 HG11 ILE 128 13.615 17.179 -12.737 298 HG21 ILE 128 HG21 ILE 128 13.795 20.973 -12.513 299 HG22 ILE 128 HG22 ILE 128 14.437 20.908 -10.872 300 HG23 ILE 128 HG23 ILE 128 12.794 20.355 -11.199 301 HD11 ILE 128 HD11 ILE 128 11.765 16.958 -11.458 302 HD12 ILE 128 HD12 ILE 128 11.235 18.603 -11.811 303 HD13 ILE 128 HD13 ILE 128 12.392 18.309 -10.512 304 H THR 129 HN THR 129 14.073 18.336 -14.779 305 HA THR 129 HA THR 129 14.847 20.494 -16.604 306 HB THR 129 HB THR 129 12.508 19.000 -17.402 307 HG1 THR 129 HG1 THR 129 13.734 16.932 -17.276 308 HG21 THR 129 HG21 THR 129 14.513 17.974 -18.868 309 HG22 THR 129 HG22 THR 129 15.335 19.401 -18.238 310 HG23 THR 129 HG23 THR 129 13.849 19.579 -19.171 311 H GLU 130 HN GLU 130 13.617 22.326 -17.081 312 HA GLU 130 HA GLU 130 11.836 23.436 -15.205 313 HB2 GLU 130 HB2 GLU 130 11.289 24.984 -17.082 314 HB3 GLU 130 HB1 GLU 130 13.022 24.675 -16.962 315 HG2 GLU 130 HG2 GLU 130 12.228 22.641 -18.613 316 HG3 GLU 130 HG1 GLU 130 11.125 23.931 -19.093 317 H ASP 131 HN ASP 131 11.165 21.266 -17.912 318 HA ASP 131 HA ASP 131 8.262 21.628 -17.769 319 HB2 ASP 131 HB2 ASP 131 10.145 19.701 -19.156 320 HB3 ASP 131 HB1 ASP 131 8.394 19.638 -19.360 321 H ASP 132 HN ASP 132 10.655 19.475 -16.354 322 HA ASP 132 HA ASP 132 8.942 17.331 -15.558 323 HB2 ASP 132 HB2 ASP 132 11.628 18.342 -15.103 324 HB3 ASP 132 HB1 ASP 132 10.950 17.676 -13.616 325 H ILE 133 HN ILE 133 9.183 20.589 -14.422 326 HA ILE 133 HA ILE 133 8.351 20.237 -11.694 327 HB ILE 133 HB ILE 133 7.907 22.528 -13.638 328 HG12 ILE 133 HG12 ILE 133 10.278 21.790 -13.479 329 HG13 ILE 133 HG11 ILE 133 10.039 23.389 -12.774 330 HG21 ILE 133 HG21 ILE 133 7.499 23.893 -11.786 331 HG22 ILE 133 HG22 ILE 133 8.303 22.789 -10.670 332 HG23 ILE 133 HG23 ILE 133 6.705 22.394 -11.302 333 HD11 ILE 133 HD11 ILE 133 9.904 22.386 -10.526 334 HD12 ILE 133 HD12 ILE 133 11.433 21.977 -11.304 335 HD13 ILE 133 HD13 ILE 133 10.136 20.784 -11.224 336 H GLU 134 HN GLU 134 6.445 21.154 -14.598 337 HA GLU 134 HA GLU 134 3.903 20.846 -13.195 338 HB2 GLU 134 HB2 GLU 134 4.631 21.106 -16.133 339 HB3 GLU 134 HB1 GLU 134 3.011 21.306 -15.467 340 HG2 GLU 134 HG2 GLU 134 3.967 23.127 -13.976 341 HG3 GLU 134 HG1 GLU 134 5.442 23.029 -14.939 342 H GLU 135 HN GLU 135 5.991 18.797 -15.120 343 HA GLU 135 HA GLU 135 4.109 16.821 -15.961 344 HB2 GLU 135 HB2 GLU 135 7.009 17.198 -15.676 345 HB3 GLU 135 HB1 GLU 135 6.510 15.514 -15.519 346 HG2 GLU 135 HG2 GLU 135 6.815 15.750 -17.837 347 HG3 GLU 135 HG1 GLU 135 5.078 15.984 -17.644 348 H LEU 136 HN LEU 136 6.192 16.937 -13.046 349 HA LEU 136 HA LEU 136 5.240 14.485 -11.901 350 HB2 LEU 136 HB2 LEU 136 6.392 16.989 -10.627 351 HB3 LEU 136 HB1 LEU 136 6.336 15.394 -9.877 352 HG LEU 136 HG LEU 136 7.627 15.720 -12.570 353 HD11 LEU 136 HD11 LEU 136 9.056 16.129 -9.930 354 HD12 LEU 136 HD12 LEU 136 8.565 17.454 -10.985 355 HD13 LEU 136 HD13 LEU 136 9.743 16.269 -11.548 356 HD21 LEU 136 HD21 LEU 136 7.478 13.463 -11.944 357 HD22 LEU 136 HD22 LEU 136 7.747 13.819 -10.237 358 HD23 LEU 136 HD23 LEU 136 9.090 13.901 -11.378 359 H MET 137 HN MET 137 4.197 17.874 -11.506 360 HA MET 137 HA MET 137 2.375 17.619 -9.387 361 HB2 MET 137 HB2 MET 137 3.093 19.479 -11.364 362 HB3 MET 137 HB1 MET 137 1.354 19.262 -11.561 363 HG2 MET 137 HG2 MET 137 2.249 19.483 -8.757 364 HG3 MET 137 HG1 MET 137 2.491 20.940 -9.721 365 HE1 MET 137 HE1 MET 137 -0.586 20.412 -7.237 366 HE2 MET 137 HE2 MET 137 -0.029 22.005 -7.747 367 HE3 MET 137 HE3 MET 137 1.146 20.752 -7.356 368 H LYS 138 HN LYS 138 1.945 16.744 -12.805 369 HA LYS 138 HA LYS 138 -0.867 16.243 -12.747 370 HB2 LYS 138 HB2 LYS 138 1.501 15.334 -14.364 371 HB3 LYS 138 HB1 LYS 138 -0.081 14.610 -14.660 372 HG2 LYS 138 HG2 LYS 138 -1.025 16.914 -14.936 373 HG3 LYS 138 HG1 LYS 138 0.611 17.559 -14.792 374 HD2 LYS 138 HD2 LYS 138 1.209 15.925 -16.709 375 HD3 LYS 138 HD1 LYS 138 -0.532 15.816 -16.972 376 HE2 LYS 138 HE2 LYS 138 -0.108 17.627 -18.345 377 HE3 LYS 138 HE1 LYS 138 -0.264 18.514 -16.816 378 HZ1 LYS 138 HZ1 LYS 138 2.260 17.636 -16.670 379 HZ2 LYS 138 HZ2 LYS 138 1.828 19.165 -17.272 380 HZ3 LYS 138 HZ3 LYS 138 2.119 17.879 -18.343 381 H ASP 139 HN ASP 139 1.844 14.431 -11.501 382 HA ASP 139 HA ASP 139 0.206 11.970 -11.163 383 HB2 ASP 139 HB2 ASP 139 3.107 12.751 -10.883 384 HB3 ASP 139 HB1 ASP 139 2.521 11.219 -10.232 385 H GLY 140 HN GLY 140 1.490 14.674 -9.342 386 HA2 GLY 140 HA2 GLY 140 0.962 13.365 -6.752 387 HA3 GLY 140 HA1 GLY 140 1.610 14.991 -6.976 388 H ASP 141 HN ASP 141 -0.671 15.418 -9.014 389 HA ASP 141 HA ASP 141 -3.052 15.442 -7.266 390 HB2 ASP 141 HB2 ASP 141 -1.255 17.479 -7.044 391 HB3 ASP 141 HB1 ASP 141 -2.303 18.110 -8.314 392 H LYS 142 HN LYS 142 -3.728 14.116 -9.184 393 HA LYS 142 HA LYS 142 -3.827 15.097 -11.855 394 HB2 LYS 142 HB2 LYS 142 -5.148 13.043 -10.166 395 HB3 LYS 142 HB1 LYS 142 -6.023 13.499 -11.629 396 HG2 LYS 142 HG2 LYS 142 -3.377 13.260 -12.478 397 HG3 LYS 142 HG1 LYS 142 -3.586 11.919 -11.352 398 HD2 LYS 142 HD2 LYS 142 -4.248 11.139 -13.538 399 HD3 LYS 142 HD1 LYS 142 -5.713 11.331 -12.575 400 HE2 LYS 142 HE2 LYS 142 -6.400 12.480 -14.461 401 HE3 LYS 142 HE1 LYS 142 -5.555 13.816 -13.653 402 HZ1 LYS 142 HZ1 LYS 142 -4.342 11.908 -15.584 403 HZ2 LYS 142 HZ2 LYS 142 -3.516 13.157 -14.782 404 HZ3 LYS 142 HZ3 LYS 142 -4.730 13.526 -15.910 405 H ASN 143 HN ASN 143 -5.541 16.088 -9.039 406 HA ASN 143 HA ASN 143 -7.976 17.040 -10.275 407 HB2 ASN 143 HB2 ASN 143 -7.732 16.573 -7.878 408 HB3 ASN 143 HB1 ASN 143 -6.488 17.817 -7.744 409 HD21 ASN 143 HD21 ASN 143 -8.327 18.519 -6.060 410 HD22 ASN 143 HD22 ASN 143 -9.473 19.612 -6.670 411 H ASN 144 HN ASN 144 -4.735 18.170 -10.299 412 HA ASN 144 HA ASN 144 -3.774 20.271 -10.865 413 HB2 ASN 144 HB2 ASN 144 -4.512 20.875 -13.092 414 HB3 ASN 144 HB1 ASN 144 -4.622 19.121 -12.947 415 HD21 ASN 144 HD21 ASN 144 -6.780 18.162 -12.774 416 HD22 ASN 144 HD22 ASN 144 -8.170 19.051 -13.172 417 H ASP 145 HN ASP 145 -5.938 20.456 -8.799 418 HA ASP 145 HA ASP 145 -7.555 22.799 -9.428 419 HB2 ASP 145 HB2 ASP 145 -8.082 22.613 -6.986 420 HB3 ASP 145 HB1 ASP 145 -8.263 21.079 -7.838 421 H GLY 146 HN GLY 146 -4.284 22.372 -8.604 422 HA2 GLY 146 HA2 GLY 146 -2.742 24.243 -8.549 423 HA3 GLY 146 HA1 GLY 146 -4.059 25.271 -7.983 424 H ARG 147 HN ARG 147 -3.982 22.239 -6.430 425 HA ARG 147 HA ARG 147 -2.168 23.117 -4.262 426 HB2 ARG 147 HB2 ARG 147 -4.990 23.617 -4.297 427 HB3 ARG 147 HB1 ARG 147 -4.657 22.424 -3.041 428 HG2 ARG 147 HG2 ARG 147 -2.883 23.903 -2.131 429 HG3 ARG 147 HG1 ARG 147 -3.283 25.108 -3.355 430 HD2 ARG 147 HD2 ARG 147 -5.751 24.721 -2.334 431 HD3 ARG 147 HD1 ARG 147 -4.781 24.352 -0.894 432 HE ARG 147 HE ARG 147 -3.705 26.685 -2.138 433 HH11 ARG 147 HH21 ARG 147 -6.489 25.563 -0.429 434 HH12 ARG 147 HH22 ARG 147 -6.844 27.108 0.266 435 HH21 ARG 147 HH11 ARG 147 -4.160 28.704 -1.237 436 HH22 ARG 147 HH12 ARG 147 -5.529 28.884 -0.192 437 H ILE 148 HN ILE 148 -1.345 21.338 -3.167 438 HA ILE 148 HA ILE 148 -2.460 18.659 -3.921 439 HB ILE 148 HB ILE 148 0.301 19.557 -3.029 440 HG12 ILE 148 HG12 ILE 148 -0.805 18.702 -5.722 441 HG13 ILE 148 HG11 ILE 148 -0.255 20.319 -5.287 442 HG21 ILE 148 HG21 ILE 148 0.975 17.254 -3.682 443 HG22 ILE 148 HG22 ILE 148 -0.720 16.855 -3.959 444 HG23 ILE 148 HG23 ILE 148 -0.161 17.252 -2.334 445 HD11 ILE 148 HD11 ILE 148 1.304 18.233 -6.363 446 HD12 ILE 148 HD12 ILE 148 1.793 18.371 -4.674 447 HD13 ILE 148 HD13 ILE 148 1.883 19.776 -5.736 448 H ASP 149 HN ASP 149 -2.856 17.152 -2.241 449 HA ASP 149 HA ASP 149 -2.678 18.260 0.544 450 HB2 ASP 149 HB2 ASP 149 -4.685 16.405 -0.776 451 HB3 ASP 149 HB1 ASP 149 -4.721 16.866 0.926 452 H TYR 150 HN TYR 150 -3.120 16.094 2.051 453 HA TYR 150 HA TYR 150 -0.670 14.566 1.881 454 HB2 TYR 150 HB2 TYR 150 -1.542 14.999 4.030 455 HB3 TYR 150 HB1 TYR 150 -3.182 14.568 3.549 456 HD1 TYR 150 HD1 TYR 150 0.011 12.717 2.954 457 HD2 TYR 150 HD2 TYR 150 -3.774 12.792 4.984 458 HE1 TYR 150 HE1 TYR 150 0.387 10.397 3.743 459 HE2 TYR 150 HE2 TYR 150 -3.397 10.472 5.773 460 HH TYR 150 HH TYR 150 -1.907 8.809 5.943 461 H ASP 151 HN ASP 151 -4.071 13.423 1.805 462 HA ASP 151 HA ASP 151 -3.659 10.795 0.973 463 HB2 ASP 151 HB2 ASP 151 -5.950 11.107 -0.093 464 HB3 ASP 151 HB1 ASP 151 -5.829 11.651 1.581 465 H GLU 152 HN GLU 152 -3.677 13.731 -1.034 466 HA GLU 152 HA GLU 152 -3.478 12.295 -3.562 467 HB2 GLU 152 HB2 GLU 152 -3.405 15.092 -2.532 468 HB3 GLU 152 HB1 GLU 152 -2.679 14.808 -4.114 469 HG2 GLU 152 HG2 GLU 152 -4.745 13.791 -4.924 470 HG3 GLU 152 HG1 GLU 152 -5.478 13.949 -3.327 471 H PHE 153 HN PHE 153 -1.247 13.053 -1.077 472 HA PHE 153 HA PHE 153 1.123 13.309 -2.776 473 HB2 PHE 153 HB2 PHE 153 0.798 14.350 -0.520 474 HB3 PHE 153 HB1 PHE 153 0.819 12.735 0.189 475 HD1 PHE 153 HD1 PHE 153 2.838 15.021 -1.983 476 HD2 PHE 153 HD2 PHE 153 2.860 11.731 0.780 477 HE1 PHE 153 HE1 PHE 153 5.317 15.067 -1.949 478 HE2 PHE 153 HE2 PHE 153 5.340 11.778 0.815 479 HZ PHE 153 HZ PHE 153 6.568 13.445 -0.550 480 H LEU 154 HN LEU 154 -0.747 10.702 -1.506 481 HA LEU 154 HA LEU 154 1.339 8.712 -1.278 482 HB2 LEU 154 HB2 LEU 154 -1.550 8.978 -1.069 483 HB3 LEU 154 HB1 LEU 154 -1.113 7.474 -1.881 484 HG LEU 154 HG LEU 154 -1.254 7.293 0.635 485 HD11 LEU 154 HD11 LEU 154 1.367 6.763 -0.786 486 HD12 LEU 154 HD12 LEU 154 0.029 5.640 -0.545 487 HD13 LEU 154 HD13 LEU 154 1.009 6.152 0.829 488 HD21 LEU 154 HD21 LEU 154 0.120 9.680 0.586 489 HD22 LEU 154 HD22 LEU 154 1.404 8.527 0.951 490 HD23 LEU 154 HD23 LEU 154 -0.013 8.630 1.996 491 H GLU 155 HN GLU 155 -1.215 9.104 -3.771 492 HA GLU 155 HA GLU 155 -0.244 7.233 -5.634 493 HB2 GLU 155 HB2 GLU 155 -2.386 8.728 -5.506 494 HB3 GLU 155 HB1 GLU 155 -1.432 9.885 -6.433 495 HG2 GLU 155 HG2 GLU 155 -0.922 7.672 -7.877 496 HG3 GLU 155 HG1 GLU 155 -2.513 7.234 -7.251 497 H PHE 156 HN PHE 156 1.086 10.309 -4.743 498 HA PHE 156 HA PHE 156 2.514 10.908 -7.178 499 HB2 PHE 156 HB2 PHE 156 2.026 12.546 -5.422 500 HB3 PHE 156 HB1 PHE 156 2.986 11.623 -4.265 501 HD1 PHE 156 HD1 PHE 156 3.643 12.478 -7.852 502 HD2 PHE 156 HD2 PHE 156 4.876 12.916 -3.762 503 HE1 PHE 156 HE1 PHE 156 5.689 13.666 -8.597 504 HE2 PHE 156 HE2 PHE 156 6.922 14.104 -4.506 505 HZ PHE 156 HZ PHE 156 7.328 14.480 -6.924 506 H MET 157 HN MET 157 3.373 9.111 -4.220 507 HA MET 157 HA MET 157 6.045 8.466 -5.348 508 HB2 MET 157 HB2 MET 157 4.809 7.642 -2.710 509 HB3 MET 157 HB1 MET 157 6.524 7.755 -3.108 510 HG2 MET 157 HG2 MET 157 4.553 10.038 -2.828 511 HG3 MET 157 HG1 MET 157 5.963 9.714 -1.820 512 HE1 MET 157 HE1 MET 157 8.836 11.267 -3.415 513 HE2 MET 157 HE2 MET 157 8.430 9.696 -2.729 514 HE3 MET 157 HE3 MET 157 7.825 11.164 -1.966 515 H LYS 158 HN LYS 158 2.895 7.118 -5.165 516 HA LYS 158 HA LYS 158 3.754 4.306 -5.207 517 HB2 LYS 158 HB2 LYS 158 1.655 5.084 -4.150 518 HB3 LYS 158 HB1 LYS 158 1.086 5.663 -5.717 519 HG2 LYS 158 HG2 LYS 158 0.216 3.611 -6.055 520 HG3 LYS 158 HG1 LYS 158 1.871 3.013 -6.180 521 HD2 LYS 158 HD2 LYS 158 1.223 1.695 -4.426 522 HD3 LYS 158 HD1 LYS 158 1.631 3.132 -3.487 523 HE2 LYS 158 HE2 LYS 158 -0.530 2.776 -2.707 524 HE3 LYS 158 HE1 LYS 158 -0.909 3.771 -4.127 525 HZ1 LYS 158 HZ1 LYS 158 -1.462 1.946 -5.382 526 HZ2 LYS 158 HZ2 LYS 158 -2.011 1.442 -3.856 527 HZ3 LYS 158 HZ3 LYS 158 -0.527 0.875 -4.457 528 H GLY 159 HN GLY 159 5.194 4.715 -7.178 529 HA2 GLY 159 HA2 GLY 159 5.133 3.682 -9.434 530 HA3 GLY 159 HA1 GLY 159 3.558 4.442 -9.666 531 H VAL 160 HN VAL 160 6.708 5.692 -8.509 532 HA VAL 160 HA VAL 160 6.652 7.656 -10.766 533 HB VAL 160 HB VAL 160 5.671 8.595 -8.668 534 HG11 VAL 160 HG11 VAL 160 8.333 7.677 -7.605 535 HG12 VAL 160 HG12 VAL 160 6.728 7.470 -6.904 536 HG13 VAL 160 HG13 VAL 160 7.511 9.049 -6.862 537 HG21 VAL 160 HG21 VAL 160 8.051 10.187 -8.592 538 HG22 VAL 160 HG22 VAL 160 6.529 10.542 -9.410 539 HG23 VAL 160 HG23 VAL 160 7.798 9.655 -10.255 540 H GLU 161 HN GLU 161 8.272 5.321 -10.657 541 HA GLU 161 HA GLU 161 10.969 6.378 -9.892 542 HB2 GLU 161 HB2 GLU 161 9.890 3.582 -10.381 543 HB3 GLU 161 HB1 GLU 161 11.566 3.943 -9.964 544 HG2 GLU 161 HG2 GLU 161 9.555 5.175 -8.183 545 HG3 GLU 161 HG1 GLU 161 9.621 3.413 -8.122 546 HO1 KDH 1 H1 KDH 1 9.615 9.456 -11.119 547 H21 KDH 1 H21 KDH 1 12.841 9.741 -2.893 548 H33 KDH 1 H33 KDH 1 10.398 13.468 -6.849 549 H4 KDH 1 H4 KDH 1 9.456 11.501 -8.449 550 HO7 KDH 1 H7 KDH 1 11.521 8.825 -11.659 551 H01 KDH 1 H01 KDH 1 11.164 14.657 -4.730 552 H01A KDH 1 H02 KDH 1 9.898 13.378 -4.558 553 HO03 KDH 1 H03 KDH 1 11.194 15.135 -1.707 554 HO10 KDH 1 H10 KDH 1 14.924 9.649 -8.683 555 H12 KDH 1 H12 KDH 1 13.449 10.409 -6.939 556 H15 KDH 1 H15 KDH 1 10.066 11.321 -6.049 557 H26 KDH 1 H26 KDH 1 12.994 13.440 -0.539 558 H39 KDH 1 H39 KDH 1 11.081 13.389 -9.775 559 H41 KDH 1 H41 KDH 1 15.052 14.673 -8.379 560 HO02 KDH 1 H42 KDH 1 14.597 11.276 -0.477 561 HO44 KDH 1 H44 KDH 1 16.754 14.458 -9.898 562 HO47 KDH 1 H47 KDH 1 14.257 11.961 -12.880 563 HO50 KDH 1 H50 KDH 1 12.478 11.782 -12.617 Start of MODEL 17 1 H1 MET 90 HT1 MET 90 13.567 8.690 2.001 2 H2 MET 90 HT2 MET 90 15.004 7.787 1.931 3 H3 MET 90 HT3 MET 90 13.690 7.227 2.850 4 HA MET 90 HA MET 90 13.853 7.414 -0.114 5 HB2 MET 90 HB2 MET 90 15.012 5.528 0.846 6 HB3 MET 90 HB1 MET 90 13.683 5.211 1.962 7 HG2 MET 90 HG2 MET 90 12.340 4.285 0.320 8 HG3 MET 90 HG1 MET 90 13.090 5.225 -0.970 9 HE1 MET 90 HE1 MET 90 12.624 2.632 -1.963 10 HE2 MET 90 HE2 MET 90 12.369 1.949 -0.359 11 HE3 MET 90 HE3 MET 90 13.568 1.234 -1.433 12 H GLY 91 HN GLY 91 11.774 5.567 2.092 13 HA2 GLY 91 HA2 GLY 91 9.438 6.711 2.437 14 HA3 GLY 91 HA1 GLY 91 9.413 6.703 0.673 15 H LYS 92 HN LYS 92 7.861 5.194 2.891 16 HA LYS 92 HA LYS 92 7.937 2.568 1.490 17 HB2 LYS 92 HB2 LYS 92 8.475 3.152 4.399 18 HB3 LYS 92 HB1 LYS 92 7.842 1.581 3.904 19 HG2 LYS 92 HG2 LYS 92 9.852 1.893 2.096 20 HG3 LYS 92 HG1 LYS 92 10.529 2.752 3.480 21 HD2 LYS 92 HD2 LYS 92 11.058 0.777 4.415 22 HD3 LYS 92 HD1 LYS 92 9.341 0.377 4.487 23 HE2 LYS 92 HE2 LYS 92 9.602 -1.172 2.858 24 HE3 LYS 92 HE1 LYS 92 10.316 0.043 1.779 25 HZ1 LYS 92 HZ1 LYS 92 11.680 -1.567 3.861 26 HZ2 LYS 92 HZ2 LYS 92 12.378 -0.173 3.186 27 HZ3 LYS 92 HZ3 LYS 92 12.021 -1.510 2.200 28 H SER 93 HN SER 93 6.381 2.953 4.588 29 HA SER 93 HA SER 93 3.730 2.768 3.253 30 HB2 SER 93 HB2 SER 93 4.769 2.361 6.070 31 HB3 SER 93 HB1 SER 93 3.057 2.271 5.666 32 HG SER 93 HG SER 93 3.851 0.726 3.972 33 H GLU 94 HN GLU 94 1.950 4.040 4.585 34 HA GLU 94 HA GLU 94 2.497 6.850 4.333 35 HB2 GLU 94 HB2 GLU 94 0.312 5.039 5.053 36 HB3 GLU 94 HB1 GLU 94 0.248 6.564 5.938 37 HG2 GLU 94 HG2 GLU 94 0.804 7.539 3.500 38 HG3 GLU 94 HG1 GLU 94 -0.023 6.058 3.013 39 H GLU 95 HN GLU 95 3.323 4.646 6.783 40 HA GLU 95 HA GLU 95 2.983 6.137 9.177 41 HB2 GLU 95 HB2 GLU 95 3.644 3.834 9.231 42 HB3 GLU 95 HB1 GLU 95 5.041 4.141 8.199 43 HG2 GLU 95 HG2 GLU 95 6.144 5.395 9.939 44 HG3 GLU 95 HG1 GLU 95 4.699 5.361 10.950 45 H GLU 96 HN GLU 96 5.892 5.946 7.084 46 HA GLU 96 HA GLU 96 7.009 8.363 8.380 47 HB2 GLU 96 HB2 GLU 96 8.032 6.587 6.137 48 HB3 GLU 96 HB1 GLU 96 8.983 7.760 7.049 49 HG2 GLU 96 HG2 GLU 96 8.891 6.480 9.026 50 HG3 GLU 96 HG1 GLU 96 7.518 5.531 8.454 51 H LEU 97 HN LEU 97 5.583 7.327 5.323 52 HA LEU 97 HA LEU 97 6.239 9.402 3.572 53 HB2 LEU 97 HB2 LEU 97 4.236 7.360 3.918 54 HB3 LEU 97 HB1 LEU 97 3.469 8.819 3.292 55 HG LEU 97 HG LEU 97 4.391 7.208 1.541 56 HD11 LEU 97 HD11 LEU 97 4.019 9.820 1.409 57 HD12 LEU 97 HD12 LEU 97 4.845 8.973 0.100 58 HD13 LEU 97 HD13 LEU 97 5.780 9.855 1.308 59 HD21 LEU 97 HD21 LEU 97 7.080 8.402 2.065 60 HD22 LEU 97 HD22 LEU 97 6.664 6.852 1.335 61 HD23 LEU 97 HD23 LEU 97 6.575 7.054 3.085 62 H SER 98 HN SER 98 3.443 9.350 5.820 63 HA SER 98 HA SER 98 2.306 11.830 5.376 64 HB2 SER 98 HB2 SER 98 1.655 11.709 7.747 65 HB3 SER 98 HB1 SER 98 1.601 10.104 7.023 66 HG SER 98 HG SER 98 3.061 9.518 8.403 67 H ASP 99 HN ASP 99 4.911 11.300 7.790 68 HA ASP 99 HA ASP 99 5.413 14.021 8.380 69 HB2 ASP 99 HB2 ASP 99 6.864 11.416 8.528 70 HB3 ASP 99 HB1 ASP 99 7.815 12.882 8.770 71 H LEU 100 HN LEU 100 6.502 12.040 5.668 72 HA LEU 100 HA LEU 100 8.587 13.829 4.759 73 HB2 LEU 100 HB2 LEU 100 7.877 11.288 4.265 74 HB3 LEU 100 HB1 LEU 100 7.077 12.054 2.893 75 HG LEU 100 HG LEU 100 9.513 13.296 2.842 76 HD11 LEU 100 HD11 LEU 100 10.138 10.405 3.447 77 HD12 LEU 100 HD12 LEU 100 10.162 11.634 4.711 78 HD13 LEU 100 HD13 LEU 100 11.254 11.766 3.332 79 HD21 LEU 100 HD21 LEU 100 9.186 10.626 1.498 80 HD22 LEU 100 HD22 LEU 100 9.823 12.131 0.837 81 HD23 LEU 100 HD23 LEU 100 8.088 11.943 1.089 82 H PHE 101 HN PHE 101 5.117 13.824 4.447 83 HA PHE 101 HA PHE 101 4.862 15.341 2.021 84 HB2 PHE 101 HB2 PHE 101 3.040 14.079 3.046 85 HB3 PHE 101 HB1 PHE 101 3.124 15.080 4.495 86 HD1 PHE 101 HD2 PHE 101 2.331 15.102 0.864 87 HD2 PHE 101 HD1 PHE 101 2.098 17.239 4.583 88 HE1 PHE 101 HE2 PHE 101 0.787 16.741 -0.174 89 HE2 PHE 101 HE1 PHE 101 0.554 18.878 3.544 90 HZ PHE 101 HZ PHE 101 -0.101 18.629 1.166 91 H ARG 102 HN ARG 102 4.314 16.517 5.368 92 HA ARG 102 HA ARG 102 4.432 19.288 4.719 93 HB2 ARG 102 HB2 ARG 102 4.490 19.563 7.108 94 HB3 ARG 102 HB1 ARG 102 3.555 18.098 6.801 95 HG2 ARG 102 HG2 ARG 102 5.942 16.946 6.977 96 HG3 ARG 102 HG1 ARG 102 6.313 18.385 7.928 97 HD2 ARG 102 HD2 ARG 102 3.725 17.135 8.611 98 HD3 ARG 102 HD1 ARG 102 5.145 16.133 8.972 99 HE ARG 102 HE ARG 102 5.742 18.785 9.787 100 HH11 ARG 102 HH21 ARG 102 3.603 16.178 10.539 101 HH12 ARG 102 HH22 ARG 102 3.464 16.606 12.211 102 HH21 ARG 102 HH11 ARG 102 5.570 19.348 11.965 103 HH22 ARG 102 HH12 ARG 102 4.578 18.395 13.018 104 H MET 103 HN MET 103 6.941 16.959 4.852 105 HA MET 103 HA MET 103 9.130 18.588 5.762 106 HB2 MET 103 HB2 MET 103 8.616 15.955 4.896 107 HB3 MET 103 HB1 MET 103 9.840 16.581 3.791 108 HG2 MET 103 HG2 MET 103 11.256 17.232 5.674 109 HG3 MET 103 HG1 MET 103 10.016 16.713 6.815 110 HE1 MET 103 HE1 MET 103 13.454 14.375 5.943 111 HE2 MET 103 HE2 MET 103 12.992 15.720 6.983 112 HE3 MET 103 HE3 MET 103 13.152 15.973 5.247 113 H PHE 104 HN PHE 104 8.286 17.587 2.415 114 HA PHE 104 HA PHE 104 10.102 19.386 1.129 115 HB2 PHE 104 HB2 PHE 104 7.480 18.188 0.173 116 HB3 PHE 104 HB1 PHE 104 8.771 18.801 -0.862 117 HD1 PHE 104 HD1 PHE 104 11.086 17.805 0.910 118 HD2 PHE 104 HD2 PHE 104 7.544 15.891 -0.587 119 HE1 PHE 104 HE1 PHE 104 12.226 15.605 1.025 120 HE2 PHE 104 HE2 PHE 104 8.684 13.691 -0.472 121 HZ PHE 104 HZ PHE 104 11.025 13.549 0.335 122 H ASP 105 HN ASP 105 6.946 19.869 2.532 123 HA ASP 105 HA ASP 105 6.255 22.272 1.051 124 HB2 ASP 105 HB2 ASP 105 4.586 20.853 2.121 125 HB3 ASP 105 HB1 ASP 105 5.351 21.085 3.694 126 H LYS 106 HN LYS 106 7.884 23.855 1.218 127 HA LYS 106 HA LYS 106 9.105 24.500 3.814 128 HB2 LYS 106 HB2 LYS 106 9.688 24.768 1.063 129 HB3 LYS 106 HB1 LYS 106 9.543 26.412 1.684 130 HG2 LYS 106 HG2 LYS 106 11.029 25.562 3.644 131 HG3 LYS 106 HG1 LYS 106 11.431 24.234 2.554 132 HD2 LYS 106 HD2 LYS 106 12.740 25.550 1.259 133 HD3 LYS 106 HD1 LYS 106 11.557 26.858 1.254 134 HE2 LYS 106 HE2 LYS 106 13.229 27.885 2.493 135 HE3 LYS 106 HE1 LYS 106 12.385 27.056 3.816 136 HZ1 LYS 106 HZ1 LYS 106 13.849 25.223 3.667 137 HZ2 LYS 106 HZ2 LYS 106 14.837 26.605 3.676 138 HZ3 LYS 106 HZ3 LYS 106 14.536 25.781 2.221 139 H ASN 107 HN ASN 107 6.331 25.495 2.017 140 HA ASN 107 HA ASN 107 6.168 28.207 3.096 141 HB2 ASN 107 HB2 ASN 107 5.213 27.483 0.923 142 HB3 ASN 107 HB1 ASN 107 4.116 26.398 1.778 143 HD21 ASN 107 HD21 ASN 107 2.574 28.010 0.462 144 HD22 ASN 107 HD22 ASN 107 2.049 29.368 1.336 145 H ALA 108 HN ALA 108 5.485 25.077 4.308 146 HA ALA 108 HA ALA 108 4.277 24.329 6.204 147 HB1 ALA 108 HB1 ALA 108 4.963 27.165 7.042 148 HB2 ALA 108 HB2 ALA 108 6.089 25.809 7.093 149 HB3 ALA 108 HB3 ALA 108 4.656 25.804 8.120 150 H ASP 109 HN ASP 109 2.376 24.799 4.433 151 HA ASP 109 HA ASP 109 0.399 26.599 5.800 152 HB2 ASP 109 HB2 ASP 109 -0.455 27.104 3.576 153 HB3 ASP 109 HB1 ASP 109 1.290 27.364 3.573 154 H GLY 110 HN GLY 110 1.157 23.417 4.836 155 HA2 GLY 110 HA2 GLY 110 -0.273 21.597 5.687 156 HA3 GLY 110 HA1 GLY 110 -1.677 22.600 5.317 157 H TYR 111 HN TYR 111 0.245 23.177 2.773 158 HA TYR 111 HA TYR 111 -0.444 20.696 1.269 159 HB2 TYR 111 HB2 TYR 111 -1.266 23.526 0.531 160 HB3 TYR 111 HB1 TYR 111 -1.573 22.086 -0.440 161 HD1 TYR 111 HD2 TYR 111 -2.428 23.874 2.676 162 HD2 TYR 111 HD1 TYR 111 -3.262 20.463 0.202 163 HE1 TYR 111 HE2 TYR 111 -4.497 23.440 3.972 164 HE2 TYR 111 HE1 TYR 111 -5.332 20.030 1.498 165 HH TYR 111 HH TYR 111 -6.582 20.645 3.223 166 H ILE 112 HN ILE 112 0.366 21.194 -1.175 167 HA ILE 112 HA ILE 112 3.089 22.437 -0.933 168 HB ILE 112 HB ILE 112 2.213 20.130 -2.696 169 HG12 ILE 112 HG12 ILE 112 3.601 20.067 0.004 170 HG13 ILE 112 HG11 ILE 112 1.938 19.562 -0.299 171 HG21 ILE 112 HG21 ILE 112 4.928 19.952 -2.106 172 HG22 ILE 112 HG22 ILE 112 4.663 21.680 -2.333 173 HG23 ILE 112 HG23 ILE 112 4.236 20.547 -3.615 174 HD11 ILE 112 HD11 ILE 112 3.190 18.091 -2.183 175 HD12 ILE 112 HD12 ILE 112 2.927 17.508 -0.539 176 HD13 ILE 112 HD13 ILE 112 4.486 18.197 -0.991 177 H ASP 113 HN ASP 113 3.612 23.937 -2.510 178 HA ASP 113 HA ASP 113 1.537 24.498 -4.588 179 HB2 ASP 113 HB2 ASP 113 2.657 26.095 -2.712 180 HB3 ASP 113 HB1 ASP 113 3.796 26.354 -4.033 181 H LEU 114 HN LEU 114 2.590 25.478 -6.666 182 HA LEU 114 HA LEU 114 4.276 23.491 -7.884 183 HB2 LEU 114 HB2 LEU 114 3.160 26.194 -8.557 184 HB3 LEU 114 HB1 LEU 114 4.387 25.497 -9.617 185 HG LEU 114 HG LEU 114 2.375 23.527 -8.893 186 HD11 LEU 114 HD11 LEU 114 0.556 24.881 -8.954 187 HD12 LEU 114 HD12 LEU 114 0.847 24.954 -10.691 188 HD13 LEU 114 HD13 LEU 114 1.471 26.224 -9.639 189 HD21 LEU 114 HD21 LEU 114 3.182 24.740 -11.556 190 HD22 LEU 114 HD22 LEU 114 2.346 23.205 -11.318 191 HD23 LEU 114 HD23 LEU 114 4.012 23.396 -10.772 192 H ASP 115 HN ASP 115 4.941 26.464 -6.157 193 HA ASP 115 HA ASP 115 7.712 26.672 -7.127 194 HB2 ASP 115 HB2 ASP 115 5.777 28.336 -5.976 195 HB3 ASP 115 HB1 ASP 115 7.001 28.159 -4.718 196 H GLU 116 HN GLU 116 5.991 25.410 -4.313 197 HA GLU 116 HA GLU 116 8.439 24.941 -2.762 198 HB2 GLU 116 HB2 GLU 116 5.626 23.868 -2.381 199 HB3 GLU 116 HB1 GLU 116 6.871 24.048 -1.144 200 HG2 GLU 116 HG2 GLU 116 6.818 26.483 -1.404 201 HG3 GLU 116 HG1 GLU 116 5.629 26.338 -2.698 202 H LEU 117 HN LEU 117 6.956 23.398 -5.376 203 HA LEU 117 HA LEU 117 7.522 20.626 -4.588 204 HB2 LEU 117 HB2 LEU 117 6.471 22.122 -6.970 205 HB3 LEU 117 HB1 LEU 117 6.981 20.446 -7.173 206 HG LEU 117 HG LEU 117 4.977 21.414 -5.112 207 HD11 LEU 117 HD11 LEU 117 4.515 21.235 -7.777 208 HD12 LEU 117 HD12 LEU 117 3.290 20.871 -6.562 209 HD13 LEU 117 HD13 LEU 117 4.210 19.563 -7.304 210 HD21 LEU 117 HD21 LEU 117 6.098 18.706 -5.855 211 HD22 LEU 117 HD22 LEU 117 4.554 18.875 -5.020 212 HD23 LEU 117 HD23 LEU 117 6.035 19.460 -4.262 213 H LYS 118 HN LYS 118 9.131 23.190 -6.393 214 HA LYS 118 HA LYS 118 11.187 21.325 -7.432 215 HB2 LYS 118 HB2 LYS 118 11.902 23.279 -8.685 216 HB3 LYS 118 HB1 LYS 118 10.142 23.199 -8.755 217 HG2 LYS 118 HG2 LYS 118 9.880 24.953 -7.196 218 HG3 LYS 118 HG1 LYS 118 11.538 24.801 -6.614 219 HD2 LYS 118 HD2 LYS 118 12.113 26.430 -8.054 220 HD3 LYS 118 HD1 LYS 118 11.778 25.299 -9.365 221 HE2 LYS 118 HE2 LYS 118 9.320 26.018 -9.168 222 HE3 LYS 118 HE1 LYS 118 9.910 27.358 -8.164 223 HZ1 LYS 118 HZ1 LYS 118 11.159 28.219 -9.876 224 HZ2 LYS 118 HZ2 LYS 118 9.809 27.641 -10.730 225 HZ3 LYS 118 HZ3 LYS 118 11.252 26.745 -10.710 226 H ILE 119 HN ILE 119 10.773 23.733 -4.899 227 HA ILE 119 HA ILE 119 13.570 24.167 -4.342 228 HB ILE 119 HB ILE 119 10.996 24.462 -2.774 229 HG12 ILE 119 HG12 ILE 119 12.798 26.675 -3.721 230 HG13 ILE 119 HG11 ILE 119 11.706 25.897 -4.868 231 HG21 ILE 119 HG21 ILE 119 12.617 26.046 -1.403 232 HG22 ILE 119 HG22 ILE 119 13.849 24.923 -1.980 233 HG23 ILE 119 HG23 ILE 119 12.500 24.331 -1.009 234 HD11 ILE 119 HD11 ILE 119 10.413 27.674 -4.022 235 HD12 ILE 119 HD12 ILE 119 11.023 27.456 -2.381 236 HD13 ILE 119 HD13 ILE 119 9.881 26.296 -3.058 237 H MET 120 HN MET 120 11.157 21.868 -3.075 238 HA MET 120 HA MET 120 12.932 20.736 -1.071 239 HB2 MET 120 HB2 MET 120 11.107 19.203 -0.750 240 HB3 MET 120 HB1 MET 120 10.378 20.756 -1.159 241 HG2 MET 120 HG2 MET 120 9.228 19.453 -2.663 242 HG3 MET 120 HG1 MET 120 10.662 19.763 -3.643 243 HE1 MET 120 HE1 MET 120 8.522 17.406 -3.847 244 HE2 MET 120 HE2 MET 120 8.374 17.238 -2.099 245 HE3 MET 120 HE3 MET 120 8.947 15.879 -3.062 246 H LEU 121 HN LEU 121 12.449 20.246 -4.483 247 HA LEU 121 HA LEU 121 13.601 17.555 -4.568 248 HB2 LEU 121 HB2 LEU 121 12.176 19.379 -6.242 249 HB3 LEU 121 HB1 LEU 121 13.667 18.941 -7.077 250 HG LEU 121 HG LEU 121 13.129 16.521 -6.566 251 HD11 LEU 121 HD11 LEU 121 11.572 16.434 -4.864 252 HD12 LEU 121 HD12 LEU 121 10.475 16.368 -6.244 253 HD13 LEU 121 HD13 LEU 121 10.746 17.895 -5.404 254 HD21 LEU 121 HD21 LEU 121 12.704 17.323 -8.788 255 HD22 LEU 121 HD22 LEU 121 11.268 18.202 -8.265 256 HD23 LEU 121 HD23 LEU 121 11.259 16.439 -8.299 257 H GLN 122 HN GLN 122 14.808 20.827 -4.628 258 HA GLN 122 HA GLN 122 17.229 20.536 -6.063 259 HB2 GLN 122 HB2 GLN 122 15.999 22.315 -4.106 260 HB3 GLN 122 HB1 GLN 122 17.748 22.226 -3.894 261 HG2 GLN 122 HG2 GLN 122 18.147 22.879 -6.165 262 HG3 GLN 122 HG1 GLN 122 16.446 22.679 -6.587 263 HE21 GLN 122 HE21 GLN 122 17.249 24.136 -3.494 264 HE22 GLN 122 HE22 GLN 122 16.815 25.722 -3.913 265 H ALA 123 HN ALA 123 16.285 19.186 -3.011 266 HA ALA 123 HA ALA 123 18.666 18.885 -1.584 267 HB1 ALA 123 HB1 ALA 123 16.750 18.011 -0.581 268 HB2 ALA 123 HB2 ALA 123 17.538 16.527 -1.116 269 HB3 ALA 123 HB3 ALA 123 16.219 17.215 -2.063 270 H THR 124 HN THR 124 17.557 17.024 -4.409 271 HA THR 124 HA THR 124 20.066 15.433 -4.412 272 HB THR 124 HB THR 124 17.805 14.422 -4.770 273 HG1 THR 124 HG1 THR 124 18.450 13.214 -6.535 274 HG21 THR 124 HG21 THR 124 17.554 15.374 -7.521 275 HG22 THR 124 HG22 THR 124 17.396 16.676 -6.341 276 HG23 THR 124 HG23 THR 124 16.332 15.272 -6.254 277 H GLY 125 HN GLY 125 18.843 18.325 -5.736 278 HA2 GLY 125 HA2 GLY 125 20.314 19.798 -7.012 279 HA3 GLY 125 HA1 GLY 125 21.073 18.367 -7.712 280 H GLU 126 HN GLU 126 17.583 18.770 -7.391 281 HA GLU 126 HA GLU 126 16.882 17.948 -9.961 282 HB2 GLU 126 HB2 GLU 126 14.778 19.129 -9.512 283 HB3 GLU 126 HB1 GLU 126 15.371 18.395 -8.023 284 HG2 GLU 126 HG2 GLU 126 15.279 20.428 -7.060 285 HG3 GLU 126 HG1 GLU 126 16.575 20.940 -8.140 286 H THR 127 HN THR 127 18.353 18.821 -11.545 287 HA THR 127 HA THR 127 18.161 21.777 -11.988 288 HB THR 127 HB THR 127 20.210 21.011 -13.532 289 HG1 THR 127 HG1 THR 127 21.253 19.281 -12.271 290 HG21 THR 127 HG21 THR 127 20.251 21.287 -10.516 291 HG22 THR 127 HG22 THR 127 20.446 22.577 -11.702 292 HG23 THR 127 HG23 THR 127 21.692 21.342 -11.530 293 H ILE 128 HN ILE 128 16.193 21.746 -13.192 294 HA ILE 128 HA ILE 128 16.443 20.540 -15.918 295 HB ILE 128 HB ILE 128 14.056 19.853 -15.672 296 HG12 ILE 128 HG12 ILE 128 14.491 20.936 -12.875 297 HG13 ILE 128 HG11 ILE 128 13.289 21.470 -14.051 298 HG21 ILE 128 HG21 ILE 128 15.818 18.232 -15.160 299 HG22 ILE 128 HG22 ILE 128 14.473 18.022 -14.039 300 HG23 ILE 128 HG23 ILE 128 15.936 18.853 -13.514 301 HD11 ILE 128 HD11 ILE 128 13.402 18.700 -12.820 302 HD12 ILE 128 HD12 ILE 128 12.175 19.289 -13.942 303 HD13 ILE 128 HD13 ILE 128 12.298 19.983 -12.325 304 H THR 129 HN THR 129 14.718 21.559 -17.404 305 HA THR 129 HA THR 129 14.923 24.419 -17.345 306 HB THR 129 HB THR 129 14.623 22.979 -19.355 307 HG1 THR 129 HG1 THR 129 14.018 24.947 -19.880 308 HG21 THR 129 HG21 THR 129 11.758 22.700 -18.421 309 HG22 THR 129 HG22 THR 129 12.976 21.441 -18.215 310 HG23 THR 129 HG23 THR 129 12.500 21.951 -19.835 311 H GLU 130 HN GLU 130 12.459 25.485 -17.816 312 HA GLU 130 HA GLU 130 11.207 25.391 -15.145 313 HB2 GLU 130 HB2 GLU 130 11.673 27.533 -16.168 314 HB3 GLU 130 HB1 GLU 130 10.834 27.062 -17.647 315 HG2 GLU 130 HG2 GLU 130 8.999 28.030 -16.753 316 HG3 GLU 130 HG1 GLU 130 8.931 26.644 -15.665 317 H ASP 131 HN ASP 131 10.230 24.823 -18.539 318 HA ASP 131 HA ASP 131 7.494 24.192 -18.034 319 HB2 ASP 131 HB2 ASP 131 8.931 24.620 -20.204 320 HB3 ASP 131 HB1 ASP 131 9.122 22.867 -20.182 321 H ASP 132 HN ASP 132 10.309 22.467 -17.155 322 HA ASP 132 HA ASP 132 8.979 19.815 -17.227 323 HB2 ASP 132 HB2 ASP 132 11.707 20.949 -16.935 324 HB3 ASP 132 HB1 ASP 132 11.409 19.442 -16.068 325 H ILE 133 HN ILE 133 9.324 22.444 -15.078 326 HA ILE 133 HA ILE 133 9.540 21.079 -12.558 327 HB ILE 133 HB ILE 133 8.364 23.730 -13.438 328 HG12 ILE 133 HG12 ILE 133 10.812 23.353 -13.780 329 HG13 ILE 133 HG11 ILE 133 10.479 24.628 -12.608 330 HG21 ILE 133 HG21 ILE 133 9.057 22.839 -10.624 331 HG22 ILE 133 HG22 ILE 133 7.413 22.916 -11.258 332 HG23 ILE 133 HG23 ILE 133 8.368 24.391 -11.103 333 HD11 ILE 133 HD11 ILE 133 10.586 22.037 -11.307 334 HD12 ILE 133 HD12 ILE 133 11.526 23.491 -10.969 335 HD13 ILE 133 HD13 ILE 133 12.073 22.353 -12.200 336 H GLU 134 HN GLU 134 6.798 21.815 -14.665 337 HA GLU 134 HA GLU 134 4.778 21.114 -12.672 338 HB2 GLU 134 HB2 GLU 134 4.921 21.854 -15.572 339 HB3 GLU 134 HB1 GLU 134 3.437 21.115 -14.970 340 HG2 GLU 134 HG2 GLU 134 3.135 22.847 -13.336 341 HG3 GLU 134 HG1 GLU 134 4.747 23.496 -13.639 342 H GLU 135 HN GLU 135 6.693 19.378 -15.014 343 HA GLU 135 HA GLU 135 5.104 17.160 -15.656 344 HB2 GLU 135 HB2 GLU 135 7.510 17.822 -16.310 345 HB3 GLU 135 HB1 GLU 135 8.009 16.988 -14.838 346 HG2 GLU 135 HG2 GLU 135 6.484 15.051 -15.792 347 HG3 GLU 135 HG1 GLU 135 6.786 15.860 -17.331 348 H LEU 136 HN LEU 136 7.197 17.533 -12.766 349 HA LEU 136 HA LEU 136 6.498 15.032 -11.556 350 HB2 LEU 136 HB2 LEU 136 7.382 17.676 -10.351 351 HB3 LEU 136 HB1 LEU 136 7.485 16.106 -9.553 352 HG LEU 136 HG LEU 136 8.717 16.339 -12.258 353 HD11 LEU 136 HD11 LEU 136 10.849 17.107 -10.952 354 HD12 LEU 136 HD12 LEU 136 9.693 17.738 -9.778 355 HD13 LEU 136 HD13 LEU 136 9.669 18.321 -11.443 356 HD21 LEU 136 HD21 LEU 136 8.867 14.677 -9.844 357 HD22 LEU 136 HD22 LEU 136 10.454 15.107 -10.482 358 HD23 LEU 136 HD23 LEU 136 9.286 14.275 -11.509 359 H MET 137 HN MET 137 4.824 18.083 -11.749 360 HA MET 137 HA MET 137 3.091 17.638 -9.441 361 HB2 MET 137 HB2 MET 137 3.805 19.708 -11.232 362 HB3 MET 137 HB1 MET 137 2.068 19.469 -11.429 363 HG2 MET 137 HG2 MET 137 2.814 19.361 -8.626 364 HG3 MET 137 HG1 MET 137 3.335 20.878 -9.359 365 HE1 MET 137 HE1 MET 137 1.474 20.656 -7.072 366 HE2 MET 137 HE2 MET 137 -0.007 21.550 -7.407 367 HE3 MET 137 HE3 MET 137 1.555 22.281 -7.765 368 H LYS 138 HN LYS 138 2.894 17.057 -12.937 369 HA LYS 138 HA LYS 138 0.201 16.613 -13.390 370 HB2 LYS 138 HB2 LYS 138 2.752 15.327 -14.280 371 HB3 LYS 138 HB1 LYS 138 1.235 14.568 -14.766 372 HG2 LYS 138 HG2 LYS 138 0.464 16.732 -15.696 373 HG3 LYS 138 HG1 LYS 138 2.005 17.463 -15.246 374 HD2 LYS 138 HD2 LYS 138 3.217 16.086 -16.773 375 HD3 LYS 138 HD1 LYS 138 1.829 15.027 -17.028 376 HE2 LYS 138 HE2 LYS 138 1.198 17.822 -17.633 377 HE3 LYS 138 HE1 LYS 138 2.509 17.185 -18.645 378 HZ1 LYS 138 HZ1 LYS 138 0.168 15.496 -18.098 379 HZ2 LYS 138 HZ2 LYS 138 1.210 15.489 -19.440 380 HZ3 LYS 138 HZ3 LYS 138 0.038 16.708 -19.277 381 H ASP 139 HN ASP 139 2.464 14.345 -11.807 382 HA ASP 139 HA ASP 139 0.322 12.391 -11.301 383 HB2 ASP 139 HB2 ASP 139 3.255 12.622 -11.126 384 HB3 ASP 139 HB1 ASP 139 2.540 11.651 -9.838 385 H GLY 140 HN GLY 140 2.212 14.774 -9.453 386 HA2 GLY 140 HA2 GLY 140 1.137 14.026 -6.878 387 HA3 GLY 140 HA1 GLY 140 1.961 15.543 -7.244 388 H ASP 141 HN ASP 141 -0.043 15.944 -9.516 389 HA ASP 141 HA ASP 141 -2.435 16.663 -7.859 390 HB2 ASP 141 HB2 ASP 141 -0.460 18.396 -8.776 391 HB3 ASP 141 HB1 ASP 141 -1.741 18.560 -9.980 392 H LYS 142 HN LYS 142 -2.203 14.398 -9.622 393 HA LYS 142 HA LYS 142 -3.005 14.706 -12.282 394 HB2 LYS 142 HB2 LYS 142 -3.228 12.726 -10.124 395 HB3 LYS 142 HB1 LYS 142 -4.504 12.576 -11.333 396 HG2 LYS 142 HG2 LYS 142 -2.501 12.852 -13.033 397 HG3 LYS 142 HG1 LYS 142 -1.538 12.289 -11.667 398 HD2 LYS 142 HD2 LYS 142 -2.224 10.369 -13.007 399 HD3 LYS 142 HD1 LYS 142 -3.061 10.321 -11.455 400 HE2 LYS 142 HE2 LYS 142 -4.496 11.839 -13.548 401 HE3 LYS 142 HE1 LYS 142 -4.335 10.102 -13.874 402 HZ1 LYS 142 HZ1 LYS 142 -4.878 10.553 -11.126 403 HZ2 LYS 142 HZ2 LYS 142 -5.761 9.639 -12.253 404 HZ3 LYS 142 HZ3 LYS 142 -6.068 11.300 -12.076 405 H ASN 143 HN ASN 143 -4.842 15.334 -9.365 406 HA ASN 143 HA ASN 143 -7.466 15.361 -10.622 407 HB2 ASN 143 HB2 ASN 143 -7.111 14.965 -8.228 408 HB3 ASN 143 HB1 ASN 143 -6.357 16.551 -8.058 409 HD21 ASN 143 HD21 ASN 143 -7.896 17.676 -6.800 410 HD22 ASN 143 HD22 ASN 143 -9.524 17.868 -7.245 411 H ASN 144 HN ASN 144 -4.811 17.427 -10.847 412 HA ASN 144 HA ASN 144 -4.569 19.704 -11.471 413 HB2 ASN 144 HB2 ASN 144 -5.723 18.238 -13.350 414 HB3 ASN 144 HB1 ASN 144 -7.107 19.278 -13.014 415 HD21 ASN 144 HD21 ASN 144 -6.945 21.541 -13.588 416 HD22 ASN 144 HD22 ASN 144 -5.657 22.145 -14.514 417 H ASP 145 HN ASP 145 -5.246 20.371 -9.214 418 HA ASP 145 HA ASP 145 -7.874 21.816 -9.282 419 HB2 ASP 145 HB2 ASP 145 -8.295 20.209 -7.689 420 HB3 ASP 145 HB1 ASP 145 -6.587 19.958 -7.349 421 H GLY 146 HN GLY 146 -4.512 22.088 -9.102 422 HA2 GLY 146 HA2 GLY 146 -3.412 24.247 -9.091 423 HA3 GLY 146 HA1 GLY 146 -4.764 24.896 -8.162 424 H ARG 147 HN ARG 147 -4.275 22.051 -6.703 425 HA ARG 147 HA ARG 147 -1.945 22.879 -5.049 426 HB2 ARG 147 HB2 ARG 147 -4.704 23.329 -4.420 427 HB3 ARG 147 HB1 ARG 147 -4.076 22.118 -3.302 428 HG2 ARG 147 HG2 ARG 147 -2.330 23.561 -2.560 429 HG3 ARG 147 HG1 ARG 147 -2.596 24.687 -3.891 430 HD2 ARG 147 HD2 ARG 147 -4.407 25.678 -2.866 431 HD3 ARG 147 HD1 ARG 147 -4.921 24.166 -2.090 432 HE ARG 147 HE ARG 147 -3.538 24.720 -0.261 433 HH11 ARG 147 HH21 ARG 147 -2.605 26.414 -3.123 434 HH12 ARG 147 HH22 ARG 147 -1.382 27.345 -2.326 435 HH21 ARG 147 HH11 ARG 147 -1.947 25.931 0.787 436 HH22 ARG 147 HH12 ARG 147 -1.011 27.074 -0.117 437 H ILE 148 HN ILE 148 -1.179 21.107 -3.681 438 HA ILE 148 HA ILE 148 -2.186 18.419 -4.562 439 HB ILE 148 HB ILE 148 0.566 19.519 -3.953 440 HG12 ILE 148 HG12 ILE 148 -0.768 18.224 -6.344 441 HG13 ILE 148 HG11 ILE 148 -0.104 19.854 -6.234 442 HG21 ILE 148 HG21 ILE 148 0.412 17.358 -2.833 443 HG22 ILE 148 HG22 ILE 148 1.379 17.178 -4.297 444 HG23 ILE 148 HG23 ILE 148 -0.297 16.629 -4.274 445 HD11 ILE 148 HD11 ILE 148 1.531 17.311 -5.989 446 HD12 ILE 148 HD12 ILE 148 2.156 18.960 -6.005 447 HD13 ILE 148 HD13 ILE 148 1.408 18.287 -7.453 448 H ASP 149 HN ASP 149 -3.534 17.954 -2.781 449 HA ASP 149 HA ASP 149 -2.837 18.551 -0.038 450 HB2 ASP 149 HB2 ASP 149 -4.795 17.062 0.395 451 HB3 ASP 149 HB1 ASP 149 -5.134 18.266 -0.849 452 H TYR 150 HN TYR 150 -3.228 16.223 1.368 453 HA TYR 150 HA TYR 150 -0.681 14.803 0.919 454 HB2 TYR 150 HB2 TYR 150 -1.345 15.566 3.149 455 HB3 TYR 150 HB1 TYR 150 -2.849 14.653 3.039 456 HD1 TYR 150 HD1 TYR 150 0.162 13.209 1.565 457 HD2 TYR 150 HD2 TYR 150 -2.226 13.437 5.129 458 HE1 TYR 150 HE1 TYR 150 1.308 11.201 2.463 459 HE2 TYR 150 HE2 TYR 150 -1.080 11.430 6.025 460 HH TYR 150 HH TYR 150 1.406 9.728 4.117 461 H ASP 151 HN ASP 151 -4.147 14.208 0.628 462 HA ASP 151 HA ASP 151 -4.104 11.354 0.457 463 HB2 ASP 151 HB2 ASP 151 -5.939 13.437 0.355 464 HB3 ASP 151 HB1 ASP 151 -6.035 12.740 -1.262 465 H GLU 152 HN GLU 152 -3.711 13.880 -2.028 466 HA GLU 152 HA GLU 152 -3.554 12.032 -4.257 467 HB2 GLU 152 HB2 GLU 152 -2.900 14.928 -3.728 468 HB3 GLU 152 HB1 GLU 152 -2.515 14.193 -5.285 469 HG2 GLU 152 HG2 GLU 152 -4.793 13.709 -5.744 470 HG3 GLU 152 HG1 GLU 152 -5.271 13.982 -4.068 471 H PHE 153 HN PHE 153 -1.163 13.632 -2.166 472 HA PHE 153 HA PHE 153 1.234 13.102 -3.486 473 HB2 PHE 153 HB2 PHE 153 0.826 14.288 -1.296 474 HB3 PHE 153 HB1 PHE 153 0.681 12.706 -0.530 475 HD1 PHE 153 HD2 PHE 153 2.991 14.697 -2.708 476 HD2 PHE 153 HD1 PHE 153 2.599 11.623 0.268 477 HE1 PHE 153 HE2 PHE 153 5.460 14.559 -2.525 478 HE2 PHE 153 HE1 PHE 153 5.068 11.485 0.450 479 HZ PHE 153 HZ PHE 153 6.499 12.952 -0.946 480 H LEU 154 HN LEU 154 -0.693 10.844 -1.507 481 HA LEU 154 HA LEU 154 1.102 8.650 -1.461 482 HB2 LEU 154 HB2 LEU 154 -1.813 9.158 -1.206 483 HB3 LEU 154 HB1 LEU 154 -1.357 7.489 -1.552 484 HG LEU 154 HG LEU 154 -1.477 8.000 0.902 485 HD11 LEU 154 HD11 LEU 154 1.099 7.293 1.214 486 HD12 LEU 154 HD12 LEU 154 0.944 7.004 -0.519 487 HD13 LEU 154 HD13 LEU 154 -0.118 6.168 0.613 488 HD21 LEU 154 HD21 LEU 154 0.548 9.321 1.764 489 HD22 LEU 154 HD22 LEU 154 -0.733 10.266 1.003 490 HD23 LEU 154 HD23 LEU 154 0.741 9.898 0.108 491 H GLU 155 HN GLU 155 -1.539 9.312 -3.799 492 HA GLU 155 HA GLU 155 -1.065 7.115 -5.531 493 HB2 GLU 155 HB2 GLU 155 -3.016 8.717 -5.460 494 HB3 GLU 155 HB1 GLU 155 -1.990 9.912 -6.255 495 HG2 GLU 155 HG2 GLU 155 -2.148 7.208 -7.503 496 HG3 GLU 155 HG1 GLU 155 -3.563 8.251 -7.652 497 H PHE 156 HN PHE 156 0.748 10.041 -5.062 498 HA PHE 156 HA PHE 156 2.119 9.889 -7.669 499 HB2 PHE 156 HB2 PHE 156 1.688 12.063 -6.781 500 HB3 PHE 156 HB1 PHE 156 2.294 11.610 -5.187 501 HD1 PHE 156 HD2 PHE 156 3.764 10.956 -8.564 502 HD2 PHE 156 HD1 PHE 156 4.148 13.012 -4.811 503 HE1 PHE 156 HE2 PHE 156 6.036 11.712 -9.210 504 HE2 PHE 156 HE1 PHE 156 6.420 13.768 -5.458 505 HZ PHE 156 HZ PHE 156 7.363 13.118 -7.658 506 H MET 157 HN MET 157 2.864 9.280 -4.234 507 HA MET 157 HA MET 157 5.590 8.353 -4.897 508 HB2 MET 157 HB2 MET 157 4.048 8.328 -2.283 509 HB3 MET 157 HB1 MET 157 5.798 8.223 -2.477 510 HG2 MET 157 HG2 MET 157 4.113 10.588 -3.349 511 HG3 MET 157 HG1 MET 157 5.038 10.517 -1.849 512 HE1 MET 157 HE1 MET 157 7.142 10.222 -1.507 513 HE2 MET 157 HE2 MET 157 7.715 11.800 -2.041 514 HE3 MET 157 HE3 MET 157 8.535 10.342 -2.592 515 H LYS 158 HN LYS 158 2.446 7.014 -4.684 516 HA LYS 158 HA LYS 158 2.974 4.409 -3.639 517 HB2 LYS 158 HB2 LYS 158 0.755 5.502 -4.053 518 HB3 LYS 158 HB1 LYS 158 1.008 5.273 -5.784 519 HG2 LYS 158 HG2 LYS 158 0.179 3.191 -5.605 520 HG3 LYS 158 HG1 LYS 158 1.518 2.772 -4.536 521 HD2 LYS 158 HD2 LYS 158 -0.276 2.346 -3.130 522 HD3 LYS 158 HD1 LYS 158 0.038 4.035 -2.733 523 HE2 LYS 158 HE2 LYS 158 -1.665 4.067 -5.002 524 HE3 LYS 158 HE1 LYS 158 -2.352 2.890 -3.865 525 HZ1 LYS 158 HZ1 LYS 158 -3.128 4.781 -2.905 526 HZ2 LYS 158 HZ2 LYS 158 -1.871 5.751 -3.511 527 HZ3 LYS 158 HZ3 LYS 158 -1.604 4.752 -2.163 528 H GLY 159 HN GLY 159 5.182 4.157 -4.755 529 HA2 GLY 159 HA2 GLY 159 6.442 2.903 -6.295 530 HA3 GLY 159 HA1 GLY 159 4.921 2.332 -6.982 531 H VAL 160 HN VAL 160 6.933 5.289 -6.858 532 HA VAL 160 HA VAL 160 5.779 6.668 -9.036 533 HB VAL 160 HB VAL 160 8.177 7.607 -9.191 534 HG11 VAL 160 HG11 VAL 160 7.990 8.664 -6.945 535 HG12 VAL 160 HG12 VAL 160 6.752 7.484 -6.516 536 HG13 VAL 160 HG13 VAL 160 6.451 8.650 -7.805 537 HG21 VAL 160 HG21 VAL 160 9.858 6.601 -8.049 538 HG22 VAL 160 HG22 VAL 160 8.789 5.201 -7.957 539 HG23 VAL 160 HG23 VAL 160 8.848 6.354 -6.624 540 H GLU 161 HN GLU 161 5.806 6.296 -11.227 541 HA GLU 161 HA GLU 161 6.801 3.862 -12.355 542 HB2 GLU 161 HB2 GLU 161 5.249 6.126 -13.076 543 HB3 GLU 161 HB1 GLU 161 6.519 5.981 -14.292 544 HG2 GLU 161 HG2 GLU 161 5.551 4.158 -15.195 545 HG3 GLU 161 HG1 GLU 161 5.421 3.378 -13.618 546 HO1 KDH 1 H1 KDH 1 7.922 9.530 -10.939 547 H21 KDH 1 H21 KDH 1 12.392 9.273 -2.923 548 H33 KDH 1 H33 KDH 1 9.329 12.983 -6.423 549 H4 KDH 1 H4 KDH 1 8.129 11.296 -7.798 550 HO7 KDH 1 H7 KDH 1 10.356 7.711 -10.967 551 H01 KDH 1 H01 KDH 1 10.588 14.212 -4.555 552 H01A KDH 1 H02 KDH 1 9.307 13.023 -4.092 553 HO03 KDH 1 H03 KDH 1 10.806 14.817 -2.816 554 HO10 KDH 1 H10 KDH 1 13.032 8.786 -9.530 555 H12 KDH 1 H12 KDH 1 12.040 9.455 -6.933 556 H15 KDH 1 H15 KDH 1 9.150 10.871 -5.473 557 H26 KDH 1 H26 KDH 1 13.019 12.986 -0.670 558 H39 KDH 1 H39 KDH 1 11.022 11.345 -9.183 559 H41 KDH 1 H41 KDH 1 12.995 15.275 -9.059 560 HO02 KDH 1 H42 KDH 1 12.951 10.049 -0.044 561 HO44 KDH 1 H44 KDH 1 14.583 14.705 -12.169 562 HO47 KDH 1 H47 KDH 1 15.224 11.971 -11.946 563 HO50 KDH 1 H50 KDH 1 12.556 10.565 -12.302 Start of MODEL 18 1 H1 MET 90 HT1 MET 90 13.166 4.796 -0.916 2 H2 MET 90 HT2 MET 90 14.365 5.688 -0.108 3 H3 MET 90 HT3 MET 90 13.657 6.300 -1.526 4 HA MET 90 HA MET 90 12.254 5.875 1.067 5 HB2 MET 90 HB2 MET 90 13.505 8.206 -0.387 6 HB3 MET 90 HB1 MET 90 12.211 8.466 0.785 7 HG2 MET 90 HG2 MET 90 13.706 6.889 2.300 8 HG3 MET 90 HG1 MET 90 14.993 7.444 1.229 9 HE1 MET 90 HE1 MET 90 12.869 9.611 4.564 10 HE2 MET 90 HE2 MET 90 13.519 7.975 4.491 11 HE3 MET 90 HE3 MET 90 12.095 8.393 3.542 12 H GLY 91 HN GLY 91 10.017 6.395 0.975 13 HA2 GLY 91 HA2 GLY 91 8.079 7.338 -0.202 14 HA3 GLY 91 HA1 GLY 91 8.906 7.013 -1.726 15 H LYS 92 HN LYS 92 6.856 5.685 0.733 16 HA LYS 92 HA LYS 92 6.576 3.202 -0.915 17 HB2 LYS 92 HB2 LYS 92 7.321 3.568 1.960 18 HB3 LYS 92 HB1 LYS 92 6.299 2.190 1.548 19 HG2 LYS 92 HG2 LYS 92 8.026 1.081 0.610 20 HG3 LYS 92 HG1 LYS 92 8.504 2.493 -0.333 21 HD2 LYS 92 HD2 LYS 92 10.341 2.037 1.127 22 HD3 LYS 92 HD1 LYS 92 9.506 3.427 1.822 23 HE2 LYS 92 HE2 LYS 92 8.767 2.236 3.648 24 HE3 LYS 92 HE1 LYS 92 8.581 0.735 2.719 25 HZ1 LYS 92 HZ1 LYS 92 11.127 1.985 3.601 26 HZ2 LYS 92 HZ2 LYS 92 11.037 0.674 2.525 27 HZ3 LYS 92 HZ3 LYS 92 10.488 0.504 4.123 28 H SER 93 HN SER 93 5.178 4.245 2.193 29 HA SER 93 HA SER 93 2.525 4.592 0.865 30 HB2 SER 93 HB2 SER 93 1.566 2.882 2.096 31 HB3 SER 93 HB1 SER 93 3.203 2.244 1.975 32 HG SER 93 HG SER 93 1.819 3.128 4.146 33 H GLU 94 HN GLU 94 0.931 5.269 2.848 34 HA GLU 94 HA GLU 94 1.658 7.838 3.729 35 HB2 GLU 94 HB2 GLU 94 -0.225 5.746 4.855 36 HB3 GLU 94 HB1 GLU 94 -0.211 7.424 5.398 37 HG2 GLU 94 HG2 GLU 94 -1.014 8.232 3.372 38 HG3 GLU 94 HG1 GLU 94 -0.394 6.855 2.460 39 H GLU 95 HN GLU 95 2.663 4.760 4.970 40 HA GLU 95 HA GLU 95 3.298 5.613 7.674 41 HB2 GLU 95 HB2 GLU 95 3.315 3.259 6.035 42 HB3 GLU 95 HB1 GLU 95 4.901 3.419 6.791 43 HG2 GLU 95 HG2 GLU 95 4.086 2.973 8.859 44 HG3 GLU 95 HG1 GLU 95 2.671 3.997 8.616 45 H GLU 96 HN GLU 96 5.196 5.190 4.675 46 HA GLU 96 HA GLU 96 7.617 6.297 5.961 47 HB2 GLU 96 HB2 GLU 96 7.343 4.364 4.207 48 HB3 GLU 96 HB1 GLU 96 7.248 5.680 3.036 49 HG2 GLU 96 HG2 GLU 96 9.548 5.194 3.093 50 HG3 GLU 96 HG1 GLU 96 9.405 6.564 4.196 51 H LEU 97 HN LEU 97 4.975 7.346 3.937 52 HA LEU 97 HA LEU 97 6.345 9.769 2.981 53 HB2 LEU 97 HB2 LEU 97 3.459 8.828 2.875 54 HB3 LEU 97 HB1 LEU 97 4.128 10.171 1.947 55 HG LEU 97 HG LEU 97 4.860 7.242 1.732 56 HD11 LEU 97 HD11 LEU 97 3.337 7.302 0.078 57 HD12 LEU 97 HD12 LEU 97 4.360 8.464 -0.767 58 HD13 LEU 97 HD13 LEU 97 3.090 9.032 0.318 59 HD21 LEU 97 HD21 LEU 97 6.249 9.728 0.737 60 HD22 LEU 97 HD22 LEU 97 6.389 8.205 -0.141 61 HD23 LEU 97 HD23 LEU 97 6.951 8.316 1.526 62 H SER 98 HN SER 98 4.256 8.825 5.632 63 HA SER 98 HA SER 98 3.047 11.232 6.399 64 HB2 SER 98 HB2 SER 98 3.516 10.197 8.768 65 HB3 SER 98 HB1 SER 98 2.517 9.304 7.625 66 HG SER 98 HG SER 98 3.965 7.797 7.707 67 H ASP 99 HN ASP 99 6.437 10.337 6.570 68 HA ASP 99 HA ASP 99 7.083 12.695 8.263 69 HB2 ASP 99 HB2 ASP 99 8.748 10.440 7.094 70 HB3 ASP 99 HB1 ASP 99 9.334 11.640 8.246 71 H LEU 100 HN LEU 100 6.880 11.832 4.956 72 HA LEU 100 HA LEU 100 8.977 13.695 4.038 73 HB2 LEU 100 HB2 LEU 100 6.930 11.880 2.742 74 HB3 LEU 100 HB1 LEU 100 7.983 12.933 1.796 75 HG LEU 100 HG LEU 100 9.022 10.947 3.833 76 HD11 LEU 100 HD11 LEU 100 8.077 10.572 1.074 77 HD12 LEU 100 HD12 LEU 100 8.412 9.370 2.320 78 HD13 LEU 100 HD13 LEU 100 9.728 10.008 1.334 79 HD21 LEU 100 HD21 LEU 100 10.645 11.864 1.533 80 HD22 LEU 100 HD22 LEU 100 11.103 11.663 3.224 81 HD23 LEU 100 HD23 LEU 100 10.248 13.117 2.709 82 H PHE 101 HN PHE 101 5.438 13.558 4.248 83 HA PHE 101 HA PHE 101 4.802 15.814 2.639 84 HB2 PHE 101 HB2 PHE 101 3.281 14.054 3.626 85 HB3 PHE 101 HB1 PHE 101 3.435 14.879 5.178 86 HD1 PHE 101 HD1 PHE 101 2.483 17.113 5.526 87 HD2 PHE 101 HD2 PHE 101 2.052 15.060 1.777 88 HE1 PHE 101 HE1 PHE 101 0.719 18.719 4.849 89 HE2 PHE 101 HE2 PHE 101 0.287 16.666 1.100 90 HZ PHE 101 HZ PHE 101 -0.379 18.496 2.636 91 H ARG 102 HN ARG 102 5.708 15.609 6.082 92 HA ARG 102 HA ARG 102 5.310 18.472 6.535 93 HB2 ARG 102 HB2 ARG 102 5.993 17.921 8.759 94 HB3 ARG 102 HB1 ARG 102 5.104 16.512 8.181 95 HG2 ARG 102 HG2 ARG 102 7.383 15.592 7.425 96 HG3 ARG 102 HG1 ARG 102 8.094 16.859 8.426 97 HD2 ARG 102 HD2 ARG 102 5.960 15.173 9.673 98 HD3 ARG 102 HD1 ARG 102 7.563 14.444 9.448 99 HE ARG 102 HE ARG 102 7.842 17.105 10.497 100 HH11 ARG 102 HH21 ARG 102 6.880 13.891 11.325 101 HH12 ARG 102 HH22 ARG 102 7.308 14.057 12.995 102 HH21 ARG 102 HH11 ARG 102 8.403 17.327 12.672 103 HH22 ARG 102 HH12 ARG 102 8.168 15.996 13.755 104 H MET 103 HN MET 103 8.044 16.345 5.779 105 HA MET 103 HA MET 103 10.048 18.442 6.208 106 HB2 MET 103 HB2 MET 103 9.964 15.667 6.056 107 HB3 MET 103 HB1 MET 103 10.778 16.129 4.561 108 HG2 MET 103 HG2 MET 103 11.735 17.685 6.833 109 HG3 MET 103 HG1 MET 103 11.957 15.953 7.085 110 HE1 MET 103 HE1 MET 103 15.459 16.696 6.054 111 HE2 MET 103 HE2 MET 103 14.275 16.510 7.344 112 HE3 MET 103 HE3 MET 103 14.564 18.102 6.647 113 H PHE 104 HN PHE 104 8.744 16.736 3.331 114 HA PHE 104 HA PHE 104 10.133 18.102 1.312 115 HB2 PHE 104 HB2 PHE 104 7.378 16.908 1.571 116 HB3 PHE 104 HB1 PHE 104 7.879 17.657 0.057 117 HD1 PHE 104 HD2 PHE 104 10.667 16.339 1.860 118 HD2 PHE 104 HD1 PHE 104 7.464 15.217 -0.774 119 HE1 PHE 104 HE2 PHE 104 11.898 14.279 1.241 120 HE2 PHE 104 HE1 PHE 104 8.696 13.156 -1.392 121 HZ PHE 104 HZ PHE 104 10.913 12.687 -0.385 122 H ASP 105 HN ASP 105 6.992 19.034 2.776 123 HA ASP 105 HA ASP 105 6.459 21.377 1.343 124 HB2 ASP 105 HB2 ASP 105 5.254 20.100 3.301 125 HB3 ASP 105 HB1 ASP 105 6.118 21.243 4.330 126 H LYS 106 HN LYS 106 8.345 22.601 0.852 127 HA LYS 106 HA LYS 106 10.288 23.399 2.844 128 HB2 LYS 106 HB2 LYS 106 10.422 23.210 0.255 129 HB3 LYS 106 HB1 LYS 106 9.692 24.816 0.245 130 HG2 LYS 106 HG2 LYS 106 12.044 25.199 0.205 131 HG3 LYS 106 HG1 LYS 106 11.550 25.505 1.870 132 HD2 LYS 106 HD2 LYS 106 13.203 24.049 2.420 133 HD3 LYS 106 HD1 LYS 106 12.058 22.804 1.922 134 HE2 LYS 106 HE2 LYS 106 13.001 23.176 -0.472 135 HE3 LYS 106 HE1 LYS 106 14.357 23.975 0.351 136 HZ1 LYS 106 HZ1 LYS 106 14.815 22.066 1.601 137 HZ2 LYS 106 HZ2 LYS 106 14.538 21.474 0.033 138 HZ3 LYS 106 HZ3 LYS 106 13.331 21.338 1.220 139 H ASN 107 HN ASN 107 7.183 24.654 1.854 140 HA ASN 107 HA ASN 107 7.692 27.305 3.079 141 HB2 ASN 107 HB2 ASN 107 6.451 27.065 0.955 142 HB3 ASN 107 HB1 ASN 107 5.253 26.059 1.769 143 HD21 ASN 107 HD21 ASN 107 3.405 27.345 1.988 144 HD22 ASN 107 HD22 ASN 107 3.400 28.935 2.583 145 H ALA 108 HN ALA 108 6.213 24.238 3.857 146 HA ALA 108 HA ALA 108 5.173 23.481 5.839 147 HB1 ALA 108 HB1 ALA 108 7.174 25.454 6.446 148 HB2 ALA 108 HB2 ALA 108 6.665 24.078 7.424 149 HB3 ALA 108 HB3 ALA 108 5.841 25.629 7.587 150 H ASP 109 HN ASP 109 3.051 24.025 4.789 151 HA ASP 109 HA ASP 109 1.639 26.134 6.357 152 HB2 ASP 109 HB2 ASP 109 0.774 27.146 4.377 153 HB3 ASP 109 HB1 ASP 109 2.491 26.906 4.057 154 H GLY 110 HN GLY 110 1.777 22.972 5.638 155 HA2 GLY 110 HA2 GLY 110 0.019 21.449 6.373 156 HA3 GLY 110 HA1 GLY 110 -1.174 22.658 5.896 157 H TYR 111 HN TYR 111 0.255 23.185 3.331 158 HA TYR 111 HA TYR 111 -0.255 20.601 1.906 159 HB2 TYR 111 HB2 TYR 111 -1.231 23.334 1.029 160 HB3 TYR 111 HB1 TYR 111 -1.668 21.771 0.337 161 HD1 TYR 111 HD2 TYR 111 -1.929 23.874 3.398 162 HD2 TYR 111 HD1 TYR 111 -3.406 20.443 1.277 163 HE1 TYR 111 HE2 TYR 111 -3.796 23.676 5.019 164 HE2 TYR 111 HE1 TYR 111 -5.273 20.245 2.898 165 HH TYR 111 HH TYR 111 -5.429 22.270 5.778 166 H ILE 112 HN ILE 112 0.427 21.028 -0.555 167 HA ILE 112 HA ILE 112 3.019 22.544 -0.524 168 HB ILE 112 HB ILE 112 2.251 19.896 -1.790 169 HG12 ILE 112 HG12 ILE 112 4.337 20.556 0.313 170 HG13 ILE 112 HG11 ILE 112 2.729 19.931 0.684 171 HG21 ILE 112 HG21 ILE 112 4.077 20.022 -3.119 172 HG22 ILE 112 HG22 ILE 112 5.077 20.655 -1.811 173 HG23 ILE 112 HG23 ILE 112 4.076 21.750 -2.765 174 HD11 ILE 112 HD11 ILE 112 5.081 18.495 -0.224 175 HD12 ILE 112 HD12 ILE 112 3.724 18.234 -1.320 176 HD13 ILE 112 HD13 ILE 112 3.558 17.856 0.395 177 H ASP 113 HN ASP 113 3.523 23.693 -2.438 178 HA ASP 113 HA ASP 113 1.283 23.921 -4.422 179 HB2 ASP 113 HB2 ASP 113 2.121 25.835 -2.808 180 HB3 ASP 113 HB1 ASP 113 3.427 25.983 -3.984 181 H LEU 114 HN LEU 114 2.219 24.776 -6.625 182 HA LEU 114 HA LEU 114 3.955 22.807 -7.744 183 HB2 LEU 114 HB2 LEU 114 3.165 25.600 -8.632 184 HB3 LEU 114 HB1 LEU 114 3.939 24.409 -9.679 185 HG LEU 114 HG LEU 114 1.676 23.225 -8.320 186 HD11 LEU 114 HD11 LEU 114 0.575 25.142 -10.234 187 HD12 LEU 114 HD12 LEU 114 1.270 25.931 -8.818 188 HD13 LEU 114 HD13 LEU 114 0.005 24.719 -8.620 189 HD21 LEU 114 HD21 LEU 114 1.065 22.634 -10.608 190 HD22 LEU 114 HD22 LEU 114 2.808 22.444 -10.414 191 HD23 LEU 114 HD23 LEU 114 2.162 23.857 -11.248 192 H ASP 115 HN ASP 115 4.609 25.895 -6.207 193 HA ASP 115 HA ASP 115 7.363 26.076 -7.196 194 HB2 ASP 115 HB2 ASP 115 5.567 27.872 -6.384 195 HB3 ASP 115 HB1 ASP 115 6.328 27.574 -4.821 196 H GLU 116 HN GLU 116 5.728 24.937 -4.263 197 HA GLU 116 HA GLU 116 8.075 24.694 -2.617 198 HB2 GLU 116 HB2 GLU 116 5.451 23.166 -2.606 199 HB3 GLU 116 HB1 GLU 116 6.573 23.297 -1.250 200 HG2 GLU 116 HG2 GLU 116 6.295 25.818 -1.408 201 HG3 GLU 116 HG1 GLU 116 4.970 25.519 -2.534 202 H LEU 117 HN LEU 117 6.363 22.347 -4.712 203 HA LEU 117 HA LEU 117 8.004 20.083 -4.141 204 HB2 LEU 117 HB2 LEU 117 6.580 20.888 -6.700 205 HB3 LEU 117 HB1 LEU 117 7.054 19.248 -6.256 206 HG LEU 117 HG LEU 117 5.382 20.777 -4.313 207 HD11 LEU 117 HD11 LEU 117 3.928 21.252 -6.032 208 HD12 LEU 117 HD12 LEU 117 3.432 19.587 -5.732 209 HD13 LEU 117 HD13 LEU 117 4.545 19.951 -7.051 210 HD21 LEU 117 HD21 LEU 117 5.955 18.620 -3.572 211 HD22 LEU 117 HD22 LEU 117 5.799 17.923 -5.185 212 HD23 LEU 117 HD23 LEU 117 4.357 18.371 -4.274 213 H LYS 118 HN LYS 118 8.250 22.516 -6.755 214 HA LYS 118 HA LYS 118 10.593 21.464 -7.998 215 HB2 LYS 118 HB2 LYS 118 9.153 23.066 -9.082 216 HB3 LYS 118 HB1 LYS 118 9.374 24.230 -7.774 217 HG2 LYS 118 HG2 LYS 118 11.952 23.468 -8.772 218 HG3 LYS 118 HG1 LYS 118 10.936 23.949 -10.131 219 HD2 LYS 118 HD2 LYS 118 10.896 26.123 -9.483 220 HD3 LYS 118 HD1 LYS 118 10.677 25.702 -7.784 221 HE2 LYS 118 HE2 LYS 118 12.853 26.223 -7.432 222 HE3 LYS 118 HE1 LYS 118 13.307 24.875 -8.494 223 HZ1 LYS 118 HZ1 LYS 118 12.809 27.699 -9.217 224 HZ2 LYS 118 HZ2 LYS 118 12.696 26.463 -10.378 225 HZ3 LYS 118 HZ3 LYS 118 14.165 26.742 -9.570 226 H ILE 119 HN ILE 119 10.165 23.771 -5.320 227 HA ILE 119 HA ILE 119 12.972 24.465 -5.103 228 HB ILE 119 HB ILE 119 10.480 24.739 -3.426 229 HG12 ILE 119 HG12 ILE 119 12.375 26.694 -4.769 230 HG13 ILE 119 HG11 ILE 119 10.766 26.246 -5.338 231 HG21 ILE 119 HG21 ILE 119 11.978 26.237 -1.948 232 HG22 ILE 119 HG22 ILE 119 13.333 25.346 -2.642 233 HG23 ILE 119 HG23 ILE 119 12.100 24.493 -1.713 234 HD11 ILE 119 HD11 ILE 119 10.971 27.247 -2.540 235 HD12 ILE 119 HD12 ILE 119 9.697 27.498 -3.734 236 HD13 ILE 119 HD13 ILE 119 11.191 28.430 -3.830 237 H MET 120 HN MET 120 10.995 21.836 -3.899 238 HA MET 120 HA MET 120 13.009 21.030 -1.886 239 HB2 MET 120 HB2 MET 120 10.684 20.823 -1.305 240 HB3 MET 120 HB1 MET 120 10.323 19.976 -2.810 241 HG2 MET 120 HG2 MET 120 12.387 18.803 -0.989 242 HG3 MET 120 HG1 MET 120 10.689 18.635 -0.543 243 HE1 MET 120 HE1 MET 120 9.151 17.455 -1.308 244 HE2 MET 120 HE2 MET 120 9.206 16.111 -2.445 245 HE3 MET 120 HE3 MET 120 8.858 17.737 -3.029 246 H LEU 121 HN LEU 121 12.201 20.356 -5.192 247 HA LEU 121 HA LEU 121 13.376 17.681 -5.283 248 HB2 LEU 121 HB2 LEU 121 11.889 19.517 -6.945 249 HB3 LEU 121 HB1 LEU 121 13.261 18.874 -7.848 250 HG LEU 121 HG LEU 121 12.584 16.577 -7.243 251 HD11 LEU 121 HD11 LEU 121 11.350 16.408 -5.349 252 HD12 LEU 121 HD12 LEU 121 9.969 16.805 -6.372 253 HD13 LEU 121 HD13 LEU 121 10.790 18.076 -5.467 254 HD21 LEU 121 HD21 LEU 121 10.189 18.064 -8.343 255 HD22 LEU 121 HD22 LEU 121 10.728 16.433 -8.741 256 HD23 LEU 121 HD23 LEU 121 11.664 17.827 -9.280 257 H GLN 122 HN GLN 122 14.513 20.980 -5.763 258 HA GLN 122 HA GLN 122 16.851 20.563 -7.278 259 HB2 GLN 122 HB2 GLN 122 17.674 22.550 -5.796 260 HB3 GLN 122 HB1 GLN 122 16.245 22.784 -6.802 261 HG2 GLN 122 HG2 GLN 122 14.851 22.925 -5.014 262 HG3 GLN 122 HG1 GLN 122 15.709 21.671 -4.120 263 HE21 GLN 122 HE21 GLN 122 16.665 24.920 -5.395 264 HE22 GLN 122 HE22 GLN 122 17.324 25.458 -3.926 265 H ALA 123 HN ALA 123 16.136 19.457 -4.082 266 HA ALA 123 HA ALA 123 18.545 19.346 -2.723 267 HB1 ALA 123 HB1 ALA 123 16.931 18.251 -1.541 268 HB2 ALA 123 HB2 ALA 123 17.519 16.813 -2.377 269 HB3 ALA 123 HB3 ALA 123 16.122 17.688 -3.004 270 H THR 124 HN THR 124 17.722 17.677 -5.701 271 HA THR 124 HA THR 124 20.366 16.259 -5.605 272 HB THR 124 HB THR 124 18.381 14.805 -5.643 273 HG1 THR 124 HG1 THR 124 19.211 13.556 -7.143 274 HG21 THR 124 HG21 THR 124 17.002 14.915 -7.831 275 HG22 THR 124 HG22 THR 124 17.668 16.539 -8.003 276 HG23 THR 124 HG23 THR 124 16.683 16.135 -6.598 277 H GLY 125 HN GLY 125 18.808 18.879 -6.985 278 HA2 GLY 125 HA2 GLY 125 20.029 20.300 -8.563 279 HA3 GLY 125 HA1 GLY 125 20.693 18.839 -9.295 280 H GLU 126 HN GLU 126 17.302 19.202 -8.421 281 HA GLU 126 HA GLU 126 16.165 18.207 -10.738 282 HB2 GLU 126 HB2 GLU 126 14.165 19.373 -10.015 283 HB3 GLU 126 HB1 GLU 126 15.068 18.911 -8.574 284 HG2 GLU 126 HG2 GLU 126 14.936 21.084 -7.958 285 HG3 GLU 126 HG1 GLU 126 16.113 21.408 -9.229 286 H THR 127 HN THR 127 17.357 18.896 -12.629 287 HA THR 127 HA THR 127 17.016 21.787 -13.353 288 HB THR 127 HB THR 127 19.323 21.150 -13.292 289 HG1 THR 127 HG1 THR 127 18.455 20.806 -15.968 290 HG21 THR 127 HG21 THR 127 18.349 18.652 -14.676 291 HG22 THR 127 HG22 THR 127 19.219 18.785 -13.148 292 HG23 THR 127 HG23 THR 127 20.053 19.107 -14.669 293 H ILE 128 HN ILE 128 14.894 21.577 -14.252 294 HA ILE 128 HA ILE 128 14.812 20.066 -16.831 295 HB ILE 128 HB ILE 128 12.517 19.343 -16.188 296 HG12 ILE 128 HG12 ILE 128 13.247 20.809 -13.639 297 HG13 ILE 128 HG11 ILE 128 11.851 21.089 -14.680 298 HG21 ILE 128 HG21 ILE 128 13.204 17.660 -14.584 299 HG22 ILE 128 HG22 ILE 128 14.568 18.651 -14.066 300 HG23 ILE 128 HG23 ILE 128 14.550 17.952 -15.685 301 HD11 ILE 128 HD11 ILE 128 12.352 18.501 -13.183 302 HD12 ILE 128 HD12 ILE 128 10.901 18.939 -14.086 303 HD13 ILE 128 HD13 ILE 128 11.304 19.793 -12.597 304 H THR 129 HN THR 129 13.145 20.935 -18.315 305 HA THR 129 HA THR 129 13.080 23.810 -18.386 306 HB THR 129 HB THR 129 12.985 22.291 -20.347 307 HG1 THR 129 HG1 THR 129 10.767 23.309 -21.055 308 HG21 THR 129 HG21 THR 129 10.205 21.642 -19.328 309 HG22 THR 129 HG22 THR 129 11.586 20.546 -19.279 310 HG23 THR 129 HG23 THR 129 10.921 21.058 -20.830 311 H GLU 130 HN GLU 130 11.338 25.230 -17.904 312 HA GLU 130 HA GLU 130 9.698 24.753 -15.687 313 HB2 GLU 130 HB2 GLU 130 8.469 26.724 -16.484 314 HB3 GLU 130 HB1 GLU 130 10.193 26.936 -16.792 315 HG2 GLU 130 HG2 GLU 130 9.833 27.100 -19.006 316 HG3 GLU 130 HG1 GLU 130 8.956 25.570 -19.016 317 H ASP 131 HN ASP 131 9.273 23.663 -18.967 318 HA ASP 131 HA ASP 131 6.416 23.175 -18.849 319 HB2 ASP 131 HB2 ASP 131 8.196 23.371 -20.811 320 HB3 ASP 131 HB1 ASP 131 8.322 21.628 -20.574 321 H ASP 132 HN ASP 132 9.175 21.576 -17.540 322 HA ASP 132 HA ASP 132 7.796 18.952 -17.345 323 HB2 ASP 132 HB2 ASP 132 10.526 20.054 -17.192 324 HB3 ASP 132 HB1 ASP 132 10.202 18.779 -16.016 325 H ILE 133 HN ILE 133 8.196 21.827 -15.518 326 HA ILE 133 HA ILE 133 8.219 20.736 -12.849 327 HB ILE 133 HB ILE 133 7.146 23.372 -13.907 328 HG12 ILE 133 HG12 ILE 133 9.446 22.934 -14.686 329 HG13 ILE 133 HG11 ILE 133 9.437 24.210 -13.468 330 HG21 ILE 133 HG21 ILE 133 6.543 23.456 -11.689 331 HG22 ILE 133 HG22 ILE 133 8.229 23.943 -11.510 332 HG23 ILE 133 HG23 ILE 133 7.757 22.271 -11.207 333 HD11 ILE 133 HD11 ILE 133 11.240 22.651 -12.966 334 HD12 ILE 133 HD12 ILE 133 10.118 21.291 -13.013 335 HD13 ILE 133 HD13 ILE 133 9.988 22.499 -11.733 336 H GLU 134 HN GLU 134 5.533 22.206 -14.726 337 HA GLU 134 HA GLU 134 3.411 21.668 -12.981 338 HB2 GLU 134 HB2 GLU 134 3.487 21.481 -16.012 339 HB3 GLU 134 HB1 GLU 134 2.045 21.770 -15.038 340 HG2 GLU 134 HG2 GLU 134 3.361 23.788 -14.071 341 HG3 GLU 134 HG1 GLU 134 4.411 23.584 -15.474 342 H GLU 135 HN GLU 135 5.274 19.423 -14.885 343 HA GLU 135 HA GLU 135 3.399 17.262 -15.073 344 HB2 GLU 135 HB2 GLU 135 6.173 17.859 -15.587 345 HB3 GLU 135 HB1 GLU 135 6.050 16.280 -14.811 346 HG2 GLU 135 HG2 GLU 135 4.051 16.807 -16.933 347 HG3 GLU 135 HG1 GLU 135 5.721 16.665 -17.484 348 H LEU 136 HN LEU 136 6.270 17.304 -12.939 349 HA LEU 136 HA LEU 136 5.597 15.268 -11.193 350 HB2 LEU 136 HB2 LEU 136 6.908 17.956 -10.713 351 HB3 LEU 136 HB1 LEU 136 6.918 16.661 -9.515 352 HG LEU 136 HG LEU 136 7.715 15.815 -12.226 353 HD11 LEU 136 HD11 LEU 136 10.048 16.976 -11.056 354 HD12 LEU 136 HD12 LEU 136 8.813 18.231 -11.158 355 HD13 LEU 136 HD13 LEU 136 9.306 17.358 -12.610 356 HD21 LEU 136 HD21 LEU 136 9.455 15.495 -9.837 357 HD22 LEU 136 HD22 LEU 136 8.958 14.299 -11.034 358 HD23 LEU 136 HD23 LEU 136 7.857 14.756 -9.735 359 H MET 137 HN MET 137 4.360 18.607 -11.116 360 HA MET 137 HA MET 137 2.963 18.362 -8.605 361 HB2 MET 137 HB2 MET 137 3.631 20.363 -10.309 362 HB3 MET 137 HB1 MET 137 1.932 20.159 -10.736 363 HG2 MET 137 HG2 MET 137 2.562 20.192 -7.832 364 HG3 MET 137 HG1 MET 137 2.740 21.723 -8.688 365 HE1 MET 137 HE1 MET 137 0.455 22.684 -7.009 366 HE2 MET 137 HE2 MET 137 1.081 21.163 -6.378 367 HE3 MET 137 HE3 MET 137 -0.654 21.368 -6.603 368 H LYS 138 HN LYS 138 2.099 17.595 -11.954 369 HA LYS 138 HA LYS 138 -0.724 17.319 -11.616 370 HB2 LYS 138 HB2 LYS 138 1.406 16.403 -13.485 371 HB3 LYS 138 HB1 LYS 138 -0.124 15.529 -13.552 372 HG2 LYS 138 HG2 LYS 138 -0.721 18.315 -13.379 373 HG3 LYS 138 HG1 LYS 138 0.489 18.100 -14.645 374 HD2 LYS 138 HD2 LYS 138 -2.090 16.519 -14.426 375 HD3 LYS 138 HD1 LYS 138 -1.826 17.874 -15.523 376 HE2 LYS 138 HE2 LYS 138 -0.242 15.277 -15.515 377 HE3 LYS 138 HE1 LYS 138 -1.445 15.762 -16.726 378 HZ1 LYS 138 HZ1 LYS 138 1.154 17.038 -16.112 379 HZ2 LYS 138 HZ2 LYS 138 -0.080 17.879 -16.924 380 HZ3 LYS 138 HZ3 LYS 138 0.588 16.474 -17.608 381 H ASP 139 HN ASP 139 1.837 14.800 -11.510 382 HA ASP 139 HA ASP 139 0.248 12.585 -10.829 383 HB2 ASP 139 HB2 ASP 139 3.058 13.474 -10.189 384 HB3 ASP 139 HB1 ASP 139 2.452 11.930 -9.585 385 H GLY 140 HN GLY 140 1.300 15.281 -8.824 386 HA2 GLY 140 HA2 GLY 140 0.122 13.975 -6.419 387 HA3 GLY 140 HA1 GLY 140 1.185 15.384 -6.391 388 H ASP 141 HN ASP 141 -0.614 16.213 -8.863 389 HA ASP 141 HA ASP 141 -2.981 17.163 -7.302 390 HB2 ASP 141 HB2 ASP 141 -0.979 18.772 -7.358 391 HB3 ASP 141 HB1 ASP 141 -1.294 18.935 -9.086 392 H LYS 142 HN LYS 142 -3.140 15.102 -9.150 393 HA LYS 142 HA LYS 142 -3.473 15.612 -11.866 394 HB2 LYS 142 HB2 LYS 142 -4.392 13.738 -9.859 395 HB3 LYS 142 HB1 LYS 142 -5.662 14.022 -11.050 396 HG2 LYS 142 HG2 LYS 142 -4.220 13.402 -12.865 397 HG3 LYS 142 HG1 LYS 142 -2.801 13.399 -11.817 398 HD2 LYS 142 HD2 LYS 142 -5.161 11.503 -11.624 399 HD3 LYS 142 HD1 LYS 142 -3.550 11.098 -12.217 400 HE2 LYS 142 HE2 LYS 142 -2.676 11.880 -9.925 401 HE3 LYS 142 HE1 LYS 142 -4.368 11.815 -9.393 402 HZ1 LYS 142 HZ1 LYS 142 -2.963 9.590 -10.771 403 HZ2 LYS 142 HZ2 LYS 142 -4.524 9.550 -10.103 404 HZ3 LYS 142 HZ3 LYS 142 -3.166 9.683 -9.090 405 H ASN 143 HN ASN 143 -5.403 16.822 -9.220 406 HA ASN 143 HA ASN 143 -7.685 17.585 -10.914 407 HB2 ASN 143 HB2 ASN 143 -7.028 18.505 -8.108 408 HB3 ASN 143 HB1 ASN 143 -8.619 18.306 -8.842 409 HD21 ASN 143 HD21 ASN 143 -6.800 16.891 -6.548 410 HD22 ASN 143 HD22 ASN 143 -7.226 15.262 -6.764 411 H ASN 144 HN ASN 144 -4.731 19.046 -9.695 412 HA ASN 144 HA ASN 144 -3.765 21.157 -10.148 413 HB2 ASN 144 HB2 ASN 144 -4.468 20.303 -12.449 414 HB3 ASN 144 HB1 ASN 144 -5.916 21.297 -12.278 415 HD21 ASN 144 HD21 ASN 144 -3.291 21.500 -14.009 416 HD22 ASN 144 HD22 ASN 144 -2.838 23.123 -13.808 417 H ASP 145 HN ASP 145 -5.607 21.148 -8.049 418 HA ASP 145 HA ASP 145 -7.567 23.310 -8.460 419 HB2 ASP 145 HB2 ASP 145 -8.139 22.774 -6.131 420 HB3 ASP 145 HB1 ASP 145 -7.972 21.285 -7.061 421 H GLY 146 HN GLY 146 -4.271 23.012 -7.477 422 HA2 GLY 146 HA2 GLY 146 -2.926 25.074 -7.332 423 HA3 GLY 146 HA1 GLY 146 -4.315 25.863 -6.583 424 H ARG 147 HN ARG 147 -4.196 22.805 -5.324 425 HA ARG 147 HA ARG 147 -2.187 23.404 -3.221 426 HB2 ARG 147 HB2 ARG 147 -5.141 23.567 -3.002 427 HB3 ARG 147 HB1 ARG 147 -4.334 22.707 -1.690 428 HG2 ARG 147 HG2 ARG 147 -3.148 25.302 -2.571 429 HG3 ARG 147 HG1 ARG 147 -4.642 25.362 -1.635 430 HD2 ARG 147 HD2 ARG 147 -3.506 23.802 0.045 431 HD3 ARG 147 HD1 ARG 147 -1.991 24.144 -0.816 432 HE ARG 147 HE ARG 147 -2.026 26.300 0.139 433 HH11 ARG 147 HH21 ARG 147 -5.174 24.879 0.096 434 HH12 ARG 147 HH22 ARG 147 -5.916 26.185 0.957 435 HH21 ARG 147 HH11 ARG 147 -2.984 28.008 1.262 436 HH22 ARG 147 HH12 ARG 147 -4.679 27.954 1.617 437 H ILE 148 HN ILE 148 -1.293 21.502 -2.438 438 HA ILE 148 HA ILE 148 -2.520 18.941 -3.398 439 HB ILE 148 HB ILE 148 0.309 19.810 -2.746 440 HG12 ILE 148 HG12 ILE 148 -1.087 18.905 -5.285 441 HG13 ILE 148 HG11 ILE 148 -0.483 20.526 -4.936 442 HG21 ILE 148 HG21 ILE 148 -0.854 17.077 -3.295 443 HG22 ILE 148 HG22 ILE 148 0.229 17.565 -1.990 444 HG23 ILE 148 HG23 ILE 148 0.836 17.447 -3.642 445 HD11 ILE 148 HD11 ILE 148 1.218 18.023 -5.143 446 HD12 ILE 148 HD12 ILE 148 1.816 19.646 -4.797 447 HD13 ILE 148 HD13 ILE 148 1.100 19.286 -6.369 448 H ASP 149 HN ASP 149 -3.685 18.072 -1.705 449 HA ASP 149 HA ASP 149 -2.962 18.515 1.091 450 HB2 ASP 149 HB2 ASP 149 -4.910 16.599 -0.235 451 HB3 ASP 149 HB1 ASP 149 -4.922 17.074 1.464 452 H TYR 150 HN TYR 150 -3.230 16.103 2.325 453 HA TYR 150 HA TYR 150 -0.703 14.760 1.692 454 HB2 TYR 150 HB2 TYR 150 -1.471 15.201 3.992 455 HB3 TYR 150 HB1 TYR 150 -2.906 14.215 3.709 456 HD1 TYR 150 HD1 TYR 150 0.809 14.126 3.908 457 HD2 TYR 150 HD2 TYR 150 -2.824 11.834 3.837 458 HE1 TYR 150 HE1 TYR 150 2.081 12.089 4.528 459 HE2 TYR 150 HE2 TYR 150 -1.551 9.798 4.457 460 HH TYR 150 HH TYR 150 0.599 9.257 5.610 461 H ASP 151 HN ASP 151 -4.174 13.946 1.568 462 HA ASP 151 HA ASP 151 -3.964 11.219 0.816 463 HB2 ASP 151 HB2 ASP 151 -5.970 12.787 1.432 464 HB3 ASP 151 HB1 ASP 151 -6.027 13.111 -0.301 465 H GLU 152 HN GLU 152 -3.416 14.148 -1.020 466 HA GLU 152 HA GLU 152 -3.474 12.762 -3.626 467 HB2 GLU 152 HB2 GLU 152 -2.698 15.573 -2.772 468 HB3 GLU 152 HB1 GLU 152 -2.945 15.045 -4.437 469 HG2 GLU 152 HG2 GLU 152 -5.266 14.201 -3.223 470 HG3 GLU 152 HG1 GLU 152 -4.931 15.708 -2.369 471 H PHE 153 HN PHE 153 -1.099 14.054 -1.329 472 HA PHE 153 HA PHE 153 1.251 13.904 -2.907 473 HB2 PHE 153 HB2 PHE 153 1.049 14.923 -0.665 474 HB3 PHE 153 HB1 PHE 153 0.802 13.326 0.041 475 HD1 PHE 153 HD1 PHE 153 3.199 14.759 -2.475 476 HD2 PHE 153 HD2 PHE 153 2.679 12.565 1.181 477 HE1 PHE 153 HE1 PHE 153 5.655 14.451 -2.311 478 HE2 PHE 153 HE2 PHE 153 5.134 12.257 1.345 479 HZ PHE 153 HZ PHE 153 6.622 13.200 -0.400 480 H LEU 154 HN LEU 154 -0.762 11.380 -1.655 481 HA LEU 154 HA LEU 154 1.158 9.252 -1.461 482 HB2 LEU 154 HB2 LEU 154 -1.687 9.712 -1.307 483 HB3 LEU 154 HB1 LEU 154 -1.378 8.256 -2.253 484 HG LEU 154 HG LEU 154 -1.528 7.590 0.059 485 HD11 LEU 154 HD11 LEU 154 1.443 7.749 -0.362 486 HD12 LEU 154 HD12 LEU 154 0.453 6.817 -1.485 487 HD13 LEU 154 HD13 LEU 154 0.474 6.399 0.229 488 HD21 LEU 154 HD21 LEU 154 0.167 8.614 1.694 489 HD22 LEU 154 HD22 LEU 154 -1.186 9.643 1.226 490 HD23 LEU 154 HD23 LEU 154 0.399 9.883 0.491 491 H GLU 155 HN GLU 155 -1.120 10.113 -4.099 492 HA GLU 155 HA GLU 155 -0.165 8.149 -5.956 493 HB2 GLU 155 HB2 GLU 155 -1.802 10.644 -5.969 494 HB3 GLU 155 HB1 GLU 155 -1.205 10.072 -7.528 495 HG2 GLU 155 HG2 GLU 155 -2.599 8.230 -5.580 496 HG3 GLU 155 HG1 GLU 155 -3.491 9.171 -6.775 497 H PHE 156 HN PHE 156 1.013 11.326 -5.054 498 HA PHE 156 HA PHE 156 2.532 12.090 -7.288 499 HB2 PHE 156 HB2 PHE 156 2.244 13.438 -5.274 500 HB3 PHE 156 HB1 PHE 156 3.131 12.250 -4.317 501 HD1 PHE 156 HD2 PHE 156 3.497 14.490 -7.297 502 HD2 PHE 156 HD1 PHE 156 5.460 12.428 -4.080 503 HE1 PHE 156 HE2 PHE 156 5.633 15.608 -7.882 504 HE2 PHE 156 HE1 PHE 156 7.595 13.546 -4.665 505 HZ PHE 156 HZ PHE 156 7.681 15.136 -6.566 506 H MET 157 HN MET 157 3.108 9.486 -5.003 507 HA MET 157 HA MET 157 5.842 9.023 -6.085 508 HB2 MET 157 HB2 MET 157 4.259 7.672 -3.872 509 HB3 MET 157 HB1 MET 157 5.981 7.458 -4.191 510 HG2 MET 157 HG2 MET 157 4.639 10.070 -3.429 511 HG3 MET 157 HG1 MET 157 5.630 9.074 -2.363 512 HE1 MET 157 HE1 MET 157 8.537 10.858 -2.341 513 HE2 MET 157 HE2 MET 157 8.682 9.143 -2.717 514 HE3 MET 157 HE3 MET 157 7.356 9.706 -1.703 515 H LYS 158 HN LYS 158 3.001 6.955 -5.337 516 HA LYS 158 HA LYS 158 2.124 5.099 -6.513 517 HB2 LYS 158 HB2 LYS 158 2.861 7.159 -8.338 518 HB3 LYS 158 HB1 LYS 158 3.326 5.624 -9.073 519 HG2 LYS 158 HG2 LYS 158 0.640 5.795 -7.771 520 HG3 LYS 158 HG1 LYS 158 0.854 6.583 -9.335 521 HD2 LYS 158 HD2 LYS 158 2.017 3.885 -9.206 522 HD3 LYS 158 HD1 LYS 158 0.267 3.915 -8.990 523 HE2 LYS 158 HE2 LYS 158 0.635 3.746 -11.362 524 HE3 LYS 158 HE1 LYS 158 0.199 5.441 -11.068 525 HZ1 LYS 158 HZ1 LYS 158 2.293 6.145 -11.436 526 HZ2 LYS 158 HZ2 LYS 158 2.434 4.705 -12.325 527 HZ3 LYS 158 HZ3 LYS 158 3.004 4.779 -10.726 528 H GLY 159 HN GLY 159 5.124 5.298 -5.537 529 HA2 GLY 159 HA2 GLY 159 6.722 3.563 -5.278 530 HA3 GLY 159 HA1 GLY 159 5.833 2.608 -6.467 531 H VAL 160 HN VAL 160 7.934 5.486 -6.219 532 HA VAL 160 HA VAL 160 8.610 5.323 -9.087 533 HB VAL 160 HB VAL 160 9.768 7.387 -8.631 534 HG11 VAL 160 HG11 VAL 160 8.027 8.671 -7.375 535 HG12 VAL 160 HG12 VAL 160 7.290 7.142 -6.899 536 HG13 VAL 160 HG13 VAL 160 7.340 7.604 -8.600 537 HG21 VAL 160 HG21 VAL 160 9.629 6.437 -5.763 538 HG22 VAL 160 HG22 VAL 160 9.951 8.122 -6.170 539 HG23 VAL 160 HG23 VAL 160 11.060 6.859 -6.703 540 H GLU 161 HN GLU 161 9.898 4.234 -6.035 541 HA GLU 161 HA GLU 161 12.617 3.802 -7.105 542 HB2 GLU 161 HB2 GLU 161 11.857 4.504 -4.716 543 HB3 GLU 161 HB1 GLU 161 11.482 2.794 -4.496 544 HG2 GLU 161 HG2 GLU 161 13.788 2.185 -5.045 545 HG3 GLU 161 HG1 GLU 161 14.180 3.877 -5.358 546 HO1 KDH 1 H1 KDH 1 8.492 9.438 -11.007 547 H21 KDH 1 H21 KDH 1 13.610 9.681 -3.340 548 H33 KDH 1 H33 KDH 1 9.472 12.804 -6.269 549 H4 KDH 1 H4 KDH 1 8.575 11.118 -7.735 550 HO7 KDH 1 H7 KDH 1 9.678 8.658 -11.453 551 H01 KDH 1 H01 KDH 1 10.592 14.162 -4.410 552 H01A KDH 1 H02 KDH 1 9.666 12.680 -3.946 553 HO03 KDH 1 H03 KDH 1 12.124 15.216 -3.020 554 HO10 KDH 1 H10 KDH 1 13.092 7.839 -9.151 555 H12 KDH 1 H12 KDH 1 12.814 10.010 -7.281 556 H15 KDH 1 H15 KDH 1 9.836 10.653 -5.473 557 H26 KDH 1 H26 KDH 1 13.590 13.287 -0.841 558 H39 KDH 1 H39 KDH 1 10.512 11.932 -9.526 559 H41 KDH 1 H41 KDH 1 12.763 15.656 -8.889 560 HO02 KDH 1 H42 KDH 1 15.435 11.607 -1.071 561 HO44 KDH 1 H44 KDH 1 14.038 16.292 -10.865 562 HO47 KDH 1 H47 KDH 1 14.661 12.627 -12.343 563 HO50 KDH 1 H50 KDH 1 12.278 10.439 -11.270 Start of MODEL 19 1 H1 MET 90 HT1 MET 90 14.024 9.029 4.069 2 H2 MET 90 HT2 MET 90 15.133 8.097 4.957 3 H3 MET 90 HT3 MET 90 13.489 8.104 5.385 4 HA MET 90 HA MET 90 14.475 7.106 2.766 5 HB2 MET 90 HB2 MET 90 14.575 6.024 5.485 6 HB3 MET 90 HB1 MET 90 13.712 4.963 4.371 7 HG2 MET 90 HG2 MET 90 15.975 5.887 2.960 8 HG3 MET 90 HG1 MET 90 16.552 5.449 4.568 9 HE1 MET 90 HE1 MET 90 15.110 4.838 1.457 10 HE2 MET 90 HE2 MET 90 14.269 3.290 1.468 11 HE3 MET 90 HE3 MET 90 15.978 3.353 1.041 12 H GLY 91 HN GLY 91 12.230 8.789 3.027 13 HA2 GLY 91 HA2 GLY 91 9.756 7.723 3.691 14 HA3 GLY 91 HA1 GLY 91 9.991 8.757 2.279 15 H LYS 92 HN LYS 92 8.538 6.017 2.974 16 HA LYS 92 HA LYS 92 9.218 4.794 0.332 17 HB2 LYS 92 HB2 LYS 92 10.002 3.840 2.854 18 HB3 LYS 92 HB1 LYS 92 8.635 2.825 2.391 19 HG2 LYS 92 HG2 LYS 92 9.880 2.770 0.056 20 HG3 LYS 92 HG1 LYS 92 11.289 3.161 1.042 21 HD2 LYS 92 HD2 LYS 92 11.302 1.119 2.075 22 HD3 LYS 92 HD1 LYS 92 9.543 0.994 2.075 23 HE2 LYS 92 HE2 LYS 92 9.885 0.784 -0.555 24 HE3 LYS 92 HE1 LYS 92 11.492 0.216 -0.065 25 HZ1 LYS 92 HZ1 LYS 92 10.556 -1.715 0.470 26 HZ2 LYS 92 HZ2 LYS 92 8.996 -1.116 0.164 27 HZ3 LYS 92 HZ3 LYS 92 9.695 -0.929 1.701 28 H SER 93 HN SER 93 7.064 4.033 3.105 29 HA SER 93 HA SER 93 4.770 4.073 1.168 30 HB2 SER 93 HB2 SER 93 5.005 1.833 1.734 31 HB3 SER 93 HB1 SER 93 5.658 2.200 3.328 32 HG SER 93 HG SER 93 3.695 2.292 4.103 33 H GLU 94 HN GLU 94 2.642 4.005 2.753 34 HA GLU 94 HA GLU 94 2.223 6.578 3.761 35 HB2 GLU 94 HB2 GLU 94 1.041 3.917 4.614 36 HB3 GLU 94 HB1 GLU 94 0.312 5.490 4.943 37 HG2 GLU 94 HG2 GLU 94 -0.430 5.728 2.808 38 HG3 GLU 94 HG1 GLU 94 1.057 5.072 2.122 39 H GLU 95 HN GLU 95 3.905 3.914 5.273 40 HA GLU 95 HA GLU 95 3.703 4.522 8.013 41 HB2 GLU 95 HB2 GLU 95 5.733 3.324 6.173 42 HB3 GLU 95 HB1 GLU 95 6.243 3.687 7.823 43 HG2 GLU 95 HG2 GLU 95 4.901 2.078 8.736 44 HG3 GLU 95 HG1 GLU 95 3.616 2.337 7.556 45 H GLU 96 HN GLU 96 6.356 5.629 5.859 46 HA GLU 96 HA GLU 96 6.904 7.856 7.751 47 HB2 GLU 96 HB2 GLU 96 8.356 6.836 5.285 48 HB3 GLU 96 HB1 GLU 96 8.987 8.018 6.433 49 HG2 GLU 96 HG2 GLU 96 8.800 6.328 8.245 50 HG3 GLU 96 HG1 GLU 96 8.248 5.144 7.060 51 H LEU 97 HN LEU 97 5.493 7.247 4.623 52 HA LEU 97 HA LEU 97 5.802 9.585 3.169 53 HB2 LEU 97 HB2 LEU 97 3.825 7.478 3.523 54 HB3 LEU 97 HB1 LEU 97 3.052 9.001 3.086 55 HG LEU 97 HG LEU 97 3.584 7.880 1.032 56 HD11 LEU 97 HD11 LEU 97 5.926 9.739 1.267 57 HD12 LEU 97 HD12 LEU 97 4.296 10.387 1.452 58 HD13 LEU 97 HD13 LEU 97 4.757 9.575 -0.044 59 HD21 LEU 97 HD21 LEU 97 6.223 7.485 0.736 60 HD22 LEU 97 HD22 LEU 97 5.164 6.248 1.414 61 HD23 LEU 97 HD23 LEU 97 6.118 7.274 2.484 62 H SER 98 HN SER 98 3.619 9.097 5.951 63 HA SER 98 HA SER 98 2.257 11.555 5.964 64 HB2 SER 98 HB2 SER 98 1.768 10.981 8.214 65 HB3 SER 98 HB1 SER 98 2.093 9.433 7.439 66 HG SER 98 HG SER 98 3.216 10.145 9.545 67 H ASP 99 HN ASP 99 5.575 10.839 6.947 68 HA ASP 99 HA ASP 99 5.926 13.592 8.016 69 HB2 ASP 99 HB2 ASP 99 7.783 11.196 7.857 70 HB3 ASP 99 HB1 ASP 99 8.078 12.668 8.783 71 H LEU 100 HN LEU 100 7.157 11.461 5.436 72 HA LEU 100 HA LEU 100 9.198 12.914 4.288 73 HB2 LEU 100 HB2 LEU 100 8.118 10.757 3.525 74 HB3 LEU 100 HB1 LEU 100 6.854 11.730 2.772 75 HG LEU 100 HG LEU 100 8.706 12.957 1.530 76 HD11 LEU 100 HD11 LEU 100 10.890 12.283 1.680 77 HD12 LEU 100 HD12 LEU 100 10.459 10.592 1.936 78 HD13 LEU 100 HD13 LEU 100 10.374 11.736 3.276 79 HD21 LEU 100 HD21 LEU 100 7.655 11.542 0.063 80 HD22 LEU 100 HD22 LEU 100 7.807 10.151 1.138 81 HD23 LEU 100 HD23 LEU 100 9.182 10.665 0.161 82 H PHE 101 HN PHE 101 5.709 13.507 3.714 83 HA PHE 101 HA PHE 101 6.022 15.747 1.974 84 HB2 PHE 101 HB2 PHE 101 3.980 14.277 2.601 85 HB3 PHE 101 HB1 PHE 101 3.787 15.373 3.970 86 HD1 PHE 101 HD2 PHE 101 3.661 17.897 3.482 87 HD2 PHE 101 HD1 PHE 101 3.187 14.878 0.463 88 HE1 PHE 101 HE2 PHE 101 2.547 19.549 2.005 89 HE2 PHE 101 HE1 PHE 101 2.073 16.530 -1.014 90 HZ PHE 101 HZ PHE 101 1.754 18.865 -0.243 91 H ARG 102 HN ARG 102 5.820 15.529 5.521 92 HA ARG 102 HA ARG 102 5.653 18.320 6.092 93 HB2 ARG 102 HB2 ARG 102 6.027 15.801 7.426 94 HB3 ARG 102 HB1 ARG 102 7.183 16.963 8.077 95 HG2 ARG 102 HG2 ARG 102 5.555 18.254 9.016 96 HG3 ARG 102 HG1 ARG 102 4.444 18.005 7.670 97 HD2 ARG 102 HD2 ARG 102 4.238 15.567 8.565 98 HD3 ARG 102 HD1 ARG 102 4.918 16.231 10.064 99 HE ARG 102 HE ARG 102 2.886 17.382 10.402 100 HH11 ARG 102 HH21 ARG 102 3.280 16.429 7.104 101 HH12 ARG 102 HH22 ARG 102 1.708 16.973 6.625 102 HH21 ARG 102 HH11 ARG 102 0.836 18.097 9.786 103 HH22 ARG 102 HH12 ARG 102 0.327 17.918 8.140 104 H MET 103 HN MET 103 8.382 16.242 5.268 105 HA MET 103 HA MET 103 10.385 18.281 5.968 106 HB2 MET 103 HB2 MET 103 10.480 15.594 4.561 107 HB3 MET 103 HB1 MET 103 11.908 16.531 5.002 108 HG2 MET 103 HG2 MET 103 10.655 16.533 7.382 109 HG3 MET 103 HG1 MET 103 10.025 15.016 6.740 110 HE1 MET 103 HE1 MET 103 11.473 14.960 9.267 111 HE2 MET 103 HE2 MET 103 12.544 16.331 8.990 112 HE3 MET 103 HE3 MET 103 13.228 14.737 9.298 113 H PHE 104 HN PHE 104 8.761 17.060 3.069 114 HA PHE 104 HA PHE 104 10.465 18.470 1.183 115 HB2 PHE 104 HB2 PHE 104 7.872 16.964 1.184 116 HB3 PHE 104 HB1 PHE 104 8.273 17.942 -0.228 117 HD1 PHE 104 HD1 PHE 104 11.199 17.708 -0.358 118 HD2 PHE 104 HD2 PHE 104 8.235 14.728 0.532 119 HE1 PHE 104 HE1 PHE 104 12.742 15.936 -1.149 120 HE2 PHE 104 HE2 PHE 104 9.779 12.956 -0.260 121 HZ PHE 104 HZ PHE 104 12.032 13.560 -1.101 122 H ASP 105 HN ASP 105 7.670 19.306 3.108 123 HA ASP 105 HA ASP 105 6.739 21.551 1.557 124 HB2 ASP 105 HB2 ASP 105 5.852 20.128 3.676 125 HB3 ASP 105 HB1 ASP 105 6.515 21.521 4.530 126 H LYS 106 HN LYS 106 9.151 22.250 1.155 127 HA LYS 106 HA LYS 106 10.883 23.367 3.013 128 HB2 LYS 106 HB2 LYS 106 10.477 23.371 0.250 129 HB3 LYS 106 HB1 LYS 106 10.491 25.082 0.682 130 HG2 LYS 106 HG2 LYS 106 12.574 23.917 2.174 131 HG3 LYS 106 HG1 LYS 106 12.705 23.218 0.560 132 HD2 LYS 106 HD2 LYS 106 13.922 25.170 0.263 133 HD3 LYS 106 HD1 LYS 106 12.313 25.727 -0.200 134 HE2 LYS 106 HE2 LYS 106 11.997 26.899 1.804 135 HE3 LYS 106 HE1 LYS 106 13.180 25.909 2.681 136 HZ1 LYS 106 HZ1 LYS 106 14.180 28.014 2.136 137 HZ2 LYS 106 HZ2 LYS 106 13.760 27.841 0.498 138 HZ3 LYS 106 HZ3 LYS 106 14.910 26.805 1.197 139 H ASN 107 HN ASN 107 8.013 24.956 1.584 140 HA ASN 107 HA ASN 107 8.379 27.444 3.024 141 HB2 ASN 107 HB2 ASN 107 7.134 27.458 0.997 142 HB3 ASN 107 HB1 ASN 107 6.135 26.098 1.510 143 HD21 ASN 107 HD21 ASN 107 4.089 27.191 1.437 144 HD22 ASN 107 HD22 ASN 107 3.707 28.493 2.456 145 H ALA 108 HN ALA 108 7.535 24.396 4.130 146 HA ALA 108 HA ALA 108 6.344 23.625 6.036 147 HB1 ALA 108 HB1 ALA 108 7.168 24.724 7.956 148 HB2 ALA 108 HB2 ALA 108 7.137 26.304 7.172 149 HB3 ALA 108 HB3 ALA 108 8.368 25.122 6.726 150 H ASP 109 HN ASP 109 4.312 24.210 4.579 151 HA ASP 109 HA ASP 109 2.638 26.147 6.141 152 HB2 ASP 109 HB2 ASP 109 1.642 26.811 3.984 153 HB3 ASP 109 HB1 ASP 109 3.388 27.055 3.956 154 H GLY 110 HN GLY 110 3.079 22.972 5.260 155 HA2 GLY 110 HA2 GLY 110 1.580 21.201 5.900 156 HA3 GLY 110 HA1 GLY 110 0.242 22.349 5.842 157 H TYR 111 HN TYR 111 1.392 23.309 3.153 158 HA TYR 111 HA TYR 111 0.590 20.965 1.474 159 HB2 TYR 111 HB2 TYR 111 -0.478 23.805 1.365 160 HB3 TYR 111 HB1 TYR 111 -0.884 22.532 0.213 161 HD1 TYR 111 HD1 TYR 111 -0.988 23.392 3.849 162 HD2 TYR 111 HD2 TYR 111 -2.597 20.982 0.679 163 HE1 TYR 111 HE1 TYR 111 -2.763 22.568 5.375 164 HE2 TYR 111 HE2 TYR 111 -4.371 20.158 2.202 165 HH TYR 111 HH TYR 111 -4.748 19.903 4.615 166 H ILE 112 HN ILE 112 1.977 20.722 -0.240 167 HA ILE 112 HA ILE 112 4.086 22.717 -0.699 168 HB ILE 112 HB ILE 112 3.359 19.979 -1.747 169 HG12 ILE 112 HG12 ILE 112 5.970 20.794 -0.508 170 HG13 ILE 112 HG11 ILE 112 4.560 20.590 0.532 171 HG21 ILE 112 HG21 ILE 112 4.351 20.706 -3.690 172 HG22 ILE 112 HG22 ILE 112 5.816 20.339 -2.779 173 HG23 ILE 112 HG23 ILE 112 5.233 22.001 -2.879 174 HD11 ILE 112 HD11 ILE 112 6.165 18.560 -0.864 175 HD12 ILE 112 HD12 ILE 112 4.425 18.353 -1.068 176 HD13 ILE 112 HD13 ILE 112 5.124 18.394 0.550 177 H ASP 113 HN ASP 113 3.936 24.314 -2.232 178 HA ASP 113 HA ASP 113 1.635 24.301 -4.102 179 HB2 ASP 113 HB2 ASP 113 2.756 26.201 -2.543 180 HB3 ASP 113 HB1 ASP 113 3.651 26.490 -4.035 181 H LEU 114 HN LEU 114 2.396 25.484 -6.326 182 HA LEU 114 HA LEU 114 3.919 23.536 -7.789 183 HB2 LEU 114 HB2 LEU 114 2.574 26.142 -8.215 184 HB3 LEU 114 HB1 LEU 114 3.844 25.752 -9.376 185 HG LEU 114 HG LEU 114 1.894 23.598 -8.695 186 HD11 LEU 114 HD11 LEU 114 1.069 25.357 -10.917 187 HD12 LEU 114 HD12 LEU 114 0.877 26.064 -9.313 188 HD13 LEU 114 HD13 LEU 114 0.084 24.538 -9.704 189 HD21 LEU 114 HD21 LEU 114 3.406 24.532 -11.148 190 HD22 LEU 114 HD22 LEU 114 2.198 23.248 -11.205 191 HD23 LEU 114 HD23 LEU 114 3.654 23.047 -10.230 192 H ASP 115 HN ASP 115 4.880 26.301 -5.933 193 HA ASP 115 HA ASP 115 7.456 26.616 -7.355 194 HB2 ASP 115 HB2 ASP 115 5.844 28.016 -5.285 195 HB3 ASP 115 HB1 ASP 115 7.592 28.223 -5.181 196 H GLU 116 HN GLU 116 6.324 25.627 -4.100 197 HA GLU 116 HA GLU 116 8.942 25.023 -3.065 198 HB2 GLU 116 HB2 GLU 116 6.122 24.167 -2.368 199 HB3 GLU 116 HB1 GLU 116 7.521 23.743 -1.381 200 HG2 GLU 116 HG2 GLU 116 7.540 25.783 -0.433 201 HG3 GLU 116 HG1 GLU 116 7.573 26.563 -2.015 202 H LEU 117 HN LEU 117 7.022 23.401 -5.382 203 HA LEU 117 HA LEU 117 7.731 20.663 -4.761 204 HB2 LEU 117 HB2 LEU 117 6.641 22.202 -7.106 205 HB3 LEU 117 HB1 LEU 117 7.076 20.503 -7.300 206 HG LEU 117 HG LEU 117 5.218 21.540 -5.140 207 HD11 LEU 117 HD11 LEU 117 3.958 19.860 -7.109 208 HD12 LEU 117 HD12 LEU 117 4.731 21.224 -7.917 209 HD13 LEU 117 HD13 LEU 117 3.544 21.510 -6.644 210 HD21 LEU 117 HD21 LEU 117 6.190 19.468 -4.459 211 HD22 LEU 117 HD22 LEU 117 6.072 18.794 -6.085 212 HD23 LEU 117 HD23 LEU 117 4.613 19.045 -5.126 213 H LYS 118 HN LYS 118 8.756 22.545 -7.627 214 HA LYS 118 HA LYS 118 10.897 21.036 -8.484 215 HB2 LYS 118 HB2 LYS 118 11.775 23.169 -9.368 216 HB3 LYS 118 HB1 LYS 118 10.018 23.111 -9.516 217 HG2 LYS 118 HG2 LYS 118 9.991 24.287 -7.206 218 HG3 LYS 118 HG1 LYS 118 11.684 24.659 -7.536 219 HD2 LYS 118 HD2 LYS 118 10.473 25.338 -9.914 220 HD3 LYS 118 HD1 LYS 118 9.250 25.801 -8.730 221 HE2 LYS 118 HE2 LYS 118 12.127 26.568 -8.264 222 HE3 LYS 118 HE1 LYS 118 11.110 27.544 -9.343 223 HZ1 LYS 118 HZ1 LYS 118 9.568 27.941 -7.663 224 HZ2 LYS 118 HZ2 LYS 118 11.057 28.095 -6.859 225 HZ3 LYS 118 HZ3 LYS 118 10.140 26.675 -6.690 226 H ILE 119 HN ILE 119 10.778 22.995 -5.569 227 HA ILE 119 HA ILE 119 13.704 22.753 -5.147 228 HB ILE 119 HB ILE 119 11.392 24.170 -3.818 229 HG12 ILE 119 HG12 ILE 119 14.023 25.258 -4.847 230 HG13 ILE 119 HG11 ILE 119 12.620 25.046 -5.895 231 HG21 ILE 119 HG21 ILE 119 12.517 23.835 -1.857 232 HG22 ILE 119 HG22 ILE 119 13.564 25.110 -2.479 233 HG23 ILE 119 HG23 ILE 119 14.023 23.419 -2.675 234 HD11 ILE 119 HD11 ILE 119 11.302 26.562 -4.576 235 HD12 ILE 119 HD12 ILE 119 12.848 27.357 -4.874 236 HD13 ILE 119 HD13 ILE 119 12.525 26.613 -3.307 237 H MET 120 HN MET 120 10.774 21.131 -4.231 238 HA MET 120 HA MET 120 11.633 20.077 -1.688 239 HB2 MET 120 HB2 MET 120 9.614 18.920 -1.804 240 HB3 MET 120 HB1 MET 120 9.305 20.206 -2.967 241 HG2 MET 120 HG2 MET 120 9.950 18.718 -4.814 242 HG3 MET 120 HG1 MET 120 10.324 17.434 -3.665 243 HE1 MET 120 HE1 MET 120 8.171 16.756 -1.708 244 HE2 MET 120 HE2 MET 120 9.044 15.848 -2.940 245 HE3 MET 120 HE3 MET 120 7.289 15.717 -2.837 246 H LEU 121 HN LEU 121 11.997 18.975 -5.037 247 HA LEU 121 HA LEU 121 13.310 16.464 -4.207 248 HB2 LEU 121 HB2 LEU 121 12.073 17.665 -6.562 249 HB3 LEU 121 HB1 LEU 121 13.595 16.871 -6.964 250 HG LEU 121 HG LEU 121 11.769 15.258 -7.135 251 HD11 LEU 121 HD11 LEU 121 12.830 14.262 -4.603 252 HD12 LEU 121 HD12 LEU 121 14.093 14.937 -5.633 253 HD13 LEU 121 HD13 LEU 121 13.063 13.639 -6.237 254 HD21 LEU 121 HD21 LEU 121 11.253 15.862 -4.206 255 HD22 LEU 121 HD22 LEU 121 10.367 14.718 -5.214 256 HD23 LEU 121 HD23 LEU 121 10.252 16.448 -5.534 257 H GLN 122 HN GLN 122 14.211 19.712 -4.873 258 HA GLN 122 HA GLN 122 16.687 19.632 -6.126 259 HB2 GLN 122 HB2 GLN 122 15.189 21.369 -4.497 260 HB3 GLN 122 HB1 GLN 122 16.768 21.260 -3.719 261 HG2 GLN 122 HG2 GLN 122 17.464 21.475 -6.368 262 HG3 GLN 122 HG1 GLN 122 16.026 22.493 -6.287 263 HE21 GLN 122 HE21 GLN 122 16.055 24.288 -4.658 264 HE22 GLN 122 HE22 GLN 122 17.542 24.920 -4.137 265 H ALA 123 HN ALA 123 15.862 18.391 -2.949 266 HA ALA 123 HA ALA 123 18.481 18.208 -1.817 267 HB1 ALA 123 HB1 ALA 123 15.811 16.887 -1.480 268 HB2 ALA 123 HB2 ALA 123 16.725 17.865 -0.331 269 HB3 ALA 123 HB3 ALA 123 17.201 16.195 -0.642 270 H THR 124 HN THR 124 16.926 16.392 -4.342 271 HA THR 124 HA THR 124 18.886 14.162 -4.118 272 HB THR 124 HB THR 124 17.406 13.113 -5.779 273 HG1 THR 124 HG1 THR 124 16.119 14.283 -6.947 274 HG21 THR 124 HG21 THR 124 15.153 13.830 -4.350 275 HG22 THR 124 HG22 THR 124 16.463 14.215 -3.233 276 HG23 THR 124 HG23 THR 124 16.305 12.581 -3.877 277 H GLY 125 HN GLY 125 18.023 16.900 -6.173 278 HA2 GLY 125 HA2 GLY 125 19.911 17.938 -7.442 279 HA3 GLY 125 HA1 GLY 125 20.433 16.301 -7.843 280 H GLU 126 HN GLU 126 17.072 17.366 -7.842 281 HA GLU 126 HA GLU 126 16.539 16.292 -10.446 282 HB2 GLU 126 HB2 GLU 126 14.395 17.558 -10.124 283 HB3 GLU 126 HB1 GLU 126 14.845 16.600 -8.712 284 HG2 GLU 126 HG2 GLU 126 14.851 18.459 -7.448 285 HG3 GLU 126 HG1 GLU 126 16.102 19.155 -8.478 286 H THR 127 HN THR 127 18.063 17.229 -11.945 287 HA THR 127 HA THR 127 17.815 20.184 -12.369 288 HB THR 127 HB THR 127 19.957 19.648 -13.751 289 HG1 THR 127 HG1 THR 127 20.029 17.515 -13.880 290 HG21 THR 127 HG21 THR 127 20.302 19.035 -10.835 291 HG22 THR 127 HG22 THR 127 19.665 20.607 -11.317 292 HG23 THR 127 HG23 THR 127 21.258 20.092 -11.873 293 H ILE 128 HN ILE 128 15.908 20.159 -13.678 294 HA ILE 128 HA ILE 128 16.314 18.998 -16.407 295 HB ILE 128 HB ILE 128 14.102 18.072 -16.351 296 HG12 ILE 128 HG12 ILE 128 13.792 19.687 -13.804 297 HG13 ILE 128 HG11 ILE 128 12.880 19.865 -15.303 298 HG21 ILE 128 HG21 ILE 128 14.867 17.492 -13.526 299 HG22 ILE 128 HG22 ILE 128 16.052 17.119 -14.777 300 HG23 ILE 128 HG23 ILE 128 14.453 16.378 -14.828 301 HD11 ILE 128 HD11 ILE 128 12.579 17.860 -13.134 302 HD12 ILE 128 HD12 ILE 128 12.392 17.254 -14.779 303 HD13 ILE 128 HD13 ILE 128 11.358 18.560 -14.197 304 H THR 129 HN THR 129 14.637 20.025 -17.963 305 HA THR 129 HA THR 129 14.865 22.869 -17.932 306 HB THR 129 HB THR 129 12.818 21.120 -19.332 307 HG1 THR 129 HG1 THR 129 15.407 21.880 -20.195 308 HG21 THR 129 HG21 THR 129 13.306 22.972 -21.121 309 HG22 THR 129 HG22 THR 129 13.872 23.904 -19.734 310 HG23 THR 129 HG23 THR 129 12.206 23.326 -19.788 311 H GLU 130 HN GLU 130 13.129 24.459 -17.636 312 HA GLU 130 HA GLU 130 11.577 24.083 -15.253 313 HB2 GLU 130 HB2 GLU 130 12.344 26.260 -15.983 314 HB3 GLU 130 HB1 GLU 130 11.497 26.094 -17.521 315 HG2 GLU 130 HG2 GLU 130 9.794 27.197 -16.515 316 HG3 GLU 130 HG1 GLU 130 9.482 25.680 -15.671 317 H ASP 131 HN ASP 131 10.727 23.956 -18.713 318 HA ASP 131 HA ASP 131 7.917 23.754 -18.505 319 HB2 ASP 131 HB2 ASP 131 9.494 23.938 -20.535 320 HB3 ASP 131 HB1 ASP 131 9.640 22.183 -20.430 321 H ASP 132 HN ASP 132 10.389 21.435 -17.668 322 HA ASP 132 HA ASP 132 8.580 19.119 -17.693 323 HB2 ASP 132 HB2 ASP 132 11.427 19.758 -17.262 324 HB3 ASP 132 HB1 ASP 132 10.831 18.436 -16.257 325 H ILE 133 HN ILE 133 9.391 21.659 -15.499 326 HA ILE 133 HA ILE 133 8.981 20.313 -12.992 327 HB ILE 133 HB ILE 133 8.686 23.180 -13.934 328 HG12 ILE 133 HG12 ILE 133 10.951 22.078 -14.037 329 HG13 ILE 133 HG11 ILE 133 10.885 23.465 -12.949 330 HG21 ILE 133 HG21 ILE 133 8.458 21.948 -11.190 331 HG22 ILE 133 HG22 ILE 133 7.394 23.126 -11.958 332 HG23 ILE 133 HG23 ILE 133 8.993 23.615 -11.397 333 HD11 ILE 133 HD11 ILE 133 10.117 21.227 -11.406 334 HD12 ILE 133 HD12 ILE 133 11.623 22.137 -11.291 335 HD13 ILE 133 HD13 ILE 133 11.527 20.719 -12.336 336 H GLU 134 HN GLU 134 6.764 22.520 -14.763 337 HA GLU 134 HA GLU 134 4.460 22.130 -13.205 338 HB2 GLU 134 HB2 GLU 134 5.015 22.735 -16.102 339 HB3 GLU 134 HB1 GLU 134 3.350 22.581 -15.541 340 HG2 GLU 134 HG2 GLU 134 4.900 24.214 -13.713 341 HG3 GLU 134 HG1 GLU 134 4.977 24.863 -15.352 342 H GLU 135 HN GLU 135 5.953 19.962 -15.510 343 HA GLU 135 HA GLU 135 3.690 18.285 -16.076 344 HB2 GLU 135 HB2 GLU 135 5.825 18.380 -17.343 345 HB3 GLU 135 HB1 GLU 135 6.660 17.668 -15.962 346 HG2 GLU 135 HG2 GLU 135 6.218 15.803 -17.323 347 HG3 GLU 135 HG1 GLU 135 4.890 15.769 -16.163 348 H LEU 136 HN LEU 136 6.108 18.274 -13.473 349 HA LEU 136 HA LEU 136 5.321 15.726 -12.346 350 HB2 LEU 136 HB2 LEU 136 6.914 18.137 -11.506 351 HB3 LEU 136 HB1 LEU 136 6.569 16.865 -10.334 352 HG LEU 136 HG LEU 136 7.514 15.888 -12.953 353 HD11 LEU 136 HD11 LEU 136 9.311 17.233 -13.134 354 HD12 LEU 136 HD12 LEU 136 9.892 16.572 -11.606 355 HD13 LEU 136 HD13 LEU 136 8.916 18.040 -11.617 356 HD21 LEU 136 HD21 LEU 136 8.973 15.217 -10.492 357 HD22 LEU 136 HD22 LEU 136 8.186 14.151 -11.655 358 HD23 LEU 136 HD23 LEU 136 7.239 14.916 -10.379 359 H MET 137 HN MET 137 4.243 19.060 -11.914 360 HA MET 137 HA MET 137 2.757 18.649 -9.476 361 HB2 MET 137 HB2 MET 137 3.472 20.842 -10.264 362 HB3 MET 137 HB1 MET 137 2.540 20.647 -11.749 363 HG2 MET 137 HG2 MET 137 1.409 22.062 -9.985 364 HG3 MET 137 HG1 MET 137 0.458 20.684 -10.537 365 HE1 MET 137 HE1 MET 137 -0.124 21.594 -6.785 366 HE2 MET 137 HE2 MET 137 0.118 22.466 -8.296 367 HE3 MET 137 HE3 MET 137 1.406 22.426 -7.095 368 H LYS 138 HN LYS 138 2.152 17.798 -12.779 369 HA LYS 138 HA LYS 138 -0.673 17.875 -12.933 370 HB2 LYS 138 HB2 LYS 138 0.731 17.394 -14.838 371 HB3 LYS 138 HB1 LYS 138 1.409 15.971 -14.045 372 HG2 LYS 138 HG2 LYS 138 -0.316 14.675 -14.706 373 HG3 LYS 138 HG1 LYS 138 -1.500 15.856 -14.145 374 HD2 LYS 138 HD2 LYS 138 -1.895 15.855 -16.446 375 HD3 LYS 138 HD1 LYS 138 -0.762 17.198 -16.281 376 HE2 LYS 138 HE2 LYS 138 0.661 16.141 -17.689 377 HE3 LYS 138 HE1 LYS 138 0.766 14.787 -16.546 378 HZ1 LYS 138 HZ1 LYS 138 -0.942 13.670 -17.555 379 HZ2 LYS 138 HZ2 LYS 138 -0.259 14.432 -18.911 380 HZ3 LYS 138 HZ3 LYS 138 -1.653 15.076 -18.184 381 H ASP 139 HN ASP 139 1.436 15.222 -11.768 382 HA ASP 139 HA ASP 139 -0.811 13.555 -10.951 383 HB2 ASP 139 HB2 ASP 139 2.184 13.548 -10.497 384 HB3 ASP 139 HB1 ASP 139 1.128 12.286 -9.861 385 H GLY 140 HN GLY 140 1.519 15.668 -9.260 386 HA2 GLY 140 HA2 GLY 140 0.521 15.093 -6.619 387 HA3 GLY 140 HA1 GLY 140 1.510 16.486 -7.057 388 H ASP 141 HN ASP 141 -0.500 17.269 -9.164 389 HA ASP 141 HA ASP 141 -2.891 17.973 -7.561 390 HB2 ASP 141 HB2 ASP 141 -0.859 19.565 -7.178 391 HB3 ASP 141 HB1 ASP 141 -1.228 20.165 -8.794 392 H LYS 142 HN LYS 142 -3.521 16.504 -9.531 393 HA LYS 142 HA LYS 142 -3.449 17.623 -12.198 394 HB2 LYS 142 HB2 LYS 142 -4.178 15.235 -10.885 395 HB3 LYS 142 HB1 LYS 142 -5.650 15.804 -11.673 396 HG2 LYS 142 HG2 LYS 142 -3.612 16.222 -13.558 397 HG3 LYS 142 HG1 LYS 142 -3.277 14.634 -12.864 398 HD2 LYS 142 HD2 LYS 142 -4.863 13.844 -14.269 399 HD3 LYS 142 HD1 LYS 142 -6.033 14.614 -13.198 400 HE2 LYS 142 HE2 LYS 142 -5.019 16.673 -14.868 401 HE3 LYS 142 HE1 LYS 142 -5.403 15.299 -15.924 402 HZ1 LYS 142 HZ1 LYS 142 -7.459 15.176 -14.285 403 HZ2 LYS 142 HZ2 LYS 142 -7.487 16.135 -15.688 404 HZ3 LYS 142 HZ3 LYS 142 -7.164 16.843 -14.177 405 H ASN 143 HN ASN 143 -5.279 18.368 -9.415 406 HA ASN 143 HA ASN 143 -7.665 19.329 -10.868 407 HB2 ASN 143 HB2 ASN 143 -7.009 19.909 -7.988 408 HB3 ASN 143 HB1 ASN 143 -8.574 19.557 -8.717 409 HD21 ASN 143 HD21 ASN 143 -6.133 18.192 -6.829 410 HD22 ASN 143 HD22 ASN 143 -6.495 16.554 -7.083 411 H ASN 144 HN ASN 144 -4.613 20.542 -9.747 412 HA ASN 144 HA ASN 144 -3.662 22.702 -9.818 413 HB2 ASN 144 HB2 ASN 144 -4.311 22.410 -12.174 414 HB3 ASN 144 HB1 ASN 144 -5.935 22.999 -11.810 415 HD21 ASN 144 HD21 ASN 144 -2.575 24.139 -11.089 416 HD22 ASN 144 HD22 ASN 144 -2.868 25.744 -11.557 417 H ASP 145 HN ASP 145 -5.544 22.247 -7.705 418 HA ASP 145 HA ASP 145 -7.469 24.423 -7.554 419 HB2 ASP 145 HB2 ASP 145 -7.823 23.549 -5.329 420 HB3 ASP 145 HB1 ASP 145 -7.528 22.169 -6.388 421 H GLY 146 HN GLY 146 -4.094 24.327 -7.278 422 HA2 GLY 146 HA2 GLY 146 -2.948 26.511 -6.995 423 HA3 GLY 146 HA1 GLY 146 -4.128 26.892 -5.740 424 H ARG 147 HN ARG 147 -3.848 23.958 -4.839 425 HA ARG 147 HA ARG 147 -1.122 24.062 -3.638 426 HB2 ARG 147 HB2 ARG 147 -2.169 23.745 -1.392 427 HB3 ARG 147 HB1 ARG 147 -2.624 25.280 -2.133 428 HG2 ARG 147 HG2 ARG 147 -4.757 24.380 -2.840 429 HG3 ARG 147 HG1 ARG 147 -4.298 22.762 -2.310 430 HD2 ARG 147 HD2 ARG 147 -5.148 23.236 -0.267 431 HD3 ARG 147 HD1 ARG 147 -3.924 24.508 -0.084 432 HE ARG 147 HE ARG 147 -5.754 25.717 -1.719 433 HH11 ARG 147 HH21 ARG 147 -6.004 23.929 1.229 434 HH12 ARG 147 HH22 ARG 147 -7.409 24.780 1.774 435 HH21 ARG 147 HH11 ARG 147 -7.583 26.832 -1.012 436 HH22 ARG 147 HH12 ARG 147 -8.301 26.420 0.509 437 H ILE 148 HN ILE 148 -0.399 21.987 -2.906 438 HA ILE 148 HA ILE 148 -1.806 19.704 -4.163 439 HB ILE 148 HB ILE 148 0.855 19.982 -2.726 440 HG12 ILE 148 HG12 ILE 148 0.065 20.073 -5.650 441 HG13 ILE 148 HG11 ILE 148 0.855 21.343 -4.716 442 HG21 ILE 148 HG21 ILE 148 0.015 17.665 -2.746 443 HG22 ILE 148 HG22 ILE 148 1.393 17.837 -3.834 444 HG23 ILE 148 HG23 ILE 148 -0.244 17.770 -4.487 445 HD11 ILE 148 HD11 ILE 148 2.090 19.254 -6.195 446 HD12 ILE 148 HD12 ILE 148 2.397 18.931 -4.489 447 HD13 ILE 148 HD13 ILE 148 2.873 20.476 -5.193 448 H ASP 149 HN ASP 149 -2.989 18.245 -2.977 449 HA ASP 149 HA ASP 149 -3.000 18.536 -0.008 450 HB2 ASP 149 HB2 ASP 149 -5.123 18.752 -1.214 451 HB3 ASP 149 HB1 ASP 149 -4.866 17.189 -1.988 452 H TYR 150 HN TYR 150 -2.921 16.556 1.302 453 HA TYR 150 HA TYR 150 -0.852 14.749 0.666 454 HB2 TYR 150 HB2 TYR 150 -2.804 15.217 2.712 455 HB3 TYR 150 HB1 TYR 150 -2.755 13.486 2.377 456 HD1 TYR 150 HD2 TYR 150 -0.666 12.204 2.639 457 HD2 TYR 150 HD1 TYR 150 -0.879 16.379 3.625 458 HE1 TYR 150 HE2 TYR 150 1.474 12.020 3.877 459 HE2 TYR 150 HE1 TYR 150 1.263 16.195 4.863 460 HH TYR 150 HH TYR 150 2.529 14.202 6.057 461 H ASP 151 HN ASP 151 -4.391 14.188 0.431 462 HA ASP 151 HA ASP 151 -4.518 11.586 -0.475 463 HB2 ASP 151 HB2 ASP 151 -6.112 13.912 -0.502 464 HB3 ASP 151 HB1 ASP 151 -6.128 13.312 -2.162 465 H GLU 152 HN GLU 152 -3.688 14.438 -2.457 466 HA GLU 152 HA GLU 152 -3.361 12.970 -4.925 467 HB2 GLU 152 HB2 GLU 152 -2.635 15.670 -3.819 468 HB3 GLU 152 HB1 GLU 152 -1.998 15.177 -5.389 469 HG2 GLU 152 HG2 GLU 152 -4.058 15.232 -6.398 470 HG3 GLU 152 HG1 GLU 152 -4.902 14.722 -4.935 471 H PHE 153 HN PHE 153 -1.098 14.042 -2.381 472 HA PHE 153 HA PHE 153 1.358 13.372 -3.570 473 HB2 PHE 153 HB2 PHE 153 0.739 14.425 -1.285 474 HB3 PHE 153 HB1 PHE 153 0.651 12.765 -0.696 475 HD1 PHE 153 HD1 PHE 153 2.929 14.831 -2.857 476 HD2 PHE 153 HD2 PHE 153 2.583 11.927 0.289 477 HE1 PHE 153 HE1 PHE 153 5.398 14.777 -2.635 478 HE2 PHE 153 HE2 PHE 153 5.053 11.873 0.510 479 HZ PHE 153 HZ PHE 153 6.460 13.299 -0.952 480 H LEU 154 HN LEU 154 -0.612 11.234 -1.461 481 HA LEU 154 HA LEU 154 0.823 8.869 -1.627 482 HB2 LEU 154 HB2 LEU 154 -2.085 9.597 -1.523 483 HB3 LEU 154 HB1 LEU 154 -1.651 7.895 -1.698 484 HG LEU 154 HG LEU 154 -0.396 7.907 0.337 485 HD11 LEU 154 HD11 LEU 154 0.073 9.941 1.601 486 HD12 LEU 154 HD12 LEU 154 -0.846 10.905 0.445 487 HD13 LEU 154 HD13 LEU 154 0.663 10.137 -0.050 488 HD21 LEU 154 HD21 LEU 154 -3.044 9.333 0.471 489 HD22 LEU 154 HD22 LEU 154 -2.126 9.039 1.947 490 HD23 LEU 154 HD23 LEU 154 -2.649 7.682 0.950 491 H GLU 155 HN GLU 155 -2.000 9.354 -3.779 492 HA GLU 155 HA GLU 155 -1.410 7.395 -5.678 493 HB2 GLU 155 HB2 GLU 155 -3.000 9.820 -5.444 494 HB3 GLU 155 HB1 GLU 155 -2.430 9.597 -7.099 495 HG2 GLU 155 HG2 GLU 155 -3.409 7.417 -7.242 496 HG3 GLU 155 HG1 GLU 155 -3.727 7.375 -5.507 497 H PHE 156 HN PHE 156 -0.089 10.677 -5.418 498 HA PHE 156 HA PHE 156 1.357 10.655 -7.919 499 HB2 PHE 156 HB2 PHE 156 0.878 12.742 -6.885 500 HB3 PHE 156 HB1 PHE 156 1.480 12.195 -5.321 501 HD1 PHE 156 HD2 PHE 156 2.733 12.481 -8.854 502 HD2 PHE 156 HD1 PHE 156 3.558 13.004 -4.671 503 HE1 PHE 156 HE2 PHE 156 4.983 13.368 -9.408 504 HE2 PHE 156 HE1 PHE 156 5.806 13.892 -5.225 505 HZ PHE 156 HZ PHE 156 6.519 14.074 -7.593 506 H MET 157 HN MET 157 2.040 9.509 -4.661 507 HA MET 157 HA MET 157 4.858 8.874 -5.387 508 HB2 MET 157 HB2 MET 157 3.241 8.732 -2.820 509 HB3 MET 157 HB1 MET 157 4.957 8.338 -2.935 510 HG2 MET 157 HG2 MET 157 3.704 11.017 -3.606 511 HG3 MET 157 HG1 MET 157 4.669 10.657 -2.175 512 HE1 MET 157 HE1 MET 157 7.880 10.562 -2.645 513 HE2 MET 157 HE2 MET 157 7.692 9.120 -3.639 514 HE3 MET 157 HE3 MET 157 6.609 9.388 -2.275 515 H LYS 158 HN LYS 158 1.767 7.436 -5.328 516 HA LYS 158 HA LYS 158 2.476 4.725 -4.614 517 HB2 LYS 158 HB2 LYS 158 0.202 6.258 -5.191 518 HB3 LYS 158 HB1 LYS 158 0.247 5.038 -6.464 519 HG2 LYS 158 HG2 LYS 158 0.910 3.751 -4.005 520 HG3 LYS 158 HG1 LYS 158 -0.546 4.710 -3.737 521 HD2 LYS 158 HD2 LYS 158 -0.244 2.913 -6.146 522 HD3 LYS 158 HD1 LYS 158 -0.890 2.319 -4.616 523 HE2 LYS 158 HE2 LYS 158 -2.084 4.861 -5.570 524 HE3 LYS 158 HE1 LYS 158 -2.455 3.427 -6.548 525 HZ1 LYS 158 HZ1 LYS 158 -3.033 3.941 -3.717 526 HZ2 LYS 158 HZ2 LYS 158 -2.719 2.343 -4.200 527 HZ3 LYS 158 HZ3 LYS 158 -4.006 3.206 -4.896 528 H GLY 159 HN GLY 159 2.605 6.602 -7.587 529 HA2 GLY 159 HA2 GLY 159 2.957 4.273 -9.313 530 HA3 GLY 159 HA1 GLY 159 3.167 5.958 -9.793 531 H VAL 160 HN VAL 160 4.949 5.925 -7.138 532 HA VAL 160 HA VAL 160 7.371 4.720 -8.421 533 HB VAL 160 HB VAL 160 7.297 7.113 -8.916 534 HG11 VAL 160 HG11 VAL 160 6.392 8.587 -7.475 535 HG12 VAL 160 HG12 VAL 160 7.570 8.154 -6.236 536 HG13 VAL 160 HG13 VAL 160 6.064 7.247 -6.375 537 HG21 VAL 160 HG21 VAL 160 9.243 7.417 -6.800 538 HG22 VAL 160 HG22 VAL 160 9.516 7.219 -8.531 539 HG23 VAL 160 HG23 VAL 160 9.361 5.801 -7.496 540 H GLU 161 HN GLU 161 8.987 4.055 -6.889 541 HA GLU 161 HA GLU 161 7.951 3.239 -4.293 542 HB2 GLU 161 HB2 GLU 161 10.580 3.089 -5.772 543 HB3 GLU 161 HB1 GLU 161 10.425 2.489 -4.120 544 HG2 GLU 161 HG2 GLU 161 9.004 0.764 -4.731 545 HG3 GLU 161 HG1 GLU 161 8.387 1.632 -6.137 546 HO1 KDH 1 H1 KDH 1 11.028 9.741 -11.560 547 H21 KDH 1 H21 KDH 1 10.184 7.434 -4.536 548 H33 KDH 1 H33 KDH 1 8.648 12.763 -6.721 549 H4 KDH 1 H4 KDH 1 10.583 9.483 -8.523 550 HO7 KDH 1 H7 KDH 1 8.035 10.818 -12.829 551 H01 KDH 1 H01 KDH 1 9.961 12.940 -4.545 552 H01A KDH 1 H02 KDH 1 8.370 12.082 -4.486 553 HO03 KDH 1 H03 KDH 1 10.430 12.343 -1.521 554 HO10 KDH 1 H10 KDH 1 5.647 10.450 -11.327 555 H12 KDH 1 H12 KDH 1 6.657 11.460 -8.244 556 H15 KDH 1 H15 KDH 1 7.715 10.642 -6.419 557 H26 KDH 1 H26 KDH 1 11.664 9.963 -1.271 558 H39 KDH 1 H39 KDH 1 11.704 14.549 -9.998 559 H41 KDH 1 H41 KDH 1 12.367 10.708 -7.960 560 HO02 KDH 1 H42 KDH 1 12.474 7.321 -2.511 561 HO44 KDH 1 H44 KDH 1 15.202 10.006 -10.171 562 HO47 KDH 1 H47 KDH 1 15.204 12.435 -12.167 563 HO50 KDH 1 H50 KDH 1 14.422 13.835 -12.312 Start of MODEL 20 1 H1 MET 90 HT1 MET 90 14.389 8.601 1.575 2 H2 MET 90 HT2 MET 90 13.407 8.804 2.947 3 H3 MET 90 HT3 MET 90 12.971 9.525 1.471 4 HA MET 90 HA MET 90 13.059 7.012 0.661 5 HB2 MET 90 HB2 MET 90 13.560 6.906 3.398 6 HB3 MET 90 HB1 MET 90 11.854 6.475 3.274 7 HG2 MET 90 HG2 MET 90 12.783 4.392 2.928 8 HG3 MET 90 HG1 MET 90 12.762 4.973 1.263 9 HE1 MET 90 HE1 MET 90 15.807 2.745 2.190 10 HE2 MET 90 HE2 MET 90 14.132 2.820 2.727 11 HE3 MET 90 HE3 MET 90 15.423 3.309 3.822 12 H GLY 91 HN GLY 91 10.668 5.912 1.093 13 HA2 GLY 91 HA2 GLY 91 8.381 7.159 1.828 14 HA3 GLY 91 HA1 GLY 91 8.782 8.055 0.362 15 H LYS 92 HN LYS 92 7.212 5.309 1.545 16 HA LYS 92 HA LYS 92 7.000 4.217 -1.237 17 HB2 LYS 92 HB2 LYS 92 7.394 2.728 1.380 18 HB3 LYS 92 HB1 LYS 92 7.065 1.949 -0.168 19 HG2 LYS 92 HG2 LYS 92 9.186 3.738 -0.656 20 HG3 LYS 92 HG1 LYS 92 9.577 2.943 0.869 21 HD2 LYS 92 HD2 LYS 92 9.505 0.785 -0.102 22 HD3 LYS 92 HD1 LYS 92 8.642 1.365 -1.528 23 HE2 LYS 92 HE2 LYS 92 10.578 2.421 -2.414 24 HE3 LYS 92 HE1 LYS 92 11.429 2.343 -0.857 25 HZ1 LYS 92 HZ1 LYS 92 11.846 0.535 -2.691 26 HZ2 LYS 92 HZ2 LYS 92 10.436 -0.151 -2.037 27 HZ3 LYS 92 HZ3 LYS 92 11.794 0.111 -1.050 28 H SER 93 HN SER 93 5.545 2.712 1.567 29 HA SER 93 HA SER 93 2.860 3.227 0.460 30 HB2 SER 93 HB2 SER 93 3.958 1.061 1.514 31 HB3 SER 93 HB1 SER 93 3.449 1.793 3.033 32 HG SER 93 HG SER 93 1.769 1.369 0.782 33 H GLU 94 HN GLU 94 1.116 3.998 1.964 34 HA GLU 94 HA GLU 94 1.567 6.516 3.084 35 HB2 GLU 94 HB2 GLU 94 -0.462 4.374 3.230 36 HB3 GLU 94 HB1 GLU 94 -0.506 5.517 4.573 37 HG2 GLU 94 HG2 GLU 94 -0.156 7.183 2.405 38 HG3 GLU 94 HG1 GLU 94 -1.206 5.926 1.748 39 H GLU 95 HN GLU 95 2.347 3.400 4.445 40 HA GLU 95 HA GLU 95 2.341 3.743 7.193 41 HB2 GLU 95 HB2 GLU 95 3.561 2.094 5.295 42 HB3 GLU 95 HB1 GLU 95 4.913 2.755 6.215 43 HG2 GLU 95 HG2 GLU 95 2.471 1.424 7.425 44 HG3 GLU 95 HG1 GLU 95 4.050 0.661 7.229 45 H GLU 96 HN GLU 96 5.166 4.623 5.168 46 HA GLU 96 HA GLU 96 6.056 6.527 7.269 47 HB2 GLU 96 HB2 GLU 96 7.270 4.730 5.480 48 HB3 GLU 96 HB1 GLU 96 7.669 6.330 4.852 49 HG2 GLU 96 HG2 GLU 96 7.922 6.297 7.734 50 HG3 GLU 96 HG1 GLU 96 8.892 5.007 7.020 51 H LEU 97 HN LEU 97 4.616 6.435 4.096 52 HA LEU 97 HA LEU 97 5.249 8.936 2.992 53 HB2 LEU 97 HB2 LEU 97 3.357 6.832 2.693 54 HB3 LEU 97 HB1 LEU 97 2.447 8.343 2.689 55 HG LEU 97 HG LEU 97 3.211 7.680 0.411 56 HD11 LEU 97 HD11 LEU 97 4.408 9.894 -0.065 57 HD12 LEU 97 HD12 LEU 97 4.316 10.196 1.670 58 HD13 LEU 97 HD13 LEU 97 2.837 10.011 0.727 59 HD21 LEU 97 HD21 LEU 97 5.611 7.118 1.807 60 HD22 LEU 97 HD22 LEU 97 5.971 8.460 0.721 61 HD23 LEU 97 HD23 LEU 97 5.318 6.956 0.076 62 H SER 98 HN SER 98 2.684 8.158 5.363 63 HA SER 98 HA SER 98 1.351 10.560 5.645 64 HB2 SER 98 HB2 SER 98 0.553 9.095 7.189 65 HB3 SER 98 HB1 SER 98 2.107 8.278 7.328 66 HG SER 98 HG SER 98 1.049 10.408 8.772 67 H ASP 99 HN ASP 99 4.498 9.756 7.155 68 HA ASP 99 HA ASP 99 4.800 12.424 8.311 69 HB2 ASP 99 HB2 ASP 99 6.896 10.282 7.869 70 HB3 ASP 99 HB1 ASP 99 6.860 11.510 9.136 71 H LEU 100 HN LEU 100 5.883 10.760 5.380 72 HA LEU 100 HA LEU 100 7.951 12.502 4.544 73 HB2 LEU 100 HB2 LEU 100 6.957 10.271 3.593 74 HB3 LEU 100 HB1 LEU 100 5.914 11.341 2.655 75 HG LEU 100 HG LEU 100 8.073 12.568 1.976 76 HD11 LEU 100 HD11 LEU 100 9.421 11.405 3.785 77 HD12 LEU 100 HD12 LEU 100 10.139 11.356 2.175 78 HD13 LEU 100 HD13 LEU 100 9.314 9.935 2.816 79 HD21 LEU 100 HD21 LEU 100 8.634 10.299 0.525 80 HD22 LEU 100 HD22 LEU 100 7.350 11.443 0.135 81 HD23 LEU 100 HD23 LEU 100 6.983 9.987 1.059 82 H PHE 101 HN PHE 101 4.425 12.740 3.986 83 HA PHE 101 HA PHE 101 4.329 14.998 2.327 84 HB2 PHE 101 HB2 PHE 101 2.434 13.561 3.110 85 HB3 PHE 101 HB1 PHE 101 2.541 14.337 4.691 86 HD1 PHE 101 HD2 PHE 101 2.440 15.370 1.077 87 HD2 PHE 101 HD1 PHE 101 1.065 16.087 5.082 88 HE1 PHE 101 HE2 PHE 101 1.033 17.241 0.259 89 HE2 PHE 101 HE1 PHE 101 -0.343 17.958 4.264 90 HZ PHE 101 HZ PHE 101 -0.359 18.535 1.853 91 H ARG 102 HN ARG 102 4.831 14.829 5.839 92 HA ARG 102 HA ARG 102 4.619 17.629 6.407 93 HB2 ARG 102 HB2 ARG 102 4.567 15.966 8.152 94 HB3 ARG 102 HB1 ARG 102 6.132 15.319 7.659 95 HG2 ARG 102 HG2 ARG 102 6.623 18.034 8.105 96 HG3 ARG 102 HG1 ARG 102 5.542 17.564 9.417 97 HD2 ARG 102 HD2 ARG 102 7.067 16.072 10.324 98 HD3 ARG 102 HD1 ARG 102 7.819 15.729 8.754 99 HE ARG 102 HE ARG 102 8.269 18.463 9.269 100 HH11 ARG 102 HH21 ARG 102 9.018 15.380 10.636 101 HH12 ARG 102 HH22 ARG 102 10.512 15.910 11.333 102 HH21 ARG 102 HH11 ARG 102 10.216 19.162 10.171 103 HH22 ARG 102 HH12 ARG 102 11.192 18.046 11.067 104 H MET 103 HN MET 103 7.582 15.636 6.031 105 HA MET 103 HA MET 103 9.403 17.835 5.910 106 HB2 MET 103 HB2 MET 103 9.337 14.930 5.301 107 HB3 MET 103 HB1 MET 103 10.616 15.845 4.501 108 HG2 MET 103 HG2 MET 103 10.575 16.805 7.139 109 HG3 MET 103 HG1 MET 103 10.405 15.056 7.284 110 HE1 MET 103 HE1 MET 103 13.392 13.589 7.088 111 HE2 MET 103 HE2 MET 103 11.916 14.033 7.941 112 HE3 MET 103 HE3 MET 103 13.429 14.849 8.330 113 H PHE 104 HN PHE 104 7.494 16.192 3.421 114 HA PHE 104 HA PHE 104 8.711 17.119 1.064 115 HB2 PHE 104 HB2 PHE 104 6.219 16.003 1.956 116 HB3 PHE 104 HB1 PHE 104 5.875 17.291 0.801 117 HD1 PHE 104 HD1 PHE 104 8.204 14.387 1.269 118 HD2 PHE 104 HD2 PHE 104 5.957 16.803 -1.478 119 HE1 PHE 104 HE1 PHE 104 8.879 12.896 -0.595 120 HE2 PHE 104 HE2 PHE 104 6.632 15.313 -3.342 121 HZ PHE 104 HZ PHE 104 8.094 13.359 -2.900 122 H ASP 105 HN ASP 105 6.727 18.859 3.393 123 HA ASP 105 HA ASP 105 6.225 21.180 1.722 124 HB2 ASP 105 HB2 ASP 105 5.423 20.116 4.196 125 HB3 ASP 105 HB1 ASP 105 6.223 21.637 4.595 126 H LYS 106 HN LYS 106 7.927 22.442 1.045 127 HA LYS 106 HA LYS 106 10.422 22.624 2.568 128 HB2 LYS 106 HB2 LYS 106 9.479 23.024 -0.074 129 HB3 LYS 106 HB1 LYS 106 10.102 24.582 0.469 130 HG2 LYS 106 HG2 LYS 106 11.888 22.500 1.334 131 HG3 LYS 106 HG1 LYS 106 11.600 22.336 -0.399 132 HD2 LYS 106 HD2 LYS 106 13.471 23.841 -0.096 133 HD3 LYS 106 HD1 LYS 106 12.089 24.794 -0.638 134 HE2 LYS 106 HE2 LYS 106 12.208 26.060 1.234 135 HE3 LYS 106 HE1 LYS 106 12.048 24.609 2.244 136 HZ1 LYS 106 HZ1 LYS 106 14.592 24.994 0.874 137 HZ2 LYS 106 HZ2 LYS 106 14.277 24.355 2.416 138 HZ3 LYS 106 HZ3 LYS 106 14.272 26.037 2.173 139 H ASN 107 HN ASN 107 7.456 24.444 2.319 140 HA ASN 107 HA ASN 107 8.689 26.756 3.758 141 HB2 ASN 107 HB2 ASN 107 7.492 27.307 1.729 142 HB3 ASN 107 HB1 ASN 107 6.102 26.342 2.229 143 HD21 ASN 107 HD21 ASN 107 4.478 27.876 2.633 144 HD22 ASN 107 HD22 ASN 107 4.665 29.226 3.644 145 H ALA 108 HN ALA 108 6.897 23.938 4.332 146 HA ALA 108 HA ALA 108 5.699 23.176 6.221 147 HB1 ALA 108 HB1 ALA 108 6.382 24.454 8.330 148 HB2 ALA 108 HB2 ALA 108 7.321 25.507 7.272 149 HB3 ALA 108 HB3 ALA 108 7.709 23.790 7.376 150 H ASP 109 HN ASP 109 3.661 23.902 5.133 151 HA ASP 109 HA ASP 109 2.309 26.002 6.752 152 HB2 ASP 109 HB2 ASP 109 1.677 27.254 4.824 153 HB3 ASP 109 HB1 ASP 109 3.386 26.892 4.587 154 H GLY 110 HN GLY 110 2.268 22.916 5.880 155 HA2 GLY 110 HA2 GLY 110 0.491 21.358 6.098 156 HA3 GLY 110 HA1 GLY 110 -0.649 22.704 6.121 157 H TYR 111 HN TYR 111 1.401 23.197 3.546 158 HA TYR 111 HA TYR 111 -0.001 21.432 1.634 159 HB2 TYR 111 HB2 TYR 111 -0.274 24.455 1.591 160 HB3 TYR 111 HB1 TYR 111 -0.977 23.338 0.422 161 HD1 TYR 111 HD2 TYR 111 -2.649 21.593 1.255 162 HD2 TYR 111 HD1 TYR 111 -1.374 24.938 3.628 163 HE1 TYR 111 HE2 TYR 111 -4.625 21.302 2.726 164 HE2 TYR 111 HE1 TYR 111 -3.349 24.648 5.099 165 HH TYR 111 HH TYR 111 -5.165 23.457 5.520 166 H ILE 112 HN ILE 112 0.827 21.895 -0.649 167 HA ILE 112 HA ILE 112 3.566 23.113 -0.610 168 HB ILE 112 HB ILE 112 2.599 20.418 -1.577 169 HG12 ILE 112 HG12 ILE 112 5.083 21.096 0.002 170 HG13 ILE 112 HG11 ILE 112 3.520 20.903 0.796 171 HG21 ILE 112 HG21 ILE 112 4.795 22.124 -2.613 172 HG22 ILE 112 HG22 ILE 112 3.911 20.821 -3.407 173 HG23 ILE 112 HG23 ILE 112 5.219 20.444 -2.285 174 HD11 ILE 112 HD11 ILE 112 3.375 18.658 -0.487 175 HD12 ILE 112 HD12 ILE 112 4.463 18.744 0.898 176 HD13 ILE 112 HD13 ILE 112 5.110 18.853 -0.739 177 H ASP 113 HN ASP 113 3.903 24.478 -2.331 178 HA ASP 113 HA ASP 113 1.810 24.576 -4.461 179 HB2 ASP 113 HB2 ASP 113 3.871 26.507 -3.366 180 HB3 ASP 113 HB1 ASP 113 2.927 26.856 -4.815 181 H LEU 114 HN LEU 114 2.936 25.525 -6.614 182 HA LEU 114 HA LEU 114 4.589 23.442 -7.684 183 HB2 LEU 114 HB2 LEU 114 3.338 25.966 -8.484 184 HB3 LEU 114 HB1 LEU 114 4.870 25.684 -9.312 185 HG LEU 114 HG LEU 114 2.605 23.677 -9.141 186 HD11 LEU 114 HD11 LEU 114 1.848 25.400 -10.586 187 HD12 LEU 114 HD12 LEU 114 2.537 24.187 -11.665 188 HD13 LEU 114 HD13 LEU 114 3.455 25.640 -11.272 189 HD21 LEU 114 HD21 LEU 114 4.535 22.399 -9.446 190 HD22 LEU 114 HD22 LEU 114 5.364 23.680 -10.331 191 HD23 LEU 114 HD23 LEU 114 4.088 22.750 -11.116 192 H ASP 115 HN ASP 115 5.359 26.767 -6.617 193 HA ASP 115 HA ASP 115 8.093 26.845 -7.334 194 HB2 ASP 115 HB2 ASP 115 6.581 28.011 -4.975 195 HB3 ASP 115 HB1 ASP 115 8.189 28.535 -5.476 196 H GLU 116 HN GLU 116 6.563 25.565 -4.373 197 HA GLU 116 HA GLU 116 9.117 24.846 -3.147 198 HB2 GLU 116 HB2 GLU 116 6.278 23.990 -2.501 199 HB3 GLU 116 HB1 GLU 116 7.660 23.958 -1.405 200 HG2 GLU 116 HG2 GLU 116 7.825 26.374 -1.441 201 HG3 GLU 116 HG1 GLU 116 6.591 26.482 -2.697 202 H LEU 117 HN LEU 117 7.116 23.407 -5.528 203 HA LEU 117 HA LEU 117 7.668 20.614 -4.874 204 HB2 LEU 117 HB2 LEU 117 6.431 22.202 -7.099 205 HB3 LEU 117 HB1 LEU 117 6.846 20.514 -7.396 206 HG LEU 117 HG LEU 117 5.156 21.466 -5.065 207 HD11 LEU 117 HD11 LEU 117 3.299 21.284 -6.357 208 HD12 LEU 117 HD12 LEU 117 3.902 19.839 -7.169 209 HD13 LEU 117 HD13 LEU 117 4.406 21.436 -7.721 210 HD21 LEU 117 HD21 LEU 117 5.842 19.398 -4.346 211 HD22 LEU 117 HD22 LEU 117 6.270 18.864 -5.971 212 HD23 LEU 117 HD23 LEU 117 4.585 18.835 -5.448 213 H LYS 118 HN LYS 118 8.987 22.999 -7.183 214 HA LYS 118 HA LYS 118 10.912 21.089 -8.300 215 HB2 LYS 118 HB2 LYS 118 11.648 23.166 -9.513 216 HB3 LYS 118 HB1 LYS 118 9.918 22.852 -9.657 217 HG2 LYS 118 HG2 LYS 118 9.497 24.882 -8.786 218 HG3 LYS 118 HG1 LYS 118 10.290 24.383 -7.291 219 HD2 LYS 118 HD2 LYS 118 12.202 25.516 -7.779 220 HD3 LYS 118 HD1 LYS 118 12.137 25.080 -9.487 221 HE2 LYS 118 HE2 LYS 118 10.356 26.776 -9.845 222 HE3 LYS 118 HE1 LYS 118 10.478 27.241 -8.136 223 HZ1 LYS 118 HZ1 LYS 118 12.490 28.187 -8.435 224 HZ2 LYS 118 HZ2 LYS 118 11.973 28.341 -10.046 225 HZ3 LYS 118 HZ3 LYS 118 12.985 27.053 -9.594 226 H ILE 119 HN ILE 119 10.816 23.066 -5.508 227 HA ILE 119 HA ILE 119 13.751 23.466 -5.404 228 HB ILE 119 HB ILE 119 11.382 24.231 -3.681 229 HG12 ILE 119 HG12 ILE 119 13.384 25.791 -5.348 230 HG13 ILE 119 HG11 ILE 119 11.679 25.540 -5.724 231 HG21 ILE 119 HG21 ILE 119 13.088 23.912 -2.072 232 HG22 ILE 119 HG22 ILE 119 13.185 25.629 -2.460 233 HG23 ILE 119 HG23 ILE 119 14.344 24.499 -3.161 234 HD11 ILE 119 HD11 ILE 119 11.122 26.689 -3.542 235 HD12 ILE 119 HD12 ILE 119 11.879 27.734 -4.744 236 HD13 ILE 119 HD13 ILE 119 12.830 27.103 -3.399 237 H MET 120 HN MET 120 11.289 22.026 -3.218 238 HA MET 120 HA MET 120 12.954 20.732 -1.400 239 HB2 MET 120 HB2 MET 120 10.406 20.881 -1.539 240 HB3 MET 120 HB1 MET 120 10.479 19.509 -2.645 241 HG2 MET 120 HG2 MET 120 11.907 19.334 -0.013 242 HG3 MET 120 HG1 MET 120 10.160 19.097 -0.060 243 HE1 MET 120 HE1 MET 120 8.946 17.117 -0.986 244 HE2 MET 120 HE2 MET 120 9.564 16.111 -2.294 245 HE3 MET 120 HE3 MET 120 9.365 17.843 -2.544 246 H LEU 121 HN LEU 121 12.157 19.736 -4.705 247 HA LEU 121 HA LEU 121 13.451 17.124 -4.472 248 HB2 LEU 121 HB2 LEU 121 12.522 18.798 -6.829 249 HB3 LEU 121 HB1 LEU 121 12.983 17.098 -6.919 250 HG LEU 121 HG LEU 121 10.746 18.206 -5.196 251 HD11 LEU 121 HD11 LEU 121 10.081 18.323 -7.509 252 HD12 LEU 121 HD12 LEU 121 9.319 16.888 -6.824 253 HD13 LEU 121 HD13 LEU 121 10.751 16.726 -7.840 254 HD21 LEU 121 HD21 LEU 121 10.608 15.389 -5.683 255 HD22 LEU 121 HD22 LEU 121 10.819 16.218 -4.141 256 HD23 LEU 121 HD23 LEU 121 12.229 15.765 -5.099 257 H GLN 122 HN GLN 122 14.560 20.333 -4.948 258 HA GLN 122 HA GLN 122 16.737 20.001 -6.740 259 HB2 GLN 122 HB2 GLN 122 15.668 22.072 -5.555 260 HB3 GLN 122 HB1 GLN 122 16.834 21.732 -4.275 261 HG2 GLN 122 HG2 GLN 122 17.907 21.738 -7.044 262 HG3 GLN 122 HG1 GLN 122 17.407 23.304 -6.402 263 HE21 GLN 122 HE21 GLN 122 18.074 23.006 -3.674 264 HE22 GLN 122 HE22 GLN 122 19.754 22.813 -3.526 265 H ALA 123 HN ALA 123 16.293 18.811 -3.514 266 HA ALA 123 HA ALA 123 18.913 18.653 -2.498 267 HB1 ALA 123 HB1 ALA 123 17.508 16.215 -1.982 268 HB2 ALA 123 HB2 ALA 123 16.322 17.518 -2.063 269 HB3 ALA 123 HB3 ALA 123 17.668 17.618 -0.927 270 H THR 124 HN THR 124 17.311 16.570 -4.901 271 HA THR 124 HA THR 124 19.676 14.810 -5.093 272 HB THR 124 HB THR 124 17.204 14.138 -5.217 273 HG1 THR 124 HG1 THR 124 19.106 13.470 -7.191 274 HG21 THR 124 HG21 THR 124 17.430 15.049 -8.083 275 HG22 THR 124 HG22 THR 124 16.732 16.087 -6.840 276 HG23 THR 124 HG23 THR 124 15.990 14.530 -7.208 277 H GLY 125 HN GLY 125 18.764 17.790 -6.385 278 HA2 GLY 125 HA2 GLY 125 20.142 19.038 -7.917 279 HA3 GLY 125 HA1 GLY 125 20.797 17.516 -8.524 280 H GLU 126 HN GLU 126 17.351 18.038 -8.091 281 HA GLU 126 HA GLU 126 16.565 17.112 -10.619 282 HB2 GLU 126 HB2 GLU 126 14.450 18.247 -10.089 283 HB3 GLU 126 HB1 GLU 126 15.127 17.529 -8.627 284 HG2 GLU 126 HG2 GLU 126 15.064 19.555 -7.654 285 HG3 GLU 126 HG1 GLU 126 16.252 20.117 -8.830 286 H THR 127 HN THR 127 17.945 18.013 -12.272 287 HA THR 127 HA THR 127 17.617 20.953 -12.756 288 HB THR 127 HB THR 127 19.710 20.658 -14.075 289 HG1 THR 127 HG1 THR 127 20.700 18.483 -13.581 290 HG21 THR 127 HG21 THR 127 20.688 19.349 -11.711 291 HG22 THR 127 HG22 THR 127 19.394 20.461 -11.264 292 HG23 THR 127 HG23 THR 127 20.798 21.053 -12.152 293 H ILE 128 HN ILE 128 15.630 20.822 -13.923 294 HA ILE 128 HA ILE 128 15.880 19.561 -16.621 295 HB ILE 128 HB ILE 128 13.504 18.801 -16.306 296 HG12 ILE 128 HG12 ILE 128 12.860 18.686 -13.787 297 HG13 ILE 128 HG11 ILE 128 14.019 19.998 -13.588 298 HG21 ILE 128 HG21 ILE 128 15.899 17.741 -15.197 299 HG22 ILE 128 HG22 ILE 128 14.459 16.859 -15.704 300 HG23 ILE 128 HG23 ILE 128 14.603 17.431 -14.042 301 HD11 ILE 128 HD11 ILE 128 11.335 20.213 -14.430 302 HD12 ILE 128 HD12 ILE 128 12.318 20.520 -15.861 303 HD13 ILE 128 HD13 ILE 128 12.550 21.492 -14.408 304 H THR 129 HN THR 129 14.305 20.526 -18.187 305 HA THR 129 HA THR 129 14.310 23.359 -18.199 306 HB THR 129 HB THR 129 12.471 21.359 -19.557 307 HG1 THR 129 HG1 THR 129 14.989 22.481 -20.190 308 HG21 THR 129 HG21 THR 129 11.583 23.053 -20.762 309 HG22 THR 129 HG22 THR 129 13.149 23.838 -20.966 310 HG23 THR 129 HG23 THR 129 12.211 24.111 -19.498 311 H GLU 130 HN GLU 130 12.885 24.883 -17.379 312 HA GLU 130 HA GLU 130 11.214 24.452 -15.201 313 HB2 GLU 130 HB2 GLU 130 11.911 26.647 -15.989 314 HB3 GLU 130 HB1 GLU 130 10.995 26.441 -17.483 315 HG2 GLU 130 HG2 GLU 130 8.917 26.603 -16.371 316 HG3 GLU 130 HG1 GLU 130 9.640 26.292 -14.792 317 H ASP 131 HN ASP 131 10.313 24.309 -18.651 318 HA ASP 131 HA ASP 131 7.520 23.970 -18.392 319 HB2 ASP 131 HB2 ASP 131 9.367 24.040 -20.395 320 HB3 ASP 131 HB1 ASP 131 8.940 22.328 -20.413 321 H ASP 132 HN ASP 132 10.096 21.808 -17.535 322 HA ASP 132 HA ASP 132 8.431 19.381 -17.607 323 HB2 ASP 132 HB2 ASP 132 11.176 20.095 -17.565 324 HB3 ASP 132 HB1 ASP 132 10.879 19.165 -16.096 325 H ILE 133 HN ILE 133 9.134 21.923 -15.364 326 HA ILE 133 HA ILE 133 8.955 20.669 -12.852 327 HB ILE 133 HB ILE 133 7.796 23.303 -13.820 328 HG12 ILE 133 HG12 ILE 133 10.164 23.142 -14.329 329 HG13 ILE 133 HG11 ILE 133 9.976 24.192 -12.925 330 HG21 ILE 133 HG21 ILE 133 7.000 22.471 -11.558 331 HG22 ILE 133 HG22 ILE 133 7.852 24.014 -11.523 332 HG23 ILE 133 HG23 ILE 133 8.680 22.539 -11.026 333 HD11 ILE 133 HD11 ILE 133 11.789 22.637 -12.482 334 HD12 ILE 133 HD12 ILE 133 10.765 21.264 -12.903 335 HD13 ILE 133 HD13 ILE 133 10.422 22.209 -11.454 336 H GLU 134 HN GLU 134 6.336 21.629 -15.068 337 HA GLU 134 HA GLU 134 4.139 21.051 -13.331 338 HB2 GLU 134 HB2 GLU 134 4.542 21.078 -16.331 339 HB3 GLU 134 HB1 GLU 134 2.957 20.839 -15.595 340 HG2 GLU 134 HG2 GLU 134 2.742 23.053 -15.278 341 HG3 GLU 134 HG1 GLU 134 4.223 23.074 -14.322 342 H GLU 135 HN GLU 135 6.368 18.966 -14.936 343 HA GLU 135 HA GLU 135 4.761 16.660 -15.414 344 HB2 GLU 135 HB2 GLU 135 7.174 17.224 -16.089 345 HB3 GLU 135 HB1 GLU 135 7.637 16.692 -14.472 346 HG2 GLU 135 HG2 GLU 135 7.625 14.566 -15.202 347 HG3 GLU 135 HG1 GLU 135 5.894 14.711 -15.508 348 H LEU 136 HN LEU 136 6.106 17.991 -12.452 349 HA LEU 136 HA LEU 136 5.501 15.524 -10.919 350 HB2 LEU 136 HB2 LEU 136 6.690 18.229 -10.223 351 HB3 LEU 136 HB1 LEU 136 6.532 16.895 -9.080 352 HG LEU 136 HG LEU 136 7.827 16.218 -11.658 353 HD11 LEU 136 HD11 LEU 136 9.058 18.180 -11.506 354 HD12 LEU 136 HD12 LEU 136 10.026 17.124 -10.479 355 HD13 LEU 136 HD13 LEU 136 8.898 18.268 -9.752 356 HD21 LEU 136 HD21 LEU 136 7.637 14.567 -9.881 357 HD22 LEU 136 HD22 LEU 136 8.384 15.671 -8.725 358 HD23 LEU 136 HD23 LEU 136 9.337 15.008 -10.052 359 H MET 137 HN MET 137 4.254 18.787 -11.419 360 HA MET 137 HA MET 137 2.540 19.060 -9.189 361 HB2 MET 137 HB2 MET 137 3.044 20.270 -11.723 362 HB3 MET 137 HB1 MET 137 1.299 20.058 -11.577 363 HG2 MET 137 HG2 MET 137 2.938 21.216 -9.321 364 HG3 MET 137 HG1 MET 137 2.304 22.232 -10.615 365 HE1 MET 137 HE1 MET 137 1.557 20.418 -7.287 366 HE2 MET 137 HE2 MET 137 0.335 21.621 -6.881 367 HE3 MET 137 HE3 MET 137 1.917 22.142 -7.457 368 H LYS 138 HN LYS 138 1.717 17.721 -12.417 369 HA LYS 138 HA LYS 138 -0.943 16.969 -11.915 370 HB2 LYS 138 HB2 LYS 138 -0.513 15.324 -13.738 371 HB3 LYS 138 HB1 LYS 138 0.180 16.906 -14.096 372 HG2 LYS 138 HG2 LYS 138 2.374 16.097 -13.207 373 HG3 LYS 138 HG1 LYS 138 1.661 14.495 -13.008 374 HD2 LYS 138 HD2 LYS 138 1.218 15.645 -15.675 375 HD3 LYS 138 HD1 LYS 138 2.921 15.389 -15.294 376 HE2 LYS 138 HE2 LYS 138 0.951 13.200 -14.676 377 HE3 LYS 138 HE1 LYS 138 1.534 13.406 -16.340 378 HZ1 LYS 138 HZ1 LYS 138 2.948 11.962 -14.841 379 HZ2 LYS 138 HZ2 LYS 138 3.363 13.384 -14.009 380 HZ3 LYS 138 HZ3 LYS 138 3.758 13.212 -15.653 381 H ASP 139 HN ASP 139 2.016 15.481 -10.763 382 HA ASP 139 HA ASP 139 0.838 12.914 -10.070 383 HB2 ASP 139 HB2 ASP 139 3.366 14.110 -10.247 384 HB3 ASP 139 HB1 ASP 139 3.173 13.737 -8.534 385 H GLY 140 HN GLY 140 1.030 16.047 -8.520 386 HA2 GLY 140 HA2 GLY 140 -0.314 14.862 -6.124 387 HA3 GLY 140 HA1 GLY 140 0.920 16.112 -5.954 388 H ASP 141 HN ASP 141 -0.913 16.602 -8.743 389 HA ASP 141 HA ASP 141 -3.063 18.149 -7.434 390 HB2 ASP 141 HB2 ASP 141 -0.568 19.291 -7.910 391 HB3 ASP 141 HB1 ASP 141 -1.528 19.811 -9.296 392 H LYS 142 HN LYS 142 -3.533 16.025 -9.043 393 HA LYS 142 HA LYS 142 -3.553 16.294 -11.836 394 HB2 LYS 142 HB2 LYS 142 -4.814 14.738 -9.768 395 HB3 LYS 142 HB1 LYS 142 -6.013 15.131 -11.001 396 HG2 LYS 142 HG2 LYS 142 -4.240 14.400 -12.717 397 HG3 LYS 142 HG1 LYS 142 -3.384 13.686 -11.350 398 HD2 LYS 142 HD2 LYS 142 -5.846 12.698 -10.873 399 HD3 LYS 142 HD1 LYS 142 -5.939 12.853 -12.627 400 HE2 LYS 142 HE2 LYS 142 -3.377 11.750 -12.021 401 HE3 LYS 142 HE1 LYS 142 -4.591 10.824 -11.115 402 HZ1 LYS 142 HZ1 LYS 142 -4.243 10.118 -13.496 403 HZ2 LYS 142 HZ2 LYS 142 -4.954 11.591 -13.956 404 HZ3 LYS 142 HZ3 LYS 142 -5.846 10.458 -13.059 405 H ASN 143 HN ASN 143 -5.736 17.749 -9.444 406 HA ASN 143 HA ASN 143 -7.468 18.880 -11.546 407 HB2 ASN 143 HB2 ASN 143 -8.906 19.306 -9.770 408 HB3 ASN 143 HB1 ASN 143 -7.965 17.983 -9.087 409 HD21 ASN 143 HD21 ASN 143 -5.754 18.953 -8.014 410 HD22 ASN 143 HD22 ASN 143 -6.022 20.277 -6.986 411 H ASN 144 HN ASN 144 -4.577 19.744 -9.938 412 HA ASN 144 HA ASN 144 -3.292 21.723 -9.985 413 HB2 ASN 144 HB2 ASN 144 -3.892 21.435 -12.400 414 HB3 ASN 144 HB1 ASN 144 -5.309 22.450 -12.131 415 HD21 ASN 144 HD21 ASN 144 -1.789 22.476 -12.402 416 HD22 ASN 144 HD22 ASN 144 -1.621 24.165 -12.413 417 H ASP 145 HN ASP 145 -5.123 21.703 -7.915 418 HA ASP 145 HA ASP 145 -6.901 24.001 -7.934 419 HB2 ASP 145 HB2 ASP 145 -6.957 23.464 -5.468 420 HB3 ASP 145 HB1 ASP 145 -7.285 22.074 -6.502 421 H GLY 146 HN GLY 146 -3.510 23.606 -7.528 422 HA2 GLY 146 HA2 GLY 146 -2.101 25.629 -7.535 423 HA3 GLY 146 HA1 GLY 146 -3.318 26.414 -6.527 424 H ARG 147 HN ARG 147 -3.197 23.374 -5.346 425 HA ARG 147 HA ARG 147 -0.758 23.677 -3.696 426 HB2 ARG 147 HB2 ARG 147 -2.140 23.654 -1.616 427 HB3 ARG 147 HB1 ARG 147 -2.443 25.086 -2.601 428 HG2 ARG 147 HG2 ARG 147 -4.611 24.531 -2.843 429 HG3 ARG 147 HG1 ARG 147 -4.176 22.925 -3.431 430 HD2 ARG 147 HD2 ARG 147 -4.462 21.951 -1.370 431 HD3 ARG 147 HD1 ARG 147 -3.856 23.378 -0.503 432 HE ARG 147 HE ARG 147 -6.626 22.889 -1.174 433 HH11 ARG 147 HH21 ARG 147 -4.169 25.305 -0.929 434 HH12 ARG 147 HH22 ARG 147 -5.286 26.593 -0.629 435 HH21 ARG 147 HH11 ARG 147 -8.091 24.561 -0.782 436 HH22 ARG 147 HH12 ARG 147 -7.503 26.173 -0.544 437 H ILE 148 HN ILE 148 -0.051 21.665 -2.960 438 HA ILE 148 HA ILE 148 -1.596 19.295 -3.865 439 HB ILE 148 HB ILE 148 1.194 19.603 -2.704 440 HG12 ILE 148 HG12 ILE 148 0.214 19.501 -5.576 441 HG13 ILE 148 HG11 ILE 148 0.954 20.888 -4.775 442 HG21 ILE 148 HG21 ILE 148 1.323 17.406 -4.233 443 HG22 ILE 148 HG22 ILE 148 -0.390 17.328 -3.810 444 HG23 ILE 148 HG23 ILE 148 0.834 17.333 -2.540 445 HD11 ILE 148 HD11 ILE 148 2.348 19.067 -6.255 446 HD12 ILE 148 HD12 ILE 148 2.523 18.388 -4.637 447 HD13 ILE 148 HD13 ILE 148 3.056 20.037 -4.963 448 H ASP 149 HN ASP 149 -3.225 19.172 -2.213 449 HA ASP 149 HA ASP 149 -2.785 19.390 0.591 450 HB2 ASP 149 HB2 ASP 149 -4.937 19.303 -0.841 451 HB3 ASP 149 HB1 ASP 149 -4.777 17.549 -0.741 452 H TYR 150 HN TYR 150 -3.363 17.250 1.981 453 HA TYR 150 HA TYR 150 -1.065 15.488 1.705 454 HB2 TYR 150 HB2 TYR 150 -1.910 16.150 3.877 455 HB3 TYR 150 HB1 TYR 150 -3.519 15.546 3.487 456 HD1 TYR 150 HD1 TYR 150 -0.701 13.608 2.265 457 HD2 TYR 150 HD2 TYR 150 -3.371 14.152 5.586 458 HE1 TYR 150 HE1 TYR 150 -0.074 11.373 3.134 459 HE2 TYR 150 HE2 TYR 150 -2.744 11.915 6.455 460 HH TYR 150 HH TYR 150 -1.402 10.158 6.208 461 H ASP 151 HN ASP 151 -4.601 15.056 1.333 462 HA ASP 151 HA ASP 151 -4.575 12.275 0.717 463 HB2 ASP 151 HB2 ASP 151 -6.588 13.512 1.286 464 HB3 ASP 151 HB1 ASP 151 -6.390 14.556 -0.123 465 H GLU 152 HN GLU 152 -4.288 15.130 -1.419 466 HA GLU 152 HA GLU 152 -4.207 13.584 -3.869 467 HB2 GLU 152 HB2 GLU 152 -3.721 16.389 -2.956 468 HB3 GLU 152 HB1 GLU 152 -3.099 15.926 -4.541 469 HG2 GLU 152 HG2 GLU 152 -5.496 14.909 -4.881 470 HG3 GLU 152 HG1 GLU 152 -5.945 16.012 -3.580 471 H PHE 153 HN PHE 153 -1.849 14.435 -1.446 472 HA PHE 153 HA PHE 153 0.543 14.241 -3.018 473 HB2 PHE 153 HB2 PHE 153 0.490 15.210 -0.789 474 HB3 PHE 153 HB1 PHE 153 -0.093 13.694 -0.101 475 HD1 PHE 153 HD1 PHE 153 2.568 14.295 -2.659 476 HD2 PHE 153 HD2 PHE 153 1.634 12.930 1.305 477 HE1 PHE 153 HE1 PHE 153 4.906 13.521 -2.376 478 HE2 PHE 153 HE2 PHE 153 3.973 12.155 1.589 479 HZ PHE 153 HZ PHE 153 5.609 12.450 -0.252 480 H LEU 154 HN LEU 154 -1.687 11.851 -1.830 481 HA LEU 154 HA LEU 154 0.053 9.567 -1.735 482 HB2 LEU 154 HB2 LEU 154 -2.789 10.241 -1.652 483 HB3 LEU 154 HB1 LEU 154 -2.501 8.711 -2.481 484 HG LEU 154 HG LEU 154 -2.811 8.429 -0.017 485 HD11 LEU 154 HD11 LEU 154 -1.561 6.704 -1.062 486 HD12 LEU 154 HD12 LEU 154 -0.575 7.189 0.318 487 HD13 LEU 154 HD13 LEU 154 -0.162 7.752 -1.302 488 HD21 LEU 154 HD21 LEU 154 -0.450 10.299 -0.021 489 HD22 LEU 154 HD22 LEU 154 -0.670 9.154 1.302 490 HD23 LEU 154 HD23 LEU 154 -1.910 10.363 0.966 491 H GLU 155 HN GLU 155 -1.839 11.054 -4.356 492 HA GLU 155 HA GLU 155 -1.303 8.982 -6.309 493 HB2 GLU 155 HB2 GLU 155 -3.201 10.448 -6.538 494 HB3 GLU 155 HB1 GLU 155 -2.180 11.882 -6.427 495 HG2 GLU 155 HG2 GLU 155 -1.229 11.510 -8.567 496 HG3 GLU 155 HG1 GLU 155 -1.807 9.844 -8.623 497 H PHE 156 HN PHE 156 0.633 11.425 -4.932 498 HA PHE 156 HA PHE 156 2.276 12.168 -7.174 499 HB2 PHE 156 HB2 PHE 156 1.959 13.119 -4.742 500 HB3 PHE 156 HB1 PHE 156 3.238 11.978 -4.328 501 HD1 PHE 156 HD1 PHE 156 2.380 14.954 -6.353 502 HD2 PHE 156 HD2 PHE 156 5.506 12.289 -5.096 503 HE1 PHE 156 HE1 PHE 156 4.079 16.529 -7.240 504 HE2 PHE 156 HE2 PHE 156 7.205 13.863 -5.984 505 HZ PHE 156 HZ PHE 156 6.491 15.983 -7.055 506 H MET 157 HN MET 157 2.834 9.798 -4.536 507 HA MET 157 HA MET 157 5.251 8.724 -5.701 508 HB2 MET 157 HB2 MET 157 3.308 7.462 -3.743 509 HB3 MET 157 HB1 MET 157 5.030 7.112 -3.902 510 HG2 MET 157 HG2 MET 157 4.925 9.880 -3.548 511 HG3 MET 157 HG1 MET 157 3.716 9.253 -2.428 512 HE1 MET 157 HE1 MET 157 7.973 9.319 -2.767 513 HE2 MET 157 HE2 MET 157 7.414 10.279 -1.399 514 HE3 MET 157 HE3 MET 157 6.648 10.474 -2.974 515 H LYS 158 HN LYS 158 1.997 7.246 -5.352 516 HA LYS 158 HA LYS 158 0.950 5.568 -6.649 517 HB2 LYS 158 HB2 LYS 158 1.417 7.663 -8.175 518 HB3 LYS 158 HB1 LYS 158 2.598 6.600 -8.943 519 HG2 LYS 158 HG2 LYS 158 0.961 5.550 -10.071 520 HG3 LYS 158 HG1 LYS 158 0.152 5.145 -8.556 521 HD2 LYS 158 HD2 LYS 158 -1.457 6.651 -8.993 522 HD3 LYS 158 HD1 LYS 158 -0.249 7.933 -9.078 523 HE2 LYS 158 HE2 LYS 158 0.168 6.744 -11.487 524 HE3 LYS 158 HE1 LYS 158 -1.570 6.448 -11.281 525 HZ1 LYS 158 HZ1 LYS 158 -1.864 8.781 -10.712 526 HZ2 LYS 158 HZ2 LYS 158 -1.177 8.628 -12.259 527 HZ3 LYS 158 HZ3 LYS 158 -0.207 9.067 -10.935 528 H GLY 159 HN GLY 159 3.827 5.164 -5.541 529 HA2 GLY 159 HA2 GLY 159 4.933 3.012 -5.447 530 HA3 GLY 159 HA1 GLY 159 4.317 2.658 -7.062 531 H VAL 160 HN VAL 160 6.462 5.025 -5.440 532 HA VAL 160 HA VAL 160 7.859 5.963 -7.691 533 HB VAL 160 HB VAL 160 8.703 5.389 -4.838 534 HG11 VAL 160 HG11 VAL 160 10.407 7.318 -5.590 535 HG12 VAL 160 HG12 VAL 160 10.212 6.520 -7.150 536 HG13 VAL 160 HG13 VAL 160 10.804 5.608 -5.762 537 HG21 VAL 160 HG21 VAL 160 7.884 7.470 -4.349 538 HG22 VAL 160 HG22 VAL 160 6.896 7.189 -5.783 539 HG23 VAL 160 HG23 VAL 160 8.377 8.138 -5.904 540 H GLU 161 HN GLU 161 9.712 3.889 -5.530 541 HA GLU 161 HA GLU 161 10.771 2.439 -7.914 542 HB2 GLU 161 HB2 GLU 161 12.685 2.034 -6.500 543 HB3 GLU 161 HB1 GLU 161 12.222 3.720 -6.265 544 HG2 GLU 161 HG2 GLU 161 11.063 3.179 -4.207 545 HG3 GLU 161 HG1 GLU 161 11.312 1.453 -4.472 546 HO1 KDH 1 H1 KDH 1 6.324 10.713 -9.489 547 H21 KDH 1 H21 KDH 1 12.012 8.358 -3.153 548 H33 KDH 1 H33 KDH 1 9.317 12.816 -6.042 549 H4 KDH 1 H4 KDH 1 7.660 11.444 -7.349 550 HO7 KDH 1 H7 KDH 1 8.021 9.271 -11.362 551 H01 KDH 1 H01 KDH 1 10.907 13.647 -4.219 552 H01A KDH 1 H02 KDH 1 9.494 12.635 -3.718 553 HO03 KDH 1 H03 KDH 1 11.276 13.982 -2.129 554 HO10 KDH 1 H10 KDH 1 10.580 7.508 -10.331 555 H12 KDH 1 H12 KDH 1 11.219 8.868 -7.039 556 H15 KDH 1 H15 KDH 1 8.840 10.697 -5.202 557 H26 KDH 1 H26 KDH 1 13.467 11.714 -0.730 558 H39 KDH 1 H39 KDH 1 12.203 14.991 -9.377 559 H41 KDH 1 H41 KDH 1 11.841 10.715 -8.412 560 HO02 KDH 1 H42 KDH 1 14.569 9.232 -1.280 561 HO44 KDH 1 H44 KDH 1 14.305 9.742 -10.428 562 HO47 KDH 1 H47 KDH 1 15.284 12.011 -11.871 563 HO50 KDH 1 H50 KDH 1 13.172 14.799 -12.270 Start of MODEL 21 1 H1 MET 90 HT1 MET 90 9.376 7.677 -3.512 2 H2 MET 90 HT2 MET 90 8.250 7.556 -4.779 3 H3 MET 90 HT3 MET 90 9.581 6.502 -4.719 4 HA MET 90 HA MET 90 7.112 6.467 -3.116 5 HB2 MET 90 HB2 MET 90 8.055 5.120 -5.278 6 HB3 MET 90 HB1 MET 90 8.671 4.092 -3.984 7 HG2 MET 90 HG2 MET 90 6.399 3.946 -3.021 8 HG3 MET 90 HG1 MET 90 5.784 4.957 -4.329 9 HE1 MET 90 HE1 MET 90 4.698 1.114 -4.578 10 HE2 MET 90 HE2 MET 90 4.611 2.492 -3.484 11 HE3 MET 90 HE3 MET 90 5.881 1.289 -3.275 12 H GLY 91 HN GLY 91 7.654 6.845 -0.955 13 HA2 GLY 91 HA2 GLY 91 10.157 6.122 0.242 14 HA3 GLY 91 HA1 GLY 91 8.679 6.498 1.131 15 H LYS 92 HN LYS 92 7.334 4.797 1.799 16 HA LYS 92 HA LYS 92 7.934 2.028 0.960 17 HB2 LYS 92 HB2 LYS 92 9.375 3.150 3.009 18 HB3 LYS 92 HB1 LYS 92 8.030 2.421 3.889 19 HG2 LYS 92 HG2 LYS 92 9.810 0.986 1.895 20 HG3 LYS 92 HG1 LYS 92 9.897 0.822 3.649 21 HD2 LYS 92 HD2 LYS 92 7.781 -0.234 3.772 22 HD3 LYS 92 HD1 LYS 92 7.334 0.289 2.147 23 HE2 LYS 92 HE2 LYS 92 8.924 -1.231 1.139 24 HE3 LYS 92 HE1 LYS 92 9.614 -1.634 2.724 25 HZ1 LYS 92 HZ1 LYS 92 6.722 -1.938 2.229 26 HZ2 LYS 92 HZ2 LYS 92 7.694 -2.710 3.390 27 HZ3 LYS 92 HZ3 LYS 92 7.796 -3.163 1.755 28 H SER 93 HN SER 93 6.439 3.637 3.781 29 HA SER 93 HA SER 93 3.780 2.574 2.926 30 HB2 SER 93 HB2 SER 93 3.448 1.653 5.140 31 HB3 SER 93 HB1 SER 93 5.007 1.072 4.562 32 HG SER 93 HG SER 93 5.714 3.190 5.671 33 H GLU 94 HN GLU 94 2.049 3.611 4.486 34 HA GLU 94 HA GLU 94 2.203 6.452 4.273 35 HB2 GLU 94 HB2 GLU 94 0.456 4.385 5.487 36 HB3 GLU 94 HB1 GLU 94 0.296 6.008 6.162 37 HG2 GLU 94 HG2 GLU 94 0.358 6.607 3.518 38 HG3 GLU 94 HG1 GLU 94 -0.397 5.013 3.455 39 H GLU 95 HN GLU 95 3.656 4.335 6.534 40 HA GLU 95 HA GLU 95 3.609 5.839 8.947 41 HB2 GLU 95 HB2 GLU 95 5.570 3.947 7.634 42 HB3 GLU 95 HB1 GLU 95 5.868 4.612 9.241 43 HG2 GLU 95 HG2 GLU 95 3.185 3.721 9.249 44 HG3 GLU 95 HG1 GLU 95 4.126 2.440 8.484 45 H GLU 96 HN GLU 96 6.442 5.659 6.769 46 HA GLU 96 HA GLU 96 7.512 8.185 7.721 47 HB2 GLU 96 HB2 GLU 96 8.301 5.912 6.199 48 HB3 GLU 96 HB1 GLU 96 8.575 7.328 5.182 49 HG2 GLU 96 HG2 GLU 96 9.420 7.482 8.046 50 HG3 GLU 96 HG1 GLU 96 10.406 6.519 6.944 51 H LEU 97 HN LEU 97 5.641 7.141 4.906 52 HA LEU 97 HA LEU 97 5.803 9.236 3.119 53 HB2 LEU 97 HB2 LEU 97 3.870 7.242 3.979 54 HB3 LEU 97 HB1 LEU 97 3.056 8.699 3.412 55 HG LEU 97 HG LEU 97 3.603 6.912 1.645 56 HD11 LEU 97 HD11 LEU 97 4.626 8.841 0.126 57 HD12 LEU 97 HD12 LEU 97 4.224 9.835 1.527 58 HD13 LEU 97 HD13 LEU 97 2.960 8.923 0.702 59 HD21 LEU 97 HD21 LEU 97 5.814 6.616 0.941 60 HD22 LEU 97 HD22 LEU 97 6.019 6.759 2.687 61 HD23 LEU 97 HD23 LEU 97 6.347 8.143 1.644 62 H SER 98 HN SER 98 3.860 9.213 6.120 63 HA SER 98 HA SER 98 2.711 11.819 5.802 64 HB2 SER 98 HB2 SER 98 1.619 10.820 7.517 65 HB3 SER 98 HB1 SER 98 2.940 9.683 7.770 66 HG SER 98 HG SER 98 2.274 11.806 9.223 67 H ASP 99 HN ASP 99 5.230 10.919 8.185 68 HA ASP 99 HA ASP 99 6.082 13.510 8.841 69 HB2 ASP 99 HB2 ASP 99 6.850 10.807 9.249 70 HB3 ASP 99 HB1 ASP 99 8.305 11.679 8.761 71 H LEU 100 HN LEU 100 6.597 11.781 5.878 72 HA LEU 100 HA LEU 100 9.026 13.111 5.032 73 HB2 LEU 100 HB2 LEU 100 7.745 10.935 4.248 74 HB3 LEU 100 HB1 LEU 100 6.929 12.057 3.159 75 HG LEU 100 HG LEU 100 9.223 12.868 2.444 76 HD11 LEU 100 HD11 LEU 100 11.066 12.081 3.471 77 HD12 LEU 100 HD12 LEU 100 10.571 10.414 3.174 78 HD13 LEU 100 HD13 LEU 100 10.011 11.256 4.619 79 HD21 LEU 100 HD21 LEU 100 9.609 10.932 0.962 80 HD22 LEU 100 HD22 LEU 100 7.885 11.281 1.092 81 HD23 LEU 100 HD23 LEU 100 8.583 9.934 1.992 82 H PHE 101 HN PHE 101 5.555 13.763 4.539 83 HA PHE 101 HA PHE 101 5.781 15.852 2.626 84 HB2 PHE 101 HB2 PHE 101 3.720 14.645 3.365 85 HB3 PHE 101 HB1 PHE 101 3.790 15.522 4.893 86 HD1 PHE 101 HD2 PHE 101 3.859 18.119 4.757 87 HD2 PHE 101 HD1 PHE 101 2.615 15.585 1.519 88 HE1 PHE 101 HE2 PHE 101 2.677 20.034 3.713 89 HE2 PHE 101 HE1 PHE 101 1.433 17.500 0.475 90 HZ PHE 101 HZ PHE 101 1.465 19.724 1.571 91 H ARG 102 HN ARG 102 6.618 15.812 5.991 92 HA ARG 102 HA ARG 102 6.272 18.599 6.608 93 HB2 ARG 102 HB2 ARG 102 7.378 16.179 7.743 94 HB3 ARG 102 HB1 ARG 102 8.462 17.537 8.048 95 HG2 ARG 102 HG2 ARG 102 7.006 18.529 9.476 96 HG3 ARG 102 HG1 ARG 102 5.619 18.179 8.444 97 HD2 ARG 102 HD2 ARG 102 5.202 16.142 9.462 98 HD3 ARG 102 HD1 ARG 102 6.910 15.879 9.865 99 HE ARG 102 HE ARG 102 6.574 17.111 11.856 100 HH11 ARG 102 HH21 ARG 102 4.054 17.656 9.557 101 HH12 ARG 102 HH22 ARG 102 3.090 18.597 10.645 102 HH21 ARG 102 HH11 ARG 102 5.325 18.333 13.283 103 HH22 ARG 102 HH12 ARG 102 3.808 18.980 12.752 104 H MET 103 HN MET 103 9.123 16.750 5.476 105 HA MET 103 HA MET 103 10.709 19.215 5.171 106 HB2 MET 103 HB2 MET 103 12.451 17.606 4.526 107 HB3 MET 103 HB1 MET 103 11.620 17.038 5.974 108 HG2 MET 103 HG2 MET 103 10.410 15.400 4.787 109 HG3 MET 103 HG1 MET 103 10.702 16.183 3.233 110 HE1 MET 103 HE1 MET 103 13.525 14.648 1.762 111 HE2 MET 103 HE2 MET 103 13.549 16.336 2.265 112 HE3 MET 103 HE3 MET 103 12.037 15.605 1.733 113 H PHE 104 HN PHE 104 8.623 17.246 3.222 114 HA PHE 104 HA PHE 104 9.745 17.778 0.626 115 HB2 PHE 104 HB2 PHE 104 7.325 16.662 1.859 116 HB3 PHE 104 HB1 PHE 104 7.010 17.446 0.311 117 HD1 PHE 104 HD1 PHE 104 10.315 16.033 1.055 118 HD2 PHE 104 HD2 PHE 104 6.509 15.306 -0.797 119 HE1 PHE 104 HE1 PHE 104 11.267 14.074 -0.132 120 HE2 PHE 104 HE2 PHE 104 7.460 13.347 -1.984 121 HZ PHE 104 HZ PHE 104 9.839 12.732 -1.650 122 H ASP 105 HN ASP 105 7.634 19.617 2.761 123 HA ASP 105 HA ASP 105 7.151 21.637 0.618 124 HB2 ASP 105 HB2 ASP 105 5.326 20.591 2.062 125 HB3 ASP 105 HB1 ASP 105 6.019 21.475 3.423 126 H LYS 106 HN LYS 106 8.767 23.168 0.551 127 HA LYS 106 HA LYS 106 10.432 23.820 2.844 128 HB2 LYS 106 HB2 LYS 106 10.838 23.924 0.251 129 HB3 LYS 106 HB1 LYS 106 10.098 25.520 0.381 130 HG2 LYS 106 HG2 LYS 106 11.806 25.736 2.423 131 HG3 LYS 106 HG1 LYS 106 12.697 24.542 1.478 132 HD2 LYS 106 HD2 LYS 106 12.831 25.986 -0.412 133 HD3 LYS 106 HD1 LYS 106 11.617 27.084 0.248 134 HE2 LYS 106 HE2 LYS 106 13.114 27.903 1.920 135 HE3 LYS 106 HE1 LYS 106 14.265 26.581 1.639 136 HZ1 LYS 106 HZ1 LYS 106 13.516 28.138 -0.697 137 HZ2 LYS 106 HZ2 LYS 106 15.033 27.517 -0.247 138 HZ3 LYS 106 HZ3 LYS 106 14.461 28.958 0.447 139 H ASN 107 HN ASN 107 7.448 25.061 1.496 140 HA ASN 107 HA ASN 107 7.512 27.669 2.746 141 HB2 ASN 107 HB2 ASN 107 6.067 26.523 0.813 142 HB3 ASN 107 HB1 ASN 107 4.969 26.205 2.157 143 HD21 ASN 107 HD21 ASN 107 3.552 27.817 0.872 144 HD22 ASN 107 HD22 ASN 107 3.779 29.471 1.183 145 H ALA 108 HN ALA 108 6.714 24.459 3.865 146 HA ALA 108 HA ALA 108 5.985 23.684 5.976 147 HB1 ALA 108 HB1 ALA 108 7.952 25.547 6.280 148 HB2 ALA 108 HB2 ALA 108 7.234 24.665 7.628 149 HB3 ALA 108 HB3 ALA 108 6.662 26.285 7.230 150 H ASP 109 HN ASP 109 3.877 24.620 4.463 151 HA ASP 109 HA ASP 109 2.268 26.245 6.408 152 HB2 ASP 109 HB2 ASP 109 1.098 27.088 4.424 153 HB3 ASP 109 HB1 ASP 109 2.835 27.326 4.231 154 H GLY 110 HN GLY 110 2.659 23.186 5.052 155 HA2 GLY 110 HA2 GLY 110 1.221 21.351 5.805 156 HA3 GLY 110 HA1 GLY 110 -0.143 22.470 5.787 157 H TYR 111 HN TYR 111 0.656 23.621 3.178 158 HA TYR 111 HA TYR 111 -0.146 21.313 1.434 159 HB2 TYR 111 HB2 TYR 111 -0.755 24.281 1.212 160 HB3 TYR 111 HB1 TYR 111 -1.358 23.025 0.129 161 HD1 TYR 111 HD2 TYR 111 -1.253 23.949 3.758 162 HD2 TYR 111 HD1 TYR 111 -3.386 21.955 0.608 163 HE1 TYR 111 HE2 TYR 111 -3.141 23.519 5.308 164 HE2 TYR 111 HE1 TYR 111 -5.274 21.525 2.158 165 HH TYR 111 HH TYR 111 -5.713 23.107 4.997 166 H ILE 112 HN ILE 112 0.974 21.085 -0.537 167 HA ILE 112 HA ILE 112 3.456 22.723 -0.797 168 HB ILE 112 HB ILE 112 2.531 20.009 -1.758 169 HG12 ILE 112 HG12 ILE 112 4.871 20.961 -0.071 170 HG13 ILE 112 HG11 ILE 112 3.412 20.179 0.538 171 HG21 ILE 112 HG21 ILE 112 4.563 21.808 -2.907 172 HG22 ILE 112 HG22 ILE 112 3.796 20.384 -3.609 173 HG23 ILE 112 HG23 ILE 112 5.167 20.198 -2.516 174 HD11 ILE 112 HD11 ILE 112 5.104 18.845 -1.568 175 HD12 ILE 112 HD12 ILE 112 3.961 18.111 -0.443 176 HD13 ILE 112 HD13 ILE 112 5.516 18.704 0.141 177 H ASP 113 HN ASP 113 3.801 23.975 -2.631 178 HA ASP 113 HA ASP 113 1.556 24.095 -4.608 179 HB2 ASP 113 HB2 ASP 113 2.718 26.015 -3.019 180 HB3 ASP 113 HB1 ASP 113 3.590 26.231 -4.538 181 H LEU 114 HN LEU 114 2.689 25.241 -6.746 182 HA LEU 114 HA LEU 114 4.370 23.131 -7.870 183 HB2 LEU 114 HB2 LEU 114 2.965 25.621 -8.744 184 HB3 LEU 114 HB1 LEU 114 4.251 25.001 -9.781 185 HG LEU 114 HG LEU 114 2.407 22.926 -8.804 186 HD11 LEU 114 HD11 LEU 114 1.320 25.394 -9.816 187 HD12 LEU 114 HD12 LEU 114 0.463 23.933 -9.326 188 HD13 LEU 114 HD13 LEU 114 1.032 24.106 -10.986 189 HD21 LEU 114 HD21 LEU 114 4.230 23.353 -10.898 190 HD22 LEU 114 HD22 LEU 114 2.648 23.303 -11.676 191 HD23 LEU 114 HD23 LEU 114 3.187 21.947 -10.684 192 H ASP 115 HN ASP 115 4.989 26.008 -6.141 193 HA ASP 115 HA ASP 115 7.613 26.496 -7.445 194 HB2 ASP 115 HB2 ASP 115 5.688 28.123 -6.431 195 HB3 ASP 115 HB1 ASP 115 6.745 27.982 -5.025 196 H GLU 116 HN GLU 116 6.289 24.838 -4.710 197 HA GLU 116 HA GLU 116 8.875 24.869 -3.245 198 HB2 GLU 116 HB2 GLU 116 6.058 23.921 -2.698 199 HB3 GLU 116 HB1 GLU 116 7.391 23.532 -1.610 200 HG2 GLU 116 HG2 GLU 116 7.281 25.580 -0.688 201 HG3 GLU 116 HG1 GLU 116 7.513 26.327 -2.268 202 H LEU 117 HN LEU 117 6.958 22.797 -5.309 203 HA LEU 117 HA LEU 117 8.043 20.250 -4.549 204 HB2 LEU 117 HB2 LEU 117 6.822 21.419 -7.058 205 HB3 LEU 117 HB1 LEU 117 7.288 19.721 -6.954 206 HG LEU 117 HG LEU 117 5.561 20.945 -4.817 207 HD11 LEU 117 HD11 LEU 117 3.685 20.939 -6.100 208 HD12 LEU 117 HD12 LEU 117 4.163 19.469 -6.948 209 HD13 LEU 117 HD13 LEU 117 4.803 21.030 -7.461 210 HD21 LEU 117 HD21 LEU 117 4.709 18.442 -5.076 211 HD22 LEU 117 HD22 LEU 117 6.180 18.801 -4.171 212 HD23 LEU 117 HD23 LEU 117 6.286 18.220 -5.833 213 H LYS 118 HN LYS 118 9.120 22.725 -6.860 214 HA LYS 118 HA LYS 118 11.373 21.068 -7.792 215 HB2 LYS 118 HB2 LYS 118 11.732 22.972 -9.273 216 HB3 LYS 118 HB1 LYS 118 10.003 22.622 -9.217 217 HG2 LYS 118 HG2 LYS 118 9.708 24.382 -7.502 218 HG3 LYS 118 HG1 LYS 118 11.432 24.747 -7.589 219 HD2 LYS 118 HD2 LYS 118 10.115 24.725 -10.214 220 HD3 LYS 118 HD1 LYS 118 9.477 25.953 -9.121 221 HE2 LYS 118 HE2 LYS 118 12.128 26.295 -8.669 222 HE3 LYS 118 HE1 LYS 118 12.171 25.756 -10.360 223 HZ1 LYS 118 HZ1 LYS 118 10.513 27.951 -9.236 224 HZ2 LYS 118 HZ2 LYS 118 10.369 27.360 -10.823 225 HZ3 LYS 118 HZ3 LYS 118 11.806 28.116 -10.321 226 H ILE 119 HN ILE 119 10.770 23.355 -5.275 227 HA ILE 119 HA ILE 119 13.616 24.155 -5.059 228 HB ILE 119 HB ILE 119 11.083 24.843 -3.540 229 HG12 ILE 119 HG12 ILE 119 12.754 26.299 -5.612 230 HG13 ILE 119 HG11 ILE 119 11.098 25.722 -5.803 231 HG21 ILE 119 HG21 ILE 119 13.097 25.034 -2.104 232 HG22 ILE 119 HG22 ILE 119 12.414 26.616 -2.478 233 HG23 ILE 119 HG23 ILE 119 13.856 26.056 -3.324 234 HD11 ILE 119 HD11 ILE 119 11.317 28.200 -5.294 235 HD12 ILE 119 HD12 ILE 119 11.905 27.740 -3.696 236 HD13 ILE 119 HD13 ILE 119 10.272 27.301 -4.194 237 H MET 120 HN MET 120 11.270 22.046 -3.469 238 HA MET 120 HA MET 120 12.948 21.553 -1.128 239 HB2 MET 120 HB2 MET 120 11.142 20.199 -0.461 240 HB3 MET 120 HB1 MET 120 10.360 21.392 -1.495 241 HG2 MET 120 HG2 MET 120 9.480 19.500 -2.457 242 HG3 MET 120 HG1 MET 120 10.987 19.567 -3.371 243 HE1 MET 120 HE1 MET 120 8.721 17.259 -1.662 244 HE2 MET 120 HE2 MET 120 9.736 15.868 -2.037 245 HE3 MET 120 HE3 MET 120 9.415 17.076 -3.279 246 H LEU 121 HN LEU 121 12.795 20.344 -4.361 247 HA LEU 121 HA LEU 121 14.133 17.785 -3.725 248 HB2 LEU 121 HB2 LEU 121 12.482 18.864 -5.756 249 HB3 LEU 121 HB1 LEU 121 14.031 18.512 -6.522 250 HG LEU 121 HG LEU 121 12.485 16.560 -6.579 251 HD11 LEU 121 HD11 LEU 121 14.879 16.163 -4.758 252 HD12 LEU 121 HD12 LEU 121 14.959 16.262 -6.517 253 HD13 LEU 121 HD13 LEU 121 14.104 14.926 -5.747 254 HD21 LEU 121 HD21 LEU 121 11.433 15.770 -4.719 255 HD22 LEU 121 HD22 LEU 121 11.788 17.362 -4.049 256 HD23 LEU 121 HD23 LEU 121 12.856 16.002 -3.703 257 H GLN 122 HN GLN 122 15.054 21.008 -4.264 258 HA GLN 122 HA GLN 122 17.305 21.029 -5.873 259 HB2 GLN 122 HB2 GLN 122 16.502 22.331 -3.302 260 HB3 GLN 122 HB1 GLN 122 18.151 22.587 -3.872 261 HG2 GLN 122 HG2 GLN 122 17.396 23.535 -5.932 262 HG3 GLN 122 HG1 GLN 122 15.739 23.000 -5.649 263 HE21 GLN 122 HE21 GLN 122 15.284 25.431 -5.966 264 HE22 GLN 122 HE22 GLN 122 15.420 26.437 -4.605 265 H ALA 123 HN ALA 123 16.930 19.355 -2.819 266 HA ALA 123 HA ALA 123 19.468 19.005 -1.809 267 HB1 ALA 123 HB1 ALA 123 17.186 17.092 -2.301 268 HB2 ALA 123 HB2 ALA 123 17.642 17.889 -0.795 269 HB3 ALA 123 HB3 ALA 123 18.632 16.576 -1.432 270 H THR 124 HN THR 124 18.132 17.245 -4.629 271 HA THR 124 HA THR 124 20.784 16.030 -5.161 272 HB THR 124 HB THR 124 18.559 14.819 -5.259 273 HG1 THR 124 HG1 THR 124 20.618 14.481 -6.635 274 HG21 THR 124 HG21 THR 124 18.012 15.845 -7.957 275 HG22 THR 124 HG22 THR 124 17.761 17.037 -6.682 276 HG23 THR 124 HG23 THR 124 16.895 15.501 -6.636 277 H GLY 125 HN GLY 125 20.022 19.014 -5.579 278 HA2 GLY 125 HA2 GLY 125 21.034 20.562 -7.094 279 HA3 GLY 125 HA1 GLY 125 21.327 19.234 -8.218 280 H GLU 126 HN GLU 126 18.465 18.336 -7.874 281 HA GLU 126 HA GLU 126 16.558 18.581 -9.268 282 HB2 GLU 126 HB2 GLU 126 16.125 19.888 -7.224 283 HB3 GLU 126 HB1 GLU 126 16.883 21.301 -7.962 284 HG2 GLU 126 HG2 GLU 126 14.379 21.325 -8.119 285 HG3 GLU 126 HG1 GLU 126 15.178 21.380 -9.690 286 H THR 127 HN THR 127 18.027 18.520 -11.267 287 HA THR 127 HA THR 127 18.136 21.193 -12.622 288 HB THR 127 HB THR 127 19.774 19.814 -14.107 289 HG1 THR 127 HG1 THR 127 20.226 17.874 -13.445 290 HG21 THR 127 HG21 THR 127 20.324 20.518 -11.217 291 HG22 THR 127 HG22 THR 127 20.627 21.511 -12.642 292 HG23 THR 127 HG23 THR 127 21.591 20.062 -12.355 293 H ILE 128 HN ILE 128 15.967 21.147 -13.431 294 HA ILE 128 HA ILE 128 15.505 19.117 -15.581 295 HB ILE 128 HB ILE 128 13.097 19.144 -14.725 296 HG12 ILE 128 HG12 ILE 128 14.497 20.505 -12.403 297 HG13 ILE 128 HG11 ILE 128 13.227 21.200 -13.410 298 HG21 ILE 128 HG21 ILE 128 14.300 18.015 -12.417 299 HG22 ILE 128 HG22 ILE 128 15.434 17.784 -13.748 300 HG23 ILE 128 HG23 ILE 128 13.783 17.176 -13.880 301 HD11 ILE 128 HD11 ILE 128 11.564 19.918 -12.444 302 HD12 ILE 128 HD12 ILE 128 12.659 20.062 -11.069 303 HD13 ILE 128 HD13 ILE 128 12.665 18.597 -12.051 304 H THR 129 HN THR 129 13.610 19.892 -17.014 305 HA THR 129 HA THR 129 14.131 22.624 -17.878 306 HB THR 129 HB THR 129 11.836 20.870 -18.747 307 HG1 THR 129 HG1 THR 129 14.605 20.526 -19.179 308 HG21 THR 129 HG21 THR 129 13.338 21.932 -20.893 309 HG22 THR 129 HG22 THR 129 13.187 23.229 -19.708 310 HG23 THR 129 HG23 THR 129 11.742 22.446 -20.346 311 H GLU 130 HN GLU 130 12.688 24.401 -17.741 312 HA GLU 130 HA GLU 130 11.193 24.830 -15.416 313 HB2 GLU 130 HB2 GLU 130 10.362 26.764 -16.592 314 HB3 GLU 130 HB1 GLU 130 11.988 26.456 -17.205 315 HG2 GLU 130 HG2 GLU 130 10.652 24.946 -18.951 316 HG3 GLU 130 HG1 GLU 130 9.347 26.064 -18.551 317 H ASP 131 HN ASP 131 10.273 23.029 -18.261 318 HA ASP 131 HA ASP 131 7.389 23.118 -17.621 319 HB2 ASP 131 HB2 ASP 131 9.158 22.400 -19.832 320 HB3 ASP 131 HB1 ASP 131 7.882 21.204 -19.593 321 H ASP 132 HN ASP 132 10.099 20.822 -17.446 322 HA ASP 132 HA ASP 132 8.688 18.456 -16.809 323 HB2 ASP 132 HB2 ASP 132 11.299 19.310 -17.040 324 HB3 ASP 132 HB1 ASP 132 11.184 18.935 -15.320 325 H ILE 133 HN ILE 133 9.029 21.354 -14.964 326 HA ILE 133 HA ILE 133 8.869 20.320 -12.298 327 HB ILE 133 HB ILE 133 7.834 22.899 -13.520 328 HG12 ILE 133 HG12 ILE 133 10.266 22.337 -13.931 329 HG13 ILE 133 HG11 ILE 133 10.012 23.813 -12.999 330 HG21 ILE 133 HG21 ILE 133 6.984 22.403 -11.224 331 HG22 ILE 133 HG22 ILE 133 8.045 23.811 -11.266 332 HG23 ILE 133 HG23 ILE 133 8.652 22.267 -10.669 333 HD11 ILE 133 HD11 ILE 133 10.854 22.905 -11.071 334 HD12 ILE 133 HD12 ILE 133 11.711 21.869 -12.212 335 HD13 ILE 133 HD13 ILE 133 10.235 21.295 -11.437 336 H GLU 134 HN GLU 134 6.363 21.084 -14.706 337 HA GLU 134 HA GLU 134 4.177 20.530 -12.813 338 HB2 GLU 134 HB2 GLU 134 4.420 21.202 -15.753 339 HB3 GLU 134 HB1 GLU 134 2.862 20.860 -15.000 340 HG2 GLU 134 HG2 GLU 134 2.788 22.888 -14.010 341 HG3 GLU 134 HG1 GLU 134 4.449 22.745 -13.433 342 H GLU 135 HN GLU 135 6.036 18.789 -15.210 343 HA GLU 135 HA GLU 135 4.288 16.713 -15.959 344 HB2 GLU 135 HB2 GLU 135 6.685 17.259 -16.681 345 HB3 GLU 135 HB1 GLU 135 7.211 16.381 -15.243 346 HG2 GLU 135 HG2 GLU 135 6.078 14.362 -16.009 347 HG3 GLU 135 HG1 GLU 135 5.420 15.226 -17.399 348 H LEU 136 HN LEU 136 5.879 17.285 -12.883 349 HA LEU 136 HA LEU 136 5.290 14.575 -11.870 350 HB2 LEU 136 HB2 LEU 136 6.433 17.102 -10.636 351 HB3 LEU 136 HB1 LEU 136 6.355 15.542 -9.817 352 HG LEU 136 HG LEU 136 7.569 15.479 -12.512 353 HD11 LEU 136 HD11 LEU 136 9.742 16.220 -10.984 354 HD12 LEU 136 HD12 LEU 136 8.494 17.334 -10.426 355 HD13 LEU 136 HD13 LEU 136 8.916 17.267 -12.137 356 HD21 LEU 136 HD21 LEU 136 9.050 14.478 -10.180 357 HD22 LEU 136 HD22 LEU 136 8.542 13.624 -11.637 358 HD23 LEU 136 HD23 LEU 136 7.415 13.827 -10.296 359 H MET 137 HN MET 137 4.172 17.921 -11.325 360 HA MET 137 HA MET 137 2.441 17.689 -9.191 361 HB2 MET 137 HB2 MET 137 2.801 19.740 -10.450 362 HB3 MET 137 HB1 MET 137 2.019 19.046 -11.871 363 HG2 MET 137 HG2 MET 137 -0.071 19.411 -11.054 364 HG3 MET 137 HG1 MET 137 0.389 18.950 -9.415 365 HE1 MET 137 HE1 MET 137 1.214 20.167 -7.740 366 HE2 MET 137 HE2 MET 137 -0.373 20.932 -7.738 367 HE3 MET 137 HE3 MET 137 1.072 21.917 -7.523 368 H LYS 138 HN LYS 138 1.521 16.934 -12.582 369 HA LYS 138 HA LYS 138 -1.082 16.093 -12.328 370 HB2 LYS 138 HB2 LYS 138 -0.472 14.405 -14.104 371 HB3 LYS 138 HB1 LYS 138 0.142 16.029 -14.418 372 HG2 LYS 138 HG2 LYS 138 2.093 14.858 -14.766 373 HG3 LYS 138 HG1 LYS 138 2.226 15.072 -13.020 374 HD2 LYS 138 HD2 LYS 138 1.997 12.859 -12.640 375 HD3 LYS 138 HD1 LYS 138 0.603 12.748 -13.715 376 HE2 LYS 138 HE2 LYS 138 3.449 12.936 -14.751 377 HE3 LYS 138 HE1 LYS 138 2.622 11.391 -14.466 378 HZ1 LYS 138 HZ1 LYS 138 2.383 12.500 -16.766 379 HZ2 LYS 138 HZ2 LYS 138 1.293 13.543 -15.984 380 HZ3 LYS 138 HZ3 LYS 138 0.995 11.871 -16.020 381 H ASP 139 HN ASP 139 1.756 14.428 -11.059 382 HA ASP 139 HA ASP 139 0.249 11.997 -10.372 383 HB2 ASP 139 HB2 ASP 139 3.034 13.040 -10.253 384 HB3 ASP 139 HB1 ASP 139 2.612 11.799 -9.072 385 H GLY 140 HN GLY 140 1.605 14.820 -8.662 386 HA2 GLY 140 HA2 GLY 140 0.453 13.851 -6.113 387 HA3 GLY 140 HA1 GLY 140 1.496 15.262 -6.303 388 H ASP 141 HN ASP 141 -0.653 15.532 -8.755 389 HA ASP 141 HA ASP 141 -2.924 16.627 -7.219 390 HB2 ASP 141 HB2 ASP 141 -0.851 18.249 -7.375 391 HB3 ASP 141 HB1 ASP 141 -1.419 18.502 -9.025 392 H LYS 142 HN LYS 142 -4.100 15.085 -8.560 393 HA LYS 142 HA LYS 142 -3.970 15.221 -11.472 394 HB2 LYS 142 HB2 LYS 142 -5.185 13.647 -9.347 395 HB3 LYS 142 HB1 LYS 142 -6.332 13.947 -10.652 396 HG2 LYS 142 HG2 LYS 142 -3.663 13.267 -11.642 397 HG3 LYS 142 HG1 LYS 142 -4.368 11.987 -10.652 398 HD2 LYS 142 HD2 LYS 142 -6.063 11.579 -12.140 399 HD3 LYS 142 HD1 LYS 142 -6.177 13.270 -12.632 400 HE2 LYS 142 HE2 LYS 142 -4.882 12.857 -14.442 401 HE3 LYS 142 HE1 LYS 142 -3.599 12.202 -13.404 402 HZ1 LYS 142 HZ1 LYS 142 -4.396 10.095 -13.573 403 HZ2 LYS 142 HZ2 LYS 142 -4.931 10.672 -15.078 404 HZ3 LYS 142 HZ3 LYS 142 -6.007 10.587 -13.767 405 H ASN 143 HN ASN 143 -5.382 17.216 -9.142 406 HA ASN 143 HA ASN 143 -7.742 17.935 -10.797 407 HB2 ASN 143 HB2 ASN 143 -6.792 19.173 -8.204 408 HB3 ASN 143 HB1 ASN 143 -8.437 19.111 -8.837 409 HD21 ASN 143 HD21 ASN 143 -6.345 17.604 -6.649 410 HD22 ASN 143 HD22 ASN 143 -7.171 16.131 -6.483 411 H ASN 144 HN ASN 144 -4.525 19.070 -10.025 412 HA ASN 144 HA ASN 144 -3.318 20.951 -10.792 413 HB2 ASN 144 HB2 ASN 144 -4.304 19.786 -12.890 414 HB3 ASN 144 HB1 ASN 144 -5.463 21.115 -12.911 415 HD21 ASN 144 HD21 ASN 144 -4.641 22.240 -14.756 416 HD22 ASN 144 HD22 ASN 144 -3.088 22.923 -14.805 417 H ASP 145 HN ASP 145 -5.343 21.441 -8.782 418 HA ASP 145 HA ASP 145 -6.885 23.807 -9.539 419 HB2 ASP 145 HB2 ASP 145 -7.415 23.775 -7.103 420 HB3 ASP 145 HB1 ASP 145 -7.632 22.190 -7.845 421 H GLY 146 HN GLY 146 -3.657 23.198 -8.489 422 HA2 GLY 146 HA2 GLY 146 -2.043 25.064 -8.704 423 HA3 GLY 146 HA1 GLY 146 -3.283 26.130 -8.042 424 H ARG 147 HN ARG 147 -3.189 23.081 -6.520 425 HA ARG 147 HA ARG 147 -1.182 23.842 -4.496 426 HB2 ARG 147 HB2 ARG 147 -2.964 23.820 -2.703 427 HB3 ARG 147 HB1 ARG 147 -3.100 25.170 -3.830 428 HG2 ARG 147 HG2 ARG 147 -5.061 24.412 -4.700 429 HG3 ARG 147 HG1 ARG 147 -4.537 22.728 -4.656 430 HD2 ARG 147 HD2 ARG 147 -6.322 22.902 -3.052 431 HD3 ARG 147 HD1 ARG 147 -4.826 22.877 -2.097 432 HE ARG 147 HE ARG 147 -5.581 25.572 -2.894 433 HH11 ARG 147 HH21 ARG 147 -6.060 23.007 -0.631 434 HH12 ARG 147 HH22 ARG 147 -6.588 24.055 0.642 435 HH21 ARG 147 HH11 ARG 147 -6.272 26.948 -1.240 436 HH22 ARG 147 HH12 ARG 147 -6.709 26.281 0.298 437 H ILE 148 HN ILE 148 -0.421 22.009 -3.443 438 HA ILE 148 HA ILE 148 -1.731 19.416 -4.154 439 HB ILE 148 HB ILE 148 1.057 20.276 -3.356 440 HG12 ILE 148 HG12 ILE 148 -0.219 19.040 -5.806 441 HG13 ILE 148 HG11 ILE 148 0.653 20.568 -5.692 442 HG21 ILE 148 HG21 ILE 148 0.066 17.439 -3.767 443 HG22 ILE 148 HG22 ILE 148 0.422 18.151 -2.194 444 HG23 ILE 148 HG23 ILE 148 1.714 17.930 -3.375 445 HD11 ILE 148 HD11 ILE 148 2.615 18.974 -4.849 446 HD12 ILE 148 HD12 ILE 148 2.330 19.237 -6.569 447 HD13 ILE 148 HD13 ILE 148 1.723 17.778 -5.788 448 H ASP 149 HN ASP 149 -3.219 19.046 -2.478 449 HA ASP 149 HA ASP 149 -2.807 19.762 0.275 450 HB2 ASP 149 HB2 ASP 149 -4.516 17.567 -0.944 451 HB3 ASP 149 HB1 ASP 149 -4.780 18.357 0.611 452 H TYR 150 HN TYR 150 -3.285 17.430 1.723 453 HA TYR 150 HA TYR 150 -0.623 16.164 1.673 454 HB2 TYR 150 HB2 TYR 150 -2.240 16.959 3.645 455 HB3 TYR 150 HB1 TYR 150 -2.865 15.320 3.466 456 HD1 TYR 150 HD2 TYR 150 -0.941 13.462 3.196 457 HD2 TYR 150 HD1 TYR 150 -0.470 17.272 5.122 458 HE1 TYR 150 HE2 TYR 150 0.994 12.579 4.470 459 HE2 TYR 150 HE1 TYR 150 1.465 16.388 6.397 460 HH TYR 150 HH TYR 150 2.127 13.723 7.111 461 H ASP 151 HN ASP 151 -3.957 14.853 1.851 462 HA ASP 151 HA ASP 151 -3.453 12.191 1.204 463 HB2 ASP 151 HB2 ASP 151 -5.657 14.122 1.030 464 HB3 ASP 151 HB1 ASP 151 -5.799 12.816 -0.146 465 H GLU 152 HN GLU 152 -3.723 14.964 -1.010 466 HA GLU 152 HA GLU 152 -3.666 13.539 -3.480 467 HB2 GLU 152 HB2 GLU 152 -3.043 16.276 -2.458 468 HB3 GLU 152 HB1 GLU 152 -2.465 15.872 -4.075 469 HG2 GLU 152 HG2 GLU 152 -4.637 15.498 -4.895 470 HG3 GLU 152 HG1 GLU 152 -5.312 15.290 -3.279 471 H PHE 153 HN PHE 153 -1.215 14.051 -1.095 472 HA PHE 153 HA PHE 153 1.085 13.791 -2.869 473 HB2 PHE 153 HB2 PHE 153 1.200 14.963 -0.732 474 HB3 PHE 153 HB1 PHE 153 0.681 13.512 0.129 475 HD1 PHE 153 HD1 PHE 153 3.225 14.283 -2.532 476 HD2 PHE 153 HD2 PHE 153 2.413 12.459 1.271 477 HE1 PHE 153 HE1 PHE 153 5.581 13.522 -2.394 478 HE2 PHE 153 HE2 PHE 153 4.769 11.698 1.409 479 HZ PHE 153 HZ PHE 153 6.354 12.229 -0.424 480 H LEU 154 HN LEU 154 -0.671 11.598 -0.656 481 HA LEU 154 HA LEU 154 0.926 9.299 -0.846 482 HB2 LEU 154 HB2 LEU 154 -1.789 10.053 -0.160 483 HB3 LEU 154 HB1 LEU 154 -1.769 8.473 -0.944 484 HG LEU 154 HG LEU 154 -1.481 8.290 1.517 485 HD11 LEU 154 HD11 LEU 154 0.419 6.788 1.449 486 HD12 LEU 154 HD12 LEU 154 1.058 7.592 0.016 487 HD13 LEU 154 HD13 LEU 154 -0.435 6.659 -0.088 488 HD21 LEU 154 HD21 LEU 154 -0.169 10.552 1.526 489 HD22 LEU 154 HD22 LEU 154 1.236 9.546 1.174 490 HD23 LEU 154 HD23 LEU 154 0.317 9.289 2.657 491 H GLU 155 HN GLU 155 -1.303 10.656 -3.225 492 HA GLU 155 HA GLU 155 -1.326 8.313 -4.955 493 HB2 GLU 155 HB2 GLU 155 -2.361 11.082 -4.868 494 HB3 GLU 155 HB1 GLU 155 -2.074 10.454 -6.491 495 HG2 GLU 155 HG2 GLU 155 -3.518 8.759 -4.471 496 HG3 GLU 155 HG1 GLU 155 -4.392 10.019 -5.344 497 H PHE 156 HN PHE 156 0.596 11.285 -4.739 498 HA PHE 156 HA PHE 156 1.876 11.273 -7.252 499 HB2 PHE 156 HB2 PHE 156 2.075 13.040 -5.557 500 HB3 PHE 156 HB1 PHE 156 2.941 11.938 -4.487 501 HD1 PHE 156 HD1 PHE 156 3.112 13.243 -8.006 502 HD2 PHE 156 HD2 PHE 156 5.271 11.969 -4.518 503 HE1 PHE 156 HE1 PHE 156 5.250 13.846 -9.109 504 HE2 PHE 156 HE2 PHE 156 7.408 12.572 -5.621 505 HZ PHE 156 HZ PHE 156 7.398 13.511 -7.916 506 H MET 157 HN MET 157 2.852 9.569 -4.254 507 HA MET 157 HA MET 157 5.148 8.276 -5.437 508 HB2 MET 157 HB2 MET 157 3.430 7.521 -3.049 509 HB3 MET 157 HB1 MET 157 5.086 6.987 -3.344 510 HG2 MET 157 HG2 MET 157 4.149 9.822 -2.824 511 HG3 MET 157 HG1 MET 157 5.178 8.834 -1.787 512 HE1 MET 157 HE1 MET 157 8.401 9.473 -2.432 513 HE2 MET 157 HE2 MET 157 6.981 9.440 -1.390 514 HE3 MET 157 HE3 MET 157 7.530 10.969 -2.069 515 H LYS 158 HN LYS 158 1.734 7.623 -5.490 516 HA LYS 158 HA LYS 158 1.659 4.817 -5.866 517 HB2 LYS 158 HB2 LYS 158 -0.071 6.985 -5.909 518 HB3 LYS 158 HB1 LYS 158 -0.152 6.385 -7.566 519 HG2 LYS 158 HG2 LYS 158 -1.342 4.579 -6.932 520 HG3 LYS 158 HG1 LYS 158 -0.182 4.192 -5.660 521 HD2 LYS 158 HD2 LYS 158 -1.916 6.540 -5.140 522 HD3 LYS 158 HD1 LYS 158 -2.732 4.977 -5.158 523 HE2 LYS 158 HE2 LYS 158 -0.155 5.137 -3.651 524 HE3 LYS 158 HE1 LYS 158 -1.580 5.907 -2.925 525 HZ1 LYS 158 HZ1 LYS 158 -1.194 3.089 -3.697 526 HZ2 LYS 158 HZ2 LYS 158 -2.758 3.750 -3.666 527 HZ3 LYS 158 HZ3 LYS 158 -1.816 3.723 -2.252 528 H GLY 159 HN GLY 159 1.421 7.211 -8.526 529 HA2 GLY 159 HA2 GLY 159 2.135 5.292 -10.546 530 HA3 GLY 159 HA1 GLY 159 2.107 7.043 -10.768 531 H VAL 160 HN VAL 160 3.994 7.774 -8.794 532 HA VAL 160 HA VAL 160 6.441 7.729 -10.105 533 HB VAL 160 HB VAL 160 5.593 7.851 -7.217 534 HG11 VAL 160 HG11 VAL 160 8.342 7.468 -8.277 535 HG12 VAL 160 HG12 VAL 160 7.689 7.099 -6.680 536 HG13 VAL 160 HG13 VAL 160 8.146 8.754 -7.086 537 HG21 VAL 160 HG21 VAL 160 5.734 9.673 -9.332 538 HG22 VAL 160 HG22 VAL 160 7.150 10.042 -8.348 539 HG23 VAL 160 HG23 VAL 160 5.542 10.073 -7.625 540 H GLU 161 HN GLU 161 7.655 6.003 -10.761 541 HA GLU 161 HA GLU 161 7.348 3.365 -9.487 542 HB2 GLU 161 HB2 GLU 161 7.557 3.914 -11.981 543 HB3 GLU 161 HB1 GLU 161 9.261 4.238 -11.665 544 HG2 GLU 161 HG2 GLU 161 9.650 2.033 -11.894 545 HG3 GLU 161 HG1 GLU 161 8.728 1.777 -10.412 546 HO1 KDH 1 H1 KDH 1 8.230 10.185 -10.612 547 H21 KDH 1 H21 KDH 1 13.605 8.075 -3.669 548 H33 KDH 1 H33 KDH 1 10.031 12.469 -5.506 549 H4 KDH 1 H4 KDH 1 8.774 11.137 -7.275 550 HO7 KDH 1 H7 KDH 1 10.299 9.067 -11.575 551 H01 KDH 1 H01 KDH 1 11.328 13.081 -3.384 552 H01A KDH 1 H02 KDH 1 10.170 11.695 -3.307 553 HO03 KDH 1 H03 KDH 1 11.619 13.052 -1.527 554 HO10 KDH 1 H10 KDH 1 13.599 9.991 -10.247 555 H12 KDH 1 H12 KDH 1 12.951 9.739 -7.360 556 H15 KDH 1 H15 KDH 1 10.051 10.147 -5.314 557 H26 KDH 1 H26 KDH 1 14.100 10.809 -0.273 558 H39 KDH 1 H39 KDH 1 14.256 14.318 -7.351 559 H41 KDH 1 H41 KDH 1 10.515 12.796 -9.095 560 HO02 KDH 1 H42 KDH 1 14.853 7.618 -1.856 561 HO44 KDH 1 H44 KDH 1 11.988 11.416 -11.752 562 HO47 KDH 1 H47 KDH 1 15.017 13.672 -11.859 563 HO50 KDH 1 H50 KDH 1 15.942 14.753 -8.961 Start of MODEL 22 1 H1 MET 90 HT1 MET 90 13.375 7.034 3.950 2 H2 MET 90 HT2 MET 90 12.031 6.817 4.966 3 H3 MET 90 HT3 MET 90 13.388 7.674 5.521 4 HA MET 90 HA MET 90 12.149 9.476 4.966 5 HB2 MET 90 HB2 MET 90 13.610 8.351 2.609 6 HB3 MET 90 HB1 MET 90 12.613 9.783 2.351 7 HG2 MET 90 HG2 MET 90 14.227 9.981 4.778 8 HG3 MET 90 HG1 MET 90 15.214 9.772 3.331 9 HE1 MET 90 HE1 MET 90 12.278 13.087 4.391 10 HE2 MET 90 HE2 MET 90 12.482 11.493 5.114 11 HE3 MET 90 HE3 MET 90 11.593 11.659 3.602 12 H GLY 91 HN GLY 91 11.556 8.018 1.819 13 HA2 GLY 91 HA2 GLY 91 8.626 8.152 2.399 14 HA3 GLY 91 HA1 GLY 91 9.330 8.386 0.799 15 H LYS 92 HN LYS 92 7.674 6.189 2.601 16 HA LYS 92 HA LYS 92 8.426 3.984 0.781 17 HB2 LYS 92 HB2 LYS 92 9.236 4.260 3.606 18 HB3 LYS 92 HB1 LYS 92 8.515 2.699 3.210 19 HG2 LYS 92 HG2 LYS 92 10.120 2.847 1.112 20 HG3 LYS 92 HG1 LYS 92 11.024 3.950 2.151 21 HD2 LYS 92 HD2 LYS 92 11.873 2.215 3.301 22 HD3 LYS 92 HD1 LYS 92 10.246 1.656 3.693 23 HE2 LYS 92 HE2 LYS 92 10.119 0.343 1.675 24 HE3 LYS 92 HE1 LYS 92 11.610 1.071 1.044 25 HZ1 LYS 92 HZ1 LYS 92 12.901 0.032 2.639 26 HZ2 LYS 92 HZ2 LYS 92 11.767 -1.177 2.270 27 HZ3 LYS 92 HZ3 LYS 92 11.592 -0.248 3.681 28 H SER 93 HN SER 93 6.964 3.482 3.929 29 HA SER 93 HA SER 93 4.423 2.710 2.597 30 HB2 SER 93 HB2 SER 93 4.075 1.973 5.122 31 HB3 SER 93 HB1 SER 93 5.133 1.046 4.063 32 HG SER 93 HG SER 93 6.714 1.569 5.329 33 H GLU 94 HN GLU 94 2.455 3.217 4.253 34 HA GLU 94 HA GLU 94 2.045 6.056 4.183 35 HB2 GLU 94 HB2 GLU 94 0.623 3.640 4.739 36 HB3 GLU 94 HB1 GLU 94 0.322 4.765 6.065 37 HG2 GLU 94 HG2 GLU 94 -0.853 6.199 4.749 38 HG3 GLU 94 HG1 GLU 94 0.248 5.995 3.384 39 H GLU 95 HN GLU 95 3.765 4.091 6.390 40 HA GLU 95 HA GLU 95 3.293 5.342 8.894 41 HB2 GLU 95 HB2 GLU 95 5.153 3.546 7.632 42 HB3 GLU 95 HB1 GLU 95 6.057 4.703 8.611 43 HG2 GLU 95 HG2 GLU 95 5.489 3.516 10.436 44 HG3 GLU 95 HG1 GLU 95 3.810 3.979 10.157 45 H GLU 96 HN GLU 96 6.160 5.963 6.842 46 HA GLU 96 HA GLU 96 6.618 8.569 8.065 47 HB2 GLU 96 HB2 GLU 96 7.787 7.425 5.516 48 HB3 GLU 96 HB1 GLU 96 8.543 8.564 6.632 49 HG2 GLU 96 HG2 GLU 96 9.449 6.818 7.725 50 HG3 GLU 96 HG1 GLU 96 7.823 6.310 8.179 51 H LEU 97 HN LEU 97 5.183 7.370 5.062 52 HA LEU 97 HA LEU 97 5.012 9.552 3.398 53 HB2 LEU 97 HB2 LEU 97 3.513 7.166 4.007 54 HB3 LEU 97 HB1 LEU 97 2.397 8.462 3.579 55 HG LEU 97 HG LEU 97 3.173 7.145 1.598 56 HD11 LEU 97 HD11 LEU 97 3.998 10.055 1.772 57 HD12 LEU 97 HD12 LEU 97 2.436 9.423 1.251 58 HD13 LEU 97 HD13 LEU 97 3.870 9.157 0.259 59 HD21 LEU 97 HD21 LEU 97 5.662 8.021 0.995 60 HD22 LEU 97 HD22 LEU 97 5.364 6.502 1.841 61 HD23 LEU 97 HD23 LEU 97 5.796 7.947 2.752 62 H SER 98 HN SER 98 2.694 8.937 6.071 63 HA SER 98 HA SER 98 1.234 11.356 5.873 64 HB2 SER 98 HB2 SER 98 0.342 9.713 7.276 65 HB3 SER 98 HB1 SER 98 1.901 9.364 8.019 66 HG SER 98 HG SER 98 1.761 11.335 9.110 67 H ASP 99 HN ASP 99 4.325 10.655 7.442 68 HA ASP 99 HA ASP 99 4.481 13.396 8.567 69 HB2 ASP 99 HB2 ASP 99 5.707 10.748 8.959 70 HB3 ASP 99 HB1 ASP 99 6.854 12.082 9.084 71 H LEU 100 HN LEU 100 5.241 11.837 5.667 72 HA LEU 100 HA LEU 100 7.781 13.067 5.036 73 HB2 LEU 100 HB2 LEU 100 5.793 11.323 3.875 74 HB3 LEU 100 HB1 LEU 100 6.281 12.533 2.688 75 HG LEU 100 HG LEU 100 8.069 10.615 4.202 76 HD11 LEU 100 HD11 LEU 100 7.362 11.055 1.293 77 HD12 LEU 100 HD12 LEU 100 7.133 9.594 2.253 78 HD13 LEU 100 HD13 LEU 100 8.758 10.102 1.794 79 HD21 LEU 100 HD21 LEU 100 9.773 11.880 2.557 80 HD22 LEU 100 HD22 LEU 100 9.470 12.449 4.199 81 HD23 LEU 100 HD23 LEU 100 8.645 13.206 2.836 82 H PHE 101 HN PHE 101 4.463 13.801 3.871 83 HA PHE 101 HA PHE 101 4.885 16.097 2.395 84 HB2 PHE 101 HB2 PHE 101 2.735 14.831 3.108 85 HB3 PHE 101 HB1 PHE 101 2.719 15.922 4.494 86 HD1 PHE 101 HD2 PHE 101 2.533 18.385 4.151 87 HD2 PHE 101 HD1 PHE 101 2.194 15.604 0.895 88 HE1 PHE 101 HE2 PHE 101 1.519 20.157 2.743 89 HE2 PHE 101 HE1 PHE 101 1.181 17.376 -0.513 90 HZ PHE 101 HZ PHE 101 0.844 19.652 0.411 91 H ARG 102 HN ARG 102 5.138 15.748 5.888 92 HA ARG 102 HA ARG 102 5.039 18.426 6.758 93 HB2 ARG 102 HB2 ARG 102 5.555 15.970 7.823 94 HB3 ARG 102 HB1 ARG 102 7.168 16.683 7.869 95 HG2 ARG 102 HG2 ARG 102 6.181 18.692 9.007 96 HG3 ARG 102 HG1 ARG 102 4.641 17.834 9.085 97 HD2 ARG 102 HD2 ARG 102 5.520 17.224 11.151 98 HD3 ARG 102 HD1 ARG 102 6.215 15.930 10.154 99 HE ARG 102 HE ARG 102 7.821 18.381 10.209 100 HH11 ARG 102 HH21 ARG 102 7.113 15.325 11.660 101 HH12 ARG 102 HH22 ARG 102 8.680 15.159 12.376 102 HH21 ARG 102 HH11 ARG 102 9.863 18.174 11.144 103 HH22 ARG 102 HH12 ARG 102 10.234 16.770 12.087 104 H MET 103 HN MET 103 7.784 16.607 5.384 105 HA MET 103 HA MET 103 9.484 19.039 5.432 106 HB2 MET 103 HB2 MET 103 9.788 16.159 5.454 107 HB3 MET 103 HB1 MET 103 10.763 16.862 4.163 108 HG2 MET 103 HG2 MET 103 11.756 18.446 5.782 109 HG3 MET 103 HG1 MET 103 10.798 17.720 7.071 110 HE1 MET 103 HE1 MET 103 14.474 17.655 6.000 111 HE2 MET 103 HE2 MET 103 13.401 17.666 4.602 112 HE3 MET 103 HE3 MET 103 14.452 16.281 4.885 113 H PHE 104 HN PHE 104 7.560 17.139 3.225 114 HA PHE 104 HA PHE 104 8.815 17.884 0.752 115 HB2 PHE 104 HB2 PHE 104 6.727 16.287 1.648 116 HB3 PHE 104 HB1 PHE 104 5.903 17.534 0.711 117 HD1 PHE 104 HD2 PHE 104 7.135 18.154 -1.587 118 HD2 PHE 104 HD1 PHE 104 7.522 14.422 0.503 119 HE1 PHE 104 HE2 PHE 104 7.856 17.053 -3.689 120 HE2 PHE 104 HE1 PHE 104 8.243 13.320 -1.599 121 HZ PHE 104 HZ PHE 104 8.410 14.636 -3.695 122 H ASP 105 HN ASP 105 6.574 19.546 2.888 123 HA ASP 105 HA ASP 105 5.906 21.603 0.879 124 HB2 ASP 105 HB2 ASP 105 4.503 20.543 2.852 125 HB3 ASP 105 HB1 ASP 105 5.320 21.769 3.821 126 H LYS 106 HN LYS 106 8.309 22.175 0.649 127 HA LYS 106 HA LYS 106 10.031 23.194 2.552 128 HB2 LYS 106 HB2 LYS 106 10.309 23.039 0.044 129 HB3 LYS 106 HB1 LYS 106 9.367 24.524 -0.093 130 HG2 LYS 106 HG2 LYS 106 11.089 25.487 1.616 131 HG3 LYS 106 HG1 LYS 106 12.095 24.128 1.114 132 HD2 LYS 106 HD2 LYS 106 12.322 24.916 -1.058 133 HD3 LYS 106 HD1 LYS 106 10.806 25.817 -0.998 134 HE2 LYS 106 HE2 LYS 106 13.040 26.639 0.837 135 HE3 LYS 106 HE1 LYS 106 13.093 27.130 -0.868 136 HZ1 LYS 106 HZ1 LYS 106 11.754 28.532 0.879 137 HZ2 LYS 106 HZ2 LYS 106 10.554 27.367 0.578 138 HZ3 LYS 106 HZ3 LYS 106 11.163 28.313 -0.695 139 H ASN 107 HN ASN 107 7.166 24.816 1.208 140 HA ASN 107 HA ASN 107 7.650 27.255 2.799 141 HB2 ASN 107 HB2 ASN 107 6.750 27.381 0.529 142 HB3 ASN 107 HB1 ASN 107 5.413 26.319 0.973 143 HD21 ASN 107 HD21 ASN 107 3.548 27.561 1.175 144 HD22 ASN 107 HD22 ASN 107 3.466 29.083 1.921 145 H ALA 108 HN ALA 108 5.867 24.269 3.057 146 HA ALA 108 HA ALA 108 4.434 23.455 4.752 147 HB1 ALA 108 HB1 ALA 108 5.560 23.765 6.689 148 HB2 ALA 108 HB2 ALA 108 5.116 25.472 6.725 149 HB3 ALA 108 HB3 ALA 108 6.555 24.953 5.847 150 H ASP 109 HN ASP 109 2.574 24.338 3.459 151 HA ASP 109 HA ASP 109 1.170 26.483 4.996 152 HB2 ASP 109 HB2 ASP 109 0.553 27.540 2.864 153 HB3 ASP 109 HB1 ASP 109 2.308 27.421 2.988 154 H GLY 110 HN GLY 110 1.096 23.363 4.067 155 HA2 GLY 110 HA2 GLY 110 -0.895 22.012 4.510 156 HA3 GLY 110 HA1 GLY 110 -1.882 23.358 3.938 157 H TYR 111 HN TYR 111 0.383 23.523 1.731 158 HA TYR 111 HA TYR 111 -0.396 21.173 0.089 159 HB2 TYR 111 HB2 TYR 111 -0.915 24.057 -0.704 160 HB3 TYR 111 HB1 TYR 111 -1.291 22.631 -1.671 161 HD1 TYR 111 HD1 TYR 111 -3.116 21.118 -1.043 162 HD2 TYR 111 HD2 TYR 111 -2.237 24.634 1.264 163 HE1 TYR 111 HE1 TYR 111 -5.305 20.913 0.104 164 HE2 TYR 111 HE2 TYR 111 -4.426 24.428 2.412 165 HH TYR 111 HH TYR 111 -6.442 21.610 2.030 166 H ILE 112 HN ILE 112 0.735 21.451 -2.171 167 HA ILE 112 HA ILE 112 3.384 22.812 -1.821 168 HB ILE 112 HB ILE 112 2.645 19.987 -2.561 169 HG12 ILE 112 HG12 ILE 112 4.953 21.068 -0.925 170 HG13 ILE 112 HG11 ILE 112 3.364 20.743 -0.231 171 HG21 ILE 112 HG21 ILE 112 5.247 19.949 -3.165 172 HG22 ILE 112 HG22 ILE 112 4.911 21.616 -3.631 173 HG23 ILE 112 HG23 ILE 112 4.024 20.293 -4.388 174 HD11 ILE 112 HD11 ILE 112 3.753 18.522 -0.172 175 HD12 ILE 112 HD12 ILE 112 5.434 18.892 -0.557 176 HD13 ILE 112 HD13 ILE 112 4.297 18.510 -1.850 177 H ASP 113 HN ASP 113 3.406 24.382 -3.393 178 HA ASP 113 HA ASP 113 1.805 24.215 -5.817 179 HB2 ASP 113 HB2 ASP 113 4.013 26.056 -4.846 180 HB3 ASP 113 HB1 ASP 113 3.062 26.349 -6.301 181 H LEU 114 HN LEU 114 2.845 24.412 -8.016 182 HA LEU 114 HA LEU 114 4.581 22.252 -8.613 183 HB2 LEU 114 HB2 LEU 114 3.658 24.766 -9.974 184 HB3 LEU 114 HB1 LEU 114 4.888 23.771 -10.757 185 HG LEU 114 HG LEU 114 2.508 22.352 -9.668 186 HD11 LEU 114 HD11 LEU 114 1.028 22.999 -11.374 187 HD12 LEU 114 HD12 LEU 114 2.318 23.687 -12.361 188 HD13 LEU 114 HD13 LEU 114 1.774 24.528 -10.909 189 HD21 LEU 114 HD21 LEU 114 4.558 21.394 -10.936 190 HD22 LEU 114 HD22 LEU 114 3.818 22.095 -12.375 191 HD23 LEU 114 HD23 LEU 114 2.957 20.864 -11.452 192 H ASP 115 HN ASP 115 5.299 25.656 -7.908 193 HA ASP 115 HA ASP 115 8.090 25.558 -8.640 194 HB2 ASP 115 HB2 ASP 115 6.228 27.452 -7.965 195 HB3 ASP 115 HB1 ASP 115 7.210 27.400 -6.500 196 H GLU 116 HN GLU 116 6.362 25.123 -5.543 197 HA GLU 116 HA GLU 116 8.774 24.753 -3.971 198 HB2 GLU 116 HB2 GLU 116 5.907 23.894 -3.454 199 HB3 GLU 116 HB1 GLU 116 7.160 24.141 -2.237 200 HG2 GLU 116 HG2 GLU 116 7.205 26.486 -2.598 201 HG3 GLU 116 HG1 GLU 116 6.325 26.349 -4.121 202 H LEU 117 HN LEU 117 7.257 22.797 -6.269 203 HA LEU 117 HA LEU 117 7.696 20.199 -4.998 204 HB2 LEU 117 HB2 LEU 117 6.860 21.285 -7.672 205 HB3 LEU 117 HB1 LEU 117 7.290 19.580 -7.536 206 HG LEU 117 HG LEU 117 5.293 20.928 -5.704 207 HD11 LEU 117 HD11 LEU 117 3.707 20.749 -7.293 208 HD12 LEU 117 HD12 LEU 117 4.142 19.067 -7.596 209 HD13 LEU 117 HD13 LEU 117 4.978 20.362 -8.452 210 HD21 LEU 117 HD21 LEU 117 4.630 18.347 -5.682 211 HD22 LEU 117 HD22 LEU 117 5.911 18.963 -4.639 212 HD23 LEU 117 HD23 LEU 117 6.319 18.150 -6.149 213 H LYS 118 HN LYS 118 9.356 22.138 -7.496 214 HA LYS 118 HA LYS 118 11.511 20.122 -7.712 215 HB2 LYS 118 HB2 LYS 118 12.234 21.595 -9.549 216 HB3 LYS 118 HB1 LYS 118 10.508 21.254 -9.680 217 HG2 LYS 118 HG2 LYS 118 10.061 23.453 -9.588 218 HG3 LYS 118 HG1 LYS 118 10.827 23.543 -8.002 219 HD2 LYS 118 HD2 LYS 118 12.887 24.184 -8.881 220 HD3 LYS 118 HD1 LYS 118 12.549 23.471 -10.459 221 HE2 LYS 118 HE2 LYS 118 10.547 25.421 -10.100 222 HE3 LYS 118 HE1 LYS 118 12.057 26.184 -9.562 223 HZ1 LYS 118 HZ1 LYS 118 12.284 26.454 -11.800 224 HZ2 LYS 118 HZ2 LYS 118 11.367 25.075 -12.184 225 HZ3 LYS 118 HZ3 LYS 118 12.974 24.912 -11.657 226 H ILE 119 HN ILE 119 10.904 23.182 -6.128 227 HA ILE 119 HA ILE 119 13.713 23.884 -5.771 228 HB ILE 119 HB ILE 119 11.060 24.802 -4.650 229 HG12 ILE 119 HG12 ILE 119 13.156 26.056 -6.454 230 HG13 ILE 119 HG11 ILE 119 11.574 25.456 -6.952 231 HG21 ILE 119 HG21 ILE 119 13.806 25.935 -4.026 232 HG22 ILE 119 HG22 ILE 119 12.796 25.041 -2.890 233 HG23 ILE 119 HG23 ILE 119 12.263 26.608 -3.499 234 HD11 ILE 119 HD11 ILE 119 10.458 27.258 -6.067 235 HD12 ILE 119 HD12 ILE 119 12.008 28.046 -6.362 236 HD13 ILE 119 HD13 ILE 119 11.611 27.457 -4.748 237 H MET 120 HN MET 120 11.326 22.023 -3.959 238 HA MET 120 HA MET 120 12.639 22.021 -1.411 239 HB2 MET 120 HB2 MET 120 10.305 21.322 -1.861 240 HB3 MET 120 HB1 MET 120 10.903 19.932 -2.769 241 HG2 MET 120 HG2 MET 120 11.946 20.299 0.000 242 HG3 MET 120 HG1 MET 120 10.276 19.757 -0.168 243 HE1 MET 120 HE1 MET 120 10.104 16.817 -2.057 244 HE2 MET 120 HE2 MET 120 9.424 18.102 -1.062 245 HE3 MET 120 HE3 MET 120 10.082 16.660 -0.295 246 H LEU 121 HN LEU 121 12.966 19.901 -4.260 247 HA LEU 121 HA LEU 121 14.999 18.245 -2.898 248 HB2 LEU 121 HB2 LEU 121 13.085 17.917 -4.910 249 HB3 LEU 121 HB1 LEU 121 14.626 17.864 -5.766 250 HG LEU 121 HG LEU 121 15.152 16.337 -3.535 251 HD11 LEU 121 HD11 LEU 121 12.734 14.950 -4.306 252 HD12 LEU 121 HD12 LEU 121 12.342 16.549 -3.673 253 HD13 LEU 121 HD13 LEU 121 13.276 15.417 -2.694 254 HD21 LEU 121 HD21 LEU 121 14.924 16.027 -6.352 255 HD22 LEU 121 HD22 LEU 121 14.096 14.654 -5.616 256 HD23 LEU 121 HD23 LEU 121 15.783 14.981 -5.221 257 H GLN 122 HN GLN 122 14.928 21.114 -4.770 258 HA GLN 122 HA GLN 122 17.138 21.081 -6.441 259 HB2 GLN 122 HB2 GLN 122 15.652 22.999 -4.831 260 HB3 GLN 122 HB1 GLN 122 17.341 23.476 -5.003 261 HG2 GLN 122 HG2 GLN 122 16.469 22.523 -7.541 262 HG3 GLN 122 HG1 GLN 122 15.242 23.645 -6.949 263 HE21 GLN 122 HE21 GLN 122 15.744 25.869 -7.001 264 HE22 GLN 122 HE22 GLN 122 17.266 26.489 -7.427 265 H ALA 123 HN ALA 123 17.129 20.852 -2.945 266 HA ALA 123 HA ALA 123 19.834 21.580 -2.397 267 HB1 ALA 123 HB1 ALA 123 18.647 21.326 -0.456 268 HB2 ALA 123 HB2 ALA 123 19.212 19.659 -0.550 269 HB3 ALA 123 HB3 ALA 123 17.607 20.080 -1.147 270 H THR 124 HN THR 124 18.417 18.647 -3.725 271 HA THR 124 HA THR 124 20.884 17.072 -3.375 272 HB THR 124 HB THR 124 19.500 15.369 -4.578 273 HG1 THR 124 HG1 THR 124 17.249 16.113 -4.874 274 HG21 THR 124 HG21 THR 124 19.297 15.560 -2.152 275 HG22 THR 124 HG22 THR 124 17.712 15.226 -2.851 276 HG23 THR 124 HG23 THR 124 18.119 16.861 -2.330 277 H GLY 125 HN GLY 125 19.711 19.353 -5.618 278 HA2 GLY 125 HA2 GLY 125 21.324 20.074 -7.370 279 HA3 GLY 125 HA1 GLY 125 21.675 18.368 -7.648 280 H GLU 126 HN GLU 126 18.395 18.715 -7.059 281 HA GLU 126 HA GLU 126 17.411 17.781 -9.465 282 HB2 GLU 126 HB2 GLU 126 15.992 18.083 -7.558 283 HB3 GLU 126 HB1 GLU 126 16.329 19.810 -7.495 284 HG2 GLU 126 HG2 GLU 126 14.352 19.997 -8.607 285 HG3 GLU 126 HG1 GLU 126 15.314 19.575 -10.023 286 H THR 127 HN THR 127 18.570 18.644 -11.283 287 HA THR 127 HA THR 127 18.135 21.558 -11.835 288 HB THR 127 HB THR 127 20.457 21.016 -11.768 289 HG1 THR 127 HG1 THR 127 20.106 20.601 -14.491 290 HG21 THR 127 HG21 THR 127 21.087 19.031 -13.499 291 HG22 THR 127 HG22 THR 127 19.503 18.474 -12.962 292 HG23 THR 127 HG23 THR 127 20.784 18.755 -11.783 293 H ILE 128 HN ILE 128 16.055 21.379 -12.820 294 HA ILE 128 HA ILE 128 16.089 20.062 -15.503 295 HB ILE 128 HB ILE 128 14.011 18.995 -15.077 296 HG12 ILE 128 HG12 ILE 128 12.975 21.007 -13.976 297 HG13 ILE 128 HG11 ILE 128 12.581 19.484 -13.182 298 HG21 ILE 128 HG21 ILE 128 16.055 18.087 -13.836 299 HG22 ILE 128 HG22 ILE 128 14.481 17.570 -13.233 300 HG23 ILE 128 HG23 ILE 128 15.377 18.831 -12.388 301 HD11 ILE 128 HD11 ILE 128 14.813 20.113 -11.808 302 HD12 ILE 128 HD12 ILE 128 13.211 20.660 -11.316 303 HD13 ILE 128 HD13 ILE 128 14.270 21.738 -12.225 304 H THR 129 HN THR 129 14.393 20.990 -16.956 305 HA THR 129 HA THR 129 14.337 23.848 -16.907 306 HB THR 129 HB THR 129 12.244 22.289 -18.356 307 HG1 THR 129 HG1 THR 129 13.635 20.883 -19.009 308 HG21 THR 129 HG21 THR 129 12.328 24.305 -19.384 309 HG22 THR 129 HG22 THR 129 13.790 23.690 -20.155 310 HG23 THR 129 HG23 THR 129 13.910 24.682 -18.702 311 H GLU 130 HN GLU 130 11.774 24.676 -17.380 312 HA GLU 130 HA GLU 130 10.559 24.532 -14.693 313 HB2 GLU 130 HB2 GLU 130 10.746 26.695 -15.670 314 HB3 GLU 130 HB1 GLU 130 10.132 26.130 -17.223 315 HG2 GLU 130 HG2 GLU 130 7.934 25.649 -16.118 316 HG3 GLU 130 HG1 GLU 130 8.563 26.382 -14.642 317 H ASP 131 HN ASP 131 9.563 23.879 -18.075 318 HA ASP 131 HA ASP 131 6.937 22.934 -17.491 319 HB2 ASP 131 HB2 ASP 131 8.304 23.504 -19.705 320 HB3 ASP 131 HB1 ASP 131 8.591 21.764 -19.698 321 H ASP 132 HN ASP 132 10.037 21.493 -16.949 322 HA ASP 132 HA ASP 132 9.249 18.710 -17.028 323 HB2 ASP 132 HB2 ASP 132 11.573 20.108 -16.914 324 HB3 ASP 132 HB1 ASP 132 11.424 19.631 -15.223 325 H ILE 133 HN ILE 133 8.755 21.262 -14.738 326 HA ILE 133 HA ILE 133 8.516 19.597 -12.361 327 HB ILE 133 HB ILE 133 7.336 22.332 -12.929 328 HG12 ILE 133 HG12 ILE 133 9.625 22.488 -13.618 329 HG13 ILE 133 HG11 ILE 133 9.569 23.138 -11.980 330 HG21 ILE 133 HG21 ILE 133 7.479 22.658 -10.574 331 HG22 ILE 133 HG22 ILE 133 8.510 21.243 -10.364 332 HG23 ILE 133 HG23 ILE 133 6.807 21.040 -10.776 333 HD11 ILE 133 HD11 ILE 133 10.022 20.556 -11.383 334 HD12 ILE 133 HD12 ILE 133 11.333 21.693 -11.697 335 HD13 ILE 133 HD13 ILE 133 10.783 20.607 -12.974 336 H GLU 134 HN GLU 134 6.184 21.088 -14.627 337 HA GLU 134 HA GLU 134 3.794 20.203 -13.349 338 HB2 GLU 134 HB2 GLU 134 4.645 20.988 -16.125 339 HB3 GLU 134 HB1 GLU 134 3.008 20.387 -15.859 340 HG2 GLU 134 HG2 GLU 134 2.838 22.110 -13.973 341 HG3 GLU 134 HG1 GLU 134 4.318 22.816 -14.624 342 H GLU 135 HN GLU 135 6.176 18.464 -15.177 343 HA GLU 135 HA GLU 135 4.509 16.304 -16.125 344 HB2 GLU 135 HB2 GLU 135 7.228 17.171 -16.187 345 HB3 GLU 135 HB1 GLU 135 7.215 15.499 -15.625 346 HG2 GLU 135 HG2 GLU 135 5.347 15.535 -17.700 347 HG3 GLU 135 HG1 GLU 135 6.665 16.550 -18.286 348 H LEU 136 HN LEU 136 6.287 16.897 -13.117 349 HA LEU 136 HA LEU 136 5.834 14.185 -12.096 350 HB2 LEU 136 HB2 LEU 136 7.005 16.778 -11.105 351 HB3 LEU 136 HB1 LEU 136 6.725 15.447 -9.981 352 HG LEU 136 HG LEU 136 8.020 14.617 -12.484 353 HD11 LEU 136 HD11 LEU 136 10.184 15.645 -11.040 354 HD12 LEU 136 HD12 LEU 136 9.006 16.958 -11.063 355 HD13 LEU 136 HD13 LEU 136 9.571 16.252 -12.578 356 HD21 LEU 136 HD21 LEU 136 7.652 13.424 -10.167 357 HD22 LEU 136 HD22 LEU 136 9.108 14.302 -9.700 358 HD23 LEU 136 HD23 LEU 136 9.158 13.165 -11.047 359 H MET 137 HN MET 137 4.454 17.429 -11.546 360 HA MET 137 HA MET 137 2.761 16.885 -9.362 361 HB2 MET 137 HB2 MET 137 3.065 19.110 -10.215 362 HB3 MET 137 HB1 MET 137 2.483 18.643 -11.814 363 HG2 MET 137 HG2 MET 137 0.246 18.374 -11.031 364 HG3 MET 137 HG1 MET 137 0.754 18.436 -9.343 365 HE1 MET 137 HE1 MET 137 0.762 19.890 -8.053 366 HE2 MET 137 HE2 MET 137 -0.494 21.095 -8.326 367 HE3 MET 137 HE3 MET 137 1.188 21.600 -8.200 368 H LYS 138 HN LYS 138 2.422 15.957 -12.744 369 HA LYS 138 HA LYS 138 -0.293 15.392 -13.009 370 HB2 LYS 138 HB2 LYS 138 2.171 13.846 -13.865 371 HB3 LYS 138 HB1 LYS 138 0.553 13.503 -14.480 372 HG2 LYS 138 HG2 LYS 138 1.146 16.346 -14.615 373 HG3 LYS 138 HG1 LYS 138 2.348 15.400 -15.494 374 HD2 LYS 138 HD2 LYS 138 0.790 14.551 -16.990 375 HD3 LYS 138 HD1 LYS 138 -0.548 14.724 -15.853 376 HE2 LYS 138 HE2 LYS 138 -0.767 17.037 -16.269 377 HE3 LYS 138 HE1 LYS 138 0.868 17.159 -16.947 378 HZ1 LYS 138 HZ1 LYS 138 -1.161 15.382 -18.152 379 HZ2 LYS 138 HZ2 LYS 138 0.255 16.004 -18.854 380 HZ3 LYS 138 HZ3 LYS 138 -1.079 17.020 -18.582 381 H ASP 139 HN ASP 139 2.054 13.766 -10.974 382 HA ASP 139 HA ASP 139 0.113 11.585 -10.356 383 HB2 ASP 139 HB2 ASP 139 3.065 12.074 -10.001 384 HB3 ASP 139 HB1 ASP 139 2.258 10.820 -9.059 385 H GLY 140 HN GLY 140 0.991 14.633 -9.219 386 HA2 GLY 140 HA2 GLY 140 0.208 13.909 -6.422 387 HA3 GLY 140 HA1 GLY 140 1.269 15.263 -6.815 388 H ASP 141 HN ASP 141 -0.715 15.582 -9.253 389 HA ASP 141 HA ASP 141 -3.059 16.710 -7.828 390 HB2 ASP 141 HB2 ASP 141 -0.794 18.223 -8.247 391 HB3 ASP 141 HB1 ASP 141 -1.765 18.614 -9.668 392 H LYS 142 HN LYS 142 -3.367 14.623 -9.484 393 HA LYS 142 HA LYS 142 -3.490 14.944 -12.267 394 HB2 LYS 142 HB2 LYS 142 -4.856 13.376 -10.158 395 HB3 LYS 142 HB1 LYS 142 -5.726 13.477 -11.690 396 HG2 LYS 142 HG2 LYS 142 -2.898 13.000 -12.139 397 HG3 LYS 142 HG1 LYS 142 -3.587 11.760 -11.090 398 HD2 LYS 142 HD2 LYS 142 -4.738 10.840 -12.797 399 HD3 LYS 142 HD1 LYS 142 -5.379 12.407 -13.291 400 HE2 LYS 142 HE2 LYS 142 -4.052 12.142 -15.133 401 HE3 LYS 142 HE1 LYS 142 -2.715 12.577 -14.049 402 HZ1 LYS 142 HZ1 LYS 142 -2.655 10.310 -15.281 403 HZ2 LYS 142 HZ2 LYS 142 -3.743 9.819 -14.072 404 HZ3 LYS 142 HZ3 LYS 142 -2.197 10.384 -13.649 405 H ASN 143 HN ASN 143 -5.534 16.347 -9.785 406 HA ASN 143 HA ASN 143 -7.725 17.129 -11.518 407 HB2 ASN 143 HB2 ASN 143 -6.836 18.449 -8.944 408 HB3 ASN 143 HB1 ASN 143 -8.478 18.273 -9.562 409 HD21 ASN 143 HD21 ASN 143 -7.199 17.264 -6.965 410 HD22 ASN 143 HD22 ASN 143 -7.537 15.601 -6.950 411 H ASN 144 HN ASN 144 -4.534 18.309 -11.023 412 HA ASN 144 HA ASN 144 -3.424 20.249 -11.789 413 HB2 ASN 144 HB2 ASN 144 -5.071 19.152 -13.753 414 HB3 ASN 144 HB1 ASN 144 -5.455 20.874 -13.795 415 HD21 ASN 144 HD21 ASN 144 -3.385 18.661 -15.159 416 HD22 ASN 144 HD22 ASN 144 -2.075 19.680 -15.512 417 H ASP 145 HN ASP 145 -5.306 20.658 -9.615 418 HA ASP 145 HA ASP 145 -6.814 23.114 -10.244 419 HB2 ASP 145 HB2 ASP 145 -7.508 22.880 -7.892 420 HB3 ASP 145 HB1 ASP 145 -7.637 21.326 -8.717 421 H GLY 146 HN GLY 146 -3.619 22.349 -9.405 422 HA2 GLY 146 HA2 GLY 146 -1.888 24.016 -9.218 423 HA3 GLY 146 HA1 GLY 146 -3.106 25.185 -8.707 424 H ARG 147 HN ARG 147 -3.589 22.251 -7.124 425 HA ARG 147 HA ARG 147 -1.813 23.008 -4.843 426 HB2 ARG 147 HB2 ARG 147 -4.807 22.507 -4.755 427 HB3 ARG 147 HB1 ARG 147 -3.785 22.794 -3.346 428 HG2 ARG 147 HG2 ARG 147 -4.010 24.745 -5.651 429 HG3 ARG 147 HG1 ARG 147 -5.011 24.841 -4.202 430 HD2 ARG 147 HD2 ARG 147 -2.306 24.525 -3.339 431 HD3 ARG 147 HD1 ARG 147 -2.342 25.821 -4.551 432 HE ARG 147 HE ARG 147 -4.596 26.154 -2.849 433 HH11 ARG 147 HH21 ARG 147 -1.144 26.274 -2.785 434 HH12 ARG 147 HH22 ARG 147 -1.080 27.473 -1.537 435 HH21 ARG 147 HH11 ARG 147 -4.523 27.717 -1.222 436 HH22 ARG 147 HH12 ARG 147 -2.990 28.290 -0.655 437 H ILE 148 HN ILE 148 -0.927 21.211 -3.869 438 HA ILE 148 HA ILE 148 -1.899 18.530 -4.767 439 HB ILE 148 HB ILE 148 0.687 19.388 -3.425 440 HG12 ILE 148 HG12 ILE 148 0.005 18.949 -6.351 441 HG13 ILE 148 HG11 ILE 148 0.460 20.479 -5.601 442 HG21 ILE 148 HG21 ILE 148 -0.391 16.820 -4.525 443 HG22 ILE 148 HG22 ILE 148 0.610 17.093 -3.100 444 HG23 ILE 148 HG23 ILE 148 1.332 17.149 -4.708 445 HD11 ILE 148 HD11 ILE 148 2.176 18.427 -6.645 446 HD12 ILE 148 HD12 ILE 148 2.468 18.589 -4.913 447 HD13 ILE 148 HD13 ILE 148 2.624 19.993 -5.968 448 H ASP 149 HN ASP 149 -3.520 17.999 -3.261 449 HA ASP 149 HA ASP 149 -3.151 18.544 -0.393 450 HB2 ASP 149 HB2 ASP 149 -5.301 18.599 -1.841 451 HB3 ASP 149 HB1 ASP 149 -5.276 16.841 -1.697 452 H TYR 150 HN TYR 150 -3.367 16.733 1.198 453 HA TYR 150 HA TYR 150 -1.410 14.729 0.949 454 HB2 TYR 150 HB2 TYR 150 -2.381 15.432 3.062 455 HB3 TYR 150 HB1 TYR 150 -3.976 14.869 2.562 456 HD1 TYR 150 HD1 TYR 150 -0.520 13.395 2.470 457 HD2 TYR 150 HD2 TYR 150 -4.611 12.942 3.698 458 HE1 TYR 150 HE1 TYR 150 -0.002 11.139 3.362 459 HE2 TYR 150 HE2 TYR 150 -4.093 10.686 4.590 460 HH TYR 150 HH TYR 150 -2.115 9.444 5.405 461 H ASP 151 HN ASP 151 -4.952 14.388 0.472 462 HA ASP 151 HA ASP 151 -5.159 11.688 -0.147 463 HB2 ASP 151 HB2 ASP 151 -6.947 13.485 -0.073 464 HB3 ASP 151 HB1 ASP 151 -6.451 13.950 -1.701 465 H GLU 152 HN GLU 152 -3.941 14.294 -2.230 466 HA GLU 152 HA GLU 152 -3.537 12.466 -4.507 467 HB2 GLU 152 HB2 GLU 152 -2.766 15.359 -3.995 468 HB3 GLU 152 HB1 GLU 152 -2.692 14.546 -5.559 469 HG2 GLU 152 HG2 GLU 152 -5.045 14.334 -5.692 470 HG3 GLU 152 HG1 GLU 152 -5.255 14.657 -3.971 471 H PHE 153 HN PHE 153 -1.609 14.056 -1.990 472 HA PHE 153 HA PHE 153 1.003 13.691 -2.899 473 HB2 PHE 153 HB2 PHE 153 0.222 14.725 -0.748 474 HB3 PHE 153 HB1 PHE 153 -0.067 13.103 -0.118 475 HD1 PHE 153 HD1 PHE 153 2.676 14.833 -2.022 476 HD2 PHE 153 HD2 PHE 153 1.607 12.302 1.280 477 HE1 PHE 153 HE1 PHE 153 5.067 14.649 -1.391 478 HE2 PHE 153 HE2 PHE 153 3.999 12.118 1.911 479 HZ PHE 153 HZ PHE 153 5.729 13.291 0.576 480 H LEU 154 HN LEU 154 -1.014 11.276 -1.179 481 HA LEU 154 HA LEU 154 0.841 9.134 -1.182 482 HB2 LEU 154 HB2 LEU 154 -2.178 9.060 -1.521 483 HB3 LEU 154 HB1 LEU 154 -1.172 7.766 -0.870 484 HG LEU 154 HG LEU 154 -1.747 10.471 0.351 485 HD11 LEU 154 HD11 LEU 154 -3.106 9.288 1.704 486 HD12 LEU 154 HD12 LEU 154 -1.812 8.152 2.084 487 HD13 LEU 154 HD13 LEU 154 -2.829 7.888 0.668 488 HD21 LEU 154 HD21 LEU 154 0.485 10.403 0.911 489 HD22 LEU 154 HD22 LEU 154 0.593 8.657 0.687 490 HD23 LEU 154 HD23 LEU 154 -0.116 9.315 2.162 491 H GLU 155 HN GLU 155 -1.748 9.843 -3.566 492 HA GLU 155 HA GLU 155 -1.280 7.813 -5.427 493 HB2 GLU 155 HB2 GLU 155 -2.148 10.686 -5.544 494 HB3 GLU 155 HB1 GLU 155 -1.918 9.809 -7.058 495 HG2 GLU 155 HG2 GLU 155 -3.394 8.238 -5.085 496 HG3 GLU 155 HG1 GLU 155 -4.208 9.754 -5.479 497 H PHE 156 HN PHE 156 0.568 10.785 -4.885 498 HA PHE 156 HA PHE 156 2.282 10.475 -7.217 499 HB2 PHE 156 HB2 PHE 156 1.842 12.641 -6.185 500 HB3 PHE 156 HB1 PHE 156 2.470 12.068 -4.640 501 HD1 PHE 156 HD2 PHE 156 3.445 12.625 -8.207 502 HD2 PHE 156 HD1 PHE 156 4.764 12.248 -4.136 503 HE1 PHE 156 HE2 PHE 156 5.736 13.288 -8.887 504 HE2 PHE 156 HE1 PHE 156 7.055 12.910 -4.817 505 HZ PHE 156 HZ PHE 156 7.541 13.430 -7.192 506 H MET 157 HN MET 157 2.786 10.003 -3.700 507 HA MET 157 HA MET 157 5.418 8.871 -3.941 508 HB2 MET 157 HB2 MET 157 3.317 8.446 -1.793 509 HB3 MET 157 HB1 MET 157 5.067 8.337 -1.595 510 HG2 MET 157 HG2 MET 157 4.494 10.878 -2.750 511 HG3 MET 157 HG1 MET 157 3.400 10.657 -1.385 512 HE1 MET 157 HE1 MET 157 7.211 8.919 -1.280 513 HE2 MET 157 HE2 MET 157 7.900 10.509 -1.604 514 HE3 MET 157 HE3 MET 157 6.691 9.841 -2.698 515 H LYS 158 HN LYS 158 2.294 7.594 -4.601 516 HA LYS 158 HA LYS 158 3.007 4.779 -4.114 517 HB2 LYS 158 HB2 LYS 158 0.738 5.595 -3.741 518 HB3 LYS 158 HB1 LYS 158 0.648 6.194 -5.398 519 HG2 LYS 158 HG2 LYS 158 0.186 4.140 -6.240 520 HG3 LYS 158 HG1 LYS 158 1.382 3.352 -5.210 521 HD2 LYS 158 HD2 LYS 158 -0.115 3.083 -3.443 522 HD3 LYS 158 HD1 LYS 158 -1.145 4.410 -3.981 523 HE2 LYS 158 HE2 LYS 158 -2.485 2.803 -4.880 524 HE3 LYS 158 HE1 LYS 158 -1.223 2.599 -6.112 525 HZ1 LYS 158 HZ1 LYS 158 -1.504 0.497 -5.083 526 HZ2 LYS 158 HZ2 LYS 158 -1.472 1.170 -3.523 527 HZ3 LYS 158 HZ3 LYS 158 -0.060 1.138 -4.467 528 H GLY 159 HN GLY 159 3.627 7.027 -6.558 529 HA2 GLY 159 HA2 GLY 159 4.159 4.813 -8.487 530 HA3 GLY 159 HA1 GLY 159 3.364 6.289 -9.037 531 H VAL 160 HN VAL 160 6.032 5.986 -6.706 532 HA VAL 160 HA VAL 160 7.778 7.463 -8.649 533 HB VAL 160 HB VAL 160 8.611 8.637 -6.531 534 HG11 VAL 160 HG11 VAL 160 6.507 10.089 -6.412 535 HG12 VAL 160 HG12 VAL 160 5.787 8.960 -7.560 536 HG13 VAL 160 HG13 VAL 160 7.219 9.884 -8.011 537 HG21 VAL 160 HG21 VAL 160 7.564 6.875 -5.022 538 HG22 VAL 160 HG22 VAL 160 6.001 7.601 -5.397 539 HG23 VAL 160 HG23 VAL 160 7.237 8.546 -4.564 540 H GLU 161 HN GLU 161 8.587 5.176 -9.025 541 HA GLU 161 HA GLU 161 9.844 3.645 -6.944 542 HB2 GLU 161 HB2 GLU 161 9.090 2.902 -9.240 543 HB3 GLU 161 HB1 GLU 161 10.489 3.745 -9.906 544 HG2 GLU 161 HG2 GLU 161 11.377 1.618 -9.644 545 HG3 GLU 161 HG1 GLU 161 11.795 2.329 -8.084 546 HO1 KDH 1 H1 KDH 1 8.951 9.553 -9.787 547 H21 KDH 1 H21 KDH 1 13.324 9.029 -1.916 548 H33 KDH 1 H33 KDH 1 9.906 12.625 -5.217 549 H4 KDH 1 H4 KDH 1 9.108 10.959 -6.906 550 HO7 KDH 1 H7 KDH 1 11.436 8.318 -10.394 551 H01 KDH 1 H01 KDH 1 10.741 13.753 -3.089 552 H01A KDH 1 H02 KDH 1 9.696 12.288 -2.905 553 HO03 KDH 1 H03 KDH 1 11.161 14.011 0.028 554 HO10 KDH 1 H10 KDH 1 14.546 9.515 -8.170 555 H12 KDH 1 H12 KDH 1 13.149 9.561 -5.844 556 H15 KDH 1 H15 KDH 1 9.985 10.397 -4.554 557 H26 KDH 1 H26 KDH 1 13.158 12.485 0.782 558 H39 KDH 1 H39 KDH 1 9.262 13.786 -7.302 559 H41 KDH 1 H41 KDH 1 13.015 15.799 -6.223 560 HO02 KDH 1 H42 KDH 1 13.962 9.107 0.457 561 HO44 KDH 1 H44 KDH 1 13.072 18.131 -7.221 562 HO47 KDH 1 H47 KDH 1 8.673 18.491 -7.451 563 HO50 KDH 1 H50 KDH 1 7.606 15.143 -8.141 Start of MODEL 23 1 H1 MET 90 HT1 MET 90 12.253 8.972 2.516 2 H2 MET 90 HT2 MET 90 12.884 8.276 3.931 3 H3 MET 90 HT3 MET 90 11.225 8.153 3.587 4 HA MET 90 HA MET 90 13.454 6.842 2.116 5 HB2 MET 90 HB2 MET 90 11.210 6.005 3.965 6 HB3 MET 90 HB1 MET 90 12.054 4.844 2.939 7 HG2 MET 90 HG2 MET 90 14.145 6.226 4.070 8 HG3 MET 90 HG1 MET 90 12.973 6.194 5.387 9 HE1 MET 90 HE1 MET 90 15.868 4.890 4.356 10 HE2 MET 90 HE2 MET 90 15.247 4.001 2.968 11 HE3 MET 90 HE3 MET 90 15.883 3.121 4.355 12 H GLY 91 HN GLY 91 9.993 7.648 2.228 13 HA2 GLY 91 HA2 GLY 91 8.508 7.883 0.399 14 HA3 GLY 91 HA1 GLY 91 9.819 7.410 -0.681 15 H LYS 92 HN LYS 92 8.268 5.746 2.081 16 HA LYS 92 HA LYS 92 7.865 3.390 0.267 17 HB2 LYS 92 HB2 LYS 92 9.398 3.514 2.448 18 HB3 LYS 92 HB1 LYS 92 7.858 3.217 3.255 19 HG2 LYS 92 HG2 LYS 92 7.783 1.064 2.555 20 HG3 LYS 92 HG1 LYS 92 8.276 1.497 0.917 21 HD2 LYS 92 HD2 LYS 92 10.104 0.236 1.654 22 HD3 LYS 92 HD1 LYS 92 10.627 1.883 2.008 23 HE2 LYS 92 HE2 LYS 92 9.264 0.056 4.020 24 HE3 LYS 92 HE1 LYS 92 11.013 0.353 3.945 25 HZ1 LYS 92 HZ1 LYS 92 10.326 2.811 3.924 26 HZ2 LYS 92 HZ2 LYS 92 10.272 1.980 5.405 27 HZ3 LYS 92 HZ3 LYS 92 8.841 2.264 4.535 28 H SER 93 HN SER 93 6.240 2.240 2.570 29 HA SER 93 HA SER 93 3.629 2.768 1.646 30 HB2 SER 93 HB2 SER 93 4.719 1.011 3.305 31 HB3 SER 93 HB1 SER 93 4.183 2.155 4.532 32 HG SER 93 HG SER 93 2.533 0.699 4.145 33 H GLU 94 HN GLU 94 1.949 3.636 3.521 34 HA GLU 94 HA GLU 94 2.252 6.483 3.566 35 HB2 GLU 94 HB2 GLU 94 0.380 4.416 4.400 36 HB3 GLU 94 HB1 GLU 94 0.432 5.741 5.565 37 HG2 GLU 94 HG2 GLU 94 -0.722 7.073 4.168 38 HG3 GLU 94 HG1 GLU 94 0.466 6.812 2.890 39 H GLU 95 HN GLU 95 3.652 4.064 5.523 40 HA GLU 95 HA GLU 95 3.765 5.293 8.088 41 HB2 GLU 95 HB2 GLU 95 5.768 3.565 6.595 42 HB3 GLU 95 HB1 GLU 95 5.758 3.824 8.340 43 HG2 GLU 95 HG2 GLU 95 3.307 2.987 8.242 44 HG3 GLU 95 HG1 GLU 95 3.736 2.363 6.648 45 H GLU 96 HN GLU 96 6.368 5.280 5.617 46 HA GLU 96 HA GLU 96 7.694 7.567 6.881 47 HB2 GLU 96 HB2 GLU 96 8.159 6.132 4.245 48 HB3 GLU 96 HB1 GLU 96 9.308 7.193 5.062 49 HG2 GLU 96 HG2 GLU 96 8.177 4.665 6.292 50 HG3 GLU 96 HG1 GLU 96 9.733 4.746 5.465 51 H LEU 97 HN LEU 97 5.369 7.056 4.346 52 HA LEU 97 HA LEU 97 5.785 9.366 2.735 53 HB2 LEU 97 HB2 LEU 97 3.885 7.254 3.142 54 HB3 LEU 97 HB1 LEU 97 3.006 8.775 2.985 55 HG LEU 97 HG LEU 97 3.487 7.555 0.801 56 HD11 LEU 97 HD11 LEU 97 2.886 9.890 0.755 57 HD12 LEU 97 HD12 LEU 97 4.256 9.679 -0.335 58 HD13 LEU 97 HD13 LEU 97 4.504 10.371 1.268 59 HD21 LEU 97 HD21 LEU 97 5.972 7.201 1.793 60 HD22 LEU 97 HD22 LEU 97 6.242 8.690 0.886 61 HD23 LEU 97 HD23 LEU 97 5.644 7.251 0.061 62 H SER 98 HN SER 98 3.600 8.908 5.541 63 HA SER 98 HA SER 98 2.447 11.444 5.705 64 HB2 SER 98 HB2 SER 98 2.196 10.908 8.084 65 HB3 SER 98 HB1 SER 98 1.996 9.441 7.129 66 HG SER 98 HG SER 98 3.444 8.818 8.589 67 H ASP 99 HN ASP 99 5.303 10.519 7.672 68 HA ASP 99 HA ASP 99 6.018 13.187 8.381 69 HB2 ASP 99 HB2 ASP 99 8.180 12.079 8.992 70 HB3 ASP 99 HB1 ASP 99 6.773 11.183 9.564 71 H LEU 100 HN LEU 100 6.509 11.407 5.437 72 HA LEU 100 HA LEU 100 8.820 12.892 4.485 73 HB2 LEU 100 HB2 LEU 100 8.212 10.639 3.711 74 HB3 LEU 100 HB1 LEU 100 6.680 11.251 3.088 75 HG LEU 100 HG LEU 100 7.915 12.742 1.544 76 HD11 LEU 100 HD11 LEU 100 9.959 13.126 2.735 77 HD12 LEU 100 HD12 LEU 100 10.401 12.232 1.281 78 HD13 LEU 100 HD13 LEU 100 10.303 11.399 2.833 79 HD21 LEU 100 HD21 LEU 100 8.499 11.047 -0.019 80 HD22 LEU 100 HD22 LEU 100 7.284 10.297 1.016 81 HD23 LEU 100 HD23 LEU 100 8.992 9.932 1.255 82 H PHE 101 HN PHE 101 5.330 13.352 4.381 83 HA PHE 101 HA PHE 101 5.272 15.324 2.272 84 HB2 PHE 101 HB2 PHE 101 3.376 13.925 3.229 85 HB3 PHE 101 HB1 PHE 101 3.397 14.992 4.632 86 HD1 PHE 101 HD1 PHE 101 3.725 15.571 0.936 87 HD2 PHE 101 HD2 PHE 101 1.610 16.490 4.561 88 HE1 PHE 101 HE1 PHE 101 2.332 17.214 -0.292 89 HE2 PHE 101 HE2 PHE 101 0.218 18.134 3.332 90 HZ PHE 101 HZ PHE 101 0.578 18.495 0.905 91 H ARG 102 HN ARG 102 5.062 15.677 5.838 92 HA ARG 102 HA ARG 102 5.383 18.564 5.752 93 HB2 ARG 102 HB2 ARG 102 5.444 18.293 8.191 94 HB3 ARG 102 HB1 ARG 102 4.195 17.245 7.515 95 HG2 ARG 102 HG2 ARG 102 5.956 15.397 7.473 96 HG3 ARG 102 HG1 ARG 102 6.959 16.460 8.460 97 HD2 ARG 102 HD2 ARG 102 5.007 16.612 10.092 98 HD3 ARG 102 HD1 ARG 102 4.250 15.296 9.171 99 HE ARG 102 HE ARG 102 6.848 14.412 9.623 100 HH11 ARG 102 HH21 ARG 102 4.212 15.539 11.551 101 HH12 ARG 102 HH22 ARG 102 4.631 14.566 12.921 102 HH21 ARG 102 HH11 ARG 102 7.401 13.140 11.401 103 HH22 ARG 102 HH12 ARG 102 6.433 13.206 12.836 104 H MET 103 HN MET 103 7.558 16.018 5.315 105 HA MET 103 HA MET 103 9.887 16.821 6.723 106 HB2 MET 103 HB2 MET 103 9.682 14.688 5.597 107 HB3 MET 103 HB1 MET 103 9.449 15.481 4.038 108 HG2 MET 103 HG2 MET 103 11.687 15.202 3.783 109 HG3 MET 103 HG1 MET 103 11.829 16.574 4.880 110 HE1 MET 103 HE1 MET 103 14.101 13.114 5.336 111 HE2 MET 103 HE2 MET 103 13.519 14.103 3.999 112 HE3 MET 103 HE3 MET 103 12.611 12.674 4.489 113 H PHE 104 HN PHE 104 9.023 17.580 3.313 114 HA PHE 104 HA PHE 104 11.126 19.639 3.206 115 HB2 PHE 104 HB2 PHE 104 8.972 18.902 1.199 116 HB3 PHE 104 HB1 PHE 104 10.495 19.729 0.867 117 HD1 PHE 104 HD1 PHE 104 12.654 18.517 1.054 118 HD2 PHE 104 HD2 PHE 104 8.883 16.514 1.522 119 HE1 PHE 104 HE1 PHE 104 13.781 16.328 0.762 120 HE2 PHE 104 HE2 PHE 104 10.010 14.324 1.229 121 HZ PHE 104 HZ PHE 104 12.459 14.231 0.850 122 H ASP 105 HN ASP 105 7.718 19.873 2.147 123 HA ASP 105 HA ASP 105 6.310 21.795 2.181 124 HB2 ASP 105 HB2 ASP 105 6.595 20.471 4.562 125 HB3 ASP 105 HB1 ASP 105 6.961 22.127 5.046 126 H LYS 106 HN LYS 106 8.630 22.721 1.142 127 HA LYS 106 HA LYS 106 10.313 24.515 2.354 128 HB2 LYS 106 HB2 LYS 106 9.078 24.133 -0.251 129 HB3 LYS 106 HB1 LYS 106 9.414 25.839 0.048 130 HG2 LYS 106 HG2 LYS 106 11.386 23.544 0.215 131 HG3 LYS 106 HG1 LYS 106 11.382 24.854 -0.966 132 HD2 LYS 106 HD2 LYS 106 12.632 26.102 0.424 133 HD3 LYS 106 HD1 LYS 106 11.341 26.040 1.625 134 HE2 LYS 106 HE2 LYS 106 13.129 25.061 2.797 135 HE3 LYS 106 HE1 LYS 106 12.335 23.628 2.112 136 HZ1 LYS 106 HZ1 LYS 106 14.311 25.090 0.501 137 HZ2 LYS 106 HZ2 LYS 106 13.876 23.449 0.440 138 HZ3 LYS 106 HZ3 LYS 106 14.863 24.023 1.698 139 H ASN 107 HN ASN 107 6.907 25.182 1.495 140 HA ASN 107 HA ASN 107 7.085 27.896 2.644 141 HB2 ASN 107 HB2 ASN 107 5.814 27.585 0.624 142 HB3 ASN 107 HB1 ASN 107 4.914 26.245 1.331 143 HD21 ASN 107 HD21 ASN 107 2.799 27.086 1.457 144 HD22 ASN 107 HD22 ASN 107 2.398 28.528 2.258 145 H ALA 108 HN ALA 108 6.049 24.703 3.605 146 HA ALA 108 HA ALA 108 5.153 23.921 5.649 147 HB1 ALA 108 HB1 ALA 108 5.831 25.271 7.588 148 HB2 ALA 108 HB2 ALA 108 6.135 26.654 6.536 149 HB3 ALA 108 HB3 ALA 108 7.144 25.213 6.412 150 H ASP 109 HN ASP 109 2.942 24.084 4.748 151 HA ASP 109 HA ASP 109 1.288 25.995 6.283 152 HB2 ASP 109 HB2 ASP 109 0.373 27.064 4.359 153 HB3 ASP 109 HB1 ASP 109 2.110 27.017 4.061 154 H GLY 110 HN GLY 110 1.778 22.962 5.710 155 HA2 GLY 110 HA2 GLY 110 0.258 21.162 6.107 156 HA3 GLY 110 HA1 GLY 110 -1.086 22.253 5.765 157 H TYR 111 HN TYR 111 0.615 23.078 3.279 158 HA TYR 111 HA TYR 111 0.089 20.656 1.606 159 HB2 TYR 111 HB2 TYR 111 -0.781 23.460 0.864 160 HB3 TYR 111 HB1 TYR 111 -1.268 21.942 0.110 161 HD1 TYR 111 HD2 TYR 111 -1.609 24.064 3.126 162 HD2 TYR 111 HD1 TYR 111 -2.981 20.544 1.079 163 HE1 TYR 111 HE2 TYR 111 -3.515 23.889 4.704 164 HE2 TYR 111 HE1 TYR 111 -4.886 20.370 2.657 165 HH TYR 111 HH TYR 111 -5.059 21.633 5.475 166 H ILE 112 HN ILE 112 0.969 21.148 -0.723 167 HA ILE 112 HA ILE 112 3.470 22.793 -0.517 168 HB ILE 112 HB ILE 112 2.953 19.965 -1.415 169 HG12 ILE 112 HG12 ILE 112 5.162 21.278 0.200 170 HG13 ILE 112 HG11 ILE 112 3.763 20.450 0.883 171 HG21 ILE 112 HG21 ILE 112 4.684 21.902 -2.741 172 HG22 ILE 112 HG22 ILE 112 4.263 20.261 -3.231 173 HG23 ILE 112 HG23 ILE 112 5.597 20.532 -2.110 174 HD11 ILE 112 HD11 ILE 112 5.132 18.821 -1.115 175 HD12 ILE 112 HD12 ILE 112 4.682 18.416 0.541 176 HD13 ILE 112 HD13 ILE 112 6.194 19.265 0.221 177 H ASP 113 HN ASP 113 3.938 24.025 -2.351 178 HA ASP 113 HA ASP 113 1.928 23.901 -4.573 179 HB2 ASP 113 HB2 ASP 113 2.803 25.957 -2.851 180 HB3 ASP 113 HB1 ASP 113 3.516 26.321 -4.423 181 H LEU 114 HN LEU 114 2.864 24.668 -6.718 182 HA LEU 114 HA LEU 114 4.911 23.037 -7.693 183 HB2 LEU 114 HB2 LEU 114 3.607 25.605 -8.460 184 HB3 LEU 114 HB1 LEU 114 5.069 25.158 -9.340 185 HG LEU 114 HG LEU 114 2.872 23.143 -8.929 186 HD11 LEU 114 HD11 LEU 114 2.106 25.415 -9.995 187 HD12 LEU 114 HD12 LEU 114 1.662 23.901 -10.783 188 HD13 LEU 114 HD13 LEU 114 3.013 24.852 -11.399 189 HD21 LEU 114 HD21 LEU 114 4.692 23.494 -11.308 190 HD22 LEU 114 HD22 LEU 114 3.900 22.027 -10.732 191 HD23 LEU 114 HD23 LEU 114 5.272 22.694 -9.847 192 H ASP 115 HN ASP 115 5.200 26.223 -6.158 193 HA ASP 115 HA ASP 115 7.972 26.669 -6.800 194 HB2 ASP 115 HB2 ASP 115 5.912 27.712 -4.900 195 HB3 ASP 115 HB1 ASP 115 7.597 28.137 -4.601 196 H GLU 116 HN GLU 116 6.343 25.011 -4.117 197 HA GLU 116 HA GLU 116 8.728 24.702 -2.493 198 HB2 GLU 116 HB2 GLU 116 6.146 23.107 -2.539 199 HB3 GLU 116 HB1 GLU 116 7.264 23.261 -1.182 200 HG2 GLU 116 HG2 GLU 116 6.853 25.775 -1.294 201 HG3 GLU 116 HG1 GLU 116 5.521 25.414 -2.395 202 H LEU 117 HN LEU 117 6.926 22.476 -4.650 203 HA LEU 117 HA LEU 117 8.593 20.202 -4.327 204 HB2 LEU 117 HB2 LEU 117 7.097 21.160 -6.788 205 HB3 LEU 117 HB1 LEU 117 7.536 19.492 -6.419 206 HG LEU 117 HG LEU 117 6.055 20.852 -4.266 207 HD11 LEU 117 HD11 LEU 117 4.968 21.810 -6.301 208 HD12 LEU 117 HD12 LEU 117 3.891 20.755 -5.387 209 HD13 LEU 117 HD13 LEU 117 4.652 20.171 -6.867 210 HD21 LEU 117 HD21 LEU 117 4.858 18.689 -4.272 211 HD22 LEU 117 HD22 LEU 117 6.604 18.444 -4.269 212 HD23 LEU 117 HD23 LEU 117 5.687 18.235 -5.761 213 H LYS 118 HN LYS 118 8.957 23.048 -6.419 214 HA LYS 118 HA LYS 118 11.093 22.034 -8.052 215 HB2 LYS 118 HB2 LYS 118 9.795 23.983 -8.668 216 HB3 LYS 118 HB1 LYS 118 10.249 24.813 -7.179 217 HG2 LYS 118 HG2 LYS 118 12.484 25.109 -7.885 218 HG3 LYS 118 HG1 LYS 118 12.343 23.878 -9.139 219 HD2 LYS 118 HD2 LYS 118 11.334 25.305 -10.619 220 HD3 LYS 118 HD1 LYS 118 10.474 26.177 -9.349 221 HE2 LYS 118 HE2 LYS 118 12.107 27.723 -10.185 222 HE3 LYS 118 HE1 LYS 118 12.793 27.108 -8.668 223 HZ1 LYS 118 HZ1 LYS 118 13.287 25.853 -11.312 224 HZ2 LYS 118 HZ2 LYS 118 14.072 25.513 -9.844 225 HZ3 LYS 118 HZ3 LYS 118 14.330 27.000 -10.624 226 H ILE 119 HN ILE 119 11.240 24.293 -5.263 227 HA ILE 119 HA ILE 119 14.133 24.011 -5.019 228 HB ILE 119 HB ILE 119 11.961 25.222 -3.280 229 HG12 ILE 119 HG12 ILE 119 13.703 27.150 -4.409 230 HG13 ILE 119 HG11 ILE 119 13.285 26.036 -5.711 231 HG21 ILE 119 HG21 ILE 119 13.525 25.520 -1.691 232 HG22 ILE 119 HG22 ILE 119 14.516 26.410 -2.847 233 HG23 ILE 119 HG23 ILE 119 14.708 24.665 -2.680 234 HD11 ILE 119 HD11 ILE 119 11.095 26.670 -5.724 235 HD12 ILE 119 HD12 ILE 119 11.712 28.127 -4.944 236 HD13 ILE 119 HD13 ILE 119 11.029 26.826 -3.968 237 H MET 120 HN MET 120 11.407 22.234 -3.885 238 HA MET 120 HA MET 120 12.400 21.232 -1.393 239 HB2 MET 120 HB2 MET 120 10.101 20.962 -1.931 240 HB3 MET 120 HB1 MET 120 10.471 20.268 -3.510 241 HG2 MET 120 HG2 MET 120 11.175 18.213 -2.571 242 HG3 MET 120 HG1 MET 120 11.337 18.909 -0.959 243 HE1 MET 120 HE1 MET 120 9.258 16.614 -3.023 244 HE2 MET 120 HE2 MET 120 8.311 16.170 -1.605 245 HE3 MET 120 HE3 MET 120 10.065 16.279 -1.484 246 H LEU 121 HN LEU 121 12.377 19.644 -4.614 247 HA LEU 121 HA LEU 121 14.184 17.533 -3.784 248 HB2 LEU 121 HB2 LEU 121 12.667 18.424 -6.126 249 HB3 LEU 121 HB1 LEU 121 14.222 17.715 -6.563 250 HG LEU 121 HG LEU 121 12.366 16.030 -6.414 251 HD11 LEU 121 HD11 LEU 121 14.991 15.918 -5.359 252 HD12 LEU 121 HD12 LEU 121 14.002 14.566 -5.913 253 HD13 LEU 121 HD13 LEU 121 13.962 15.053 -4.218 254 HD21 LEU 121 HD21 LEU 121 11.389 17.345 -4.365 255 HD22 LEU 121 HD22 LEU 121 12.517 16.368 -3.426 256 HD23 LEU 121 HD23 LEU 121 11.265 15.586 -4.390 257 H GLN 122 HN GLN 122 14.640 20.799 -4.742 258 HA GLN 122 HA GLN 122 16.980 20.949 -6.198 259 HB2 GLN 122 HB2 GLN 122 15.484 22.698 -4.895 260 HB3 GLN 122 HB1 GLN 122 16.726 22.524 -3.654 261 HG2 GLN 122 HG2 GLN 122 18.391 23.428 -4.994 262 HG3 GLN 122 HG1 GLN 122 17.584 22.958 -6.491 263 HE21 GLN 122 HE21 GLN 122 17.394 25.298 -3.782 264 HE22 GLN 122 HE22 GLN 122 16.509 26.462 -4.644 265 H ALA 123 HN ALA 123 16.677 20.026 -2.783 266 HA ALA 123 HA ALA 123 19.283 20.079 -1.850 267 HB1 ALA 123 HB1 ALA 123 17.920 17.526 -1.343 268 HB2 ALA 123 HB2 ALA 123 16.861 18.923 -1.155 269 HB3 ALA 123 HB3 ALA 123 18.347 18.810 -0.212 270 H THR 124 HN THR 124 17.981 18.004 -4.361 271 HA THR 124 HA THR 124 20.457 16.350 -4.400 272 HB THR 124 HB THR 124 18.058 15.455 -4.506 273 HG1 THR 124 HG1 THR 124 18.772 13.829 -5.705 274 HG21 THR 124 HG21 THR 124 17.774 17.387 -6.446 275 HG22 THR 124 HG22 THR 124 16.682 16.022 -6.216 276 HG23 THR 124 HG23 THR 124 17.979 15.922 -7.407 277 H GLY 125 HN GLY 125 19.146 19.131 -5.886 278 HA2 GLY 125 HA2 GLY 125 20.399 20.480 -7.449 279 HA3 GLY 125 HA1 GLY 125 21.278 19.034 -7.948 280 H GLU 126 HN GLU 126 17.798 19.014 -7.600 281 HA GLU 126 HA GLU 126 17.194 17.853 -10.064 282 HB2 GLU 126 HB2 GLU 126 14.940 18.959 -9.674 283 HB3 GLU 126 HB1 GLU 126 15.580 18.084 -8.283 284 HG2 GLU 126 HG2 GLU 126 15.512 19.968 -7.059 285 HG3 GLU 126 HG1 GLU 126 16.608 20.749 -8.198 286 H THR 127 HN THR 127 18.486 18.818 -11.753 287 HA THR 127 HA THR 127 17.761 21.637 -12.474 288 HB THR 127 HB THR 127 20.120 21.335 -12.079 289 HG1 THR 127 HG1 THR 127 19.727 22.495 -13.946 290 HG21 THR 127 HG21 THR 127 20.785 19.168 -12.119 291 HG22 THR 127 HG22 THR 127 21.086 19.453 -13.833 292 HG23 THR 127 HG23 THR 127 19.566 18.724 -13.314 293 H ILE 128 HN ILE 128 15.846 21.120 -13.669 294 HA ILE 128 HA ILE 128 16.364 19.684 -16.241 295 HB ILE 128 HB ILE 128 14.143 18.603 -15.941 296 HG12 ILE 128 HG12 ILE 128 13.385 20.503 -14.349 297 HG13 ILE 128 HG11 ILE 128 12.854 18.864 -13.982 298 HG21 ILE 128 HG21 ILE 128 15.861 17.173 -15.280 299 HG22 ILE 128 HG22 ILE 128 14.869 17.239 -13.824 300 HG23 ILE 128 HG23 ILE 128 16.339 18.205 -13.933 301 HD11 ILE 128 HD11 ILE 128 14.319 20.625 -12.305 302 HD12 ILE 128 HD12 ILE 128 15.415 19.317 -12.742 303 HD13 ILE 128 HD13 ILE 128 13.870 18.953 -11.977 304 H THR 129 HN THR 129 14.590 20.207 -17.865 305 HA THR 129 HA THR 129 14.249 23.016 -18.186 306 HB THR 129 HB THR 129 12.505 20.825 -19.341 307 HG1 THR 129 HG1 THR 129 15.035 21.656 -20.290 308 HG21 THR 129 HG21 THR 129 13.057 23.643 -19.926 309 HG22 THR 129 HG22 THR 129 11.721 22.624 -20.464 310 HG23 THR 129 HG23 THR 129 13.257 22.594 -21.330 311 H GLU 130 HN GLU 130 12.313 24.308 -17.964 312 HA GLU 130 HA GLU 130 10.854 24.059 -15.570 313 HB2 GLU 130 HB2 GLU 130 11.024 26.117 -16.841 314 HB3 GLU 130 HB1 GLU 130 10.201 25.384 -18.218 315 HG2 GLU 130 HG2 GLU 130 8.424 26.500 -17.237 316 HG3 GLU 130 HG1 GLU 130 8.300 24.944 -16.417 317 H ASP 131 HN ASP 131 9.911 23.012 -18.860 318 HA ASP 131 HA ASP 131 7.290 22.115 -18.304 319 HB2 ASP 131 HB2 ASP 131 8.527 22.341 -20.514 320 HB3 ASP 131 HB1 ASP 131 9.311 20.804 -20.143 321 H ASP 132 HN ASP 132 10.314 20.813 -17.244 322 HA ASP 132 HA ASP 132 9.240 18.103 -16.749 323 HB2 ASP 132 HB2 ASP 132 11.785 19.439 -17.006 324 HB3 ASP 132 HB1 ASP 132 11.744 18.537 -15.490 325 H ILE 133 HN ILE 133 9.295 21.114 -15.138 326 HA ILE 133 HA ILE 133 9.308 19.932 -12.419 327 HB ILE 133 HB ILE 133 8.844 22.809 -13.227 328 HG12 ILE 133 HG12 ILE 133 11.432 21.238 -13.104 329 HG13 ILE 133 HG11 ILE 133 10.818 22.206 -14.445 330 HG21 ILE 133 HG21 ILE 133 8.538 22.172 -10.850 331 HG22 ILE 133 HG22 ILE 133 9.921 23.246 -11.061 332 HG23 ILE 133 HG23 ILE 133 10.175 21.517 -10.825 333 HD11 ILE 133 HD11 ILE 133 12.607 23.390 -13.192 334 HD12 ILE 133 HD12 ILE 133 11.620 23.304 -11.733 335 HD13 ILE 133 HD13 ILE 133 11.070 24.251 -13.116 336 H GLU 134 HN GLU 134 7.119 22.005 -14.372 337 HA GLU 134 HA GLU 134 4.899 21.889 -12.580 338 HB2 GLU 134 HB2 GLU 134 5.164 22.293 -15.573 339 HB3 GLU 134 HB1 GLU 134 3.659 22.557 -14.693 340 HG2 GLU 134 HG2 GLU 134 4.486 24.409 -13.558 341 HG3 GLU 134 HG1 GLU 134 6.162 23.878 -13.704 342 H GLU 135 HN GLU 135 6.233 19.482 -14.638 343 HA GLU 135 HA GLU 135 3.857 18.003 -15.310 344 HB2 GLU 135 HB2 GLU 135 6.800 17.677 -15.297 345 HB3 GLU 135 HB1 GLU 135 5.885 16.171 -15.220 346 HG2 GLU 135 HG2 GLU 135 4.716 16.666 -17.247 347 HG3 GLU 135 HG1 GLU 135 5.287 18.335 -17.247 348 H LEU 136 HN LEU 136 6.278 17.512 -12.706 349 HA LEU 136 HA LEU 136 5.155 15.307 -11.406 350 HB2 LEU 136 HB2 LEU 136 6.493 17.808 -10.333 351 HB3 LEU 136 HB1 LEU 136 6.231 16.354 -9.369 352 HG LEU 136 HG LEU 136 7.615 16.182 -12.037 353 HD11 LEU 136 HD11 LEU 136 9.753 16.529 -10.982 354 HD12 LEU 136 HD12 LEU 136 9.009 16.646 -9.388 355 HD13 LEU 136 HD13 LEU 136 8.742 17.917 -10.580 356 HD21 LEU 136 HD21 LEU 136 7.096 14.048 -11.188 357 HD22 LEU 136 HD22 LEU 136 7.408 14.534 -9.521 358 HD23 LEU 136 HD23 LEU 136 8.753 14.297 -10.637 359 H MET 137 HN MET 137 4.239 18.739 -11.077 360 HA MET 137 HA MET 137 2.368 18.476 -8.956 361 HB2 MET 137 HB2 MET 137 3.037 20.643 -9.618 362 HB3 MET 137 HB1 MET 137 2.718 20.316 -11.321 363 HG2 MET 137 HG2 MET 137 1.003 21.796 -10.173 364 HG3 MET 137 HG1 MET 137 0.343 20.371 -10.974 365 HE1 MET 137 HE1 MET 137 0.559 22.005 -7.086 366 HE2 MET 137 HE2 MET 137 1.991 21.726 -8.074 367 HE3 MET 137 HE3 MET 137 1.650 20.664 -6.710 368 H LYS 138 HN LYS 138 1.940 18.099 -12.481 369 HA LYS 138 HA LYS 138 -0.843 17.809 -12.650 370 HB2 LYS 138 HB2 LYS 138 1.536 17.128 -14.149 371 HB3 LYS 138 HB1 LYS 138 0.339 15.844 -14.310 372 HG2 LYS 138 HG2 LYS 138 -0.179 18.793 -14.792 373 HG3 LYS 138 HG1 LYS 138 0.032 17.574 -16.049 374 HD2 LYS 138 HD2 LYS 138 -2.096 16.854 -15.835 375 HD3 LYS 138 HD1 LYS 138 -1.965 16.771 -14.078 376 HE2 LYS 138 HE2 LYS 138 -2.017 19.475 -14.430 377 HE3 LYS 138 HE1 LYS 138 -3.042 18.944 -15.779 378 HZ1 LYS 138 HZ1 LYS 138 -3.314 18.123 -12.935 379 HZ2 LYS 138 HZ2 LYS 138 -4.237 17.499 -14.218 380 HZ3 LYS 138 HZ3 LYS 138 -4.372 19.137 -13.789 381 H ASP 139 HN ASP 139 1.531 15.174 -12.098 382 HA ASP 139 HA ASP 139 -0.507 13.193 -11.520 383 HB2 ASP 139 HB2 ASP 139 2.459 13.476 -11.462 384 HB3 ASP 139 HB1 ASP 139 1.772 12.184 -10.478 385 H GLY 140 HN GLY 140 1.423 15.434 -9.584 386 HA2 GLY 140 HA2 GLY 140 0.753 14.255 -7.027 387 HA3 GLY 140 HA1 GLY 140 1.425 15.868 -7.271 388 H ASP 141 HN ASP 141 -0.830 16.477 -9.197 389 HA ASP 141 HA ASP 141 -3.179 16.525 -7.377 390 HB2 ASP 141 HB2 ASP 141 -1.326 18.574 -7.411 391 HB3 ASP 141 HB1 ASP 141 -2.537 19.140 -8.565 392 H LYS 142 HN LYS 142 -3.363 15.025 -9.551 393 HA LYS 142 HA LYS 142 -3.815 16.109 -12.097 394 HB2 LYS 142 HB2 LYS 142 -4.738 13.796 -10.486 395 HB3 LYS 142 HB1 LYS 142 -5.754 14.194 -11.873 396 HG2 LYS 142 HG2 LYS 142 -3.325 14.387 -13.037 397 HG3 LYS 142 HG1 LYS 142 -2.960 13.181 -11.803 398 HD2 LYS 142 HD2 LYS 142 -3.758 11.740 -13.393 399 HD3 LYS 142 HD1 LYS 142 -5.314 12.204 -12.705 400 HE2 LYS 142 HE2 LYS 142 -5.799 12.731 -14.894 401 HE3 LYS 142 HE1 LYS 142 -4.940 14.232 -14.498 402 HZ1 LYS 142 HZ1 LYS 142 -2.976 12.367 -15.001 403 HZ2 LYS 142 HZ2 LYS 142 -3.438 13.650 -16.014 404 HZ3 LYS 142 HZ3 LYS 142 -4.129 12.113 -16.219 405 H ASN 143 HN ASN 143 -5.700 16.454 -9.184 406 HA ASN 143 HA ASN 143 -8.191 17.286 -10.400 407 HB2 ASN 143 HB2 ASN 143 -8.325 16.545 -8.181 408 HB3 ASN 143 HB1 ASN 143 -6.854 17.393 -7.707 409 HD21 ASN 143 HD21 ASN 143 -7.551 18.868 -6.127 410 HD22 ASN 143 HD22 ASN 143 -8.834 19.961 -6.335 411 H ASN 144 HN ASN 144 -5.135 18.779 -10.141 412 HA ASN 144 HA ASN 144 -4.403 21.001 -10.494 413 HB2 ASN 144 HB2 ASN 144 -5.928 20.186 -12.509 414 HB3 ASN 144 HB1 ASN 144 -7.000 21.455 -11.917 415 HD21 ASN 144 HD21 ASN 144 -3.414 21.182 -12.314 416 HD22 ASN 144 HD22 ASN 144 -3.251 22.658 -13.136 417 H ASP 145 HN ASP 145 -4.813 21.448 -8.141 418 HA ASP 145 HA ASP 145 -7.170 23.260 -7.732 419 HB2 ASP 145 HB2 ASP 145 -7.433 21.391 -6.321 420 HB3 ASP 145 HB1 ASP 145 -5.701 21.263 -6.016 421 H GLY 146 HN GLY 146 -3.700 22.898 -7.547 422 HA2 GLY 146 HA2 GLY 146 -2.332 24.953 -7.676 423 HA3 GLY 146 HA1 GLY 146 -3.515 25.734 -6.625 424 H ARG 147 HN ARG 147 -3.369 22.793 -5.317 425 HA ARG 147 HA ARG 147 -0.831 23.152 -3.814 426 HB2 ARG 147 HB2 ARG 147 -3.486 23.940 -2.947 427 HB3 ARG 147 HB1 ARG 147 -2.825 22.708 -1.872 428 HG2 ARG 147 HG2 ARG 147 -1.543 24.283 -0.906 429 HG3 ARG 147 HG1 ARG 147 -0.707 24.505 -2.443 430 HD2 ARG 147 HD2 ARG 147 -1.565 26.669 -1.914 431 HD3 ARG 147 HD1 ARG 147 -2.729 26.016 -3.084 432 HE ARG 147 HE ARG 147 -4.316 25.958 -1.345 433 HH11 ARG 147 HH21 ARG 147 -1.090 25.921 -0.110 434 HH12 ARG 147 HH22 ARG 147 -1.587 25.969 1.548 435 HH21 ARG 147 HH11 ARG 147 -4.974 26.024 0.811 436 HH22 ARG 147 HH12 ARG 147 -3.783 26.028 2.069 437 H ILE 148 HN ILE 148 -0.024 21.167 -3.133 438 HA ILE 148 HA ILE 148 -1.509 18.751 -3.960 439 HB ILE 148 HB ILE 148 1.225 19.065 -2.687 440 HG12 ILE 148 HG12 ILE 148 0.287 19.357 -5.548 441 HG13 ILE 148 HG11 ILE 148 1.282 20.469 -4.608 442 HG21 ILE 148 HG21 ILE 148 -0.005 16.927 -4.455 443 HG22 ILE 148 HG22 ILE 148 0.354 16.768 -2.736 444 HG23 ILE 148 HG23 ILE 148 1.669 16.943 -3.899 445 HD11 ILE 148 HD11 ILE 148 2.818 19.368 -6.039 446 HD12 ILE 148 HD12 ILE 148 2.061 17.797 -5.777 447 HD13 ILE 148 HD13 ILE 148 2.998 18.550 -4.487 448 H ASP 149 HN ASP 149 -3.044 18.133 -2.459 449 HA ASP 149 HA ASP 149 -2.639 18.513 0.421 450 HB2 ASP 149 HB2 ASP 149 -4.747 17.175 -1.302 451 HB3 ASP 149 HB1 ASP 149 -4.882 17.341 0.449 452 H TYR 150 HN TYR 150 -2.741 16.660 1.939 453 HA TYR 150 HA TYR 150 -0.818 14.662 1.547 454 HB2 TYR 150 HB2 TYR 150 -1.637 15.129 3.730 455 HB3 TYR 150 HB1 TYR 150 -3.312 14.871 3.242 456 HD1 TYR 150 HD1 TYR 150 -0.086 13.198 3.967 457 HD2 TYR 150 HD2 TYR 150 -4.263 12.661 3.125 458 HE1 TYR 150 HE1 TYR 150 0.090 10.811 4.616 459 HE2 TYR 150 HE2 TYR 150 -4.088 10.276 3.774 460 HH TYR 150 HH TYR 150 -1.654 9.022 5.527 461 H ASP 151 HN ASP 151 -4.371 14.250 1.247 462 HA ASP 151 HA ASP 151 -4.471 11.596 0.373 463 HB2 ASP 151 HB2 ASP 151 -6.452 12.869 0.862 464 HB3 ASP 151 HB1 ASP 151 -6.065 14.061 -0.379 465 H GLU 152 HN GLU 152 -4.053 14.520 -1.659 466 HA GLU 152 HA GLU 152 -3.754 13.019 -4.126 467 HB2 GLU 152 HB2 GLU 152 -3.238 15.851 -3.201 468 HB3 GLU 152 HB1 GLU 152 -2.885 15.342 -4.853 469 HG2 GLU 152 HG2 GLU 152 -5.132 14.949 -5.356 470 HG3 GLU 152 HG1 GLU 152 -5.576 14.739 -3.661 471 H PHE 153 HN PHE 153 -1.549 14.191 -1.633 472 HA PHE 153 HA PHE 153 0.921 14.080 -3.011 473 HB2 PHE 153 HB2 PHE 153 0.489 14.934 -0.706 474 HB3 PHE 153 HB1 PHE 153 0.270 13.273 -0.156 475 HD1 PHE 153 HD1 PHE 153 2.735 14.681 -2.592 476 HD2 PHE 153 HD2 PHE 153 2.120 12.817 1.229 477 HE1 PHE 153 HE1 PHE 153 5.188 14.449 -2.309 478 HE2 PHE 153 HE2 PHE 153 4.573 12.585 1.512 479 HZ PHE 153 HZ PHE 153 6.107 13.401 -0.258 480 H LEU 154 HN LEU 154 -1.174 11.505 -1.897 481 HA LEU 154 HA LEU 154 0.842 9.397 -2.038 482 HB2 LEU 154 HB2 LEU 154 -2.192 9.297 -2.039 483 HB3 LEU 154 HB1 LEU 154 -1.105 7.972 -1.617 484 HG LEU 154 HG LEU 154 -1.463 10.590 -0.138 485 HD11 LEU 154 HD11 LEU 154 -3.103 9.181 0.694 486 HD12 LEU 154 HD12 LEU 154 -1.749 8.712 1.723 487 HD13 LEU 154 HD13 LEU 154 -2.182 7.722 0.328 488 HD21 LEU 154 HD21 LEU 154 0.550 8.364 0.326 489 HD22 LEU 154 HD22 LEU 154 0.309 9.762 1.375 490 HD23 LEU 154 HD23 LEU 154 0.930 9.983 -0.262 491 H GLU 155 HN GLU 155 -1.949 10.340 -4.093 492 HA GLU 155 HA GLU 155 -1.754 8.442 -6.125 493 HB2 GLU 155 HB2 GLU 155 -2.298 11.425 -6.204 494 HB3 GLU 155 HB1 GLU 155 -2.588 10.359 -7.579 495 HG2 GLU 155 HG2 GLU 155 -3.757 9.778 -4.856 496 HG3 GLU 155 HG1 GLU 155 -4.585 10.816 -6.017 497 H PHE 156 HN PHE 156 0.369 11.180 -5.477 498 HA PHE 156 HA PHE 156 1.790 11.255 -7.956 499 HB2 PHE 156 HB2 PHE 156 1.926 13.009 -6.277 500 HB3 PHE 156 HB1 PHE 156 2.570 11.876 -5.089 501 HD1 PHE 156 HD1 PHE 156 4.868 11.042 -5.247 502 HD2 PHE 156 HD2 PHE 156 3.308 13.838 -8.113 503 HE1 PHE 156 HE1 PHE 156 7.168 11.502 -6.052 504 HE2 PHE 156 HE2 PHE 156 5.609 14.297 -8.917 505 HZ PHE 156 HZ PHE 156 7.538 13.129 -7.887 506 H MET 157 HN MET 157 2.549 9.543 -4.893 507 HA MET 157 HA MET 157 4.921 8.246 -5.738 508 HB2 MET 157 HB2 MET 157 2.750 7.137 -3.931 509 HB3 MET 157 HB1 MET 157 4.477 6.788 -3.856 510 HG2 MET 157 HG2 MET 157 4.022 9.645 -3.747 511 HG3 MET 157 HG1 MET 157 3.106 8.826 -2.481 512 HE1 MET 157 HE1 MET 157 6.355 10.740 -2.190 513 HE2 MET 157 HE2 MET 157 5.917 10.227 -3.818 514 HE3 MET 157 HE3 MET 157 7.400 9.624 -3.081 515 H LYS 158 HN LYS 158 1.549 7.522 -6.432 516 HA LYS 158 HA LYS 158 1.969 4.820 -7.396 517 HB2 LYS 158 HB2 LYS 158 -0.144 6.747 -7.007 518 HB3 LYS 158 HB1 LYS 158 -0.300 6.017 -8.605 519 HG2 LYS 158 HG2 LYS 158 -0.611 3.883 -7.754 520 HG3 LYS 158 HG1 LYS 158 0.280 4.233 -6.272 521 HD2 LYS 158 HD2 LYS 158 -1.661 5.885 -5.759 522 HD3 LYS 158 HD1 LYS 158 -2.550 4.979 -6.985 523 HE2 LYS 158 HE2 LYS 158 -2.652 3.063 -5.690 524 HE3 LYS 158 HE1 LYS 158 -1.124 3.420 -4.860 525 HZ1 LYS 158 HZ1 LYS 158 -2.248 5.348 -3.827 526 HZ2 LYS 158 HZ2 LYS 158 -2.920 3.860 -3.356 527 HZ3 LYS 158 HZ3 LYS 158 -3.714 4.830 -4.502 528 H GLY 159 HN GLY 159 2.523 7.964 -8.743 529 HA2 GLY 159 HA2 GLY 159 2.436 6.996 -11.529 530 HA3 GLY 159 HA1 GLY 159 2.813 8.642 -11.017 531 H VAL 160 HN VAL 160 4.469 6.225 -9.259 532 HA VAL 160 HA VAL 160 6.954 6.782 -10.847 533 HB VAL 160 HB VAL 160 6.759 5.937 -7.947 534 HG11 VAL 160 HG11 VAL 160 8.887 7.708 -8.407 535 HG12 VAL 160 HG12 VAL 160 8.871 6.642 -9.812 536 HG13 VAL 160 HG13 VAL 160 9.000 5.961 -8.191 537 HG21 VAL 160 HG21 VAL 160 7.209 8.590 -7.767 538 HG22 VAL 160 HG22 VAL 160 5.585 7.904 -7.713 539 HG23 VAL 160 HG23 VAL 160 6.210 8.576 -9.220 540 H GLU 161 HN GLU 161 6.162 4.838 -12.176 541 HA GLU 161 HA GLU 161 6.372 2.548 -12.731 542 HB2 GLU 161 HB2 GLU 161 8.652 3.423 -11.523 543 HB3 GLU 161 HB1 GLU 161 8.207 2.101 -10.442 544 HG2 GLU 161 HG2 GLU 161 7.803 0.846 -12.772 545 HG3 GLU 161 HG1 GLU 161 9.011 2.012 -13.315 546 HO1 KDH 1 H1 KDH 1 12.319 8.935 -11.246 547 H21 KDH 1 H21 KDH 1 11.831 8.069 -3.550 548 H33 KDH 1 H33 KDH 1 9.150 12.469 -6.513 549 H4 KDH 1 H4 KDH 1 12.097 9.457 -7.685 550 HO7 KDH 1 H7 KDH 1 10.298 9.811 -12.357 551 H01 KDH 1 H01 KDH 1 10.217 13.277 -4.316 552 H01A KDH 1 H02 KDH 1 8.888 12.054 -4.239 553 HO03 KDH 1 H03 KDH 1 11.754 13.388 -1.386 554 HO10 KDH 1 H10 KDH 1 7.902 10.905 -11.345 555 H12 KDH 1 H12 KDH 1 7.936 10.845 -8.083 556 H15 KDH 1 H15 KDH 1 8.895 10.209 -6.018 557 H26 KDH 1 H26 KDH 1 12.144 11.205 -0.497 558 H39 KDH 1 H39 KDH 1 13.394 14.686 -8.328 559 H41 KDH 1 H41 KDH 1 9.749 12.438 -9.340 560 HO02 KDH 1 H42 KDH 1 13.417 8.157 -1.619 561 HO44 KDH 1 H44 KDH 1 10.612 12.568 -12.870 562 HO47 KDH 1 H47 KDH 1 11.982 13.240 -13.302 563 HO50 KDH 1 H50 KDH 1 14.461 14.553 -11.834 Start of MODEL 24 1 H1 MET 90 HT1 MET 90 13.454 6.091 1.115 2 H2 MET 90 HT2 MET 90 14.160 7.157 2.235 3 H3 MET 90 HT3 MET 90 12.844 7.665 1.287 4 HA MET 90 HA MET 90 12.591 5.384 3.161 5 HB2 MET 90 HB2 MET 90 12.814 8.319 3.617 6 HB3 MET 90 HB1 MET 90 11.545 7.481 4.511 7 HG2 MET 90 HG2 MET 90 14.312 6.316 4.439 8 HG3 MET 90 HG1 MET 90 13.960 7.649 5.538 9 HE1 MET 90 HE1 MET 90 13.140 3.310 6.057 10 HE2 MET 90 HE2 MET 90 14.577 4.224 5.603 11 HE3 MET 90 HE3 MET 90 13.256 4.043 4.451 12 H GLY 91 HN GLY 91 11.502 6.412 0.425 13 HA2 GLY 91 HA2 GLY 91 8.650 6.787 1.199 14 HA3 GLY 91 HA1 GLY 91 9.325 7.136 -0.393 15 H LYS 92 HN LYS 92 7.436 4.966 1.243 16 HA LYS 92 HA LYS 92 7.801 2.930 -0.899 17 HB2 LYS 92 HB2 LYS 92 8.576 2.731 1.915 18 HB3 LYS 92 HB1 LYS 92 7.466 1.446 1.438 19 HG2 LYS 92 HG2 LYS 92 9.626 2.032 -0.501 20 HG3 LYS 92 HG1 LYS 92 10.155 1.334 1.030 21 HD2 LYS 92 HD2 LYS 92 7.785 -0.029 0.098 22 HD3 LYS 92 HD1 LYS 92 9.017 -0.034 -1.164 23 HE2 LYS 92 HE2 LYS 92 10.651 -1.015 0.347 24 HE3 LYS 92 HE1 LYS 92 9.528 -0.867 1.714 25 HZ1 LYS 92 HZ1 LYS 92 7.967 -2.108 -0.005 26 HZ2 LYS 92 HZ2 LYS 92 8.984 -2.956 1.060 27 HZ3 LYS 92 HZ3 LYS 92 9.456 -2.707 -0.553 28 H SER 93 HN SER 93 6.090 2.535 2.160 29 HA SER 93 HA SER 93 3.512 2.487 0.642 30 HB2 SER 93 HB2 SER 93 2.887 0.799 2.107 31 HB3 SER 93 HB1 SER 93 4.633 0.568 2.124 32 HG SER 93 HG SER 93 4.447 0.916 4.185 33 H GLU 94 HN GLU 94 1.600 3.121 2.213 34 HA GLU 94 HA GLU 94 1.747 5.870 2.834 35 HB2 GLU 94 HB2 GLU 94 -0.020 3.560 3.546 36 HB3 GLU 94 HB1 GLU 94 -0.289 5.110 4.346 37 HG2 GLU 94 HG2 GLU 94 -1.399 5.809 2.518 38 HG3 GLU 94 HG1 GLU 94 0.113 5.703 1.612 39 H GLU 95 HN GLU 95 2.979 3.177 4.612 40 HA GLU 95 HA GLU 95 2.830 3.868 7.298 41 HB2 GLU 95 HB2 GLU 95 4.178 2.066 5.809 42 HB3 GLU 95 HB1 GLU 95 5.512 3.148 6.210 43 HG2 GLU 95 HG2 GLU 95 3.825 2.615 8.526 44 HG3 GLU 95 HG1 GLU 95 4.486 1.130 7.842 45 H GLU 96 HN GLU 96 5.696 4.799 5.364 46 HA GLU 96 HA GLU 96 6.142 7.123 7.141 47 HB2 GLU 96 HB2 GLU 96 8.018 5.710 6.531 48 HB3 GLU 96 HB1 GLU 96 7.637 5.869 4.816 49 HG2 GLU 96 HG2 GLU 96 9.223 7.517 4.913 50 HG3 GLU 96 HG1 GLU 96 7.861 8.484 5.477 51 H LEU 97 HN LEU 97 4.963 6.395 3.932 52 HA LEU 97 HA LEU 97 5.268 8.668 2.414 53 HB2 LEU 97 HB2 LEU 97 3.440 6.493 2.697 54 HB3 LEU 97 HB1 LEU 97 2.494 7.948 2.393 55 HG LEU 97 HG LEU 97 3.202 6.752 0.302 56 HD11 LEU 97 HD11 LEU 97 3.424 8.739 -0.827 57 HD12 LEU 97 HD12 LEU 97 4.673 9.340 0.263 58 HD13 LEU 97 HD13 LEU 97 2.978 9.390 0.750 59 HD21 LEU 97 HD21 LEU 97 5.845 7.610 0.026 60 HD22 LEU 97 HD22 LEU 97 5.314 5.950 0.296 61 HD23 LEU 97 HD23 LEU 97 5.774 6.961 1.665 62 H SER 98 HN SER 98 3.136 8.312 5.235 63 HA SER 98 HA SER 98 1.736 10.793 5.000 64 HB2 SER 98 HB2 SER 98 1.302 8.745 6.476 65 HB3 SER 98 HB1 SER 98 2.549 9.376 7.549 66 HG SER 98 HG SER 98 -0.019 10.289 7.035 67 H ASP 99 HN ASP 99 4.591 9.971 7.014 68 HA ASP 99 HA ASP 99 5.059 12.681 7.878 69 HB2 ASP 99 HB2 ASP 99 6.062 10.044 8.279 70 HB3 ASP 99 HB1 ASP 99 7.437 11.068 7.863 71 H LEU 100 HN LEU 100 6.330 10.721 5.192 72 HA LEU 100 HA LEU 100 8.459 12.236 4.259 73 HB2 LEU 100 HB2 LEU 100 6.772 10.214 3.347 74 HB3 LEU 100 HB1 LEU 100 6.590 11.485 2.137 75 HG LEU 100 HG LEU 100 9.368 11.239 2.863 76 HD11 LEU 100 HD11 LEU 100 9.229 8.981 3.395 77 HD12 LEU 100 HD12 LEU 100 9.473 8.887 1.651 78 HD13 LEU 100 HD13 LEU 100 7.853 8.707 2.326 79 HD21 LEU 100 HD21 LEU 100 9.270 11.998 0.733 80 HD22 LEU 100 HD22 LEU 100 7.631 11.384 0.516 81 HD23 LEU 100 HD23 LEU 100 9.013 10.320 0.256 82 H PHE 101 HN PHE 101 5.014 13.018 4.046 83 HA PHE 101 HA PHE 101 5.168 15.162 2.165 84 HB2 PHE 101 HB2 PHE 101 3.139 13.943 3.053 85 HB3 PHE 101 HB1 PHE 101 3.319 14.860 4.550 86 HD1 PHE 101 HD1 PHE 101 3.396 17.442 4.361 87 HD2 PHE 101 HD2 PHE 101 1.972 14.867 1.231 88 HE1 PHE 101 HE1 PHE 101 2.190 19.352 3.339 89 HE2 PHE 101 HE2 PHE 101 0.766 16.778 0.209 90 HZ PHE 101 HZ PHE 101 0.874 19.020 1.262 91 H ARG 102 HN ARG 102 5.498 15.120 5.717 92 HA ARG 102 HA ARG 102 5.560 17.824 6.343 93 HB2 ARG 102 HB2 ARG 102 6.571 15.321 7.375 94 HB3 ARG 102 HB1 ARG 102 7.726 16.614 7.701 95 HG2 ARG 102 HG2 ARG 102 6.409 17.399 9.345 96 HG3 ARG 102 HG1 ARG 102 5.088 17.614 8.196 97 HD2 ARG 102 HD2 ARG 102 4.037 15.694 8.862 98 HD3 ARG 102 HD1 ARG 102 5.566 14.811 9.041 99 HE ARG 102 HE ARG 102 5.258 16.933 11.015 100 HH11 ARG 102 HH21 ARG 102 4.521 13.668 10.158 101 HH12 ARG 102 HH22 ARG 102 4.326 13.146 11.797 102 HH21 ARG 102 HH11 ARG 102 5.009 16.261 13.156 103 HH22 ARG 102 HH12 ARG 102 4.604 14.611 13.492 104 H MET 103 HN MET 103 8.586 16.010 5.681 105 HA MET 103 HA MET 103 10.146 18.378 5.219 106 HB2 MET 103 HB2 MET 103 11.841 16.777 4.554 107 HB3 MET 103 HB1 MET 103 10.922 16.066 5.881 108 HG2 MET 103 HG2 MET 103 10.267 14.348 4.585 109 HG3 MET 103 HG1 MET 103 9.658 15.453 3.352 110 HE1 MET 103 HE1 MET 103 13.418 13.005 3.467 111 HE2 MET 103 HE2 MET 103 11.962 12.964 4.458 112 HE3 MET 103 HE3 MET 103 13.222 14.145 4.805 113 H PHE 104 HN PHE 104 7.853 16.751 3.261 114 HA PHE 104 HA PHE 104 8.983 17.342 0.652 115 HB2 PHE 104 HB2 PHE 104 6.940 15.819 1.711 116 HB3 PHE 104 HB1 PHE 104 6.057 17.129 0.929 117 HD1 PHE 104 HD2 PHE 104 6.399 17.593 -1.505 118 HD2 PHE 104 HD1 PHE 104 8.119 14.167 0.433 119 HE1 PHE 104 HE2 PHE 104 6.794 16.541 -3.717 120 HE2 PHE 104 HE1 PHE 104 8.514 13.115 -1.778 121 HZ PHE 104 HZ PHE 104 7.851 14.301 -3.852 122 H ASP 105 HN ASP 105 7.080 19.120 2.993 123 HA ASP 105 HA ASP 105 6.397 21.236 1.024 124 HB2 ASP 105 HB2 ASP 105 4.861 20.229 2.832 125 HB3 ASP 105 HB1 ASP 105 5.821 21.147 3.992 126 H LYS 106 HN LYS 106 8.226 22.491 0.627 127 HA LYS 106 HA LYS 106 10.291 23.077 2.529 128 HB2 LYS 106 HB2 LYS 106 9.564 23.626 -0.188 129 HB3 LYS 106 HB1 LYS 106 10.024 25.147 0.577 130 HG2 LYS 106 HG2 LYS 106 11.801 22.929 1.293 131 HG3 LYS 106 HG1 LYS 106 11.789 23.270 -0.438 132 HD2 LYS 106 HD2 LYS 106 13.320 24.866 0.123 133 HD3 LYS 106 HD1 LYS 106 11.890 25.799 0.565 134 HE2 LYS 106 HE2 LYS 106 13.075 25.953 2.560 135 HE3 LYS 106 HE1 LYS 106 12.205 24.437 2.867 136 HZ1 LYS 106 HZ1 LYS 106 15.003 24.856 2.174 137 HZ2 LYS 106 HZ2 LYS 106 14.239 23.534 1.431 138 HZ3 LYS 106 HZ3 LYS 106 14.294 23.644 3.125 139 H ASN 107 HN ASN 107 7.108 24.384 2.089 140 HA ASN 107 HA ASN 107 7.718 26.916 3.491 141 HB2 ASN 107 HB2 ASN 107 5.913 26.079 1.573 142 HB3 ASN 107 HB1 ASN 107 4.918 26.132 3.028 143 HD21 ASN 107 HD21 ASN 107 4.470 28.019 0.955 144 HD22 ASN 107 HD22 ASN 107 4.947 29.556 1.495 145 H ALA 108 HN ALA 108 6.497 23.723 4.202 146 HA ALA 108 HA ALA 108 5.764 22.751 6.230 147 HB1 ALA 108 HB1 ALA 108 7.932 24.519 6.658 148 HB2 ALA 108 HB2 ALA 108 7.431 23.180 7.691 149 HB3 ALA 108 HB3 ALA 108 6.801 24.802 7.982 150 H ASP 109 HN ASP 109 3.666 24.028 5.137 151 HA ASP 109 HA ASP 109 2.481 25.594 7.407 152 HB2 ASP 109 HB2 ASP 109 1.339 26.931 5.674 153 HB3 ASP 109 HB1 ASP 109 3.088 26.983 5.445 154 H GLY 110 HN GLY 110 2.232 22.876 5.348 155 HA2 GLY 110 HA2 GLY 110 0.544 21.170 5.996 156 HA3 GLY 110 HA1 GLY 110 -0.608 22.490 6.202 157 H TYR 111 HN TYR 111 1.317 23.131 3.538 158 HA TYR 111 HA TYR 111 -0.286 21.567 1.602 159 HB2 TYR 111 HB2 TYR 111 -0.376 24.591 1.864 160 HB3 TYR 111 HB1 TYR 111 -1.097 23.680 0.538 161 HD1 TYR 111 HD2 TYR 111 -2.883 21.942 1.076 162 HD2 TYR 111 HD1 TYR 111 -1.506 24.840 3.932 163 HE1 TYR 111 HE2 TYR 111 -4.917 21.562 2.444 164 HE2 TYR 111 HE1 TYR 111 -3.539 24.460 5.299 165 HH TYR 111 HH TYR 111 -5.381 23.242 5.552 166 H ILE 112 HN ILE 112 0.682 21.606 -0.514 167 HA ILE 112 HA ILE 112 3.361 22.955 -0.638 168 HB ILE 112 HB ILE 112 2.433 20.223 -1.570 169 HG12 ILE 112 HG12 ILE 112 4.529 21.141 0.425 170 HG13 ILE 112 HG11 ILE 112 2.989 20.374 0.815 171 HG21 ILE 112 HG21 ILE 112 3.928 21.260 -3.246 172 HG22 ILE 112 HG22 ILE 112 4.725 19.920 -2.421 173 HG23 ILE 112 HG23 ILE 112 5.114 21.583 -1.981 174 HD11 ILE 112 HD11 ILE 112 3.942 18.533 -0.894 175 HD12 ILE 112 HD12 ILE 112 4.306 18.491 0.831 176 HD13 ILE 112 HD13 ILE 112 5.475 19.172 -0.300 177 H ASP 113 HN ASP 113 3.725 24.145 -2.494 178 HA ASP 113 HA ASP 113 1.564 24.141 -4.562 179 HB2 ASP 113 HB2 ASP 113 2.377 26.408 -5.020 180 HB3 ASP 113 HB1 ASP 113 2.103 26.225 -3.288 181 H LEU 114 HN LEU 114 2.945 25.269 -6.673 182 HA LEU 114 HA LEU 114 4.428 23.001 -7.728 183 HB2 LEU 114 HB2 LEU 114 3.972 25.835 -8.718 184 HB3 LEU 114 HB1 LEU 114 4.610 24.516 -9.700 185 HG LEU 114 HG LEU 114 2.239 23.568 -8.437 186 HD11 LEU 114 HD11 LEU 114 1.940 26.202 -8.386 187 HD12 LEU 114 HD12 LEU 114 0.601 25.157 -8.861 188 HD13 LEU 114 HD13 LEU 114 1.565 25.972 -10.094 189 HD21 LEU 114 HD21 LEU 114 2.377 24.447 -11.308 190 HD22 LEU 114 HD22 LEU 114 1.673 22.981 -10.627 191 HD23 LEU 114 HD23 LEU 114 3.425 23.142 -10.752 192 H ASP 115 HN ASP 115 5.278 26.126 -6.321 193 HA ASP 115 HA ASP 115 8.047 26.131 -7.162 194 HB2 ASP 115 HB2 ASP 115 6.232 27.599 -5.321 195 HB3 ASP 115 HB1 ASP 115 7.954 27.704 -4.953 196 H GLU 116 HN GLU 116 6.627 25.595 -3.907 197 HA GLU 116 HA GLU 116 8.937 24.663 -2.606 198 HB2 GLU 116 HB2 GLU 116 6.040 23.802 -2.305 199 HB3 GLU 116 HB1 GLU 116 7.294 23.579 -1.085 200 HG2 GLU 116 HG2 GLU 116 7.318 25.795 -0.507 201 HG3 GLU 116 HG1 GLU 116 6.979 26.334 -2.152 202 H LEU 117 HN LEU 117 6.995 23.077 -5.022 203 HA LEU 117 HA LEU 117 7.748 20.347 -4.404 204 HB2 LEU 117 HB2 LEU 117 6.485 21.884 -6.644 205 HB3 LEU 117 HB1 LEU 117 7.044 20.244 -6.975 206 HG LEU 117 HG LEU 117 5.284 20.908 -4.607 207 HD11 LEU 117 HD11 LEU 117 4.018 19.530 -6.862 208 HD12 LEU 117 HD12 LEU 117 4.518 21.174 -7.260 209 HD13 LEU 117 HD13 LEU 117 3.428 20.888 -5.903 210 HD21 LEU 117 HD21 LEU 117 5.039 18.274 -5.798 211 HD22 LEU 117 HD22 LEU 117 5.485 18.706 -4.148 212 HD23 LEU 117 HD23 LEU 117 6.723 18.617 -5.400 213 H LYS 118 HN LYS 118 8.917 22.725 -6.816 214 HA LYS 118 HA LYS 118 11.086 20.962 -7.699 215 HB2 LYS 118 HB2 LYS 118 11.618 22.960 -9.095 216 HB3 LYS 118 HB1 LYS 118 9.915 22.513 -9.203 217 HG2 LYS 118 HG2 LYS 118 9.221 24.419 -8.177 218 HG3 LYS 118 HG1 LYS 118 10.545 24.385 -7.012 219 HD2 LYS 118 HD2 LYS 118 11.608 24.875 -9.641 220 HD3 LYS 118 HD1 LYS 118 10.315 26.028 -9.310 221 HE2 LYS 118 HE2 LYS 118 11.420 26.942 -7.457 222 HE3 LYS 118 HE1 LYS 118 12.402 25.484 -7.204 223 HZ1 LYS 118 HZ1 LYS 118 13.853 26.066 -8.806 224 HZ2 LYS 118 HZ2 LYS 118 13.284 27.640 -8.515 225 HZ3 LYS 118 HZ3 LYS 118 12.660 26.733 -9.809 226 H ILE 119 HN ILE 119 10.639 23.171 -5.120 227 HA ILE 119 HA ILE 119 13.512 23.878 -4.921 228 HB ILE 119 HB ILE 119 11.033 24.558 -3.308 229 HG12 ILE 119 HG12 ILE 119 12.662 26.050 -5.387 230 HG13 ILE 119 HG11 ILE 119 10.983 25.529 -5.527 231 HG21 ILE 119 HG21 ILE 119 13.733 24.728 -2.527 232 HG22 ILE 119 HG22 ILE 119 12.358 25.525 -1.763 233 HG23 ILE 119 HG23 ILE 119 13.282 26.363 -3.010 234 HD11 ILE 119 HD11 ILE 119 12.141 27.755 -3.878 235 HD12 ILE 119 HD12 ILE 119 10.649 26.972 -3.355 236 HD13 ILE 119 HD13 ILE 119 10.723 27.768 -4.927 237 H MET 120 HN MET 120 11.040 22.035 -3.124 238 HA MET 120 HA MET 120 12.507 21.311 -0.838 239 HB2 MET 120 HB2 MET 120 10.090 20.852 -1.449 240 HB3 MET 120 HB1 MET 120 10.668 19.524 -2.456 241 HG2 MET 120 HG2 MET 120 11.695 19.591 0.330 242 HG3 MET 120 HG1 MET 120 9.984 19.204 0.140 243 HE1 MET 120 HE1 MET 120 9.037 17.804 -1.288 244 HE2 MET 120 HE2 MET 120 9.512 16.107 -1.325 245 HE3 MET 120 HE3 MET 120 9.884 17.149 -2.696 246 H LEU 121 HN LEU 121 12.717 20.035 -4.132 247 HA LEU 121 HA LEU 121 14.573 17.882 -3.321 248 HB2 LEU 121 HB2 LEU 121 12.810 18.548 -5.506 249 HB3 LEU 121 HB1 LEU 121 14.419 18.198 -6.137 250 HG LEU 121 HG LEU 121 13.121 16.127 -5.997 251 HD11 LEU 121 HD11 LEU 121 15.015 15.061 -5.403 252 HD12 LEU 121 HD12 LEU 121 14.775 15.504 -3.712 253 HD13 LEU 121 HD13 LEU 121 15.638 16.595 -4.796 254 HD21 LEU 121 HD21 LEU 121 12.133 17.325 -3.630 255 HD22 LEU 121 HD22 LEU 121 12.991 15.870 -3.123 256 HD23 LEU 121 HD23 LEU 121 11.683 15.757 -4.301 257 H GLN 122 HN GLN 122 14.695 21.129 -4.604 258 HA GLN 122 HA GLN 122 17.042 21.333 -6.028 259 HB2 GLN 122 HB2 GLN 122 15.454 23.139 -5.225 260 HB3 GLN 122 HB1 GLN 122 16.307 23.105 -3.681 261 HG2 GLN 122 HG2 GLN 122 18.180 23.270 -5.893 262 HG3 GLN 122 HG1 GLN 122 17.017 24.596 -5.950 263 HE21 GLN 122 HE21 GLN 122 18.480 26.237 -5.184 264 HE22 GLN 122 HE22 GLN 122 19.109 26.232 -3.607 265 H ALA 123 HN ALA 123 16.753 20.629 -2.581 266 HA ALA 123 HA ALA 123 19.374 21.129 -1.682 267 HB1 ALA 123 HB1 ALA 123 17.775 18.685 -0.924 268 HB2 ALA 123 HB2 ALA 123 17.213 20.302 -0.500 269 HB3 ALA 123 HB3 ALA 123 18.759 19.716 0.114 270 H THR 124 HN THR 124 18.279 18.736 -3.945 271 HA THR 124 HA THR 124 20.728 17.082 -3.603 272 HB THR 124 HB THR 124 19.533 15.569 -5.126 273 HG1 THR 124 HG1 THR 124 17.310 16.386 -5.652 274 HG21 THR 124 HG21 THR 124 18.870 15.314 -2.854 275 HG22 THR 124 HG22 THR 124 17.367 15.367 -3.777 276 HG23 THR 124 HG23 THR 124 17.910 16.793 -2.892 277 H GLY 125 HN GLY 125 19.582 19.700 -5.497 278 HA2 GLY 125 HA2 GLY 125 21.075 20.895 -6.999 279 HA3 GLY 125 HA1 GLY 125 21.912 19.376 -7.320 280 H GLU 126 HN GLU 126 18.407 19.713 -7.296 281 HA GLU 126 HA GLU 126 18.148 18.475 -9.898 282 HB2 GLU 126 HB2 GLU 126 15.758 18.930 -9.493 283 HB3 GLU 126 HB1 GLU 126 16.520 18.325 -8.022 284 HG2 GLU 126 HG2 GLU 126 15.751 20.165 -6.973 285 HG3 GLU 126 HG1 GLU 126 16.897 21.102 -7.932 286 H THR 127 HN THR 127 19.316 19.856 -11.386 287 HA THR 127 HA THR 127 18.273 22.635 -11.716 288 HB THR 127 HB THR 127 20.329 22.976 -12.962 289 HG1 THR 127 HG1 THR 127 20.341 20.991 -14.055 290 HG21 THR 127 HG21 THR 127 21.190 23.177 -10.883 291 HG22 THR 127 HG22 THR 127 21.868 21.570 -11.140 292 HG23 THR 127 HG23 THR 127 20.327 21.752 -10.303 293 H ILE 128 HN ILE 128 16.308 22.175 -12.838 294 HA ILE 128 HA ILE 128 16.698 21.154 -15.625 295 HB ILE 128 HB ILE 128 14.782 19.737 -15.366 296 HG12 ILE 128 HG12 ILE 128 14.373 21.263 -12.781 297 HG13 ILE 128 HG11 ILE 128 13.279 21.170 -14.162 298 HG21 ILE 128 HG21 ILE 128 16.201 19.518 -12.707 299 HG22 ILE 128 HG22 ILE 128 16.973 19.054 -14.223 300 HG23 ILE 128 HG23 ILE 128 15.516 18.220 -13.684 301 HD11 ILE 128 HD11 ILE 128 13.756 18.501 -13.398 302 HD12 ILE 128 HD12 ILE 128 12.271 19.423 -13.162 303 HD13 ILE 128 HD13 ILE 128 13.497 19.384 -11.894 304 H THR 129 HN THR 129 14.684 21.753 -16.983 305 HA THR 129 HA THR 129 14.230 24.565 -16.925 306 HB THR 129 HB THR 129 12.513 23.997 -18.626 307 HG1 THR 129 HG1 THR 129 12.852 21.485 -17.430 308 HG21 THR 129 HG21 THR 129 15.134 23.730 -18.913 309 HG22 THR 129 HG22 THR 129 14.032 23.223 -20.193 310 HG23 THR 129 HG23 THR 129 14.716 22.026 -19.092 311 H GLU 130 HN GLU 130 12.342 25.757 -16.271 312 HA GLU 130 HA GLU 130 11.084 24.887 -13.833 313 HB2 GLU 130 HB2 GLU 130 9.942 27.002 -14.010 314 HB3 GLU 130 HB1 GLU 130 11.557 27.244 -14.677 315 HG2 GLU 130 HG2 GLU 130 10.604 26.800 -16.961 316 HG3 GLU 130 HG1 GLU 130 8.999 26.775 -16.230 317 H ASP 131 HN ASP 131 10.326 24.385 -17.183 318 HA ASP 131 HA ASP 131 7.466 23.930 -16.837 319 HB2 ASP 131 HB2 ASP 131 8.419 24.627 -18.966 320 HB3 ASP 131 HB1 ASP 131 9.487 23.223 -18.990 321 H ASP 132 HN ASP 132 10.386 21.954 -16.690 322 HA ASP 132 HA ASP 132 9.333 19.356 -16.957 323 HB2 ASP 132 HB2 ASP 132 11.673 20.699 -15.928 324 HB3 ASP 132 HB1 ASP 132 11.251 19.354 -14.868 325 H ILE 133 HN ILE 133 9.342 21.494 -14.109 326 HA ILE 133 HA ILE 133 8.476 19.754 -12.098 327 HB ILE 133 HB ILE 133 7.509 22.577 -12.662 328 HG12 ILE 133 HG12 ILE 133 9.895 22.642 -12.763 329 HG13 ILE 133 HG11 ILE 133 9.486 23.137 -11.122 330 HG21 ILE 133 HG21 ILE 133 7.541 20.790 -10.245 331 HG22 ILE 133 HG22 ILE 133 6.250 21.835 -10.838 332 HG23 ILE 133 HG23 ILE 133 7.657 22.538 -10.040 333 HD11 ILE 133 HD11 ILE 133 9.667 20.506 -10.684 334 HD12 ILE 133 HD12 ILE 133 11.087 21.552 -10.631 335 HD13 ILE 133 HD13 ILE 133 10.743 20.604 -12.079 336 H GLU 134 HN GLU 134 6.441 21.492 -14.477 337 HA GLU 134 HA GLU 134 3.893 20.672 -13.633 338 HB2 GLU 134 HB2 GLU 134 5.126 21.120 -16.362 339 HB3 GLU 134 HB1 GLU 134 3.395 20.868 -16.139 340 HG2 GLU 134 HG2 GLU 134 4.076 22.783 -14.215 341 HG3 GLU 134 HG1 GLU 134 4.975 23.260 -15.656 342 H GLU 135 HN GLU 135 6.273 18.890 -15.586 343 HA GLU 135 HA GLU 135 4.727 16.698 -16.431 344 HB2 GLU 135 HB2 GLU 135 7.081 17.214 -17.036 345 HB3 GLU 135 HB1 GLU 135 7.587 16.755 -15.410 346 HG2 GLU 135 HG2 GLU 135 7.929 14.881 -16.955 347 HG3 GLU 135 HG1 GLU 135 6.670 14.479 -15.786 348 H LEU 136 HN LEU 136 6.153 17.348 -13.251 349 HA LEU 136 HA LEU 136 5.261 14.715 -12.220 350 HB2 LEU 136 HB2 LEU 136 6.799 17.071 -11.088 351 HB3 LEU 136 HB1 LEU 136 6.426 15.621 -10.155 352 HG LEU 136 HG LEU 136 7.521 14.874 -12.717 353 HD11 LEU 136 HD11 LEU 136 8.594 17.295 -11.730 354 HD12 LEU 136 HD12 LEU 136 9.258 16.276 -13.007 355 HD13 LEU 136 HD13 LEU 136 9.772 16.043 -11.336 356 HD21 LEU 136 HD21 LEU 136 7.422 13.662 -10.430 357 HD22 LEU 136 HD22 LEU 136 8.845 14.617 -10.015 358 HD23 LEU 136 HD23 LEU 136 8.902 13.495 -11.374 359 H MET 137 HN MET 137 4.820 18.164 -11.311 360 HA MET 137 HA MET 137 2.840 17.890 -9.358 361 HB2 MET 137 HB2 MET 137 4.065 19.909 -10.799 362 HB3 MET 137 HB1 MET 137 2.376 20.066 -11.281 363 HG2 MET 137 HG2 MET 137 2.877 19.646 -8.382 364 HG3 MET 137 HG1 MET 137 3.366 21.207 -9.041 365 HE1 MET 137 HE1 MET 137 1.942 21.527 -7.074 366 HE2 MET 137 HE2 MET 137 0.374 20.749 -6.871 367 HE3 MET 137 HE3 MET 137 0.455 22.422 -7.416 368 H LYS 138 HN LYS 138 2.533 17.550 -12.852 369 HA LYS 138 HA LYS 138 -0.221 17.829 -13.271 370 HB2 LYS 138 HB2 LYS 138 2.051 16.751 -14.563 371 HB3 LYS 138 HB1 LYS 138 0.828 15.481 -14.602 372 HG2 LYS 138 HG2 LYS 138 -0.272 16.570 -16.232 373 HG3 LYS 138 HG1 LYS 138 -0.450 17.977 -15.183 374 HD2 LYS 138 HD2 LYS 138 1.322 19.075 -16.126 375 HD3 LYS 138 HD1 LYS 138 2.236 17.589 -16.385 376 HE2 LYS 138 HE2 LYS 138 1.564 18.500 -18.561 377 HE3 LYS 138 HE1 LYS 138 0.637 17.016 -18.257 378 HZ1 LYS 138 HZ1 LYS 138 -1.036 18.549 -17.141 379 HZ2 LYS 138 HZ2 LYS 138 -0.971 18.595 -18.838 380 HZ3 LYS 138 HZ3 LYS 138 -0.237 19.825 -17.923 381 H ASP 139 HN ASP 139 1.492 15.265 -11.580 382 HA ASP 139 HA ASP 139 -1.006 13.650 -11.371 383 HB2 ASP 139 HB2 ASP 139 1.880 13.205 -11.400 384 HB3 ASP 139 HB1 ASP 139 1.101 12.368 -10.057 385 H GLY 140 HN GLY 140 1.111 15.725 -9.522 386 HA2 GLY 140 HA2 GLY 140 0.161 14.824 -6.914 387 HA3 GLY 140 HA1 GLY 140 1.142 16.259 -7.219 388 H ASP 141 HN ASP 141 -0.861 17.113 -9.324 389 HA ASP 141 HA ASP 141 -3.239 17.763 -7.662 390 HB2 ASP 141 HB2 ASP 141 -0.960 19.492 -8.219 391 HB3 ASP 141 HB1 ASP 141 -2.463 20.197 -8.816 392 H LYS 142 HN LYS 142 -3.336 16.092 -9.826 393 HA LYS 142 HA LYS 142 -3.554 17.030 -12.431 394 HB2 LYS 142 HB2 LYS 142 -4.797 14.954 -10.738 395 HB3 LYS 142 HB1 LYS 142 -5.726 15.367 -12.179 396 HG2 LYS 142 HG2 LYS 142 -3.409 15.178 -13.398 397 HG3 LYS 142 HG1 LYS 142 -2.950 14.232 -11.981 398 HD2 LYS 142 HD2 LYS 142 -3.809 12.535 -13.286 399 HD3 LYS 142 HD1 LYS 142 -5.293 13.047 -12.483 400 HE2 LYS 142 HE2 LYS 142 -6.187 13.858 -14.418 401 HE3 LYS 142 HE1 LYS 142 -4.651 14.594 -14.917 402 HZ1 LYS 142 HZ1 LYS 142 -3.806 12.423 -15.490 403 HZ2 LYS 142 HZ2 LYS 142 -5.260 12.694 -16.327 404 HZ3 LYS 142 HZ3 LYS 142 -5.237 11.680 -14.964 405 H ASN 143 HN ASN 143 -5.748 17.657 -9.732 406 HA ASN 143 HA ASN 143 -7.692 18.994 -11.527 407 HB2 ASN 143 HB2 ASN 143 -9.175 18.568 -9.828 408 HB3 ASN 143 HB1 ASN 143 -7.943 17.415 -9.328 409 HD21 ASN 143 HD21 ASN 143 -6.228 18.394 -7.745 410 HD22 ASN 143 HD22 ASN 143 -6.804 19.502 -6.596 411 H ASN 144 HN ASN 144 -4.955 20.119 -11.080 412 HA ASN 144 HA ASN 144 -3.978 22.228 -10.635 413 HB2 ASN 144 HB2 ASN 144 -5.585 23.034 -12.190 414 HB3 ASN 144 HB1 ASN 144 -6.920 22.772 -11.068 415 HD21 ASN 144 HD21 ASN 144 -3.890 24.718 -11.336 416 HD22 ASN 144 HD22 ASN 144 -4.516 26.071 -10.524 417 H ASP 145 HN ASP 145 -6.974 23.187 -9.081 418 HA ASP 145 HA ASP 145 -7.491 23.588 -6.804 419 HB2 ASP 145 HB2 ASP 145 -5.907 21.229 -6.974 420 HB3 ASP 145 HB1 ASP 145 -5.313 22.150 -5.593 421 H GLY 146 HN GLY 146 -3.918 23.345 -7.063 422 HA2 GLY 146 HA2 GLY 146 -2.542 25.400 -7.066 423 HA3 GLY 146 HA1 GLY 146 -3.764 26.145 -6.033 424 H ARG 147 HN ARG 147 -3.252 22.908 -5.208 425 HA ARG 147 HA ARG 147 -0.966 23.320 -3.418 426 HB2 ARG 147 HB2 ARG 147 -2.338 23.108 -1.366 427 HB3 ARG 147 HB1 ARG 147 -2.813 24.530 -2.296 428 HG2 ARG 147 HG2 ARG 147 -4.284 22.204 -3.195 429 HG3 ARG 147 HG1 ARG 147 -4.485 22.424 -1.456 430 HD2 ARG 147 HD2 ARG 147 -4.825 24.973 -2.161 431 HD3 ARG 147 HD1 ARG 147 -5.314 24.229 -3.697 432 HE ARG 147 HE ARG 147 -6.580 22.720 -1.706 433 HH11 ARG 147 HH21 ARG 147 -6.473 26.007 -2.761 434 HH12 ARG 147 HH22 ARG 147 -8.095 26.354 -2.265 435 HH21 ARG 147 HH11 ARG 147 -8.699 23.161 -1.059 436 HH22 ARG 147 HH12 ARG 147 -9.354 24.746 -1.305 437 H ILE 148 HN ILE 148 -0.224 21.312 -2.591 438 HA ILE 148 HA ILE 148 -1.603 18.903 -3.707 439 HB ILE 148 HB ILE 148 1.227 19.380 -2.713 440 HG12 ILE 148 HG12 ILE 148 -0.022 19.352 -5.472 441 HG13 ILE 148 HG11 ILE 148 0.878 20.664 -4.710 442 HG21 ILE 148 HG21 ILE 148 0.013 17.051 -4.233 443 HG22 ILE 148 HG22 ILE 148 0.512 17.021 -2.542 444 HG23 ILE 148 HG23 ILE 148 1.718 17.228 -3.813 445 HD11 ILE 148 HD11 ILE 148 2.078 17.954 -5.337 446 HD12 ILE 148 HD12 ILE 148 2.933 19.399 -4.796 447 HD13 ILE 148 HD13 ILE 148 2.209 19.352 -6.404 448 H ASP 149 HN ASP 149 -3.100 18.484 -2.007 449 HA ASP 149 HA ASP 149 -2.362 18.529 0.797 450 HB2 ASP 149 HB2 ASP 149 -4.607 17.363 0.968 451 HB3 ASP 149 HB1 ASP 149 -4.639 18.884 0.075 452 H TYR 150 HN TYR 150 -2.358 16.576 2.187 453 HA TYR 150 HA TYR 150 -0.510 14.589 1.455 454 HB2 TYR 150 HB2 TYR 150 -1.159 15.089 3.745 455 HB3 TYR 150 HB1 TYR 150 -2.816 14.578 3.428 456 HD1 TYR 150 HD2 TYR 150 -0.147 12.694 1.823 457 HD2 TYR 150 HD1 TYR 150 -2.594 12.967 5.342 458 HE1 TYR 150 HE2 TYR 150 0.456 10.365 2.422 459 HE2 TYR 150 HE1 TYR 150 -1.990 10.638 5.942 460 HH TYR 150 HH TYR 150 -0.595 8.927 5.485 461 H ASP 151 HN ASP 151 -4.091 14.373 1.404 462 HA ASP 151 HA ASP 151 -4.458 11.739 0.583 463 HB2 ASP 151 HB2 ASP 151 -5.810 14.358 0.169 464 HB3 ASP 151 HB1 ASP 151 -6.336 13.037 -0.875 465 H GLU 152 HN GLU 152 -3.850 14.544 -1.567 466 HA GLU 152 HA GLU 152 -3.642 12.890 -3.958 467 HB2 GLU 152 HB2 GLU 152 -2.986 15.759 -3.237 468 HB3 GLU 152 HB1 GLU 152 -2.789 15.121 -4.869 469 HG2 GLU 152 HG2 GLU 152 -5.204 14.426 -4.821 470 HG3 GLU 152 HG1 GLU 152 -5.362 15.257 -3.273 471 H PHE 153 HN PHE 153 -1.546 13.494 -1.358 472 HA PHE 153 HA PHE 153 0.994 13.637 -2.712 473 HB2 PHE 153 HB2 PHE 153 0.420 14.245 -0.324 474 HB3 PHE 153 HB1 PHE 153 0.335 12.519 0.028 475 HD1 PHE 153 HD1 PHE 153 2.606 15.115 -1.424 476 HD2 PHE 153 HD2 PHE 153 2.283 11.329 0.580 477 HE1 PHE 153 HE1 PHE 153 5.070 15.048 -1.153 478 HE2 PHE 153 HE2 PHE 153 4.747 11.262 0.850 479 HZ PHE 153 HZ PHE 153 6.140 13.122 -0.015 480 H LEU 154 HN LEU 154 -1.164 10.994 -1.939 481 HA LEU 154 HA LEU 154 0.862 8.898 -2.211 482 HB2 LEU 154 HB2 LEU 154 -2.031 9.200 -1.658 483 HB3 LEU 154 HB1 LEU 154 -1.581 7.694 -2.459 484 HG LEU 154 HG LEU 154 -1.478 7.381 -0.039 485 HD11 LEU 154 HD11 LEU 154 0.360 6.103 -0.297 486 HD12 LEU 154 HD12 LEU 154 1.399 7.527 -0.391 487 HD13 LEU 154 HD13 LEU 154 0.621 6.905 -1.846 488 HD21 LEU 154 HD21 LEU 154 0.074 8.725 1.327 489 HD22 LEU 154 HD22 LEU 154 -1.133 9.759 0.562 490 HD23 LEU 154 HD23 LEU 154 0.504 9.681 -0.092 491 H GLU 155 HN GLU 155 -2.041 9.738 -4.151 492 HA GLU 155 HA GLU 155 -1.405 8.103 -6.393 493 HB2 GLU 155 HB2 GLU 155 -3.497 9.590 -5.586 494 HB3 GLU 155 HB1 GLU 155 -2.813 10.706 -6.769 495 HG2 GLU 155 HG2 GLU 155 -4.047 9.492 -8.254 496 HG3 GLU 155 HG1 GLU 155 -2.688 8.370 -8.161 497 H PHE 156 HN PHE 156 0.074 11.002 -5.301 498 HA PHE 156 HA PHE 156 0.884 12.124 -7.835 499 HB2 PHE 156 HB2 PHE 156 0.900 13.466 -5.850 500 HB3 PHE 156 HB1 PHE 156 1.884 12.287 -4.983 501 HD1 PHE 156 HD1 PHE 156 2.463 13.226 -8.509 502 HD2 PHE 156 HD2 PHE 156 3.706 13.790 -4.437 503 HE1 PHE 156 HE1 PHE 156 4.524 14.362 -9.295 504 HE2 PHE 156 HE2 PHE 156 5.766 14.926 -5.222 505 HZ PHE 156 HZ PHE 156 6.175 15.211 -7.651 506 H MET 157 HN MET 157 2.590 10.032 -5.476 507 HA MET 157 HA MET 157 4.742 9.562 -7.476 508 HB2 MET 157 HB2 MET 157 5.900 8.601 -5.523 509 HB3 MET 157 HB1 MET 157 5.261 10.198 -5.134 510 HG2 MET 157 HG2 MET 157 3.375 9.243 -3.972 511 HG3 MET 157 HG1 MET 157 3.788 7.621 -4.529 512 HE1 MET 157 HE1 MET 157 6.837 9.862 -3.771 513 HE2 MET 157 HE2 MET 157 6.731 10.086 -2.027 514 HE3 MET 157 HE3 MET 157 5.461 10.724 -3.068 515 H LYS 158 HN LYS 158 2.174 7.856 -5.729 516 HA LYS 158 HA LYS 158 1.460 5.593 -5.875 517 HB2 LYS 158 HB2 LYS 158 0.999 6.975 -8.097 518 HB3 LYS 158 HB1 LYS 158 2.143 5.823 -8.785 519 HG2 LYS 158 HG2 LYS 158 0.570 4.217 -8.825 520 HG3 LYS 158 HG1 LYS 158 0.268 4.427 -7.100 521 HD2 LYS 158 HD2 LYS 158 -1.283 6.250 -7.545 522 HD3 LYS 158 HD1 LYS 158 -0.912 6.188 -9.268 523 HE2 LYS 158 HE2 LYS 158 -1.622 3.555 -8.640 524 HE3 LYS 158 HE1 LYS 158 -2.784 4.553 -7.744 525 HZ1 LYS 158 HZ1 LYS 158 -2.172 4.598 -10.638 526 HZ2 LYS 158 HZ2 LYS 158 -2.898 5.927 -9.868 527 HZ3 LYS 158 HZ3 LYS 158 -3.680 4.419 -9.883 528 H GLY 159 HN GLY 159 4.235 5.759 -5.166 529 HA2 GLY 159 HA2 GLY 159 6.108 4.350 -5.040 530 HA3 GLY 159 HA1 GLY 159 5.115 3.112 -5.811 531 H VAL 160 HN VAL 160 6.609 6.229 -6.766 532 HA VAL 160 HA VAL 160 6.828 5.764 -9.524 533 HB VAL 160 HB VAL 160 8.675 7.404 -9.376 534 HG11 VAL 160 HG11 VAL 160 7.314 9.121 -8.668 535 HG12 VAL 160 HG12 VAL 160 6.848 8.281 -7.189 536 HG13 VAL 160 HG13 VAL 160 6.104 7.839 -8.726 537 HG21 VAL 160 HG21 VAL 160 8.509 6.818 -6.401 538 HG22 VAL 160 HG22 VAL 160 9.479 8.097 -7.131 539 HG23 VAL 160 HG23 VAL 160 9.857 6.407 -7.461 540 H GLU 161 HN GLU 161 7.988 4.293 -10.705 541 HA GLU 161 HA GLU 161 9.854 2.471 -9.323 542 HB2 GLU 161 HB2 GLU 161 8.000 1.963 -11.081 543 HB3 GLU 161 HB1 GLU 161 9.179 2.531 -12.263 544 HG2 GLU 161 HG2 GLU 161 10.739 0.854 -10.809 545 HG3 GLU 161 HG1 GLU 161 9.177 0.051 -10.640 546 HO1 KDH 1 H1 KDH 1 8.172 9.691 -10.630 547 H21 KDH 1 H21 KDH 1 13.359 8.679 -3.290 548 H33 KDH 1 H33 KDH 1 9.604 12.590 -5.772 549 H4 KDH 1 H4 KDH 1 8.596 11.228 -7.497 550 HO7 KDH 1 H7 KDH 1 11.498 8.934 -11.433 551 H01 KDH 1 H01 KDH 1 10.659 13.461 -3.618 552 H01A KDH 1 H02 KDH 1 9.582 12.014 -3.497 553 HO03 KDH 1 H03 KDH 1 12.387 13.929 -1.146 554 HO10 KDH 1 H10 KDH 1 12.586 8.399 -10.508 555 H12 KDH 1 H12 KDH 1 12.702 9.688 -7.092 556 H15 KDH 1 H15 KDH 1 9.691 10.298 -5.314 557 H26 KDH 1 H26 KDH 1 13.337 11.710 -0.119 558 H39 KDH 1 H39 KDH 1 10.559 12.423 -8.840 559 H41 KDH 1 H41 KDH 1 13.362 15.574 -7.591 560 HO02 KDH 1 H42 KDH 1 14.033 8.494 -0.746 561 HO44 KDH 1 H44 KDH 1 15.157 15.284 -10.737 562 HO47 KDH 1 H47 KDH 1 14.004 12.945 -12.077 563 HO50 KDH 1 H50 KDH 1 12.189 12.265 -12.123 Start of MODEL 25 1 H1 MET 90 HT1 MET 90 15.420 6.343 2.596 2 H2 MET 90 HT2 MET 90 14.329 7.242 3.538 3 H3 MET 90 HT3 MET 90 14.008 6.966 1.893 4 HA MET 90 HA MET 90 13.777 4.581 2.319 5 HB2 MET 90 HB2 MET 90 15.443 4.973 4.302 6 HB3 MET 90 HB1 MET 90 13.983 5.302 5.237 7 HG2 MET 90 HG2 MET 90 13.080 3.082 4.362 8 HG3 MET 90 HG1 MET 90 14.712 2.754 3.779 9 HE1 MET 90 HE1 MET 90 13.656 0.794 7.175 10 HE2 MET 90 HE2 MET 90 14.294 0.453 5.569 11 HE3 MET 90 HE3 MET 90 12.757 1.299 5.738 12 H GLY 91 HN GLY 91 11.967 6.464 1.619 13 HA2 GLY 91 HA2 GLY 91 9.850 6.407 3.727 14 HA3 GLY 91 HA1 GLY 91 9.909 7.570 2.401 15 H LYS 92 HN LYS 92 7.849 5.469 3.251 16 HA LYS 92 HA LYS 92 7.332 4.478 0.503 17 HB2 LYS 92 HB2 LYS 92 8.280 2.900 2.805 18 HB3 LYS 92 HB1 LYS 92 6.855 2.225 2.013 19 HG2 LYS 92 HG2 LYS 92 7.954 2.053 -0.077 20 HG3 LYS 92 HG1 LYS 92 9.249 3.143 0.421 21 HD2 LYS 92 HD2 LYS 92 10.198 0.963 0.532 22 HD3 LYS 92 HD1 LYS 92 9.827 1.391 2.203 23 HE2 LYS 92 HE2 LYS 92 7.578 0.194 1.859 24 HE3 LYS 92 HE1 LYS 92 8.293 -0.475 0.378 25 HZ1 LYS 92 HZ1 LYS 92 10.266 -1.059 1.827 26 HZ2 LYS 92 HZ2 LYS 92 8.863 -1.987 2.063 27 HZ3 LYS 92 HZ3 LYS 92 9.265 -0.755 3.162 28 H SER 93 HN SER 93 5.937 3.121 3.432 29 HA SER 93 HA SER 93 3.252 3.933 2.595 30 HB2 SER 93 HB2 SER 93 4.513 2.338 4.812 31 HB3 SER 93 HB1 SER 93 2.808 2.771 4.907 32 HG SER 93 HG SER 93 3.969 1.575 2.617 33 H GLU 94 HN GLU 94 1.781 5.071 4.161 34 HA GLU 94 HA GLU 94 2.520 7.641 4.860 35 HB2 GLU 94 HB2 GLU 94 0.468 5.681 5.621 36 HB3 GLU 94 HB1 GLU 94 0.738 6.917 6.850 37 HG2 GLU 94 HG2 GLU 94 -0.198 8.538 5.578 38 HG3 GLU 94 HG1 GLU 94 0.653 8.005 4.128 39 H GLU 95 HN GLU 95 3.298 4.691 6.590 40 HA GLU 95 HA GLU 95 3.845 5.450 9.184 41 HB2 GLU 95 HB2 GLU 95 5.137 3.680 7.158 42 HB3 GLU 95 HB1 GLU 95 6.024 3.964 8.656 43 HG2 GLU 95 HG2 GLU 95 3.882 3.360 9.896 44 HG3 GLU 95 HG1 GLU 95 3.247 2.805 8.346 45 H GLU 96 HN GLU 96 6.448 5.587 6.724 46 HA GLU 96 HA GLU 96 7.749 7.756 8.282 47 HB2 GLU 96 HB2 GLU 96 8.574 5.476 6.882 48 HB3 GLU 96 HB1 GLU 96 9.076 6.822 5.858 49 HG2 GLU 96 HG2 GLU 96 10.799 7.228 7.244 50 HG3 GLU 96 HG1 GLU 96 9.662 7.529 8.559 51 H LEU 97 HN LEU 97 5.774 7.362 5.494 52 HA LEU 97 HA LEU 97 6.748 9.450 3.800 53 HB2 LEU 97 HB2 LEU 97 4.719 7.556 3.839 54 HB3 LEU 97 HB1 LEU 97 3.837 9.082 3.894 55 HG LEU 97 HG LEU 97 4.963 9.874 1.899 56 HD11 LEU 97 HD11 LEU 97 6.461 8.020 0.745 57 HD12 LEU 97 HD12 LEU 97 6.677 7.468 2.405 58 HD13 LEU 97 HD13 LEU 97 7.154 9.103 1.951 59 HD21 LEU 97 HD21 LEU 97 3.413 7.422 1.985 60 HD22 LEU 97 HD22 LEU 97 4.498 7.424 0.594 61 HD23 LEU 97 HD23 LEU 97 3.343 8.738 0.813 62 H SER 98 HN SER 98 4.655 9.500 6.651 63 HA SER 98 HA SER 98 3.558 12.106 6.407 64 HB2 SER 98 HB2 SER 98 2.954 10.321 8.051 65 HB3 SER 98 HB1 SER 98 4.471 10.623 8.894 66 HG SER 98 HG SER 98 2.135 11.958 9.031 67 H ASP 99 HN ASP 99 6.811 11.087 7.141 68 HA ASP 99 HA ASP 99 7.594 13.641 8.374 69 HB2 ASP 99 HB2 ASP 99 8.466 11.062 8.500 70 HB3 ASP 99 HB1 ASP 99 9.618 11.735 7.346 71 H LEU 100 HN LEU 100 7.078 12.572 5.203 72 HA LEU 100 HA LEU 100 9.206 14.281 4.022 73 HB2 LEU 100 HB2 LEU 100 7.114 12.421 2.844 74 HB3 LEU 100 HB1 LEU 100 8.389 13.216 1.922 75 HG LEU 100 HG LEU 100 8.693 11.126 4.086 76 HD11 LEU 100 HD11 LEU 100 8.588 11.053 1.260 77 HD12 LEU 100 HD12 LEU 100 9.035 9.738 2.347 78 HD13 LEU 100 HD13 LEU 100 10.279 10.805 1.695 79 HD21 LEU 100 HD21 LEU 100 10.353 12.840 4.546 80 HD22 LEU 100 HD22 LEU 100 10.788 12.933 2.839 81 HD23 LEU 100 HD23 LEU 100 11.163 11.481 3.766 82 H PHE 101 HN PHE 101 5.650 13.883 3.750 83 HA PHE 101 HA PHE 101 5.053 16.114 2.164 84 HB2 PHE 101 HB2 PHE 101 3.637 14.189 3.275 85 HB3 PHE 101 HB1 PHE 101 3.374 15.382 4.548 86 HD1 PHE 101 HD2 PHE 101 3.115 14.878 0.854 87 HD2 PHE 101 HD1 PHE 101 1.790 17.106 4.278 88 HE1 PHE 101 HE2 PHE 101 1.390 15.990 -0.537 89 HE2 PHE 101 HE1 PHE 101 0.065 18.218 2.887 90 HZ PHE 101 HZ PHE 101 -0.136 17.660 0.479 91 H ARG 102 HN ARG 102 5.776 16.001 5.635 92 HA ARG 102 HA ARG 102 5.153 18.864 5.993 93 HB2 ARG 102 HB2 ARG 102 5.698 18.359 8.322 94 HB3 ARG 102 HB1 ARG 102 4.676 17.073 7.678 95 HG2 ARG 102 HG2 ARG 102 6.533 15.600 7.399 96 HG3 ARG 102 HG1 ARG 102 7.694 16.903 7.655 97 HD2 ARG 102 HD2 ARG 102 7.343 15.364 9.663 98 HD3 ARG 102 HD1 ARG 102 7.071 17.086 9.995 99 HE ARG 102 HE ARG 102 4.670 15.710 9.065 100 HH11 ARG 102 HH21 ARG 102 6.688 16.502 11.754 101 HH12 ARG 102 HH22 ARG 102 5.411 16.369 12.916 102 HH21 ARG 102 HH11 ARG 102 2.999 15.532 10.571 103 HH22 ARG 102 HH12 ARG 102 3.326 15.818 12.248 104 H MET 103 HN MET 103 7.790 17.085 4.849 105 HA MET 103 HA MET 103 9.840 18.936 5.944 106 HB2 MET 103 HB2 MET 103 9.730 16.237 5.326 107 HB3 MET 103 HB1 MET 103 10.629 16.914 3.968 108 HG2 MET 103 HG2 MET 103 12.460 17.118 5.255 109 HG3 MET 103 HG1 MET 103 11.569 18.139 6.384 110 HE1 MET 103 HE1 MET 103 11.152 17.368 8.892 111 HE2 MET 103 HE2 MET 103 10.146 15.926 9.005 112 HE3 MET 103 HE3 MET 103 9.742 17.185 7.841 113 H PHE 104 HN PHE 104 8.775 17.758 2.725 114 HA PHE 104 HA PHE 104 10.317 19.512 1.133 115 HB2 PHE 104 HB2 PHE 104 7.499 18.506 0.628 116 HB3 PHE 104 HB1 PHE 104 8.703 18.925 -0.591 117 HD1 PHE 104 HD1 PHE 104 11.064 17.737 1.102 118 HD2 PHE 104 HD2 PHE 104 7.262 16.199 -0.174 119 HE1 PHE 104 HE1 PHE 104 11.964 15.428 1.203 120 HE2 PHE 104 HE2 PHE 104 8.162 13.890 -0.074 121 HZ PHE 104 HZ PHE 104 10.513 13.505 0.615 122 H ASP 105 HN ASP 105 7.109 20.022 2.613 123 HA ASP 105 HA ASP 105 6.344 22.438 1.421 124 HB2 ASP 105 HB2 ASP 105 5.194 20.957 3.177 125 HB3 ASP 105 HB1 ASP 105 6.134 21.840 4.380 126 H LYS 106 HN LYS 106 8.244 23.739 1.003 127 HA LYS 106 HA LYS 106 9.907 24.652 3.254 128 HB2 LYS 106 HB2 LYS 106 9.994 24.492 0.384 129 HB3 LYS 106 HB1 LYS 106 10.316 26.157 0.871 130 HG2 LYS 106 HG2 LYS 106 12.325 25.621 1.769 131 HG3 LYS 106 HG1 LYS 106 11.683 24.176 2.550 132 HD2 LYS 106 HD2 LYS 106 11.605 23.239 0.088 133 HD3 LYS 106 HD1 LYS 106 12.813 24.489 -0.212 134 HE2 LYS 106 HE2 LYS 106 14.404 23.171 0.710 135 HE3 LYS 106 HE1 LYS 106 13.490 23.126 2.232 136 HZ1 LYS 106 HZ1 LYS 106 12.446 21.562 -0.001 137 HZ2 LYS 106 HZ2 LYS 106 12.433 21.218 1.663 138 HZ3 LYS 106 HZ3 LYS 106 13.846 20.969 0.752 139 H ASN 107 HN ASN 107 7.061 25.699 1.562 140 HA ASN 107 HA ASN 107 7.305 28.529 2.282 141 HB2 ASN 107 HB2 ASN 107 6.151 27.862 0.261 142 HB3 ASN 107 HB1 ASN 107 5.102 26.770 1.166 143 HD21 ASN 107 HD21 ASN 107 3.290 27.686 2.300 144 HD22 ASN 107 HD22 ASN 107 2.869 29.326 2.177 145 H ALA 108 HN ALA 108 6.605 25.777 4.058 146 HA ALA 108 HA ALA 108 5.536 25.437 6.142 147 HB1 ALA 108 HB1 ALA 108 7.015 27.741 6.176 148 HB2 ALA 108 HB2 ALA 108 6.196 27.081 7.592 149 HB3 ALA 108 HB3 ALA 108 5.428 28.354 6.643 150 H ASP 109 HN ASP 109 3.481 24.806 5.203 151 HA ASP 109 HA ASP 109 1.282 26.640 5.835 152 HB2 ASP 109 HB2 ASP 109 1.553 27.603 3.758 153 HB3 ASP 109 HB1 ASP 109 2.360 26.186 3.097 154 H GLY 110 HN GLY 110 2.360 23.593 4.352 155 HA2 GLY 110 HA2 GLY 110 1.429 21.512 5.390 156 HA3 GLY 110 HA1 GLY 110 -0.138 22.322 5.401 157 H TYR 111 HN TYR 111 1.196 23.320 2.594 158 HA TYR 111 HA TYR 111 0.356 20.898 1.046 159 HB2 TYR 111 HB2 TYR 111 -0.524 23.768 0.585 160 HB3 TYR 111 HB1 TYR 111 -1.012 22.372 -0.375 161 HD1 TYR 111 HD2 TYR 111 -1.330 24.058 2.892 162 HD2 TYR 111 HD1 TYR 111 -2.607 20.748 0.472 163 HE1 TYR 111 HE2 TYR 111 -3.180 23.611 4.482 164 HE2 TYR 111 HE1 TYR 111 -4.459 20.301 2.060 165 HH TYR 111 HH TYR 111 -4.584 21.498 5.119 166 H ILE 112 HN ILE 112 1.760 20.488 -0.636 167 HA ILE 112 HA ILE 112 4.008 22.338 -1.102 168 HB ILE 112 HB ILE 112 3.197 19.595 -2.097 169 HG12 ILE 112 HG12 ILE 112 5.551 20.484 -0.407 170 HG13 ILE 112 HG11 ILE 112 4.027 19.913 0.273 171 HG21 ILE 112 HG21 ILE 112 4.497 20.098 -3.900 172 HG22 ILE 112 HG22 ILE 112 5.831 19.853 -2.773 173 HG23 ILE 112 HG23 ILE 112 5.240 21.482 -3.100 174 HD11 ILE 112 HD11 ILE 112 4.668 17.979 -1.625 175 HD12 ILE 112 HD12 ILE 112 4.886 17.829 0.118 176 HD13 ILE 112 HD13 ILE 112 6.222 18.380 -0.894 177 H ASP 113 HN ASP 113 3.536 24.060 -2.451 178 HA ASP 113 HA ASP 113 1.574 23.768 -4.634 179 HB2 ASP 113 HB2 ASP 113 3.234 25.981 -3.425 180 HB3 ASP 113 HB1 ASP 113 2.323 26.240 -4.914 181 H LEU 114 HN LEU 114 2.224 24.564 -6.856 182 HA LEU 114 HA LEU 114 4.238 23.050 -8.064 183 HB2 LEU 114 HB2 LEU 114 2.995 25.729 -8.727 184 HB3 LEU 114 HB1 LEU 114 4.072 24.894 -9.845 185 HG LEU 114 HG LEU 114 1.952 23.185 -8.726 186 HD11 LEU 114 HD11 LEU 114 0.402 24.891 -8.918 187 HD12 LEU 114 HD12 LEU 114 0.402 24.308 -10.583 188 HD13 LEU 114 HD13 LEU 114 1.336 25.740 -10.150 189 HD21 LEU 114 HD21 LEU 114 3.340 23.719 -11.320 190 HD22 LEU 114 HD22 LEU 114 1.750 22.960 -11.384 191 HD23 LEU 114 HD23 LEU 114 3.061 22.185 -10.494 192 H ASP 115 HN ASP 115 4.490 26.445 -6.947 193 HA ASP 115 HA ASP 115 7.199 26.878 -7.702 194 HB2 ASP 115 HB2 ASP 115 5.352 28.485 -6.903 195 HB3 ASP 115 HB1 ASP 115 5.825 28.026 -5.266 196 H GLU 116 HN GLU 116 5.817 25.211 -4.925 197 HA GLU 116 HA GLU 116 8.417 25.124 -3.515 198 HB2 GLU 116 HB2 GLU 116 5.752 23.815 -2.888 199 HB3 GLU 116 HB1 GLU 116 7.084 24.087 -1.763 200 HG2 GLU 116 HG2 GLU 116 6.839 26.523 -2.050 201 HG3 GLU 116 HG1 GLU 116 5.509 26.258 -3.179 202 H LEU 117 HN LEU 117 6.884 23.336 -5.952 203 HA LEU 117 HA LEU 117 7.774 20.671 -5.142 204 HB2 LEU 117 HB2 LEU 117 6.547 21.989 -7.550 205 HB3 LEU 117 HB1 LEU 117 7.180 20.348 -7.690 206 HG LEU 117 HG LEU 117 5.236 21.186 -5.526 207 HD11 LEU 117 HD11 LEU 117 4.245 19.462 -7.692 208 HD12 LEU 117 HD12 LEU 117 4.644 21.097 -8.221 209 HD13 LEU 117 HD13 LEU 117 3.478 20.851 -6.920 210 HD21 LEU 117 HD21 LEU 117 6.574 19.172 -5.063 211 HD22 LEU 117 HD22 LEU 117 6.108 18.491 -6.623 212 HD23 LEU 117 HD23 LEU 117 4.893 18.732 -5.367 213 H LYS 118 HN LYS 118 8.802 22.975 -7.695 214 HA LYS 118 HA LYS 118 11.045 21.505 -8.629 215 HB2 LYS 118 HB2 LYS 118 11.690 23.645 -9.596 216 HB3 LYS 118 HB1 LYS 118 9.931 23.515 -9.655 217 HG2 LYS 118 HG2 LYS 118 9.723 24.882 -7.643 218 HG3 LYS 118 HG1 LYS 118 11.478 24.948 -7.476 219 HD2 LYS 118 HD2 LYS 118 11.697 26.537 -9.088 220 HD3 LYS 118 HD1 LYS 118 10.472 25.793 -10.117 221 HE2 LYS 118 HE2 LYS 118 9.091 27.484 -9.485 222 HE3 LYS 118 HE1 LYS 118 9.048 26.728 -7.880 223 HZ1 LYS 118 HZ1 LYS 118 11.106 27.902 -7.331 224 HZ2 LYS 118 HZ2 LYS 118 9.856 28.991 -7.706 225 HZ3 LYS 118 HZ3 LYS 118 11.080 28.673 -8.842 226 H ILE 119 HN ILE 119 10.718 23.752 -5.899 227 HA ILE 119 HA ILE 119 13.552 23.911 -5.315 228 HB ILE 119 HB ILE 119 10.962 24.532 -3.894 229 HG12 ILE 119 HG12 ILE 119 13.276 26.309 -4.718 230 HG13 ILE 119 HG11 ILE 119 11.898 25.969 -5.765 231 HG21 ILE 119 HG21 ILE 119 12.148 24.148 -1.963 232 HG22 ILE 119 HG22 ILE 119 12.771 25.759 -2.317 233 HG23 ILE 119 HG23 ILE 119 13.709 24.333 -2.761 234 HD11 ILE 119 HD11 ILE 119 11.418 26.950 -2.968 235 HD12 ILE 119 HD12 ILE 119 10.402 27.126 -4.399 236 HD13 ILE 119 HD13 ILE 119 11.861 28.101 -4.228 237 H MET 120 HN MET 120 10.947 21.722 -4.386 238 HA MET 120 HA MET 120 12.277 20.456 -2.166 239 HB2 MET 120 HB2 MET 120 9.894 20.268 -2.497 240 HB3 MET 120 HB1 MET 120 10.116 19.620 -4.122 241 HG2 MET 120 HG2 MET 120 11.604 17.901 -2.506 242 HG3 MET 120 HG1 MET 120 10.153 18.227 -1.559 243 HE1 MET 120 HE1 MET 120 8.714 15.238 -2.452 244 HE2 MET 120 HE2 MET 120 10.074 15.940 -1.580 245 HE3 MET 120 HE3 MET 120 10.370 14.927 -2.992 246 H LEU 121 HN LEU 121 11.871 19.399 -5.572 247 HA LEU 121 HA LEU 121 13.596 17.122 -5.386 248 HB2 LEU 121 HB2 LEU 121 12.226 18.760 -7.418 249 HB3 LEU 121 HB1 LEU 121 13.683 17.961 -8.011 250 HG LEU 121 HG LEU 121 11.795 16.470 -8.345 251 HD11 LEU 121 HD11 LEU 121 12.755 15.016 -6.038 252 HD12 LEU 121 HD12 LEU 121 14.094 15.848 -6.830 253 HD13 LEU 121 HD13 LEU 121 13.087 14.726 -7.746 254 HD21 LEU 121 HD21 LEU 121 11.155 17.377 -5.597 255 HD22 LEU 121 HD22 LEU 121 10.847 15.670 -5.920 256 HD23 LEU 121 HD23 LEU 121 10.072 16.909 -6.907 257 H GLN 122 HN GLN 122 14.275 20.522 -5.627 258 HA GLN 122 HA GLN 122 16.677 20.767 -6.964 259 HB2 GLN 122 HB2 GLN 122 15.282 22.405 -5.503 260 HB3 GLN 122 HB1 GLN 122 16.309 21.861 -4.175 261 HG2 GLN 122 HG2 GLN 122 17.501 22.815 -6.777 262 HG3 GLN 122 HG1 GLN 122 17.072 23.952 -5.498 263 HE21 GLN 122 HE21 GLN 122 19.811 23.481 -6.331 264 HE22 GLN 122 HE22 GLN 122 20.632 22.777 -5.022 265 H ALA 123 HN ALA 123 16.127 19.072 -3.924 266 HA ALA 123 HA ALA 123 18.707 18.837 -2.864 267 HB1 ALA 123 HB1 ALA 123 17.724 17.176 -1.607 268 HB2 ALA 123 HB2 ALA 123 17.024 16.385 -3.019 269 HB3 ALA 123 HB3 ALA 123 16.257 17.822 -2.343 270 H THR 124 HN THR 124 17.325 17.189 -5.680 271 HA THR 124 HA THR 124 19.819 15.596 -6.021 272 HB THR 124 HB THR 124 18.437 14.410 -7.694 273 HG1 THR 124 HG1 THR 124 16.276 15.104 -7.946 274 HG21 THR 124 HG21 THR 124 16.649 14.835 -5.318 275 HG22 THR 124 HG22 THR 124 18.241 14.109 -5.098 276 HG23 THR 124 HG23 THR 124 17.055 13.333 -6.148 277 H GLY 125 HN GLY 125 19.422 18.619 -6.571 278 HA2 GLY 125 HA2 GLY 125 20.215 20.142 -8.170 279 HA3 GLY 125 HA1 GLY 125 21.095 18.788 -8.879 280 H GLU 126 HN GLU 126 17.586 18.897 -8.498 281 HA GLU 126 HA GLU 126 16.946 18.010 -11.081 282 HB2 GLU 126 HB2 GLU 126 14.732 19.001 -10.575 283 HB3 GLU 126 HB1 GLU 126 15.405 18.201 -9.154 284 HG2 GLU 126 HG2 GLU 126 15.088 20.145 -8.050 285 HG3 GLU 126 HG1 GLU 126 16.415 20.799 -9.012 286 H THR 127 HN THR 127 18.247 19.082 -12.687 287 HA THR 127 HA THR 127 17.820 22.025 -12.993 288 HB THR 127 HB THR 127 19.735 21.364 -14.787 289 HG1 THR 127 HG1 THR 127 20.302 19.383 -14.483 290 HG21 THR 127 HG21 THR 127 20.736 22.792 -13.367 291 HG22 THR 127 HG22 THR 127 21.119 21.412 -12.338 292 HG23 THR 127 HG23 THR 127 19.641 22.333 -12.063 293 H ILE 128 HN ILE 128 15.748 21.956 -14.013 294 HA ILE 128 HA ILE 128 15.795 20.912 -16.815 295 HB ILE 128 HB ILE 128 13.577 19.971 -16.447 296 HG12 ILE 128 HG12 ILE 128 13.839 21.012 -13.609 297 HG13 ILE 128 HG11 ILE 128 12.828 21.747 -14.853 298 HG21 ILE 128 HG21 ILE 128 15.472 19.254 -14.193 299 HG22 ILE 128 HG22 ILE 128 15.491 18.564 -15.816 300 HG23 ILE 128 HG23 ILE 128 14.123 18.261 -14.745 301 HD11 ILE 128 HD11 ILE 128 11.287 20.036 -14.810 302 HD12 ILE 128 HD12 ILE 128 11.853 19.935 -13.143 303 HD13 ILE 128 HD13 ILE 128 12.487 18.825 -14.359 304 H THR 129 HN THR 129 13.858 21.911 -18.058 305 HA THR 129 HA THR 129 13.904 24.798 -17.702 306 HB THR 129 HB THR 129 11.866 23.507 -19.434 307 HG1 THR 129 HG1 THR 129 13.230 22.034 -20.038 308 HG21 THR 129 HG21 THR 129 12.989 25.958 -19.323 309 HG22 THR 129 HG22 THR 129 12.361 25.264 -20.818 310 HG23 THR 129 HG23 THR 129 14.088 25.188 -20.468 311 H GLU 130 HN GLU 130 12.079 26.129 -17.135 312 HA GLU 130 HA GLU 130 10.476 25.281 -14.965 313 HB2 GLU 130 HB2 GLU 130 9.251 27.386 -15.439 314 HB3 GLU 130 HB1 GLU 130 10.994 27.615 -15.578 315 HG2 GLU 130 HG2 GLU 130 10.928 27.711 -17.917 316 HG3 GLU 130 HG1 GLU 130 9.380 26.871 -18.004 317 H ASP 131 HN ASP 131 9.936 24.993 -18.430 318 HA ASP 131 HA ASP 131 7.092 24.470 -18.299 319 HB2 ASP 131 HB2 ASP 131 8.081 25.209 -20.349 320 HB3 ASP 131 HB1 ASP 131 9.302 23.936 -20.298 321 H ASP 132 HN ASP 132 9.844 22.602 -17.450 322 HA ASP 132 HA ASP 132 8.501 20.000 -17.919 323 HB2 ASP 132 HB2 ASP 132 11.210 21.041 -17.254 324 HB3 ASP 132 HB1 ASP 132 10.819 19.430 -16.648 325 H ILE 133 HN ILE 133 8.716 22.356 -15.452 326 HA ILE 133 HA ILE 133 8.645 20.620 -13.132 327 HB ILE 133 HB ILE 133 7.670 23.468 -13.530 328 HG12 ILE 133 HG12 ILE 133 10.050 22.969 -14.286 329 HG13 ILE 133 HG11 ILE 133 9.908 24.178 -13.010 330 HG21 ILE 133 HG21 ILE 133 6.969 22.424 -11.403 331 HG22 ILE 133 HG22 ILE 133 8.171 23.683 -11.123 332 HG23 ILE 133 HG23 ILE 133 8.643 21.985 -11.068 333 HD11 ILE 133 HD11 ILE 133 10.607 22.658 -11.334 334 HD12 ILE 133 HD12 ILE 133 11.686 22.334 -12.691 335 HD13 ILE 133 HD13 ILE 133 10.326 21.258 -12.369 336 H GLU 134 HN GLU 134 6.114 22.387 -14.954 337 HA GLU 134 HA GLU 134 3.863 21.666 -13.417 338 HB2 GLU 134 HB2 GLU 134 4.265 22.057 -16.399 339 HB3 GLU 134 HB1 GLU 134 2.677 21.968 -15.636 340 HG2 GLU 134 HG2 GLU 134 3.676 23.825 -14.046 341 HG3 GLU 134 HG1 GLU 134 4.775 24.098 -15.399 342 H GLU 135 HN GLU 135 5.866 19.681 -15.444 343 HA GLU 135 HA GLU 135 3.996 17.611 -16.122 344 HB2 GLU 135 HB2 GLU 135 6.768 18.243 -16.372 345 HB3 GLU 135 HB1 GLU 135 6.656 16.612 -15.711 346 HG2 GLU 135 HG2 GLU 135 4.679 16.782 -17.728 347 HG3 GLU 135 HG1 GLU 135 6.139 17.503 -18.405 348 H LEU 136 HN LEU 136 5.981 18.205 -13.246 349 HA LEU 136 HA LEU 136 5.397 15.601 -12.045 350 HB2 LEU 136 HB2 LEU 136 6.710 18.184 -11.190 351 HB3 LEU 136 HB1 LEU 136 6.489 16.848 -10.059 352 HG LEU 136 HG LEU 136 7.538 15.799 -12.510 353 HD11 LEU 136 HD11 LEU 136 8.988 18.201 -11.371 354 HD12 LEU 136 HD12 LEU 136 8.457 17.957 -13.035 355 HD13 LEU 136 HD13 LEU 136 9.777 16.988 -12.380 356 HD21 LEU 136 HD21 LEU 136 9.443 15.207 -10.938 357 HD22 LEU 136 HD22 LEU 136 7.849 14.694 -10.391 358 HD23 LEU 136 HD23 LEU 136 8.603 16.127 -9.692 359 H MET 137 HN MET 137 3.677 18.534 -12.349 360 HA MET 137 HA MET 137 2.295 18.473 -9.784 361 HB2 MET 137 HB2 MET 137 2.734 20.403 -11.487 362 HB3 MET 137 HB1 MET 137 1.310 19.777 -12.318 363 HG2 MET 137 HG2 MET 137 0.690 21.564 -10.730 364 HG3 MET 137 HG1 MET 137 -0.014 20.020 -10.253 365 HE1 MET 137 HE1 MET 137 -0.075 20.598 -7.204 366 HE2 MET 137 HE2 MET 137 -0.401 21.730 -8.513 367 HE3 MET 137 HE3 MET 137 0.699 22.189 -7.215 368 H LYS 138 HN LYS 138 1.349 17.597 -13.136 369 HA LYS 138 HA LYS 138 -1.273 16.706 -12.626 370 HB2 LYS 138 HB2 LYS 138 -1.008 15.505 -14.708 371 HB3 LYS 138 HB1 LYS 138 -0.042 16.977 -14.826 372 HG2 LYS 138 HG2 LYS 138 1.918 15.550 -13.956 373 HG3 LYS 138 HG1 LYS 138 0.908 14.154 -14.330 374 HD2 LYS 138 HD2 LYS 138 0.802 15.924 -16.567 375 HD3 LYS 138 HD1 LYS 138 2.497 15.713 -16.126 376 HE2 LYS 138 HE2 LYS 138 2.488 13.646 -17.047 377 HE3 LYS 138 HE1 LYS 138 1.167 13.160 -15.965 378 HZ1 LYS 138 HZ1 LYS 138 -0.328 14.474 -17.488 379 HZ2 LYS 138 HZ2 LYS 138 0.289 13.030 -18.134 380 HZ3 LYS 138 HZ3 LYS 138 0.960 14.522 -18.590 381 H ASP 139 HN ASP 139 1.813 15.000 -12.164 382 HA ASP 139 HA ASP 139 0.536 12.474 -11.422 383 HB2 ASP 139 HB2 ASP 139 2.817 12.846 -12.495 384 HB3 ASP 139 HB1 ASP 139 3.368 13.431 -10.924 385 H GLY 140 HN GLY 140 2.230 15.094 -9.671 386 HA2 GLY 140 HA2 GLY 140 1.870 13.930 -7.062 387 HA3 GLY 140 HA1 GLY 140 2.258 15.622 -7.381 388 H ASP 141 HN ASP 141 -0.068 16.105 -9.056 389 HA ASP 141 HA ASP 141 -2.355 15.676 -7.193 390 HB2 ASP 141 HB2 ASP 141 -1.014 17.823 -6.743 391 HB3 ASP 141 HB1 ASP 141 -1.607 18.390 -8.305 392 H LYS 142 HN LYS 142 -3.611 14.537 -8.689 393 HA LYS 142 HA LYS 142 -3.720 15.187 -11.511 394 HB2 LYS 142 HB2 LYS 142 -4.766 13.249 -9.607 395 HB3 LYS 142 HB1 LYS 142 -5.996 13.718 -10.780 396 HG2 LYS 142 HG2 LYS 142 -5.018 12.350 -12.276 397 HG3 LYS 142 HG1 LYS 142 -3.604 13.404 -12.250 398 HD2 LYS 142 HD2 LYS 142 -2.704 11.321 -11.645 399 HD3 LYS 142 HD1 LYS 142 -2.966 12.100 -10.084 400 HE2 LYS 142 HE2 LYS 142 -4.679 10.672 -9.511 401 HE3 LYS 142 HE1 LYS 142 -5.252 10.529 -11.185 402 HZ1 LYS 142 HZ1 LYS 142 -3.858 8.616 -10.008 403 HZ2 LYS 142 HZ2 LYS 142 -2.568 9.541 -10.613 404 HZ3 LYS 142 HZ3 LYS 142 -3.747 8.926 -11.671 405 H ASN 143 HN ASN 143 -5.130 16.627 -8.759 406 HA ASN 143 HA ASN 143 -7.629 17.490 -10.021 407 HB2 ASN 143 HB2 ASN 143 -7.311 17.090 -7.580 408 HB3 ASN 143 HB1 ASN 143 -6.171 18.436 -7.530 409 HD21 ASN 143 HD21 ASN 143 -7.769 19.457 -5.978 410 HD22 ASN 143 HD22 ASN 143 -9.122 20.261 -6.612 411 H ASN 144 HN ASN 144 -4.356 18.718 -9.704 412 HA ASN 144 HA ASN 144 -3.349 20.686 -10.542 413 HB2 ASN 144 HB2 ASN 144 -4.329 19.564 -12.572 414 HB3 ASN 144 HB1 ASN 144 -5.765 20.569 -12.374 415 HD21 ASN 144 HD21 ASN 144 -4.840 21.219 -14.695 416 HD22 ASN 144 HD22 ASN 144 -3.790 22.552 -14.704 417 H ASP 145 HN ASP 145 -4.844 21.202 -8.259 418 HA ASP 145 HA ASP 145 -6.550 23.569 -8.883 419 HB2 ASP 145 HB2 ASP 145 -7.336 23.258 -6.603 420 HB3 ASP 145 HB1 ASP 145 -7.312 21.681 -7.394 421 H GLY 146 HN GLY 146 -3.353 23.033 -8.446 422 HA2 GLY 146 HA2 GLY 146 -1.662 24.663 -8.073 423 HA3 GLY 146 HA1 GLY 146 -2.897 25.764 -7.458 424 H ARG 147 HN ARG 147 -2.979 22.583 -6.159 425 HA ARG 147 HA ARG 147 -1.220 23.228 -3.869 426 HB2 ARG 147 HB2 ARG 147 -4.070 23.717 -3.948 427 HB3 ARG 147 HB1 ARG 147 -3.705 22.501 -2.724 428 HG2 ARG 147 HG2 ARG 147 -2.654 23.998 -1.384 429 HG3 ARG 147 HG1 ARG 147 -1.819 24.757 -2.740 430 HD2 ARG 147 HD2 ARG 147 -3.302 26.441 -1.906 431 HD3 ARG 147 HD1 ARG 147 -4.127 25.786 -3.335 432 HE ARG 147 HE ARG 147 -4.941 24.142 -1.235 433 HH11 ARG 147 HH21 ARG 147 -4.980 27.517 -1.969 434 HH12 ARG 147 HH22 ARG 147 -6.433 27.825 -1.079 435 HH21 ARG 147 HH11 ARG 147 -6.836 24.533 -0.073 436 HH22 ARG 147 HH12 ARG 147 -7.483 26.138 -0.008 437 H ILE 148 HN ILE 148 -0.281 21.324 -3.229 438 HA ILE 148 HA ILE 148 -1.533 18.763 -4.120 439 HB ILE 148 HB ILE 148 1.252 19.408 -3.097 440 HG12 ILE 148 HG12 ILE 148 0.185 19.113 -5.925 441 HG13 ILE 148 HG11 ILE 148 0.763 20.607 -5.185 442 HG21 ILE 148 HG21 ILE 148 0.410 17.010 -2.937 443 HG22 ILE 148 HG22 ILE 148 1.867 17.236 -3.907 444 HG23 ILE 148 HG23 ILE 148 0.305 17.019 -4.698 445 HD11 ILE 148 HD11 ILE 148 2.608 18.264 -5.142 446 HD12 ILE 148 HD12 ILE 148 2.975 19.980 -5.313 447 HD13 ILE 148 HD13 ILE 148 2.359 19.068 -6.692 448 H ASP 149 HN ASP 149 -2.820 17.902 -2.522 449 HA ASP 149 HA ASP 149 -2.151 18.356 0.330 450 HB2 ASP 149 HB2 ASP 149 -4.460 16.954 -1.059 451 HB3 ASP 149 HB1 ASP 149 -4.392 17.367 0.654 452 H TYR 150 HN TYR 150 -2.692 16.218 1.698 453 HA TYR 150 HA TYR 150 -0.637 14.281 1.046 454 HB2 TYR 150 HB2 TYR 150 -1.851 15.158 3.292 455 HB3 TYR 150 HB1 TYR 150 -2.788 13.688 3.022 456 HD1 TYR 150 HD1 TYR 150 -0.426 12.255 1.539 457 HD2 TYR 150 HD2 TYR 150 -0.759 14.288 5.309 458 HE1 TYR 150 HE1 TYR 150 1.443 10.896 2.437 459 HE2 TYR 150 HE2 TYR 150 1.111 12.928 6.207 460 HH TYR 150 HH TYR 150 3.260 11.509 4.655 461 H ASP 151 HN ASP 151 -4.214 14.103 1.153 462 HA ASP 151 HA ASP 151 -4.606 11.434 0.418 463 HB2 ASP 151 HB2 ASP 151 -6.308 13.175 1.036 464 HB3 ASP 151 HB1 ASP 151 -6.132 13.861 -0.580 465 H GLU 152 HN GLU 152 -3.507 14.112 -1.587 466 HA GLU 152 HA GLU 152 -3.853 12.572 -4.088 467 HB2 GLU 152 HB2 GLU 152 -2.778 15.310 -3.356 468 HB3 GLU 152 HB1 GLU 152 -2.811 14.706 -5.013 469 HG2 GLU 152 HG2 GLU 152 -5.166 14.640 -5.073 470 HG3 GLU 152 HG1 GLU 152 -5.301 14.688 -3.315 471 H PHE 153 HN PHE 153 -1.248 13.616 -1.912 472 HA PHE 153 HA PHE 153 1.029 13.063 -3.456 473 HB2 PHE 153 HB2 PHE 153 0.836 14.008 -1.112 474 HB3 PHE 153 HB1 PHE 153 0.613 12.356 -0.537 475 HD1 PHE 153 HD2 PHE 153 2.920 14.285 -2.791 476 HD2 PHE 153 HD1 PHE 153 2.505 11.195 0.166 477 HE1 PHE 153 HE2 PHE 153 5.377 13.944 -2.800 478 HE2 PHE 153 HE1 PHE 153 4.962 10.856 0.156 479 HZ PHE 153 HZ PHE 153 6.398 12.231 -1.327 480 H LEU 154 HN LEU 154 -1.252 10.824 -1.997 481 HA LEU 154 HA LEU 154 0.374 8.451 -2.108 482 HB2 LEU 154 HB2 LEU 154 -2.401 9.270 -1.626 483 HB3 LEU 154 HB1 LEU 154 -2.279 7.682 -2.383 484 HG LEU 154 HG LEU 154 -2.223 7.526 0.094 485 HD11 LEU 154 HD11 LEU 154 -0.834 6.049 -1.574 486 HD12 LEU 154 HD12 LEU 154 -0.514 5.928 0.156 487 HD13 LEU 154 HD13 LEU 154 0.551 6.885 -0.872 488 HD21 LEU 154 HD21 LEU 154 -1.218 9.578 0.756 489 HD22 LEU 154 HD22 LEU 154 0.168 9.331 -0.306 490 HD23 LEU 154 HD23 LEU 154 -0.017 8.346 1.145 491 H GLU 155 HN GLU 155 -2.254 9.556 -4.295 492 HA GLU 155 HA GLU 155 -2.053 7.589 -6.276 493 HB2 GLU 155 HB2 GLU 155 -2.878 10.438 -6.082 494 HB3 GLU 155 HB1 GLU 155 -2.622 9.819 -7.714 495 HG2 GLU 155 HG2 GLU 155 -4.388 8.515 -5.621 496 HG3 GLU 155 HG1 GLU 155 -4.969 9.502 -6.963 497 H PHE 156 HN PHE 156 0.211 10.135 -5.526 498 HA PHE 156 HA PHE 156 1.599 9.934 -8.127 499 HB2 PHE 156 HB2 PHE 156 1.500 12.104 -7.178 500 HB3 PHE 156 HB1 PHE 156 1.908 11.511 -5.569 501 HD1 PHE 156 HD2 PHE 156 4.220 10.847 -5.014 502 HD2 PHE 156 HD1 PHE 156 3.214 12.488 -8.854 503 HE1 PHE 156 HE2 PHE 156 6.624 11.251 -5.472 504 HE2 PHE 156 HE1 PHE 156 5.618 12.893 -9.311 505 HZ PHE 156 HZ PHE 156 7.323 12.274 -7.620 506 H MET 157 HN MET 157 2.306 9.201 -4.689 507 HA MET 157 HA MET 157 4.896 8.048 -5.164 508 HB2 MET 157 HB2 MET 157 2.807 7.811 -2.984 509 HB3 MET 157 HB1 MET 157 4.393 7.047 -2.861 510 HG2 MET 157 HG2 MET 157 5.046 9.606 -3.639 511 HG3 MET 157 HG1 MET 157 3.656 9.881 -2.590 512 HE1 MET 157 HE1 MET 157 6.745 10.495 -2.675 513 HE2 MET 157 HE2 MET 157 7.543 8.925 -2.622 514 HE3 MET 157 HE3 MET 157 7.620 9.992 -1.222 515 H LYS 158 HN LYS 158 1.622 6.761 -5.338 516 HA LYS 158 HA LYS 158 2.472 3.959 -5.418 517 HB2 LYS 158 HB2 LYS 158 0.060 5.542 -5.232 518 HB3 LYS 158 HB1 LYS 158 -0.133 4.306 -6.475 519 HG2 LYS 158 HG2 LYS 158 -0.089 2.603 -4.968 520 HG3 LYS 158 HG1 LYS 158 1.178 3.364 -4.004 521 HD2 LYS 158 HD2 LYS 158 -0.610 5.025 -3.232 522 HD3 LYS 158 HD1 LYS 158 -1.792 3.925 -3.941 523 HE2 LYS 158 HE2 LYS 158 0.278 3.023 -1.913 524 HE3 LYS 158 HE1 LYS 158 -1.364 3.532 -1.469 525 HZ1 LYS 158 HZ1 LYS 158 -2.309 1.861 -2.801 526 HZ2 LYS 158 HZ2 LYS 158 -1.056 1.083 -1.959 527 HZ3 LYS 158 HZ3 LYS 158 -0.843 1.525 -3.585 528 H GLY 159 HN GLY 159 3.976 5.266 -7.328 529 HA2 GLY 159 HA2 GLY 159 3.302 3.834 -9.736 530 HA3 GLY 159 HA1 GLY 159 2.956 5.554 -9.924 531 H VAL 160 HN VAL 160 4.999 6.759 -8.562 532 HA VAL 160 HA VAL 160 7.174 6.738 -10.367 533 HB VAL 160 HB VAL 160 6.583 8.506 -8.715 534 HG11 VAL 160 HG11 VAL 160 6.068 6.944 -6.844 535 HG12 VAL 160 HG12 VAL 160 7.201 8.208 -6.363 536 HG13 VAL 160 HG13 VAL 160 7.788 6.580 -6.703 537 HG21 VAL 160 HG21 VAL 160 9.311 7.348 -8.994 538 HG22 VAL 160 HG22 VAL 160 9.102 8.567 -7.737 539 HG23 VAL 160 HG23 VAL 160 8.725 8.957 -9.415 540 H GLU 161 HN GLU 161 6.610 4.809 -7.452 541 HA GLU 161 HA GLU 161 9.318 3.630 -7.549 542 HB2 GLU 161 HB2 GLU 161 6.943 2.850 -5.840 543 HB3 GLU 161 HB1 GLU 161 8.656 2.640 -5.472 544 HG2 GLU 161 HG2 GLU 161 8.860 5.178 -5.559 545 HG3 GLU 161 HG1 GLU 161 7.097 5.231 -5.594 546 HO1 KDH 1 H1 KDH 1 13.810 8.271 -5.395 547 H21 KDH 1 H21 KDH 1 9.562 8.609 -2.796 548 H33 KDH 1 H33 KDH 1 9.113 12.993 -5.509 549 H4 KDH 1 H4 KDH 1 11.920 9.519 -5.090 550 HO7 KDH 1 H7 KDH 1 13.813 8.850 -10.105 551 H01 KDH 1 H01 KDH 1 12.046 12.545 -4.851 552 H01A KDH 1 H02 KDH 1 10.875 13.738 -4.167 553 HO03 KDH 1 H03 KDH 1 10.796 14.083 -1.779 554 HO10 KDH 1 H10 KDH 1 12.921 9.899 -10.737 555 H12 KDH 1 H12 KDH 1 10.297 11.433 -8.711 556 H15 KDH 1 H15 KDH 1 9.011 11.057 -6.775 557 H26 KDH 1 H26 KDH 1 11.452 11.450 -0.036 558 H39 KDH 1 H39 KDH 1 8.549 12.312 -9.864 559 H41 KDH 1 H41 KDH 1 11.904 14.976 -8.870 560 HO02 KDH 1 H42 KDH 1 10.931 8.178 -0.563 561 HO44 KDH 1 H44 KDH 1 13.679 14.867 -10.519 562 HO47 KDH 1 H47 KDH 1 12.257 12.412 -13.202 563 HO50 KDH 1 H50 KDH 1 9.004 12.407 -13.125 Start of MODEL 26 1 H1 MET 90 HT1 MET 90 14.033 5.709 1.933 2 H2 MET 90 HT2 MET 90 13.744 6.994 0.859 3 H3 MET 90 HT3 MET 90 13.083 5.459 0.551 4 HA MET 90 HA MET 90 11.951 5.813 2.871 5 HB2 MET 90 HB2 MET 90 13.060 8.436 1.954 6 HB3 MET 90 HB1 MET 90 11.490 8.444 2.758 7 HG2 MET 90 HG2 MET 90 12.403 7.368 4.713 8 HG3 MET 90 HG1 MET 90 13.941 7.082 3.901 9 HE1 MET 90 HE1 MET 90 13.532 9.607 6.921 10 HE2 MET 90 HE2 MET 90 12.354 8.455 6.298 11 HE3 MET 90 HE3 MET 90 12.070 10.183 6.108 12 H GLY 91 HN GLY 91 9.729 7.255 2.589 13 HA2 GLY 91 HA2 GLY 91 7.748 7.515 1.356 14 HA3 GLY 91 HA1 GLY 91 8.757 7.629 -0.087 15 H LYS 92 HN LYS 92 6.274 5.911 1.031 16 HA LYS 92 HA LYS 92 6.798 3.651 -0.744 17 HB2 LYS 92 HB2 LYS 92 8.122 3.086 1.273 18 HB3 LYS 92 HB1 LYS 92 6.670 3.241 2.262 19 HG2 LYS 92 HG2 LYS 92 5.966 1.521 0.141 20 HG3 LYS 92 HG1 LYS 92 7.556 0.983 0.686 21 HD2 LYS 92 HD2 LYS 92 6.600 1.146 3.073 22 HD3 LYS 92 HD1 LYS 92 5.016 1.239 2.300 23 HE2 LYS 92 HE2 LYS 92 7.022 -1.032 2.137 24 HE3 LYS 92 HE1 LYS 92 5.351 -1.091 2.731 25 HZ1 LYS 92 HZ1 LYS 92 6.246 -0.542 -0.048 26 HZ2 LYS 92 HZ2 LYS 92 4.647 -0.332 0.488 27 HZ3 LYS 92 HZ3 LYS 92 5.351 -1.879 0.491 28 H SER 93 HN SER 93 4.881 3.754 2.261 29 HA SER 93 HA SER 93 2.401 3.721 0.570 30 HB2 SER 93 HB2 SER 93 3.069 1.546 1.630 31 HB3 SER 93 HB1 SER 93 2.944 2.320 3.207 32 HG SER 93 HG SER 93 1.018 1.222 2.601 33 H GLU 94 HN GLU 94 0.434 4.228 2.159 34 HA GLU 94 HA GLU 94 0.406 6.890 2.909 35 HB2 GLU 94 HB2 GLU 94 -0.952 4.531 4.258 36 HB3 GLU 94 HB1 GLU 94 -1.480 6.209 4.385 37 HG2 GLU 94 HG2 GLU 94 -1.465 6.115 1.756 38 HG3 GLU 94 HG1 GLU 94 -1.572 4.373 2.013 39 H GLU 95 HN GLU 95 1.866 4.225 4.657 40 HA GLU 95 HA GLU 95 2.130 5.621 7.200 41 HB2 GLU 95 HB2 GLU 95 2.076 3.218 7.132 42 HB3 GLU 95 HB1 GLU 95 3.371 3.164 5.935 43 HG2 GLU 95 HG2 GLU 95 4.393 2.639 8.033 44 HG3 GLU 95 HG1 GLU 95 4.849 4.304 7.672 45 H GLU 96 HN GLU 96 4.277 5.016 4.413 46 HA GLU 96 HA GLU 96 6.466 6.557 5.669 47 HB2 GLU 96 HB2 GLU 96 6.057 5.007 3.105 48 HB3 GLU 96 HB1 GLU 96 7.529 5.932 3.406 49 HG2 GLU 96 HG2 GLU 96 7.092 4.476 5.766 50 HG3 GLU 96 HG1 GLU 96 6.753 3.342 4.458 51 H LEU 97 HN LEU 97 3.888 7.036 3.357 52 HA LEU 97 HA LEU 97 5.071 9.378 2.073 53 HB2 LEU 97 HB2 LEU 97 2.240 8.287 2.206 54 HB3 LEU 97 HB1 LEU 97 2.799 9.521 1.077 55 HG LEU 97 HG LEU 97 3.682 6.632 1.239 56 HD11 LEU 97 HD11 LEU 97 2.124 6.422 -0.373 57 HD12 LEU 97 HD12 LEU 97 3.115 7.468 -1.390 58 HD13 LEU 97 HD13 LEU 97 1.840 8.163 -0.389 59 HD21 LEU 97 HD21 LEU 97 5.251 7.255 -0.623 60 HD22 LEU 97 HD22 LEU 97 5.685 7.973 0.928 61 HD23 LEU 97 HD23 LEU 97 4.885 8.950 -0.304 62 H SER 98 HN SER 98 3.286 8.779 4.992 63 HA SER 98 HA SER 98 2.038 11.350 5.319 64 HB2 SER 98 HB2 SER 98 1.222 9.672 6.714 65 HB3 SER 98 HB1 SER 98 2.826 9.013 7.024 66 HG SER 98 HG SER 98 3.217 10.629 8.448 67 H ASP 99 HN ASP 99 5.131 10.029 6.554 68 HA ASP 99 HA ASP 99 5.936 12.495 7.836 69 HB2 ASP 99 HB2 ASP 99 8.138 11.265 7.920 70 HB3 ASP 99 HB1 ASP 99 6.775 10.326 8.530 71 H LEU 100 HN LEU 100 6.886 10.942 4.743 72 HA LEU 100 HA LEU 100 8.814 12.667 3.778 73 HB2 LEU 100 HB2 LEU 100 6.849 10.837 2.757 74 HB3 LEU 100 HB1 LEU 100 6.934 12.232 1.680 75 HG LEU 100 HG LEU 100 9.596 11.735 2.250 76 HD11 LEU 100 HD11 LEU 100 7.999 9.227 2.419 77 HD12 LEU 100 HD12 LEU 100 9.541 9.631 3.171 78 HD13 LEU 100 HD13 LEU 100 9.486 9.160 1.473 79 HD21 LEU 100 HD21 LEU 100 8.246 12.175 0.051 80 HD22 LEU 100 HD22 LEU 100 8.207 10.417 -0.076 81 HD23 LEU 100 HD23 LEU 100 9.753 11.264 -0.047 82 H PHE 101 HN PHE 101 5.290 13.246 3.728 83 HA PHE 101 HA PHE 101 5.218 15.668 2.297 84 HB2 PHE 101 HB2 PHE 101 3.427 14.078 3.460 85 HB3 PHE 101 HB1 PHE 101 3.533 15.284 4.743 86 HD1 PHE 101 HD1 PHE 101 2.879 14.833 1.103 87 HD2 PHE 101 HD2 PHE 101 2.525 17.423 4.511 88 HE1 PHE 101 HE1 PHE 101 1.424 16.356 -0.206 89 HE2 PHE 101 HE2 PHE 101 1.069 18.946 3.202 90 HZ PHE 101 HZ PHE 101 0.519 18.412 0.843 91 H ARG 102 HN ARG 102 6.361 15.061 5.562 92 HA ARG 102 HA ARG 102 6.178 17.734 6.586 93 HB2 ARG 102 HB2 ARG 102 7.453 16.851 8.358 94 HB3 ARG 102 HB1 ARG 102 6.662 15.421 7.701 95 HG2 ARG 102 HG2 ARG 102 8.738 15.080 6.263 96 HG3 ARG 102 HG1 ARG 102 9.509 16.334 7.233 97 HD2 ARG 102 HD2 ARG 102 8.159 14.266 8.846 98 HD3 ARG 102 HD1 ARG 102 9.527 13.663 7.888 99 HE ARG 102 HE ARG 102 10.298 16.145 9.038 100 HH11 ARG 102 HH21 ARG 102 9.464 12.917 9.942 101 HH12 ARG 102 HH22 ARG 102 10.461 12.920 11.358 102 HH21 ARG 102 HH11 ARG 102 11.598 16.158 10.879 103 HH22 ARG 102 HH12 ARG 102 11.669 14.752 11.887 104 H MET 103 HN MET 103 8.662 16.074 4.668 105 HA MET 103 HA MET 103 10.468 18.409 4.779 106 HB2 MET 103 HB2 MET 103 10.723 15.658 4.504 107 HB3 MET 103 HB1 MET 103 11.044 16.256 2.876 108 HG2 MET 103 HG2 MET 103 12.344 17.909 4.885 109 HG3 MET 103 HG1 MET 103 12.849 16.224 5.014 110 HE1 MET 103 HE1 MET 103 14.318 15.304 1.663 111 HE2 MET 103 HE2 MET 103 12.793 14.918 2.455 112 HE3 MET 103 HE3 MET 103 14.279 14.972 3.400 113 H PHE 104 HN PHE 104 8.137 16.950 2.574 114 HA PHE 104 HA PHE 104 8.972 18.266 0.166 115 HB2 PHE 104 HB2 PHE 104 7.180 16.357 0.855 116 HB3 PHE 104 HB1 PHE 104 6.087 17.729 0.660 117 HD1 PHE 104 HD1 PHE 104 8.099 19.079 -1.409 118 HD2 PHE 104 HD2 PHE 104 6.185 15.243 -1.134 119 HE1 PHE 104 HE1 PHE 104 8.239 18.833 -3.872 120 HE2 PHE 104 HE2 PHE 104 6.327 14.999 -3.599 121 HZ PHE 104 HZ PHE 104 7.353 16.793 -4.966 122 H ASP 105 HN ASP 105 6.685 19.213 2.737 123 HA ASP 105 HA ASP 105 6.004 21.730 1.377 124 HB2 ASP 105 HB2 ASP 105 4.449 20.334 2.779 125 HB3 ASP 105 HB1 ASP 105 5.420 20.755 4.190 126 H LYS 106 HN LYS 106 8.564 22.122 1.441 127 HA LYS 106 HA LYS 106 9.948 22.834 3.794 128 HB2 LYS 106 HB2 LYS 106 10.587 22.698 1.246 129 HB3 LYS 106 HB1 LYS 106 10.170 24.412 1.240 130 HG2 LYS 106 HG2 LYS 106 11.709 24.432 3.412 131 HG3 LYS 106 HG1 LYS 106 12.411 23.010 2.639 132 HD2 LYS 106 HD2 LYS 106 12.329 24.632 0.502 133 HD3 LYS 106 HD1 LYS 106 12.456 25.858 1.764 134 HE2 LYS 106 HE2 LYS 106 14.699 25.101 0.925 135 HE3 LYS 106 HE1 LYS 106 14.478 24.761 2.653 136 HZ1 LYS 106 HZ1 LYS 106 15.178 22.885 0.920 137 HZ2 LYS 106 HZ2 LYS 106 13.489 22.758 0.783 138 HZ3 LYS 106 HZ3 LYS 106 14.239 22.554 2.293 139 H ASN 107 HN ASN 107 7.311 24.450 2.202 140 HA ASN 107 HA ASN 107 7.799 27.090 3.353 141 HB2 ASN 107 HB2 ASN 107 6.504 26.325 1.219 142 HB3 ASN 107 HB1 ASN 107 5.170 26.021 2.332 143 HD21 ASN 107 HD21 ASN 107 4.155 27.871 0.984 144 HD22 ASN 107 HD22 ASN 107 4.474 29.461 1.486 145 H ALA 108 HN ALA 108 6.369 24.137 4.451 146 HA ALA 108 HA ALA 108 5.270 23.590 6.470 147 HB1 ALA 108 HB1 ALA 108 5.916 25.042 8.352 148 HB2 ALA 108 HB2 ALA 108 6.430 26.293 7.221 149 HB3 ALA 108 HB3 ALA 108 7.301 24.762 7.296 150 H ASP 109 HN ASP 109 3.302 24.166 4.936 151 HA ASP 109 HA ASP 109 1.645 26.186 6.390 152 HB2 ASP 109 HB2 ASP 109 0.912 27.096 4.258 153 HB3 ASP 109 HB1 ASP 109 2.676 27.090 4.271 154 H GLY 110 HN GLY 110 1.978 23.039 5.630 155 HA2 GLY 110 HA2 GLY 110 0.287 21.379 6.060 156 HA3 GLY 110 HA1 GLY 110 -0.951 22.586 5.708 157 H TYR 111 HN TYR 111 0.630 23.398 3.242 158 HA TYR 111 HA TYR 111 -0.009 21.018 1.530 159 HB2 TYR 111 HB2 TYR 111 -0.590 23.940 0.948 160 HB3 TYR 111 HB1 TYR 111 -1.083 22.557 -0.029 161 HD1 TYR 111 HD1 TYR 111 -1.379 23.928 3.448 162 HD2 TYR 111 HD2 TYR 111 -3.172 21.565 0.341 163 HE1 TYR 111 HE1 TYR 111 -3.438 23.697 4.811 164 HE2 TYR 111 HE2 TYR 111 -5.230 21.334 1.704 165 HH TYR 111 HH TYR 111 -6.073 21.582 3.815 166 H ILE 112 HN ILE 112 0.864 21.712 -0.855 167 HA ILE 112 HA ILE 112 3.631 22.813 -0.479 168 HB ILE 112 HB ILE 112 2.570 20.359 -1.876 169 HG12 ILE 112 HG12 ILE 112 4.780 20.975 0.101 170 HG13 ILE 112 HG11 ILE 112 3.344 19.984 0.363 171 HG21 ILE 112 HG21 ILE 112 5.197 21.781 -2.408 172 HG22 ILE 112 HG22 ILE 112 3.905 21.486 -3.572 173 HG23 ILE 112 HG23 ILE 112 4.835 20.134 -2.926 174 HD11 ILE 112 HD11 ILE 112 4.696 18.912 -1.898 175 HD12 ILE 112 HD12 ILE 112 4.497 18.174 -0.308 176 HD13 ILE 112 HD13 ILE 112 5.909 19.176 -0.644 177 H ASP 113 HN ASP 113 4.323 24.230 -2.100 178 HA ASP 113 HA ASP 113 2.281 24.973 -4.158 179 HB2 ASP 113 HB2 ASP 113 3.360 26.504 -2.278 180 HB3 ASP 113 HB1 ASP 113 4.682 26.622 -3.440 181 H LEU 114 HN LEU 114 2.984 25.282 -6.345 182 HA LEU 114 HA LEU 114 4.740 23.443 -7.490 183 HB2 LEU 114 HB2 LEU 114 3.837 26.219 -8.275 184 HB3 LEU 114 HB1 LEU 114 4.809 25.224 -9.360 185 HG LEU 114 HG LEU 114 2.543 23.781 -8.177 186 HD11 LEU 114 HD11 LEU 114 1.630 25.566 -10.337 187 HD12 LEU 114 HD12 LEU 114 1.955 26.389 -8.812 188 HD13 LEU 114 HD13 LEU 114 0.796 25.060 -8.867 189 HD21 LEU 114 HD21 LEU 114 3.532 24.286 -11.003 190 HD22 LEU 114 HD22 LEU 114 2.250 23.152 -10.579 191 HD23 LEU 114 HD23 LEU 114 3.895 22.878 -10.005 192 H ASP 115 HN ASP 115 5.496 26.762 -6.402 193 HA ASP 115 HA ASP 115 8.212 26.829 -7.282 194 HB2 ASP 115 HB2 ASP 115 6.670 28.159 -5.040 195 HB3 ASP 115 HB1 ASP 115 8.336 28.589 -5.429 196 H GLU 116 HN GLU 116 6.701 25.099 -4.691 197 HA GLU 116 HA GLU 116 9.271 24.717 -3.241 198 HB2 GLU 116 HB2 GLU 116 6.501 23.638 -2.646 199 HB3 GLU 116 HB1 GLU 116 7.849 23.799 -1.519 200 HG2 GLU 116 HG2 GLU 116 7.755 26.229 -1.683 201 HG3 GLU 116 HG1 GLU 116 6.500 26.126 -2.918 202 H LEU 117 HN LEU 117 7.109 23.074 -5.439 203 HA LEU 117 HA LEU 117 7.925 20.363 -4.893 204 HB2 LEU 117 HB2 LEU 117 6.718 21.804 -7.269 205 HB3 LEU 117 HB1 LEU 117 6.930 20.054 -7.222 206 HG LEU 117 HG LEU 117 5.556 21.413 -4.927 207 HD11 LEU 117 HD11 LEU 117 4.666 21.572 -7.643 208 HD12 LEU 117 HD12 LEU 117 3.826 22.106 -6.187 209 HD13 LEU 117 HD13 LEU 117 3.604 20.460 -6.780 210 HD21 LEU 117 HD21 LEU 117 5.807 19.138 -4.498 211 HD22 LEU 117 HD22 LEU 117 5.675 18.698 -6.201 212 HD23 LEU 117 HD23 LEU 117 4.231 19.145 -5.291 213 H LYS 118 HN LYS 118 9.588 22.976 -6.330 214 HA LYS 118 HA LYS 118 11.242 21.283 -8.111 215 HB2 LYS 118 HB2 LYS 118 12.156 23.437 -8.794 216 HB3 LYS 118 HB1 LYS 118 10.399 23.572 -8.700 217 HG2 LYS 118 HG2 LYS 118 10.887 24.317 -6.218 218 HG3 LYS 118 HG1 LYS 118 12.484 24.701 -6.861 219 HD2 LYS 118 HD2 LYS 118 9.955 25.655 -8.210 220 HD3 LYS 118 HD1 LYS 118 10.732 26.582 -6.927 221 HE2 LYS 118 HE2 LYS 118 12.871 26.518 -8.264 222 HE3 LYS 118 HE1 LYS 118 11.950 25.784 -9.591 223 HZ1 LYS 118 HZ1 LYS 118 10.987 28.232 -8.252 224 HZ2 LYS 118 HZ2 LYS 118 10.595 27.639 -9.795 225 HZ3 LYS 118 HZ3 LYS 118 12.119 28.333 -9.511 226 H ILE 119 HN ILE 119 11.357 22.608 -4.888 227 HA ILE 119 HA ILE 119 14.298 22.362 -4.691 228 HB ILE 119 HB ILE 119 12.019 23.255 -2.925 229 HG12 ILE 119 HG12 ILE 119 14.172 25.081 -3.002 230 HG13 ILE 119 HG11 ILE 119 13.996 24.477 -4.650 231 HG21 ILE 119 HG21 ILE 119 13.184 22.639 -1.095 232 HG22 ILE 119 HG22 ILE 119 14.402 23.825 -1.569 233 HG23 ILE 119 HG23 ILE 119 14.567 22.142 -2.070 234 HD11 ILE 119 HD11 ILE 119 11.882 25.358 -4.897 235 HD12 ILE 119 HD12 ILE 119 12.525 26.520 -3.736 236 HD13 ILE 119 HD13 ILE 119 11.500 25.196 -3.183 237 H MET 120 HN MET 120 11.416 20.533 -3.883 238 HA MET 120 HA MET 120 12.468 18.797 -1.880 239 HB2 MET 120 HB2 MET 120 10.135 18.827 -2.242 240 HB3 MET 120 HB1 MET 120 10.313 18.654 -3.987 241 HG2 MET 120 HG2 MET 120 9.568 16.529 -3.159 242 HG3 MET 120 HG1 MET 120 11.276 16.342 -3.548 243 HE1 MET 120 HE1 MET 120 9.685 14.356 -0.617 244 HE2 MET 120 HE2 MET 120 8.863 15.289 -1.866 245 HE3 MET 120 HE3 MET 120 8.788 15.819 -0.187 246 H LEU 121 HN LEU 121 13.081 18.982 -5.292 247 HA LEU 121 HA LEU 121 14.010 16.210 -5.574 248 HB2 LEU 121 HB2 LEU 121 13.653 18.666 -7.211 249 HB3 LEU 121 HB1 LEU 121 14.906 17.553 -7.760 250 HG LEU 121 HG LEU 121 12.514 17.188 -8.666 251 HD11 LEU 121 HD11 LEU 121 13.179 14.614 -7.495 252 HD12 LEU 121 HD12 LEU 121 14.624 15.447 -8.066 253 HD13 LEU 121 HD13 LEU 121 13.289 15.137 -9.175 254 HD21 LEU 121 HD21 LEU 121 12.137 15.788 -6.014 255 HD22 LEU 121 HD22 LEU 121 10.932 16.113 -7.260 256 HD23 LEU 121 HD23 LEU 121 11.562 17.434 -6.277 257 H GLN 122 HN GLN 122 15.346 19.117 -4.353 258 HA GLN 122 HA GLN 122 17.998 19.229 -5.133 259 HB2 GLN 122 HB2 GLN 122 16.515 20.379 -3.229 260 HB3 GLN 122 HB1 GLN 122 17.392 19.243 -2.203 261 HG2 GLN 122 HG2 GLN 122 19.156 20.563 -4.117 262 HG3 GLN 122 HG1 GLN 122 18.328 21.721 -3.076 263 HE21 GLN 122 HE21 GLN 122 18.341 20.997 -0.620 264 HE22 GLN 122 HE22 GLN 122 19.807 20.357 -0.051 265 H ALA 123 HN ALA 123 16.463 16.686 -3.261 266 HA ALA 123 HA ALA 123 18.720 15.453 -2.071 267 HB1 ALA 123 HB1 ALA 123 17.156 13.868 -1.550 268 HB2 ALA 123 HB2 ALA 123 16.635 13.698 -3.226 269 HB3 ALA 123 HB3 ALA 123 16.024 15.029 -2.243 270 H THR 124 HN THR 124 17.883 15.745 -5.403 271 HA THR 124 HA THR 124 20.023 13.761 -6.100 272 HB THR 124 HB THR 124 18.625 12.984 -7.903 273 HG1 THR 124 HG1 THR 124 16.511 14.020 -8.121 274 HG21 THR 124 HG21 THR 124 16.433 13.231 -5.960 275 HG22 THR 124 HG22 THR 124 17.951 12.678 -5.255 276 HG23 THR 124 HG23 THR 124 17.220 11.784 -6.589 277 H GLY 125 HN GLY 125 19.739 16.861 -5.875 278 HA2 GLY 125 HA2 GLY 125 21.089 18.485 -7.014 279 HA3 GLY 125 HA1 GLY 125 21.162 17.408 -8.410 280 H GLU 126 HN GLU 126 18.071 17.149 -7.818 281 HA GLU 126 HA GLU 126 16.228 17.969 -9.086 282 HB2 GLU 126 HB2 GLU 126 15.669 20.246 -8.217 283 HB3 GLU 126 HB1 GLU 126 16.171 19.139 -6.943 284 HG2 GLU 126 HG2 GLU 126 18.369 20.106 -6.852 285 HG3 GLU 126 HG1 GLU 126 18.075 21.050 -8.314 286 H THR 127 HN THR 127 17.901 17.755 -11.081 287 HA THR 127 HA THR 127 18.259 20.482 -12.273 288 HB THR 127 HB THR 127 19.966 19.347 -13.661 289 HG1 THR 127 HG1 THR 127 19.447 17.305 -13.893 290 HG21 THR 127 HG21 THR 127 20.619 18.345 -10.942 291 HG22 THR 127 HG22 THR 127 20.221 20.058 -11.074 292 HG23 THR 127 HG23 THR 127 21.555 19.387 -12.012 293 H ILE 128 HN ILE 128 16.124 20.666 -13.125 294 HA ILE 128 HA ILE 128 15.581 18.878 -15.459 295 HB ILE 128 HB ILE 128 13.220 18.792 -14.723 296 HG12 ILE 128 HG12 ILE 128 14.297 20.472 -12.441 297 HG13 ILE 128 HG11 ILE 128 13.001 20.888 -13.563 298 HG21 ILE 128 HG21 ILE 128 13.539 17.168 -13.063 299 HG22 ILE 128 HG22 ILE 128 14.868 18.055 -12.315 300 HG23 ILE 128 HG23 ILE 128 15.119 17.217 -13.847 301 HD11 ILE 128 HD11 ILE 128 11.619 20.106 -11.939 302 HD12 ILE 128 HD12 ILE 128 12.917 19.223 -11.135 303 HD13 ILE 128 HD13 ILE 128 12.096 18.512 -12.524 304 H THR 129 HN THR 129 14.097 19.947 -17.036 305 HA THR 129 HA THR 129 14.756 22.730 -17.451 306 HB THR 129 HB THR 129 14.323 21.166 -19.275 307 HG1 THR 129 HG1 THR 129 13.481 22.754 -20.327 308 HG21 THR 129 HG21 THR 129 12.709 19.619 -19.076 309 HG22 THR 129 HG22 THR 129 11.486 20.889 -19.132 310 HG23 THR 129 HG23 THR 129 12.160 20.382 -17.583 311 H GLU 130 HN GLU 130 13.504 24.567 -17.010 312 HA GLU 130 HA GLU 130 11.793 24.763 -14.843 313 HB2 GLU 130 HB2 GLU 130 12.608 26.727 -15.903 314 HB3 GLU 130 HB1 GLU 130 11.954 26.249 -17.470 315 HG2 GLU 130 HG2 GLU 130 9.744 26.756 -16.843 316 HG3 GLU 130 HG1 GLU 130 10.125 26.710 -15.121 317 H ASP 131 HN ASP 131 10.933 23.825 -18.154 318 HA ASP 131 HA ASP 131 8.098 23.909 -17.940 319 HB2 ASP 131 HB2 ASP 131 10.190 22.790 -19.646 320 HB3 ASP 131 HB1 ASP 131 8.760 21.758 -19.594 321 H ASP 132 HN ASP 132 10.416 21.678 -16.587 322 HA ASP 132 HA ASP 132 8.471 19.528 -16.129 323 HB2 ASP 132 HB2 ASP 132 11.336 20.045 -15.911 324 HB3 ASP 132 HB1 ASP 132 10.726 19.154 -14.516 325 H ILE 133 HN ILE 133 9.361 22.455 -14.546 326 HA ILE 133 HA ILE 133 8.983 21.784 -11.803 327 HB ILE 133 HB ILE 133 8.359 24.323 -13.347 328 HG12 ILE 133 HG12 ILE 133 10.678 23.442 -13.631 329 HG13 ILE 133 HG11 ILE 133 10.644 24.974 -12.756 330 HG21 ILE 133 HG21 ILE 133 8.838 23.792 -10.400 331 HG22 ILE 133 HG22 ILE 133 7.368 24.428 -11.138 332 HG23 ILE 133 HG23 ILE 133 8.838 25.402 -11.120 333 HD11 ILE 133 HD11 ILE 133 11.538 22.346 -11.850 334 HD12 ILE 133 HD12 ILE 133 10.357 23.062 -10.752 335 HD13 ILE 133 HD13 ILE 133 11.838 23.935 -11.145 336 H GLU 134 HN GLU 134 6.615 23.078 -14.169 337 HA GLU 134 HA GLU 134 4.383 22.675 -12.305 338 HB2 GLU 134 HB2 GLU 134 4.590 23.467 -15.230 339 HB3 GLU 134 HB1 GLU 134 3.102 23.528 -14.284 340 HG2 GLU 134 HG2 GLU 134 3.697 25.594 -13.612 341 HG3 GLU 134 HG1 GLU 134 5.030 24.856 -12.722 342 H GLU 135 HN GLU 135 6.118 20.701 -14.447 343 HA GLU 135 HA GLU 135 3.915 19.032 -15.394 344 HB2 GLU 135 HB2 GLU 135 6.268 19.511 -16.393 345 HB3 GLU 135 HB1 GLU 135 6.837 18.294 -15.250 346 HG2 GLU 135 HG2 GLU 135 6.326 16.824 -16.910 347 HG3 GLU 135 HG1 GLU 135 4.671 17.024 -16.332 348 H LEU 136 HN LEU 136 5.594 19.280 -12.420 349 HA LEU 136 HA LEU 136 5.280 16.412 -11.733 350 HB2 LEU 136 HB2 LEU 136 6.544 18.865 -10.538 351 HB3 LEU 136 HB1 LEU 136 6.249 17.457 -9.518 352 HG LEU 136 HG LEU 136 7.558 17.017 -12.170 353 HD11 LEU 136 HD11 LEU 136 8.581 18.864 -10.263 354 HD12 LEU 136 HD12 LEU 136 9.393 18.229 -11.694 355 HD13 LEU 136 HD13 LEU 136 9.559 17.401 -10.146 356 HD21 LEU 136 HD21 LEU 136 8.009 15.003 -11.241 357 HD22 LEU 136 HD22 LEU 136 6.907 15.468 -9.945 358 HD23 LEU 136 HD23 LEU 136 8.640 15.745 -9.770 359 H MET 137 HN MET 137 3.574 19.413 -11.337 360 HA MET 137 HA MET 137 2.137 18.711 -8.913 361 HB2 MET 137 HB2 MET 137 2.459 21.013 -9.601 362 HB3 MET 137 HB1 MET 137 1.675 20.703 -11.151 363 HG2 MET 137 HG2 MET 137 -0.442 20.659 -10.230 364 HG3 MET 137 HG1 MET 137 0.135 20.072 -8.671 365 HE1 MET 137 HE1 MET 137 -0.036 22.410 -6.478 366 HE2 MET 137 HE2 MET 137 1.680 22.522 -6.862 367 HE3 MET 137 HE3 MET 137 0.847 20.978 -7.026 368 H LYS 138 HN LYS 138 1.382 18.495 -12.401 369 HA LYS 138 HA LYS 138 -1.309 17.752 -12.329 370 HB2 LYS 138 HB2 LYS 138 -0.764 16.542 -14.427 371 HB3 LYS 138 HB1 LYS 138 0.053 18.103 -14.353 372 HG2 LYS 138 HG2 LYS 138 2.106 17.149 -14.297 373 HG3 LYS 138 HG1 LYS 138 1.599 15.927 -13.131 374 HD2 LYS 138 HD2 LYS 138 0.653 14.550 -14.857 375 HD3 LYS 138 HD1 LYS 138 0.837 15.829 -16.058 376 HE2 LYS 138 HE2 LYS 138 2.961 15.175 -16.503 377 HE3 LYS 138 HE1 LYS 138 3.386 15.244 -14.781 378 HZ1 LYS 138 HZ1 LYS 138 2.093 13.126 -14.535 379 HZ2 LYS 138 HZ2 LYS 138 3.541 12.983 -15.411 380 HZ3 LYS 138 HZ3 LYS 138 2.052 13.025 -16.227 381 H ASP 139 HN ASP 139 1.460 15.921 -11.233 382 HA ASP 139 HA ASP 139 -0.078 13.394 -11.078 383 HB2 ASP 139 HB2 ASP 139 2.734 14.327 -10.890 384 HB3 ASP 139 HB1 ASP 139 2.329 12.924 -9.900 385 H GLY 140 HN GLY 140 0.882 16.065 -9.047 386 HA2 GLY 140 HA2 GLY 140 0.021 14.542 -6.627 387 HA3 GLY 140 HA1 GLY 140 1.032 15.986 -6.592 388 H ASP 141 HN ASP 141 -1.121 16.750 -8.882 389 HA ASP 141 HA ASP 141 -3.476 17.344 -7.245 390 HB2 ASP 141 HB2 ASP 141 -1.254 19.000 -7.011 391 HB3 ASP 141 HB1 ASP 141 -2.273 19.849 -8.175 392 H LYS 142 HN LYS 142 -4.401 16.255 -9.158 393 HA LYS 142 HA LYS 142 -4.097 17.123 -11.848 394 HB2 LYS 142 HB2 LYS 142 -5.814 15.427 -10.226 395 HB3 LYS 142 HB1 LYS 142 -6.740 16.234 -11.492 396 HG2 LYS 142 HG2 LYS 142 -5.979 14.590 -12.853 397 HG3 LYS 142 HG1 LYS 142 -4.451 15.471 -12.830 398 HD2 LYS 142 HD2 LYS 142 -3.534 13.609 -11.943 399 HD3 LYS 142 HD1 LYS 142 -4.405 14.008 -10.461 400 HE2 LYS 142 HE2 LYS 142 -5.572 12.081 -10.711 401 HE3 LYS 142 HE1 LYS 142 -6.292 12.765 -12.182 402 HZ1 LYS 142 HZ1 LYS 142 -5.176 11.049 -13.130 403 HZ2 LYS 142 HZ2 LYS 142 -4.008 10.968 -11.898 404 HZ3 LYS 142 HZ3 LYS 142 -3.897 12.163 -13.101 405 H ASN 143 HN ASN 143 -5.655 18.650 -9.177 406 HA ASN 143 HA ASN 143 -7.598 20.198 -10.706 407 HB2 ASN 143 HB2 ASN 143 -6.427 20.818 -7.985 408 HB3 ASN 143 HB1 ASN 143 -8.047 21.186 -8.578 409 HD21 ASN 143 HD21 ASN 143 -6.502 19.118 -6.514 410 HD22 ASN 143 HD22 ASN 143 -7.533 17.774 -6.622 411 H ASN 144 HN ASN 144 -4.227 20.540 -9.830 412 HA ASN 144 HA ASN 144 -2.654 22.233 -10.328 413 HB2 ASN 144 HB2 ASN 144 -3.475 21.614 -12.576 414 HB3 ASN 144 HB1 ASN 144 -4.783 22.788 -12.421 415 HD21 ASN 144 HD21 ASN 144 -3.969 24.077 -14.226 416 HD22 ASN 144 HD22 ASN 144 -2.562 25.014 -14.076 417 H ASP 145 HN ASP 145 -4.602 22.862 -8.273 418 HA ASP 145 HA ASP 145 -5.443 25.656 -8.770 419 HB2 ASP 145 HB2 ASP 145 -6.493 25.361 -6.548 420 HB3 ASP 145 HB1 ASP 145 -6.892 24.014 -7.615 421 H GLY 146 HN GLY 146 -2.605 24.166 -7.849 422 HA2 GLY 146 HA2 GLY 146 -0.619 25.303 -7.156 423 HA3 GLY 146 HA1 GLY 146 -1.612 26.660 -6.620 424 H ARG 147 HN ARG 147 -2.805 23.627 -5.617 425 HA ARG 147 HA ARG 147 -1.399 23.832 -2.984 426 HB2 ARG 147 HB2 ARG 147 -4.099 24.540 -3.638 427 HB3 ARG 147 HB1 ARG 147 -4.137 23.123 -2.589 428 HG2 ARG 147 HG2 ARG 147 -2.318 24.482 -1.227 429 HG3 ARG 147 HG1 ARG 147 -3.065 25.863 -2.030 430 HD2 ARG 147 HD2 ARG 147 -5.316 24.972 -1.214 431 HD3 ARG 147 HD1 ARG 147 -4.393 23.855 -0.189 432 HE ARG 147 HE ARG 147 -3.291 26.452 0.151 433 HH11 ARG 147 HH21 ARG 147 -6.194 24.675 0.747 434 HH12 ARG 147 HH22 ARG 147 -6.620 25.597 2.150 435 HH21 ARG 147 HH11 ARG 147 -3.839 27.658 1.976 436 HH22 ARG 147 HH12 ARG 147 -5.290 27.283 2.845 437 H ILE 148 HN ILE 148 -0.811 21.833 -2.206 438 HA ILE 148 HA ILE 148 -2.015 19.418 -3.526 439 HB ILE 148 HB ILE 148 0.804 19.998 -2.559 440 HG12 ILE 148 HG12 ILE 148 -0.378 19.537 -5.317 441 HG13 ILE 148 HG11 ILE 148 0.257 21.062 -4.697 442 HG21 ILE 148 HG21 ILE 148 0.663 17.719 -2.167 443 HG22 ILE 148 HG22 ILE 148 1.095 17.708 -3.877 444 HG23 ILE 148 HG23 ILE 148 -0.585 17.480 -3.390 445 HD11 ILE 148 HD11 ILE 148 2.427 20.426 -4.987 446 HD12 ILE 148 HD12 ILE 148 1.735 19.289 -6.145 447 HD13 ILE 148 HD13 ILE 148 2.106 18.761 -4.503 448 H ASP 149 HN ASP 149 -3.160 18.227 -2.058 449 HA ASP 149 HA ASP 149 -2.597 18.551 0.846 450 HB2 ASP 149 HB2 ASP 149 -4.887 18.676 -0.460 451 HB3 ASP 149 HB1 ASP 149 -4.813 16.916 -0.360 452 H TYR 150 HN TYR 150 -3.267 16.210 1.951 453 HA TYR 150 HA TYR 150 -1.045 14.450 1.329 454 HB2 TYR 150 HB2 TYR 150 -1.869 14.764 3.592 455 HB3 TYR 150 HB1 TYR 150 -3.485 14.241 3.119 456 HD1 TYR 150 HD2 TYR 150 -0.532 12.605 1.692 457 HD2 TYR 150 HD1 TYR 150 -3.481 12.437 4.810 458 HE1 TYR 150 HE2 TYR 150 0.091 10.249 2.153 459 HE2 TYR 150 HE1 TYR 150 -2.858 10.081 5.271 460 HH TYR 150 HH TYR 150 -1.568 8.135 3.474 461 H ASP 151 HN ASP 151 -4.596 13.902 1.231 462 HA ASP 151 HA ASP 151 -4.642 11.383 0.020 463 HB2 ASP 151 HB2 ASP 151 -6.877 12.091 -0.771 464 HB3 ASP 151 HB1 ASP 151 -6.584 12.668 0.871 465 H GLU 152 HN GLU 152 -4.202 14.556 -1.525 466 HA GLU 152 HA GLU 152 -4.214 13.468 -4.242 467 HB2 GLU 152 HB2 GLU 152 -3.304 16.127 -3.087 468 HB3 GLU 152 HB1 GLU 152 -3.610 15.803 -4.793 469 HG2 GLU 152 HG2 GLU 152 -5.970 15.222 -4.220 470 HG3 GLU 152 HG1 GLU 152 -5.645 15.681 -2.548 471 H PHE 153 HN PHE 153 -1.906 13.702 -1.711 472 HA PHE 153 HA PHE 153 0.505 14.027 -3.266 473 HB2 PHE 153 HB2 PHE 153 0.193 14.419 -0.811 474 HB3 PHE 153 HB1 PHE 153 0.035 12.677 -0.589 475 HD1 PHE 153 HD1 PHE 153 2.318 14.704 -2.763 476 HD2 PHE 153 HD2 PHE 153 1.969 11.908 0.477 477 HE1 PHE 153 HE1 PHE 153 4.787 14.488 -2.685 478 HE2 PHE 153 HE2 PHE 153 4.438 11.691 0.556 479 HZ PHE 153 HZ PHE 153 5.848 12.981 -1.024 480 H LEU 154 HN LEU 154 -1.409 11.213 -2.269 481 HA LEU 154 HA LEU 154 0.424 9.134 -2.822 482 HB2 LEU 154 HB2 LEU 154 -2.452 9.552 -2.508 483 HB3 LEU 154 HB1 LEU 154 -2.090 8.223 -3.611 484 HG LEU 154 HG LEU 154 -2.255 7.485 -1.230 485 HD11 LEU 154 HD11 LEU 154 -0.021 6.305 -1.206 486 HD12 LEU 154 HD12 LEU 154 0.442 7.283 -2.598 487 HD13 LEU 154 HD13 LEU 154 -0.905 6.152 -2.724 488 HD21 LEU 154 HD21 LEU 154 -0.303 8.132 0.245 489 HD22 LEU 154 HD22 LEU 154 -1.423 9.450 -0.097 490 HD23 LEU 154 HD23 LEU 154 0.116 9.355 -0.955 491 H GLU 155 HN GLU 155 -1.979 10.598 -5.049 492 HA GLU 155 HA GLU 155 -1.313 9.079 -7.352 493 HB2 GLU 155 HB2 GLU 155 -3.290 10.587 -6.952 494 HB3 GLU 155 HB1 GLU 155 -2.220 11.968 -7.195 495 HG2 GLU 155 HG2 GLU 155 -3.519 11.222 -9.254 496 HG3 GLU 155 HG1 GLU 155 -1.770 11.335 -9.461 497 H PHE 156 HN PHE 156 0.434 11.655 -5.796 498 HA PHE 156 HA PHE 156 1.905 12.632 -8.073 499 HB2 PHE 156 HB2 PHE 156 1.668 13.808 -5.919 500 HB3 PHE 156 HB1 PHE 156 2.573 12.527 -5.114 501 HD1 PHE 156 HD2 PHE 156 2.818 15.126 -7.780 502 HD2 PHE 156 HD1 PHE 156 4.940 12.526 -5.098 503 HE1 PHE 156 HE2 PHE 156 4.947 16.251 -8.372 504 HE2 PHE 156 HE1 PHE 156 7.068 13.652 -5.692 505 HZ PHE 156 HZ PHE 156 7.072 15.515 -7.328 506 H MET 157 HN MET 157 3.082 10.543 -5.401 507 HA MET 157 HA MET 157 5.179 9.490 -7.231 508 HB2 MET 157 HB2 MET 157 6.164 8.679 -5.114 509 HB3 MET 157 HB1 MET 157 5.772 10.394 -5.004 510 HG2 MET 157 HG2 MET 157 3.428 9.207 -4.170 511 HG3 MET 157 HG1 MET 157 4.651 8.120 -3.516 512 HE1 MET 157 HE1 MET 157 7.070 10.467 -1.756 513 HE2 MET 157 HE2 MET 157 6.939 11.061 -3.409 514 HE3 MET 157 HE3 MET 157 6.938 9.327 -3.102 515 H LYS 158 HN LYS 158 2.327 8.454 -5.426 516 HA LYS 158 HA LYS 158 1.099 6.442 -5.530 517 HB2 LYS 158 HB2 LYS 158 1.715 7.062 -8.016 518 HB3 LYS 158 HB1 LYS 158 2.794 5.672 -7.892 519 HG2 LYS 158 HG2 LYS 158 1.036 4.326 -8.290 520 HG3 LYS 158 HG1 LYS 158 0.327 4.861 -6.766 521 HD2 LYS 158 HD2 LYS 158 -0.357 6.972 -8.248 522 HD3 LYS 158 HD1 LYS 158 -0.240 5.786 -9.550 523 HE2 LYS 158 HE2 LYS 158 -1.639 4.593 -7.329 524 HE3 LYS 158 HE1 LYS 158 -2.409 6.135 -7.754 525 HZ1 LYS 158 HZ1 LYS 158 -3.037 4.057 -9.108 526 HZ2 LYS 158 HZ2 LYS 158 -1.526 4.261 -9.856 527 HZ3 LYS 158 HZ3 LYS 158 -2.695 5.490 -9.947 528 H GLY 159 HN GLY 159 4.271 5.389 -6.811 529 HA2 GLY 159 HA2 GLY 159 4.764 3.878 -4.308 530 HA3 GLY 159 HA1 GLY 159 4.665 2.953 -5.808 531 H VAL 160 HN VAL 160 5.920 4.900 -7.507 532 HA VAL 160 HA VAL 160 8.106 5.419 -8.246 533 HB VAL 160 HB VAL 160 8.222 5.964 -5.265 534 HG11 VAL 160 HG11 VAL 160 10.485 5.680 -6.354 535 HG12 VAL 160 HG12 VAL 160 10.197 7.286 -5.684 536 HG13 VAL 160 HG13 VAL 160 10.068 7.020 -7.423 537 HG21 VAL 160 HG21 VAL 160 7.790 8.274 -5.940 538 HG22 VAL 160 HG22 VAL 160 6.531 7.229 -6.598 539 HG23 VAL 160 HG23 VAL 160 7.829 7.810 -7.641 540 H GLU 161 HN GLU 161 9.301 4.439 -5.097 541 HA GLU 161 HA GLU 161 11.072 2.454 -6.323 542 HB2 GLU 161 HB2 GLU 161 10.751 3.951 -3.841 543 HB3 GLU 161 HB1 GLU 161 11.194 2.272 -3.534 544 HG2 GLU 161 HG2 GLU 161 12.787 3.109 -5.712 545 HG3 GLU 161 HG1 GLU 161 12.842 4.423 -4.538 546 HO1 KDH 1 H1 KDH 1 6.513 11.654 -11.491 547 H21 KDH 1 H21 KDH 1 10.637 8.181 -3.971 548 H33 KDH 1 H33 KDH 1 8.767 13.186 -6.598 549 H4 KDH 1 H4 KDH 1 6.761 11.882 -7.947 550 HO7 KDH 1 H7 KDH 1 8.171 8.767 -11.993 551 H01 KDH 1 H01 KDH 1 10.382 13.632 -4.651 552 H01A KDH 1 H02 KDH 1 8.786 12.863 -4.291 553 HO03 KDH 1 H03 KDH 1 11.902 13.731 -3.118 554 HO10 KDH 1 H10 KDH 1 10.580 8.004 -9.852 555 H12 KDH 1 H12 KDH 1 10.413 9.418 -7.927 556 H15 KDH 1 H15 KDH 1 7.932 11.114 -5.930 557 H26 KDH 1 H26 KDH 1 12.296 11.085 -1.132 558 H39 KDH 1 H39 KDH 1 10.461 13.766 -10.907 559 H41 KDH 1 H41 KDH 1 12.383 11.137 -7.946 560 HO02 KDH 1 H42 KDH 1 11.232 7.921 -1.380 561 HO44 KDH 1 H44 KDH 1 14.059 9.799 -8.752 562 HO47 KDH 1 H47 KDH 1 13.287 9.885 -12.602 563 HO50 KDH 1 H50 KDH 1 12.727 13.120 -13.334 Start of MODEL 27 1 H1 MET 90 HT1 MET 90 12.260 9.196 -0.311 2 H2 MET 90 HT2 MET 90 12.444 8.281 1.108 3 H3 MET 90 HT3 MET 90 10.987 9.101 0.805 4 HA MET 90 HA MET 90 11.208 7.554 -1.403 5 HB2 MET 90 HB2 MET 90 11.960 5.367 -0.573 6 HB3 MET 90 HB1 MET 90 13.230 6.565 -0.323 7 HG2 MET 90 HG2 MET 90 13.174 6.245 1.905 8 HG3 MET 90 HG1 MET 90 11.433 6.524 1.945 9 HE1 MET 90 HE1 MET 90 14.217 4.113 0.968 10 HE2 MET 90 HE2 MET 90 13.761 2.625 1.794 11 HE3 MET 90 HE3 MET 90 14.124 4.070 2.734 12 H GLY 91 HN GLY 91 9.169 8.858 -0.159 13 HA2 GLY 91 HA2 GLY 91 7.582 7.660 1.765 14 HA3 GLY 91 HA1 GLY 91 6.896 8.454 0.346 15 H LYS 92 HN LYS 92 5.738 6.148 1.582 16 HA LYS 92 HA LYS 92 5.716 4.336 -0.757 17 HB2 LYS 92 HB2 LYS 92 7.544 3.775 1.053 18 HB3 LYS 92 HB1 LYS 92 6.172 3.155 1.973 19 HG2 LYS 92 HG2 LYS 92 6.562 1.237 0.806 20 HG3 LYS 92 HG1 LYS 92 5.680 2.063 -0.479 21 HD2 LYS 92 HD2 LYS 92 7.572 1.621 -1.684 22 HD3 LYS 92 HD1 LYS 92 8.160 3.081 -0.887 23 HE2 LYS 92 HE2 LYS 92 9.052 1.611 0.972 24 HE3 LYS 92 HE1 LYS 92 8.652 0.209 -0.039 25 HZ1 LYS 92 HZ1 LYS 92 10.973 1.362 -0.260 26 HZ2 LYS 92 HZ2 LYS 92 10.114 2.456 -1.237 27 HZ3 LYS 92 HZ3 LYS 92 10.157 0.806 -1.640 28 H SER 93 HN SER 93 4.674 4.236 2.675 29 HA SER 93 HA SER 93 1.846 3.980 1.701 30 HB2 SER 93 HB2 SER 93 3.128 1.899 2.590 31 HB3 SER 93 HB1 SER 93 2.961 2.653 4.173 32 HG SER 93 HG SER 93 1.234 1.143 3.313 33 H GLU 94 HN GLU 94 0.246 4.670 3.387 34 HA GLU 94 HA GLU 94 0.555 7.238 4.375 35 HB2 GLU 94 HB2 GLU 94 -0.938 4.937 5.678 36 HB3 GLU 94 HB1 GLU 94 -1.308 6.651 5.871 37 HG2 GLU 94 HG2 GLU 94 -1.464 6.641 3.256 38 HG3 GLU 94 HG1 GLU 94 -1.672 4.900 3.454 39 H GLU 95 HN GLU 95 1.837 4.274 5.741 40 HA GLU 95 HA GLU 95 2.316 4.966 8.417 41 HB2 GLU 95 HB2 GLU 95 3.741 3.343 6.323 42 HB3 GLU 95 HB1 GLU 95 4.467 3.523 7.921 43 HG2 GLU 95 HG2 GLU 95 2.715 2.411 8.992 44 HG3 GLU 95 HG1 GLU 95 1.574 2.749 7.690 45 H GLU 96 HN GLU 96 4.645 5.445 5.721 46 HA GLU 96 HA GLU 96 6.158 7.382 7.368 47 HB2 GLU 96 HB2 GLU 96 6.498 5.817 4.851 48 HB3 GLU 96 HB1 GLU 96 7.418 7.316 4.990 49 HG2 GLU 96 HG2 GLU 96 8.877 5.773 5.964 50 HG3 GLU 96 HG1 GLU 96 8.025 6.404 7.374 51 H LEU 97 HN LEU 97 4.308 7.333 4.311 52 HA LEU 97 HA LEU 97 4.670 9.872 3.299 53 HB2 LEU 97 HB2 LEU 97 2.107 8.301 3.718 54 HB3 LEU 97 HB1 LEU 97 2.243 9.683 2.629 55 HG LEU 97 HG LEU 97 3.732 7.052 2.448 56 HD11 LEU 97 HD11 LEU 97 2.665 7.079 0.159 57 HD12 LEU 97 HD12 LEU 97 1.747 8.497 0.670 58 HD13 LEU 97 HD13 LEU 97 1.516 6.953 1.491 59 HD21 LEU 97 HD21 LEU 97 4.636 8.213 0.301 60 HD22 LEU 97 HD22 LEU 97 5.377 8.631 1.846 61 HD23 LEU 97 HD23 LEU 97 4.197 9.716 1.112 62 H SER 98 HN SER 98 2.366 9.056 5.931 63 HA SER 98 HA SER 98 1.254 11.532 6.491 64 HB2 SER 98 HB2 SER 98 0.804 10.603 8.603 65 HB3 SER 98 HB1 SER 98 1.120 9.171 7.629 66 HG SER 98 HG SER 98 2.755 8.789 8.877 67 H ASP 99 HN ASP 99 4.482 10.378 7.474 68 HA ASP 99 HA ASP 99 5.122 12.941 8.783 69 HB2 ASP 99 HB2 ASP 99 6.446 10.275 8.315 70 HB3 ASP 99 HB1 ASP 99 7.397 11.640 8.903 71 H LEU 100 HN LEU 100 5.387 11.515 5.650 72 HA LEU 100 HA LEU 100 7.674 13.126 4.764 73 HB2 LEU 100 HB2 LEU 100 6.347 10.803 3.984 74 HB3 LEU 100 HB1 LEU 100 5.924 11.964 2.726 75 HG LEU 100 HG LEU 100 8.477 12.545 2.768 76 HD11 LEU 100 HD11 LEU 100 8.445 10.653 4.783 77 HD12 LEU 100 HD12 LEU 100 9.879 11.161 3.891 78 HD13 LEU 100 HD13 LEU 100 8.993 9.721 3.390 79 HD21 LEU 100 HD21 LEU 100 6.934 11.101 1.100 80 HD22 LEU 100 HD22 LEU 100 8.022 9.823 1.642 81 HD23 LEU 100 HD23 LEU 100 8.675 11.265 0.865 82 H PHE 101 HN PHE 101 4.254 13.557 5.057 83 HA PHE 101 HA PHE 101 4.010 15.577 2.943 84 HB2 PHE 101 HB2 PHE 101 2.220 13.980 3.835 85 HB3 PHE 101 HB1 PHE 101 2.158 15.002 5.272 86 HD1 PHE 101 HD1 PHE 101 1.922 15.153 1.539 87 HD2 PHE 101 HD2 PHE 101 0.829 16.945 5.286 88 HE1 PHE 101 HE1 PHE 101 0.437 16.741 0.346 89 HE2 PHE 101 HE2 PHE 101 -0.655 18.534 4.093 90 HZ PHE 101 HZ PHE 101 -0.851 18.431 1.623 91 H ARG 102 HN ARG 102 3.794 15.669 6.528 92 HA ARG 102 HA ARG 102 3.752 18.501 6.792 93 HB2 ARG 102 HB2 ARG 102 4.605 17.924 9.114 94 HB3 ARG 102 HB1 ARG 102 3.183 17.011 8.611 95 HG2 ARG 102 HG2 ARG 102 4.316 15.096 8.925 96 HG3 ARG 102 HG1 ARG 102 5.474 15.591 7.690 97 HD2 ARG 102 HD2 ARG 102 6.674 15.171 9.788 98 HD3 ARG 102 HD1 ARG 102 6.693 16.916 9.462 99 HE ARG 102 HE ARG 102 4.370 16.054 11.014 100 HH11 ARG 102 HH21 ARG 102 7.674 17.060 11.059 101 HH12 ARG 102 HH22 ARG 102 7.600 17.671 12.677 102 HH21 ARG 102 HH11 ARG 102 4.262 16.846 13.124 103 HH22 ARG 102 HH12 ARG 102 5.672 17.544 13.848 104 H MET 103 HN MET 103 6.385 16.260 6.204 105 HA MET 103 HA MET 103 8.481 18.240 6.806 106 HB2 MET 103 HB2 MET 103 8.757 15.834 7.262 107 HB3 MET 103 HB1 MET 103 8.506 15.473 5.554 108 HG2 MET 103 HG2 MET 103 10.498 17.288 5.339 109 HG3 MET 103 HG1 MET 103 10.890 16.604 6.917 110 HE1 MET 103 HE1 MET 103 13.100 15.395 3.972 111 HE2 MET 103 HE2 MET 103 12.198 16.879 4.269 112 HE3 MET 103 HE3 MET 103 11.671 15.775 3.001 113 H PHE 104 HN PHE 104 7.016 16.710 3.938 114 HA PHE 104 HA PHE 104 8.676 17.726 1.905 115 HB2 PHE 104 HB2 PHE 104 5.925 16.747 2.254 116 HB3 PHE 104 HB1 PHE 104 6.101 17.850 0.889 117 HD1 PHE 104 HD2 PHE 104 8.421 15.313 2.391 118 HD2 PHE 104 HD1 PHE 104 6.245 16.602 -1.080 119 HE1 PHE 104 HE2 PHE 104 9.468 13.500 1.061 120 HE2 PHE 104 HE1 PHE 104 7.291 14.789 -2.410 121 HZ PHE 104 HZ PHE 104 8.903 13.239 -1.339 122 H ASP 105 HN ASP 105 5.677 19.228 3.174 123 HA ASP 105 HA ASP 105 5.940 21.691 1.743 124 HB2 ASP 105 HB2 ASP 105 3.888 20.783 2.825 125 HB3 ASP 105 HB1 ASP 105 4.612 21.080 4.405 126 H LYS 106 HN LYS 106 8.200 22.321 2.042 127 HA LYS 106 HA LYS 106 9.276 22.825 4.706 128 HB2 LYS 106 HB2 LYS 106 11.162 23.712 3.404 129 HB3 LYS 106 HB1 LYS 106 10.599 22.202 2.686 130 HG2 LYS 106 HG2 LYS 106 10.390 23.322 0.739 131 HG3 LYS 106 HG1 LYS 106 9.033 24.179 1.473 132 HD2 LYS 106 HD2 LYS 106 10.779 25.720 0.556 133 HD3 LYS 106 HD1 LYS 106 10.516 25.927 2.288 134 HE2 LYS 106 HE2 LYS 106 12.675 25.405 2.723 135 HE3 LYS 106 HE1 LYS 106 12.533 23.891 1.808 136 HZ1 LYS 106 HZ1 LYS 106 12.998 26.605 0.691 137 HZ2 LYS 106 HZ2 LYS 106 12.686 25.224 -0.248 138 HZ3 LYS 106 HZ3 LYS 106 14.096 25.313 0.695 139 H ASN 107 HN ASN 107 7.115 24.505 2.674 140 HA ASN 107 HA ASN 107 7.908 27.224 3.395 141 HB2 ASN 107 HB2 ASN 107 6.754 26.660 1.299 142 HB3 ASN 107 HB1 ASN 107 5.382 26.025 2.208 143 HD21 ASN 107 HD21 ASN 107 3.842 27.612 1.474 144 HD22 ASN 107 HD22 ASN 107 3.961 29.253 1.890 145 H ALA 108 HN ALA 108 6.133 24.707 4.932 146 HA ALA 108 HA ALA 108 5.063 24.676 7.045 147 HB1 ALA 108 HB1 ALA 108 5.598 27.608 7.341 148 HB2 ALA 108 HB2 ALA 108 6.981 26.517 7.255 149 HB3 ALA 108 HB3 ALA 108 5.776 26.316 8.528 150 H ASP 109 HN ASP 109 2.970 24.405 6.055 151 HA ASP 109 HA ASP 109 1.081 26.540 6.571 152 HB2 ASP 109 HB2 ASP 109 0.493 26.738 4.065 153 HB3 ASP 109 HB1 ASP 109 1.970 27.540 4.600 154 H GLY 110 HN GLY 110 1.790 23.528 4.826 155 HA2 GLY 110 HA2 GLY 110 0.456 21.528 5.482 156 HA3 GLY 110 HA1 GLY 110 -0.956 22.584 5.550 157 H TYR 111 HN TYR 111 1.239 23.198 2.973 158 HA TYR 111 HA TYR 111 -0.222 21.449 1.073 159 HB2 TYR 111 HB2 TYR 111 -0.277 24.479 1.123 160 HB3 TYR 111 HB1 TYR 111 -0.752 23.537 -0.291 161 HD1 TYR 111 HD1 TYR 111 -1.589 24.385 3.202 162 HD2 TYR 111 HD2 TYR 111 -2.788 22.205 -0.300 163 HE1 TYR 111 HE1 TYR 111 -3.836 24.033 4.191 164 HE2 TYR 111 HE2 TYR 111 -5.035 21.853 0.689 165 HH TYR 111 HH TYR 111 -6.390 23.459 2.786 166 H ILE 112 HN ILE 112 0.772 21.679 -1.169 167 HA ILE 112 HA ILE 112 3.614 22.627 -1.039 168 HB ILE 112 HB ILE 112 2.480 20.025 -2.114 169 HG12 ILE 112 HG12 ILE 112 4.284 20.733 0.216 170 HG13 ILE 112 HG11 ILE 112 2.706 19.949 0.282 171 HG21 ILE 112 HG21 ILE 112 5.335 20.062 -2.017 172 HG22 ILE 112 HG22 ILE 112 4.804 21.490 -2.907 173 HG23 ILE 112 HG23 ILE 112 4.297 19.885 -3.432 174 HD11 ILE 112 HD11 ILE 112 5.332 18.816 -0.657 175 HD12 ILE 112 HD12 ILE 112 3.811 18.128 -1.223 176 HD13 ILE 112 HD13 ILE 112 4.187 18.139 0.500 177 H ASP 113 HN ASP 113 3.985 24.060 -2.686 178 HA ASP 113 HA ASP 113 2.088 24.194 -4.961 179 HB2 ASP 113 HB2 ASP 113 4.025 25.927 -3.551 180 HB3 ASP 113 HB1 ASP 113 3.946 26.183 -5.294 181 H LEU 114 HN LEU 114 3.515 24.984 -7.070 182 HA LEU 114 HA LEU 114 4.939 22.600 -7.924 183 HB2 LEU 114 HB2 LEU 114 4.107 25.253 -9.015 184 HB3 LEU 114 HB1 LEU 114 5.391 24.397 -9.870 185 HG LEU 114 HG LEU 114 2.971 22.837 -9.076 186 HD11 LEU 114 HD11 LEU 114 2.044 24.923 -10.033 187 HD12 LEU 114 HD12 LEU 114 1.786 23.553 -11.113 188 HD13 LEU 114 HD13 LEU 114 3.066 24.717 -11.456 189 HD21 LEU 114 HD21 LEU 114 4.457 21.470 -10.198 190 HD22 LEU 114 HD22 LEU 114 5.126 22.799 -11.145 191 HD23 LEU 114 HD23 LEU 114 3.566 22.101 -11.584 192 H ASP 115 HN ASP 115 5.867 25.716 -6.606 193 HA ASP 115 HA ASP 115 8.663 25.562 -7.434 194 HB2 ASP 115 HB2 ASP 115 7.260 27.200 -5.295 195 HB3 ASP 115 HB1 ASP 115 8.843 27.547 -5.993 196 H GLU 116 HN GLU 116 6.854 24.908 -4.424 197 HA GLU 116 HA GLU 116 9.186 24.235 -2.851 198 HB2 GLU 116 HB2 GLU 116 6.275 23.426 -2.544 199 HB3 GLU 116 HB1 GLU 116 7.490 23.452 -1.265 200 HG2 GLU 116 HG2 GLU 116 7.662 25.828 -1.336 201 HG3 GLU 116 HG1 GLU 116 6.777 25.920 -2.858 202 H LEU 117 HN LEU 117 7.310 22.518 -5.215 203 HA LEU 117 HA LEU 117 7.916 19.824 -4.313 204 HB2 LEU 117 HB2 LEU 117 6.878 21.167 -6.798 205 HB3 LEU 117 HB1 LEU 117 7.283 19.452 -6.841 206 HG LEU 117 HG LEU 117 5.429 20.689 -4.789 207 HD11 LEU 117 HD11 LEU 117 4.961 20.218 -7.543 208 HD12 LEU 117 HD12 LEU 117 3.766 20.600 -6.304 209 HD13 LEU 117 HD13 LEU 117 4.150 18.918 -6.670 210 HD21 LEU 117 HD21 LEU 117 6.195 17.859 -5.550 211 HD22 LEU 117 HD22 LEU 117 4.758 18.227 -4.596 212 HD23 LEU 117 HD23 LEU 117 6.357 18.635 -3.975 213 H LYS 118 HN LYS 118 9.326 22.018 -6.758 214 HA LYS 118 HA LYS 118 11.482 20.075 -7.331 215 HB2 LYS 118 HB2 LYS 118 12.085 21.836 -9.016 216 HB3 LYS 118 HB1 LYS 118 10.415 21.287 -9.157 217 HG2 LYS 118 HG2 LYS 118 9.713 23.403 -8.888 218 HG3 LYS 118 HG1 LYS 118 10.442 23.428 -7.282 219 HD2 LYS 118 HD2 LYS 118 12.214 24.657 -7.981 220 HD3 LYS 118 HD1 LYS 118 12.396 23.709 -9.458 221 HE2 LYS 118 HE2 LYS 118 10.187 24.959 -10.193 222 HE3 LYS 118 HE1 LYS 118 10.702 26.144 -8.976 223 HZ1 LYS 118 HZ1 LYS 118 11.933 26.858 -10.744 224 HZ2 LYS 118 HZ2 LYS 118 12.044 25.315 -11.446 225 HZ3 LYS 118 HZ3 LYS 118 13.017 25.717 -10.113 226 H ILE 119 HN ILE 119 10.987 23.072 -5.540 227 HA ILE 119 HA ILE 119 13.736 23.848 -5.261 228 HB ILE 119 HB ILE 119 11.183 24.271 -3.703 229 HG12 ILE 119 HG12 ILE 119 12.980 26.184 -5.224 230 HG13 ILE 119 HG11 ILE 119 11.579 25.379 -5.931 231 HG21 ILE 119 HG21 ILE 119 12.898 24.363 -2.010 232 HG22 ILE 119 HG22 ILE 119 12.495 26.028 -2.430 233 HG23 ILE 119 HG23 ILE 119 13.966 25.288 -3.065 234 HD11 ILE 119 HD11 ILE 119 11.556 27.264 -3.557 235 HD12 ILE 119 HD12 ILE 119 10.147 26.392 -4.160 236 HD13 ILE 119 HD13 ILE 119 10.931 27.606 -5.170 237 H MET 120 HN MET 120 11.607 21.843 -3.202 238 HA MET 120 HA MET 120 13.431 21.273 -1.116 239 HB2 MET 120 HB2 MET 120 11.059 20.706 -1.069 240 HB3 MET 120 HB1 MET 120 11.261 19.612 -2.439 241 HG2 MET 120 HG2 MET 120 12.406 18.019 -1.170 242 HG3 MET 120 HG1 MET 120 12.900 19.198 0.045 243 HE1 MET 120 HE1 MET 120 10.604 16.994 -1.498 244 HE2 MET 120 HE2 MET 120 9.098 17.895 -1.341 245 HE3 MET 120 HE3 MET 120 9.410 16.522 -0.281 246 H LEU 121 HN LEU 121 13.396 20.221 -4.425 247 HA LEU 121 HA LEU 121 15.190 17.920 -3.946 248 HB2 LEU 121 HB2 LEU 121 13.632 19.139 -6.183 249 HB3 LEU 121 HB1 LEU 121 15.039 18.168 -6.619 250 HG LEU 121 HG LEU 121 12.983 16.789 -6.511 251 HD11 LEU 121 HD11 LEU 121 14.736 16.092 -4.152 252 HD12 LEU 121 HD12 LEU 121 15.321 15.961 -5.811 253 HD13 LEU 121 HD13 LEU 121 13.941 14.999 -5.283 254 HD21 LEU 121 HD21 LEU 121 11.540 16.848 -4.751 255 HD22 LEU 121 HD22 LEU 121 12.321 18.384 -4.375 256 HD23 LEU 121 HD23 LEU 121 12.846 16.907 -3.566 257 H GLN 122 HN GLN 122 15.432 21.303 -4.681 258 HA GLN 122 HA GLN 122 17.679 21.649 -6.240 259 HB2 GLN 122 HB2 GLN 122 16.597 22.956 -3.775 260 HB3 GLN 122 HB1 GLN 122 18.185 23.469 -4.343 261 HG2 GLN 122 HG2 GLN 122 17.157 23.786 -6.636 262 HG3 GLN 122 HG1 GLN 122 15.582 23.520 -5.889 263 HE21 GLN 122 HE21 GLN 122 18.465 25.661 -5.691 264 HE22 GLN 122 HE22 GLN 122 17.619 26.992 -5.064 265 H ALA 123 HN ALA 123 17.584 20.303 -2.979 266 HA ALA 123 HA ALA 123 20.410 20.430 -2.431 267 HB1 ALA 123 HB1 ALA 123 17.998 18.955 -1.436 268 HB2 ALA 123 HB2 ALA 123 19.079 20.041 -0.564 269 HB3 ALA 123 HB3 ALA 123 19.589 18.391 -0.924 270 H THR 124 HN THR 124 18.371 18.164 -4.200 271 HA THR 124 HA THR 124 20.437 16.099 -4.409 272 HB THR 124 HB THR 124 17.664 16.627 -5.445 273 HG1 THR 124 HG1 THR 124 17.380 15.432 -3.760 274 HG21 THR 124 HG21 THR 124 17.765 14.513 -6.732 275 HG22 THR 124 HG22 THR 124 19.495 14.408 -6.404 276 HG23 THR 124 HG23 THR 124 18.862 15.727 -7.389 277 H GLY 125 HN GLY 125 20.066 19.105 -5.828 278 HA2 GLY 125 HA2 GLY 125 21.361 20.067 -7.563 279 HA3 GLY 125 HA1 GLY 125 22.005 18.464 -7.924 280 H GLU 126 HN GLU 126 18.556 19.018 -7.698 281 HA GLU 126 HA GLU 126 17.983 17.844 -10.229 282 HB2 GLU 126 HB2 GLU 126 15.725 18.721 -9.783 283 HB3 GLU 126 HB1 GLU 126 16.434 18.088 -8.297 284 HG2 GLU 126 HG2 GLU 126 16.004 20.093 -7.359 285 HG3 GLU 126 HG1 GLU 126 17.274 20.756 -8.388 286 H THR 127 HN THR 127 19.268 18.892 -11.865 287 HA THR 127 HA THR 127 18.570 21.759 -12.398 288 HB THR 127 HB THR 127 20.922 21.464 -12.056 289 HG1 THR 127 HG1 THR 127 20.383 21.310 -14.835 290 HG21 THR 127 HG21 THR 127 21.923 19.635 -13.818 291 HG22 THR 127 HG22 THR 127 20.387 18.883 -13.386 292 HG23 THR 127 HG23 THR 127 21.558 19.282 -12.129 293 H ILE 128 HN ILE 128 16.641 21.321 -13.601 294 HA ILE 128 HA ILE 128 17.138 20.093 -16.283 295 HB ILE 128 HB ILE 128 14.848 19.041 -15.993 296 HG12 ILE 128 HG12 ILE 128 15.291 20.097 -13.188 297 HG13 ILE 128 HG11 ILE 128 13.922 20.419 -14.252 298 HG21 ILE 128 HG21 ILE 128 17.168 17.969 -15.486 299 HG22 ILE 128 HG22 ILE 128 15.720 17.157 -14.891 300 HG23 ILE 128 HG23 ILE 128 16.696 18.135 -13.795 301 HD11 ILE 128 HD11 ILE 128 13.349 18.736 -12.528 302 HD12 ILE 128 HD12 ILE 128 14.651 17.702 -13.116 303 HD13 ILE 128 HD13 ILE 128 13.266 18.051 -14.151 304 H THR 129 HN THR 129 15.274 20.712 -17.813 305 HA THR 129 HA THR 129 14.910 23.562 -17.841 306 HB THR 129 HB THR 129 14.939 21.935 -19.781 307 HG1 THR 129 HG1 THR 129 13.445 23.124 -20.923 308 HG21 THR 129 HG21 THR 129 13.424 20.277 -18.665 309 HG22 THR 129 HG22 THR 129 12.916 20.704 -20.300 310 HG23 THR 129 HG23 THR 129 12.089 21.403 -18.908 311 H GLU 130 HN GLU 130 13.114 24.806 -17.215 312 HA GLU 130 HA GLU 130 11.516 24.093 -15.038 313 HB2 GLU 130 HB2 GLU 130 11.722 26.367 -15.758 314 HB3 GLU 130 HB1 GLU 130 11.096 25.985 -17.363 315 HG2 GLU 130 HG2 GLU 130 8.902 25.852 -16.628 316 HG3 GLU 130 HG1 GLU 130 9.369 25.399 -14.989 317 H ASP 131 HN ASP 131 10.911 23.496 -18.481 318 HA ASP 131 HA ASP 131 8.167 22.690 -18.264 319 HB2 ASP 131 HB2 ASP 131 9.407 23.289 -20.343 320 HB3 ASP 131 HB1 ASP 131 10.343 21.802 -20.186 321 H ASP 132 HN ASP 132 11.013 21.201 -17.106 322 HA ASP 132 HA ASP 132 9.907 18.448 -17.270 323 HB2 ASP 132 HB2 ASP 132 12.520 19.774 -16.636 324 HB3 ASP 132 HB1 ASP 132 12.235 18.146 -16.018 325 H ILE 133 HN ILE 133 9.884 21.103 -15.121 326 HA ILE 133 HA ILE 133 9.909 19.611 -12.614 327 HB ILE 133 HB ILE 133 8.855 22.381 -13.263 328 HG12 ILE 133 HG12 ILE 133 11.213 21.906 -14.076 329 HG13 ILE 133 HG11 ILE 133 11.092 23.201 -12.885 330 HG21 ILE 133 HG21 ILE 133 9.903 22.604 -10.821 331 HG22 ILE 133 HG22 ILE 133 9.543 20.879 -10.771 332 HG23 ILE 133 HG23 ILE 133 8.249 22.042 -11.058 333 HD11 ILE 133 HD11 ILE 133 12.955 21.631 -12.377 334 HD12 ILE 133 HD12 ILE 133 11.785 20.319 -12.242 335 HD13 ILE 133 HD13 ILE 133 11.741 21.661 -11.098 336 H GLU 134 HN GLU 134 7.452 20.646 -14.920 337 HA GLU 134 HA GLU 134 5.191 20.139 -13.143 338 HB2 GLU 134 HB2 GLU 134 5.670 20.779 -16.041 339 HB3 GLU 134 HB1 GLU 134 4.063 20.264 -15.526 340 HG2 GLU 134 HG2 GLU 134 5.250 22.277 -13.753 341 HG3 GLU 134 HG1 GLU 134 5.020 22.856 -15.403 342 H GLU 135 HN GLU 135 7.319 18.130 -14.861 343 HA GLU 135 HA GLU 135 5.549 16.066 -15.795 344 HB2 GLU 135 HB2 GLU 135 8.419 16.546 -15.326 345 HB3 GLU 135 HB1 GLU 135 7.948 14.850 -15.211 346 HG2 GLU 135 HG2 GLU 135 6.788 15.076 -17.419 347 HG3 GLU 135 HG1 GLU 135 7.430 16.714 -17.543 348 H LEU 136 HN LEU 136 6.695 16.906 -12.614 349 HA LEU 136 HA LEU 136 6.085 14.226 -11.506 350 HB2 LEU 136 HB2 LEU 136 7.154 16.839 -10.410 351 HB3 LEU 136 HB1 LEU 136 6.855 15.430 -9.391 352 HG LEU 136 HG LEU 136 8.419 14.933 -11.863 353 HD11 LEU 136 HD11 LEU 136 9.758 16.742 -11.439 354 HD12 LEU 136 HD12 LEU 136 10.447 15.664 -10.225 355 HD13 LEU 136 HD13 LEU 136 9.239 16.861 -9.758 356 HD21 LEU 136 HD21 LEU 136 7.823 13.274 -10.005 357 HD22 LEU 136 HD22 LEU 136 8.966 14.154 -8.989 358 HD23 LEU 136 HD23 LEU 136 9.527 13.349 -10.454 359 H MET 137 HN MET 137 5.052 17.598 -10.830 360 HA MET 137 HA MET 137 2.984 17.226 -9.051 361 HB2 MET 137 HB2 MET 137 3.586 19.406 -9.848 362 HB3 MET 137 HB1 MET 137 3.197 18.974 -11.514 363 HG2 MET 137 HG2 MET 137 0.881 19.017 -11.119 364 HG3 MET 137 HG1 MET 137 1.082 18.848 -9.375 365 HE1 MET 137 HE1 MET 137 1.532 21.956 -7.851 366 HE2 MET 137 HE2 MET 137 1.261 20.215 -7.874 367 HE3 MET 137 HE3 MET 137 -0.066 21.311 -8.250 368 H LYS 138 HN LYS 138 2.898 16.499 -12.527 369 HA LYS 138 HA LYS 138 0.211 16.104 -13.049 370 HB2 LYS 138 HB2 LYS 138 0.965 14.597 -14.739 371 HB3 LYS 138 HB1 LYS 138 2.313 15.702 -14.473 372 HG2 LYS 138 HG2 LYS 138 3.353 14.057 -12.944 373 HG3 LYS 138 HG1 LYS 138 2.016 12.945 -13.243 374 HD2 LYS 138 HD2 LYS 138 3.434 14.037 -15.627 375 HD3 LYS 138 HD1 LYS 138 4.293 12.840 -14.658 376 HE2 LYS 138 HE2 LYS 138 3.136 11.346 -15.966 377 HE3 LYS 138 HE1 LYS 138 1.810 11.685 -14.835 378 HZ1 LYS 138 HZ1 LYS 138 1.440 13.730 -16.342 379 HZ2 LYS 138 HZ2 LYS 138 0.869 12.217 -16.864 380 HZ3 LYS 138 HZ3 LYS 138 2.314 12.848 -17.498 381 H ASP 139 HN ASP 139 2.308 14.034 -11.073 382 HA ASP 139 HA ASP 139 0.124 12.063 -10.682 383 HB2 ASP 139 HB2 ASP 139 2.766 11.783 -10.993 384 HB3 ASP 139 HB1 ASP 139 2.744 11.986 -9.241 385 H GLY 140 HN GLY 140 1.623 14.766 -9.053 386 HA2 GLY 140 HA2 GLY 140 0.177 14.066 -6.536 387 HA3 GLY 140 HA1 GLY 140 1.532 15.191 -6.634 388 H ASP 141 HN ASP 141 -0.728 15.456 -9.192 389 HA ASP 141 HA ASP 141 -2.707 17.165 -8.047 390 HB2 ASP 141 HB2 ASP 141 -0.151 18.247 -7.973 391 HB3 ASP 141 HB1 ASP 141 -0.849 18.978 -9.418 392 H LYS 142 HN LYS 142 -3.298 15.446 -9.892 393 HA LYS 142 HA LYS 142 -2.778 16.053 -12.638 394 HB2 LYS 142 HB2 LYS 142 -4.123 14.145 -11.101 395 HB3 LYS 142 HB1 LYS 142 -5.394 14.883 -12.077 396 HG2 LYS 142 HG2 LYS 142 -2.906 14.314 -13.555 397 HG3 LYS 142 HG1 LYS 142 -3.739 12.880 -12.954 398 HD2 LYS 142 HD2 LYS 142 -4.877 13.142 -14.941 399 HD3 LYS 142 HD1 LYS 142 -5.869 14.184 -13.919 400 HE2 LYS 142 HE2 LYS 142 -4.059 16.015 -14.641 401 HE3 LYS 142 HE1 LYS 142 -3.903 14.939 -16.045 402 HZ1 LYS 142 HZ1 LYS 142 -6.598 15.510 -15.068 403 HZ2 LYS 142 HZ2 LYS 142 -6.054 15.253 -16.656 404 HZ3 LYS 142 HZ3 LYS 142 -5.803 16.755 -15.902 405 H ASN 143 HN ASN 143 -5.467 17.010 -10.482 406 HA ASN 143 HA ASN 143 -6.900 18.485 -12.510 407 HB2 ASN 143 HB2 ASN 143 -8.421 18.659 -10.815 408 HB3 ASN 143 HB1 ASN 143 -7.364 17.529 -9.977 409 HD21 ASN 143 HD21 ASN 143 -5.598 18.611 -8.569 410 HD22 ASN 143 HD22 ASN 143 -5.997 20.075 -7.809 411 H ASN 144 HN ASN 144 -4.127 19.199 -10.557 412 HA ASN 144 HA ASN 144 -2.852 21.174 -10.295 413 HB2 ASN 144 HB2 ASN 144 -3.788 20.837 -13.015 414 HB3 ASN 144 HB1 ASN 144 -3.601 22.552 -12.645 415 HD21 ASN 144 HD21 ASN 144 -1.486 23.373 -12.656 416 HD22 ASN 144 HD22 ASN 144 -0.086 22.416 -12.711 417 H ASP 145 HN ASP 145 -4.917 21.492 -8.667 418 HA ASP 145 HA ASP 145 -6.718 23.674 -9.360 419 HB2 ASP 145 HB2 ASP 145 -7.321 23.451 -6.960 420 HB3 ASP 145 HB1 ASP 145 -7.251 21.879 -7.754 421 H GLY 146 HN GLY 146 -3.446 23.664 -8.756 422 HA2 GLY 146 HA2 GLY 146 -2.272 25.834 -8.769 423 HA3 GLY 146 HA1 GLY 146 -3.558 26.473 -7.744 424 H ARG 147 HN ARG 147 -3.144 23.508 -6.516 425 HA ARG 147 HA ARG 147 -0.650 23.883 -5.020 426 HB2 ARG 147 HB2 ARG 147 -2.082 23.967 -2.833 427 HB3 ARG 147 HB1 ARG 147 -1.884 25.450 -3.764 428 HG2 ARG 147 HG2 ARG 147 -4.053 25.269 -4.718 429 HG3 ARG 147 HG1 ARG 147 -4.218 23.586 -4.218 430 HD2 ARG 147 HD2 ARG 147 -3.756 24.907 -1.814 431 HD3 ARG 147 HD1 ARG 147 -4.811 26.022 -2.705 432 HE ARG 147 HE ARG 147 -5.844 23.424 -3.111 433 HH11 ARG 147 HH21 ARG 147 -5.269 25.662 -0.541 434 HH12 ARG 147 HH22 ARG 147 -6.588 25.091 0.424 435 HH21 ARG 147 HH11 ARG 147 -7.565 22.673 -1.860 436 HH22 ARG 147 HH12 ARG 147 -7.888 23.403 -0.323 437 H ILE 148 HN ILE 148 -0.205 22.014 -3.649 438 HA ILE 148 HA ILE 148 -1.802 19.615 -4.437 439 HB ILE 148 HB ILE 148 0.985 19.984 -3.290 440 HG12 ILE 148 HG12 ILE 148 -0.047 19.342 -6.070 441 HG13 ILE 148 HG11 ILE 148 0.840 20.786 -5.578 442 HG21 ILE 148 HG21 ILE 148 -0.235 17.803 -2.738 443 HG22 ILE 148 HG22 ILE 148 1.302 17.634 -3.588 444 HG23 ILE 148 HG23 ILE 148 -0.216 17.471 -4.470 445 HD11 ILE 148 HD11 ILE 148 2.818 19.463 -5.082 446 HD12 ILE 148 HD12 ILE 148 2.285 19.091 -6.722 447 HD13 ILE 148 HD13 ILE 148 1.942 17.967 -5.406 448 H ASP 149 HN ASP 149 -2.731 18.299 -2.846 449 HA ASP 149 HA ASP 149 -2.510 19.282 -0.018 450 HB2 ASP 149 HB2 ASP 149 -4.887 18.373 0.109 451 HB3 ASP 149 HB1 ASP 149 -4.676 19.769 -0.949 452 H TYR 150 HN TYR 150 -3.041 17.493 1.596 453 HA TYR 150 HA TYR 150 -1.323 15.234 1.249 454 HB2 TYR 150 HB2 TYR 150 -1.932 16.189 3.413 455 HB3 TYR 150 HB1 TYR 150 -3.630 15.802 3.138 456 HD1 TYR 150 HD1 TYR 150 -0.272 14.124 3.179 457 HD2 TYR 150 HD2 TYR 150 -4.474 13.812 4.013 458 HE1 TYR 150 HE1 TYR 150 0.086 11.864 4.136 459 HE2 TYR 150 HE2 TYR 150 -4.117 11.552 4.969 460 HH TYR 150 HH TYR 150 -2.520 9.744 4.862 461 H ASP 151 HN ASP 151 -4.734 15.729 0.538 462 HA ASP 151 HA ASP 151 -5.607 13.020 0.404 463 HB2 ASP 151 HB2 ASP 151 -6.550 15.627 -0.138 464 HB3 ASP 151 HB1 ASP 151 -6.780 14.714 -1.630 465 H GLU 152 HN GLU 152 -4.050 15.091 -2.048 466 HA GLU 152 HA GLU 152 -4.124 12.942 -4.065 467 HB2 GLU 152 HB2 GLU 152 -2.834 15.692 -4.010 468 HB3 GLU 152 HB1 GLU 152 -3.054 14.690 -5.446 469 HG2 GLU 152 HG2 GLU 152 -5.476 14.789 -5.200 470 HG3 GLU 152 HG1 GLU 152 -5.316 15.673 -3.683 471 H PHE 153 HN PHE 153 -1.813 14.387 -1.820 472 HA PHE 153 HA PHE 153 0.670 13.636 -2.761 473 HB2 PHE 153 HB2 PHE 153 -0.165 14.650 -0.506 474 HB3 PHE 153 HB1 PHE 153 -0.192 12.977 0.052 475 HD1 PHE 153 HD1 PHE 153 1.973 15.656 -1.328 476 HD2 PHE 153 HD2 PHE 153 1.831 11.777 0.509 477 HE1 PHE 153 HE1 PHE 153 4.425 15.736 -0.972 478 HE2 PHE 153 HE2 PHE 153 4.284 11.856 0.865 479 HZ PHE 153 HZ PHE 153 5.582 13.836 0.125 480 H LEU 154 HN LEU 154 -1.889 11.498 -1.638 481 HA LEU 154 HA LEU 154 -0.231 9.115 -1.436 482 HB2 LEU 154 HB2 LEU 154 -3.144 9.840 -1.414 483 HB3 LEU 154 HB1 LEU 154 -2.689 8.143 -1.562 484 HG LEU 154 HG LEU 154 -3.029 8.848 0.811 485 HD11 LEU 154 HD11 LEU 154 -1.424 7.023 0.113 486 HD12 LEU 154 HD12 LEU 154 -1.034 7.785 1.655 487 HD13 LEU 154 HD13 LEU 154 -0.128 8.216 0.205 488 HD21 LEU 154 HD21 LEU 154 -1.416 10.373 1.838 489 HD22 LEU 154 HD22 LEU 154 -2.209 11.187 0.490 490 HD23 LEU 154 HD23 LEU 154 -0.573 10.557 0.300 491 H GLU 155 HN GLU 155 -2.446 10.437 -3.909 492 HA GLU 155 HA GLU 155 -2.295 8.228 -5.727 493 HB2 GLU 155 HB2 GLU 155 -3.810 10.386 -5.552 494 HB3 GLU 155 HB1 GLU 155 -2.584 11.085 -6.611 495 HG2 GLU 155 HG2 GLU 155 -3.068 9.633 -8.362 496 HG3 GLU 155 HG1 GLU 155 -3.724 8.395 -7.290 497 H PHE 156 HN PHE 156 0.069 10.529 -4.824 498 HA PHE 156 HA PHE 156 1.526 10.386 -7.405 499 HB2 PHE 156 HB2 PHE 156 1.468 12.532 -6.365 500 HB3 PHE 156 HB1 PHE 156 1.850 11.855 -4.782 501 HD1 PHE 156 HD1 PHE 156 3.483 10.848 -7.951 502 HD2 PHE 156 HD2 PHE 156 3.843 13.130 -4.330 503 HE1 PHE 156 HE1 PHE 156 5.902 11.166 -8.392 504 HE2 PHE 156 HE2 PHE 156 6.262 13.449 -4.771 505 HZ PHE 156 HZ PHE 156 7.292 12.467 -6.802 506 H MET 157 HN MET 157 2.201 9.680 -3.951 507 HA MET 157 HA MET 157 4.664 8.267 -4.515 508 HB2 MET 157 HB2 MET 157 2.849 8.119 -2.090 509 HB3 MET 157 HB1 MET 157 4.584 7.807 -2.136 510 HG2 MET 157 HG2 MET 157 3.185 10.457 -2.568 511 HG3 MET 157 HG1 MET 157 4.295 10.031 -1.266 512 HE1 MET 157 HE1 MET 157 6.925 9.106 -1.957 513 HE2 MET 157 HE2 MET 157 6.431 10.589 -1.143 514 HE3 MET 157 HE3 MET 157 7.658 10.653 -2.406 515 H LYS 158 HN LYS 158 1.422 7.394 -4.970 516 HA LYS 158 HA LYS 158 1.141 4.745 -4.160 517 HB2 LYS 158 HB2 LYS 158 -0.419 4.578 -5.994 518 HB3 LYS 158 HB1 LYS 158 -0.452 6.253 -5.442 519 HG2 LYS 158 HG2 LYS 158 -0.085 6.783 -7.616 520 HG3 LYS 158 HG1 LYS 158 1.581 6.293 -7.303 521 HD2 LYS 158 HD2 LYS 158 1.282 4.751 -8.929 522 HD3 LYS 158 HD1 LYS 158 0.284 3.882 -7.763 523 HE2 LYS 158 HE2 LYS 158 -1.308 5.976 -8.915 524 HE3 LYS 158 HE1 LYS 158 -0.556 5.043 -10.225 525 HZ1 LYS 158 HZ1 LYS 158 -1.396 3.051 -9.400 526 HZ2 LYS 158 HZ2 LYS 158 -2.699 4.124 -9.201 527 HZ3 LYS 158 HZ3 LYS 158 -1.732 3.701 -7.870 528 H GLY 159 HN GLY 159 3.310 6.021 -6.596 529 HA2 GLY 159 HA2 GLY 159 4.770 3.526 -6.739 530 HA3 GLY 159 HA1 GLY 159 3.834 3.804 -8.208 531 H VAL 160 HN VAL 160 6.272 5.325 -6.101 532 HA VAL 160 HA VAL 160 6.963 7.368 -8.066 533 HB VAL 160 HB VAL 160 8.297 6.320 -5.549 534 HG11 VAL 160 HG11 VAL 160 9.769 7.566 -7.258 535 HG12 VAL 160 HG12 VAL 160 9.738 8.205 -5.615 536 HG13 VAL 160 HG13 VAL 160 8.792 8.986 -6.882 537 HG21 VAL 160 HG21 VAL 160 7.341 8.831 -5.018 538 HG22 VAL 160 HG22 VAL 160 6.466 7.344 -4.654 539 HG23 VAL 160 HG23 VAL 160 6.119 8.230 -6.139 540 H GLU 161 HN GLU 161 7.281 5.691 -9.866 541 HA GLU 161 HA GLU 161 8.703 4.369 -11.220 542 HB2 GLU 161 HB2 GLU 161 10.426 6.356 -9.749 543 HB3 GLU 161 HB1 GLU 161 11.156 5.224 -10.888 544 HG2 GLU 161 HG2 GLU 161 8.968 6.157 -12.292 545 HG3 GLU 161 HG1 GLU 161 9.499 7.590 -11.412 546 HO1 KDH 1 H1 KDH 1 14.652 9.714 -9.419 547 H21 KDH 1 H21 KDH 1 14.503 10.449 -1.829 548 H33 KDH 1 H33 KDH 1 10.197 12.767 -5.229 549 H4 KDH 1 H4 KDH 1 14.150 10.962 -6.029 550 HO7 KDH 1 H7 KDH 1 13.379 8.722 -10.004 551 H01 KDH 1 H01 KDH 1 10.746 14.231 -3.203 552 H01A KDH 1 H02 KDH 1 10.089 12.574 -2.900 553 HO03 KDH 1 H03 KDH 1 11.498 14.996 0.040 554 HO10 KDH 1 H10 KDH 1 9.501 10.363 -9.395 555 H12 KDH 1 H12 KDH 1 9.785 10.750 -6.567 556 H15 KDH 1 H15 KDH 1 10.875 10.695 -4.396 557 H26 KDH 1 H26 KDH 1 13.336 13.798 0.752 558 H39 KDH 1 H39 KDH 1 10.915 12.438 -8.361 559 H41 KDH 1 H41 KDH 1 13.892 15.493 -7.284 560 HO02 KDH 1 H42 KDH 1 15.425 10.869 0.172 561 HO44 KDH 1 H44 KDH 1 16.141 14.414 -9.644 562 HO47 KDH 1 H47 KDH 1 13.826 12.795 -11.921 563 HO50 KDH 1 H50 KDH 1 11.387 11.242 -10.298 Start of MODEL 28 1 H1 MET 90 HT1 MET 90 13.587 8.671 1.513 2 H2 MET 90 HT2 MET 90 14.474 7.447 0.738 3 H3 MET 90 HT3 MET 90 13.233 7.042 1.825 4 HA MET 90 HA MET 90 12.605 8.645 -0.573 5 HB2 MET 90 HB2 MET 90 13.394 5.763 -0.317 6 HB3 MET 90 HB1 MET 90 12.129 6.188 -1.471 7 HG2 MET 90 HG2 MET 90 13.579 7.657 -2.669 8 HG3 MET 90 HG1 MET 90 14.790 7.622 -1.387 9 HE1 MET 90 HE1 MET 90 12.490 5.335 -3.101 10 HE2 MET 90 HE2 MET 90 13.417 3.955 -3.685 11 HE3 MET 90 HE3 MET 90 13.403 5.454 -4.611 12 H GLY 91 HN GLY 91 10.318 8.371 -1.069 13 HA2 GLY 91 HA2 GLY 91 8.687 7.889 1.312 14 HA3 GLY 91 HA1 GLY 91 8.089 8.410 -0.265 15 H LYS 92 HN LYS 92 6.956 6.292 1.396 16 HA LYS 92 HA LYS 92 7.179 4.062 -0.580 17 HB2 LYS 92 HB2 LYS 92 8.667 3.442 1.189 18 HB3 LYS 92 HB1 LYS 92 7.527 3.976 2.425 19 HG2 LYS 92 HG2 LYS 92 6.288 2.064 2.297 20 HG3 LYS 92 HG1 LYS 92 6.497 1.928 0.551 21 HD2 LYS 92 HD2 LYS 92 9.057 1.574 1.757 22 HD3 LYS 92 HD1 LYS 92 7.914 0.538 2.612 23 HE2 LYS 92 HE2 LYS 92 7.150 -0.401 0.444 24 HE3 LYS 92 HE1 LYS 92 8.338 0.613 -0.398 25 HZ1 LYS 92 HZ1 LYS 92 9.865 -0.446 1.494 26 HZ2 LYS 92 HZ2 LYS 92 9.669 -1.160 -0.034 27 HZ3 LYS 92 HZ3 LYS 92 8.765 -1.721 1.291 28 H SER 93 HN SER 93 5.542 4.272 2.578 29 HA SER 93 HA SER 93 2.910 4.272 1.142 30 HB2 SER 93 HB2 SER 93 4.184 2.274 2.885 31 HB3 SER 93 HB1 SER 93 2.542 2.684 3.371 32 HG SER 93 HG SER 93 3.076 2.258 0.658 33 H GLU 94 HN GLU 94 1.153 4.404 3.118 34 HA GLU 94 HA GLU 94 1.249 7.024 4.156 35 HB2 GLU 94 HB2 GLU 94 -0.162 4.593 5.302 36 HB3 GLU 94 HB1 GLU 94 -0.657 6.276 5.487 37 HG2 GLU 94 HG2 GLU 94 -0.362 5.892 2.717 38 HG3 GLU 94 HG1 GLU 94 -1.196 4.452 3.302 39 H GLU 95 HN GLU 95 2.890 4.194 5.283 40 HA GLU 95 HA GLU 95 3.120 4.917 8.076 41 HB2 GLU 95 HB2 GLU 95 3.680 2.752 6.461 42 HB3 GLU 95 HB1 GLU 95 5.292 3.356 6.845 43 HG2 GLU 95 HG2 GLU 95 4.763 1.829 8.596 44 HG3 GLU 95 HG1 GLU 95 4.520 3.434 9.287 45 H GLU 96 HN GLU 96 5.232 5.398 5.232 46 HA GLU 96 HA GLU 96 7.087 7.045 6.870 47 HB2 GLU 96 HB2 GLU 96 7.211 5.311 4.587 48 HB3 GLU 96 HB1 GLU 96 7.804 6.904 4.114 49 HG2 GLU 96 HG2 GLU 96 9.457 6.908 5.838 50 HG3 GLU 96 HG1 GLU 96 8.729 5.513 6.634 51 H LEU 97 HN LEU 97 4.871 7.322 4.100 52 HA LEU 97 HA LEU 97 5.489 9.988 3.318 53 HB2 LEU 97 HB2 LEU 97 2.874 8.443 3.287 54 HB3 LEU 97 HB1 LEU 97 3.218 9.874 2.315 55 HG LEU 97 HG LEU 97 4.650 7.206 2.180 56 HD11 LEU 97 HD11 LEU 97 2.563 8.595 0.582 57 HD12 LEU 97 HD12 LEU 97 2.838 6.868 0.817 58 HD13 LEU 97 HD13 LEU 97 3.826 7.771 -0.331 59 HD21 LEU 97 HD21 LEU 97 5.373 9.937 1.251 60 HD22 LEU 97 HD22 LEU 97 5.607 8.633 0.087 61 HD23 LEU 97 HD23 LEU 97 6.417 8.573 1.653 62 H SER 98 HN SER 98 3.649 8.752 6.035 63 HA SER 98 HA SER 98 1.982 10.900 6.713 64 HB2 SER 98 HB2 SER 98 1.692 9.315 8.303 65 HB3 SER 98 HB1 SER 98 3.272 8.615 7.966 66 HG SER 98 HG SER 98 3.414 9.384 10.008 67 H ASP 99 HN ASP 99 5.359 10.443 7.857 68 HA ASP 99 HA ASP 99 5.453 13.228 8.817 69 HB2 ASP 99 HB2 ASP 99 6.818 10.706 9.208 70 HB3 ASP 99 HB1 ASP 99 7.990 11.990 8.911 71 H LEU 100 HN LEU 100 6.115 11.587 5.886 72 HA LEU 100 HA LEU 100 8.377 13.113 4.949 73 HB2 LEU 100 HB2 LEU 100 7.113 10.896 4.154 74 HB3 LEU 100 HB1 LEU 100 6.280 12.042 3.103 75 HG LEU 100 HG LEU 100 8.669 12.914 2.545 76 HD11 LEU 100 HD11 LEU 100 10.200 11.875 3.890 77 HD12 LEU 100 HD12 LEU 100 10.118 10.621 2.653 78 HD13 LEU 100 HD13 LEU 100 9.176 10.461 4.135 79 HD21 LEU 100 HD21 LEU 100 7.045 10.764 1.498 80 HD22 LEU 100 HD22 LEU 100 8.751 10.412 1.224 81 HD23 LEU 100 HD23 LEU 100 8.053 11.914 0.619 82 H PHE 101 HN PHE 101 4.855 13.445 4.367 83 HA PHE 101 HA PHE 101 4.954 15.751 2.713 84 HB2 PHE 101 HB2 PHE 101 3.033 14.148 3.336 85 HB3 PHE 101 HB1 PHE 101 2.828 15.144 4.777 86 HD1 PHE 101 HD2 PHE 101 2.780 17.768 4.308 87 HD2 PHE 101 HD1 PHE 101 1.844 14.731 1.417 88 HE1 PHE 101 HE2 PHE 101 1.495 19.425 2.983 89 HE2 PHE 101 HE1 PHE 101 0.559 16.388 0.092 90 HZ PHE 101 HZ PHE 101 0.384 18.734 0.876 91 H ARG 102 HN ARG 102 4.665 15.496 6.271 92 HA ARG 102 HA ARG 102 4.320 18.118 7.061 93 HB2 ARG 102 HB2 ARG 102 4.559 16.277 8.613 94 HB3 ARG 102 HB1 ARG 102 6.219 15.988 8.091 95 HG2 ARG 102 HG2 ARG 102 6.451 18.572 8.815 96 HG3 ARG 102 HG1 ARG 102 5.139 18.097 9.893 97 HD2 ARG 102 HD2 ARG 102 6.541 16.145 10.647 98 HD3 ARG 102 HD1 ARG 102 7.881 16.806 9.689 99 HE ARG 102 HE ARG 102 6.681 18.811 11.418 100 HH11 ARG 102 HH21 ARG 102 8.890 16.162 11.217 101 HH12 ARG 102 HH22 ARG 102 9.864 16.708 12.540 102 HH21 ARG 102 HH11 ARG 102 7.948 19.533 13.141 103 HH22 ARG 102 HH12 ARG 102 9.334 18.614 13.626 104 H MET 103 HN MET 103 7.301 16.675 5.781 105 HA MET 103 HA MET 103 8.740 19.261 6.059 106 HB2 MET 103 HB2 MET 103 9.844 17.185 6.735 107 HB3 MET 103 HB1 MET 103 9.544 16.479 5.147 108 HG2 MET 103 HG2 MET 103 11.258 17.620 4.175 109 HG3 MET 103 HG1 MET 103 10.931 19.087 5.097 110 HE1 MET 103 HE1 MET 103 13.835 16.127 5.060 111 HE2 MET 103 HE2 MET 103 14.530 17.740 5.189 112 HE3 MET 103 HE3 MET 103 13.230 17.439 4.039 113 H PHE 104 HN PHE 104 7.357 17.135 3.601 114 HA PHE 104 HA PHE 104 8.553 18.074 1.250 115 HB2 PHE 104 HB2 PHE 104 6.587 16.360 1.871 116 HB3 PHE 104 HB1 PHE 104 5.588 17.710 1.332 117 HD1 PHE 104 HD2 PHE 104 6.471 18.884 -0.910 118 HD2 PHE 104 HD1 PHE 104 7.300 14.835 0.262 119 HE1 PHE 104 HE2 PHE 104 6.949 18.298 -3.272 120 HE2 PHE 104 HE1 PHE 104 7.778 14.249 -2.100 121 HZ PHE 104 HZ PHE 104 7.602 15.981 -3.867 122 H ASP 105 HN ASP 105 6.404 19.770 3.411 123 HA ASP 105 HA ASP 105 5.740 21.860 1.428 124 HB2 ASP 105 HB2 ASP 105 4.540 20.767 3.665 125 HB3 ASP 105 HB1 ASP 105 5.148 22.306 4.275 126 H LYS 106 HN LYS 106 8.011 22.574 1.067 127 HA LYS 106 HA LYS 106 9.895 23.428 2.918 128 HB2 LYS 106 HB2 LYS 106 10.247 23.495 0.522 129 HB3 LYS 106 HB1 LYS 106 8.962 24.686 0.320 130 HG2 LYS 106 HG2 LYS 106 10.542 26.281 0.519 131 HG3 LYS 106 HG1 LYS 106 10.679 25.822 2.217 132 HD2 LYS 106 HD2 LYS 106 12.199 24.427 0.000 133 HD3 LYS 106 HD1 LYS 106 12.861 25.776 0.924 134 HE2 LYS 106 HE2 LYS 106 12.319 24.412 3.033 135 HE3 LYS 106 HE1 LYS 106 12.080 23.034 1.942 136 HZ1 LYS 106 HZ1 LYS 106 14.277 22.808 1.870 137 HZ2 LYS 106 HZ2 LYS 106 14.514 24.221 2.783 138 HZ3 LYS 106 HZ3 LYS 106 14.385 24.311 1.091 139 H ASN 107 HN ASN 107 6.998 25.208 1.842 140 HA ASN 107 HA ASN 107 7.569 27.548 3.487 141 HB2 ASN 107 HB2 ASN 107 6.283 27.816 1.490 142 HB3 ASN 107 HB1 ASN 107 5.201 26.492 1.924 143 HD21 ASN 107 HD21 ASN 107 3.309 27.925 1.837 144 HD22 ASN 107 HD22 ASN 107 3.029 29.076 3.052 145 H ALA 108 HN ALA 108 6.069 24.459 3.997 146 HA ALA 108 HA ALA 108 5.054 23.520 5.913 147 HB1 ALA 108 HB1 ALA 108 7.156 25.195 6.652 148 HB2 ALA 108 HB2 ALA 108 6.358 24.021 7.698 149 HB3 ALA 108 HB3 ALA 108 5.829 25.703 7.697 150 H ASP 109 HN ASP 109 3.067 24.530 4.587 151 HA ASP 109 HA ASP 109 1.591 26.319 6.490 152 HB2 ASP 109 HB2 ASP 109 0.596 27.359 4.464 153 HB3 ASP 109 HB1 ASP 109 2.352 27.525 4.485 154 H GLY 110 HN GLY 110 1.638 23.375 4.729 155 HA2 GLY 110 HA2 GLY 110 -0.097 21.716 5.441 156 HA3 GLY 110 HA1 GLY 110 -1.281 23.013 5.276 157 H TYR 111 HN TYR 111 0.406 23.839 2.783 158 HA TYR 111 HA TYR 111 -0.558 21.695 0.930 159 HB2 TYR 111 HB2 TYR 111 -1.032 24.685 0.693 160 HB3 TYR 111 HB1 TYR 111 -1.569 23.464 -0.461 161 HD1 TYR 111 HD2 TYR 111 -1.886 24.552 3.092 162 HD2 TYR 111 HD1 TYR 111 -3.586 22.271 -0.125 163 HE1 TYR 111 HE2 TYR 111 -3.937 24.185 4.437 164 HE2 TYR 111 HE1 TYR 111 -5.638 21.902 1.219 165 HH TYR 111 HH TYR 111 -5.804 22.407 4.492 166 H ILE 112 HN ILE 112 0.453 21.899 -1.248 167 HA ILE 112 HA ILE 112 3.092 23.326 -1.148 168 HB ILE 112 HB ILE 112 2.383 20.678 -2.453 169 HG12 ILE 112 HG12 ILE 112 3.844 21.280 0.139 170 HG13 ILE 112 HG11 ILE 112 2.261 20.513 -0.005 171 HG21 ILE 112 HG21 ILE 112 4.323 21.043 -3.549 172 HG22 ILE 112 HG22 ILE 112 5.130 20.848 -1.992 173 HG23 ILE 112 HG23 ILE 112 4.690 22.458 -2.562 174 HD11 ILE 112 HD11 ILE 112 4.095 19.107 -1.694 175 HD12 ILE 112 HD12 ILE 112 3.243 18.508 -0.271 176 HD13 ILE 112 HD13 ILE 112 4.825 19.267 -0.097 177 H ASP 113 HN ASP 113 3.688 24.408 -3.064 178 HA ASP 113 HA ASP 113 1.586 24.495 -5.202 179 HB2 ASP 113 HB2 ASP 113 2.322 26.790 -5.540 180 HB3 ASP 113 HB1 ASP 113 2.036 26.549 -3.816 181 H LEU 114 HN LEU 114 2.884 25.548 -7.285 182 HA LEU 114 HA LEU 114 4.580 23.407 -8.246 183 HB2 LEU 114 HB2 LEU 114 3.423 25.981 -9.183 184 HB3 LEU 114 HB1 LEU 114 4.851 25.413 -10.049 185 HG LEU 114 HG LEU 114 2.618 23.491 -9.474 186 HD11 LEU 114 HD11 LEU 114 2.534 24.827 -12.102 187 HD12 LEU 114 HD12 LEU 114 2.069 25.859 -10.749 188 HD13 LEU 114 HD13 LEU 114 1.209 24.347 -11.041 189 HD21 LEU 114 HD21 LEU 114 3.549 22.953 -11.956 190 HD22 LEU 114 HD22 LEU 114 4.298 22.305 -10.497 191 HD23 LEU 114 HD23 LEU 114 4.974 23.737 -11.274 192 H ASP 115 HN ASP 115 5.180 26.742 -7.143 193 HA ASP 115 HA ASP 115 7.962 26.865 -7.806 194 HB2 ASP 115 HB2 ASP 115 6.034 28.238 -5.975 195 HB3 ASP 115 HB1 ASP 115 7.755 28.543 -5.735 196 H GLU 116 HN GLU 116 6.477 26.338 -4.583 197 HA GLU 116 HA GLU 116 8.829 25.596 -3.201 198 HB2 GLU 116 HB2 GLU 116 5.966 24.644 -2.855 199 HB3 GLU 116 HB1 GLU 116 7.219 24.584 -1.615 200 HG2 GLU 116 HG2 GLU 116 7.450 27.070 -1.798 201 HG3 GLU 116 HG1 GLU 116 6.088 27.077 -2.918 202 H LEU 117 HN LEU 117 6.726 23.699 -5.305 203 HA LEU 117 HA LEU 117 7.459 21.064 -4.645 204 HB2 LEU 117 HB2 LEU 117 6.452 22.579 -6.974 205 HB3 LEU 117 HB1 LEU 117 7.220 21.044 -7.378 206 HG LEU 117 HG LEU 117 5.004 21.409 -5.341 207 HD11 LEU 117 HD11 LEU 117 3.593 21.233 -7.086 208 HD12 LEU 117 HD12 LEU 117 4.306 19.671 -7.486 209 HD13 LEU 117 HD13 LEU 117 4.958 21.146 -8.199 210 HD21 LEU 117 HD21 LEU 117 6.341 19.553 -4.663 211 HD22 LEU 117 HD22 LEU 117 6.571 19.016 -6.327 212 HD23 LEU 117 HD23 LEU 117 4.993 18.848 -5.556 213 H LYS 118 HN LYS 118 9.043 23.223 -7.030 214 HA LYS 118 HA LYS 118 11.246 21.332 -7.436 215 HB2 LYS 118 HB2 LYS 118 12.015 23.145 -8.961 216 HB3 LYS 118 HB1 LYS 118 10.323 22.726 -9.235 217 HG2 LYS 118 HG2 LYS 118 9.582 24.757 -8.541 218 HG3 LYS 118 HG1 LYS 118 10.726 24.818 -7.199 219 HD2 LYS 118 HD2 LYS 118 12.403 25.773 -8.490 220 HD3 LYS 118 HD1 LYS 118 11.773 25.098 -9.992 221 HE2 LYS 118 HE2 LYS 118 9.989 27.020 -8.579 222 HE3 LYS 118 HE1 LYS 118 11.438 27.697 -9.348 223 HZ1 LYS 118 HZ1 LYS 118 9.784 27.592 -11.021 224 HZ2 LYS 118 HZ2 LYS 118 9.348 26.004 -10.600 225 HZ3 LYS 118 HZ3 LYS 118 10.850 26.310 -11.332 226 H ILE 119 HN ILE 119 10.604 24.037 -5.336 227 HA ILE 119 HA ILE 119 13.421 24.670 -4.833 228 HB ILE 119 HB ILE 119 10.747 25.432 -3.650 229 HG12 ILE 119 HG12 ILE 119 12.894 26.878 -5.232 230 HG13 ILE 119 HG11 ILE 119 11.273 26.456 -5.785 231 HG21 ILE 119 HG21 ILE 119 13.523 26.252 -2.748 232 HG22 ILE 119 HG22 ILE 119 12.286 25.447 -1.781 233 HG23 ILE 119 HG23 ILE 119 12.051 27.116 -2.301 234 HD11 ILE 119 HD11 ILE 119 12.008 28.442 -3.619 235 HD12 ILE 119 HD12 ILE 119 10.358 27.896 -3.920 236 HD13 ILE 119 HD13 ILE 119 11.233 28.786 -5.166 237 H MET 120 HN MET 120 11.036 22.473 -3.517 238 HA MET 120 HA MET 120 12.527 22.029 -1.013 239 HB2 MET 120 HB2 MET 120 10.001 21.989 -1.343 240 HB3 MET 120 HB1 MET 120 10.223 20.469 -2.211 241 HG2 MET 120 HG2 MET 120 11.422 20.817 0.524 242 HG3 MET 120 HG1 MET 120 9.715 20.404 0.358 243 HE1 MET 120 HE1 MET 120 9.198 17.248 -0.722 244 HE2 MET 120 HE2 MET 120 9.751 17.925 -2.252 245 HE3 MET 120 HE3 MET 120 8.857 18.937 -1.121 246 H LEU 121 HN LEU 121 12.425 20.709 -4.230 247 HA LEU 121 HA LEU 121 13.513 18.087 -3.526 248 HB2 LEU 121 HB2 LEU 121 12.535 19.568 -5.842 249 HB3 LEU 121 HB1 LEU 121 13.972 18.621 -6.233 250 HG LEU 121 HG LEU 121 12.132 17.119 -4.550 251 HD11 LEU 121 HD11 LEU 121 10.272 18.137 -5.518 252 HD12 LEU 121 HD12 LEU 121 10.563 16.813 -6.646 253 HD13 LEU 121 HD13 LEU 121 11.106 18.444 -7.041 254 HD21 LEU 121 HD21 LEU 121 13.506 15.674 -5.644 255 HD22 LEU 121 HD22 LEU 121 13.810 16.814 -6.955 256 HD23 LEU 121 HD23 LEU 121 12.349 15.826 -6.967 257 H GLN 122 HN GLN 122 14.826 21.235 -3.895 258 HA GLN 122 HA GLN 122 17.319 20.958 -5.075 259 HB2 GLN 122 HB2 GLN 122 16.049 22.569 -3.000 260 HB3 GLN 122 HB1 GLN 122 17.781 22.394 -2.718 261 HG2 GLN 122 HG2 GLN 122 17.993 22.944 -5.267 262 HG3 GLN 122 HG1 GLN 122 16.367 23.602 -5.081 263 HE21 GLN 122 HE21 GLN 122 16.252 25.726 -4.326 264 HE22 GLN 122 HE22 GLN 122 17.517 26.548 -3.548 265 H ALA 123 HN ALA 123 16.214 19.492 -2.094 266 HA ALA 123 HA ALA 123 18.550 18.914 -0.694 267 HB1 ALA 123 HB1 ALA 123 16.917 17.845 0.438 268 HB2 ALA 123 HB2 ALA 123 16.969 16.556 -0.765 269 HB3 ALA 123 HB3 ALA 123 15.863 17.914 -0.974 270 H THR 124 HN THR 124 17.548 17.624 -3.804 271 HA THR 124 HA THR 124 19.947 15.819 -3.774 272 HB THR 124 HB THR 124 17.830 14.611 -3.840 273 HG1 THR 124 HG1 THR 124 18.444 13.378 -5.441 274 HG21 THR 124 HG21 THR 124 16.233 15.012 -5.711 275 HG22 THR 124 HG22 THR 124 17.203 16.398 -6.204 276 HG23 THR 124 HG23 THR 124 16.389 16.404 -4.641 277 H GLY 125 HN GLY 125 19.477 18.758 -4.691 278 HA2 GLY 125 HA2 GLY 125 20.732 19.957 -6.341 279 HA3 GLY 125 HA1 GLY 125 20.949 18.452 -7.235 280 H GLU 126 HN GLU 126 17.956 17.977 -6.833 281 HA GLU 126 HA GLU 126 16.199 18.081 -8.441 282 HB2 GLU 126 HB2 GLU 126 14.930 19.973 -7.857 283 HB3 GLU 126 HB1 GLU 126 16.014 19.777 -6.484 284 HG2 GLU 126 HG2 GLU 126 16.769 21.868 -6.809 285 HG3 GLU 126 HG1 GLU 126 17.375 21.395 -8.392 286 H THR 127 HN THR 127 18.530 18.106 -9.981 287 HA THR 127 HA THR 127 18.460 20.456 -11.767 288 HB THR 127 HB THR 127 20.586 19.413 -11.219 289 HG1 THR 127 HG1 THR 127 20.899 19.954 -13.229 290 HG21 THR 127 HG21 THR 127 19.014 16.985 -11.595 291 HG22 THR 127 HG22 THR 127 20.520 17.217 -10.707 292 HG23 THR 127 HG23 THR 127 20.559 16.912 -12.444 293 H ILE 128 HN ILE 128 16.364 20.328 -12.744 294 HA ILE 128 HA ILE 128 16.051 18.067 -14.681 295 HB ILE 128 HB ILE 128 14.704 17.642 -12.676 296 HG12 ILE 128 HG12 ILE 128 12.398 17.745 -13.772 297 HG13 ILE 128 HG11 ILE 128 13.182 18.562 -15.124 298 HG21 ILE 128 HG21 ILE 128 13.069 19.221 -11.871 299 HG22 ILE 128 HG22 ILE 128 13.352 20.294 -13.241 300 HG23 ILE 128 HG23 ILE 128 14.602 20.081 -12.015 301 HD11 ILE 128 HD11 ILE 128 14.848 16.556 -15.059 302 HD12 ILE 128 HD12 ILE 128 13.257 16.309 -15.779 303 HD13 ILE 128 HD13 ILE 128 13.580 15.747 -14.139 304 H THR 129 HN THR 129 14.621 18.648 -16.511 305 HA THR 129 HA THR 129 15.081 21.318 -17.509 306 HB THR 129 HB THR 129 13.006 20.095 -18.966 307 HG1 THR 129 HG1 THR 129 14.272 17.957 -19.082 308 HG21 THR 129 HG21 THR 129 15.918 20.520 -19.181 309 HG22 THR 129 HG22 THR 129 14.643 20.844 -20.355 310 HG23 THR 129 HG23 THR 129 15.287 19.212 -20.181 311 H GLU 130 HN GLU 130 13.718 23.104 -17.453 312 HA GLU 130 HA GLU 130 11.792 23.511 -15.484 313 HB2 GLU 130 HB2 GLU 130 12.856 25.223 -16.935 314 HB3 GLU 130 HB1 GLU 130 11.870 24.669 -18.289 315 HG2 GLU 130 HG2 GLU 130 9.830 25.146 -16.846 316 HG3 GLU 130 HG1 GLU 130 10.920 25.957 -15.721 317 H ASP 131 HN ASP 131 11.104 22.645 -18.899 318 HA ASP 131 HA ASP 131 8.305 22.419 -18.733 319 HB2 ASP 131 HB2 ASP 131 9.893 22.268 -20.728 320 HB3 ASP 131 HB1 ASP 131 10.149 20.581 -20.281 321 H ASP 132 HN ASP 132 10.746 20.365 -17.346 322 HA ASP 132 HA ASP 132 8.967 18.041 -17.025 323 HB2 ASP 132 HB2 ASP 132 11.772 18.730 -16.812 324 HB3 ASP 132 HB1 ASP 132 11.249 17.862 -15.370 325 H ILE 133 HN ILE 133 9.619 20.968 -15.330 326 HA ILE 133 HA ILE 133 9.090 20.036 -12.635 327 HB ILE 133 HB ILE 133 8.946 22.757 -13.975 328 HG12 ILE 133 HG12 ILE 133 11.158 21.625 -14.063 329 HG13 ILE 133 HG11 ILE 133 11.193 23.049 -13.022 330 HG21 ILE 133 HG21 ILE 133 7.887 22.099 -11.525 331 HG22 ILE 133 HG22 ILE 133 8.482 23.702 -11.959 332 HG23 ILE 133 HG23 ILE 133 9.527 22.578 -11.090 333 HD11 ILE 133 HD11 ILE 133 10.471 21.164 -11.211 334 HD12 ILE 133 HD12 ILE 133 12.150 21.596 -11.537 335 HD13 ILE 133 HD13 ILE 133 11.438 20.179 -12.309 336 H GLU 134 HN GLU 134 7.086 20.793 -15.360 337 HA GLU 134 HA GLU 134 4.676 21.333 -13.743 338 HB2 GLU 134 HB2 GLU 134 5.514 21.313 -16.612 339 HB3 GLU 134 HB1 GLU 134 3.795 21.117 -16.269 340 HG2 GLU 134 HG2 GLU 134 3.699 23.196 -15.088 341 HG3 GLU 134 HG1 GLU 134 5.457 23.336 -15.058 342 H GLU 135 HN GLU 135 6.342 18.585 -14.877 343 HA GLU 135 HA GLU 135 4.128 16.842 -15.494 344 HB2 GLU 135 HB2 GLU 135 6.550 16.572 -16.120 345 HB3 GLU 135 HB1 GLU 135 6.895 16.191 -14.433 346 HG2 GLU 135 HG2 GLU 135 4.732 14.544 -15.084 347 HG3 GLU 135 HG1 GLU 135 5.771 14.488 -16.508 348 H LEU 136 HN LEU 136 6.257 16.846 -12.596 349 HA LEU 136 HA LEU 136 4.897 15.081 -10.958 350 HB2 LEU 136 HB2 LEU 136 5.991 17.788 -10.125 351 HB3 LEU 136 HB1 LEU 136 5.880 16.344 -9.119 352 HG LEU 136 HG LEU 136 7.266 15.518 -11.414 353 HD11 LEU 136 HD11 LEU 136 7.538 18.009 -11.847 354 HD12 LEU 136 HD12 LEU 136 9.045 17.104 -11.707 355 HD13 LEU 136 HD13 LEU 136 8.476 18.085 -10.356 356 HD21 LEU 136 HD21 LEU 136 9.239 15.801 -9.615 357 HD22 LEU 136 HD22 LEU 136 8.000 14.557 -9.448 358 HD23 LEU 136 HD23 LEU 136 7.866 16.063 -8.540 359 H MET 137 HN MET 137 3.889 18.332 -11.865 360 HA MET 137 HA MET 137 1.867 18.728 -9.874 361 HB2 MET 137 HB2 MET 137 2.893 19.943 -12.271 362 HB3 MET 137 HB1 MET 137 1.130 19.944 -12.339 363 HG2 MET 137 HG2 MET 137 2.781 20.949 -10.003 364 HG3 MET 137 HG1 MET 137 2.011 21.974 -11.213 365 HE1 MET 137 HE1 MET 137 0.369 21.696 -7.463 366 HE2 MET 137 HE2 MET 137 1.961 21.906 -8.188 367 HE3 MET 137 HE3 MET 137 1.431 20.300 -7.694 368 H LYS 138 HN LYS 138 1.728 17.295 -13.151 369 HA LYS 138 HA LYS 138 -1.028 16.851 -13.403 370 HB2 LYS 138 HB2 LYS 138 1.480 15.453 -14.262 371 HB3 LYS 138 HB1 LYS 138 -0.065 14.659 -14.567 372 HG2 LYS 138 HG2 LYS 138 -0.834 16.410 -15.945 373 HG3 LYS 138 HG1 LYS 138 0.364 17.545 -15.322 374 HD2 LYS 138 HD2 LYS 138 1.871 15.421 -16.359 375 HD3 LYS 138 HD1 LYS 138 0.587 15.681 -17.541 376 HE2 LYS 138 HE2 LYS 138 1.846 18.157 -16.494 377 HE3 LYS 138 HE1 LYS 138 2.882 17.141 -17.517 378 HZ1 LYS 138 HZ1 LYS 138 0.088 17.863 -18.213 379 HZ2 LYS 138 HZ2 LYS 138 1.231 17.091 -19.206 380 HZ3 LYS 138 HZ3 LYS 138 1.438 18.722 -18.776 381 H ASP 139 HN ASP 139 1.254 14.336 -12.254 382 HA ASP 139 HA ASP 139 -0.835 12.737 -11.055 383 HB2 ASP 139 HB2 ASP 139 2.172 12.787 -10.625 384 HB3 ASP 139 HB1 ASP 139 1.097 11.447 -10.226 385 H GLY 140 HN GLY 140 1.712 14.843 -9.668 386 HA2 GLY 140 HA2 GLY 140 1.046 14.543 -6.946 387 HA3 GLY 140 HA1 GLY 140 1.759 16.006 -7.626 388 H ASP 141 HN ASP 141 -0.485 16.472 -9.460 389 HA ASP 141 HA ASP 141 -2.671 17.126 -7.517 390 HB2 ASP 141 HB2 ASP 141 -0.797 18.867 -8.776 391 HB3 ASP 141 HB1 ASP 141 -2.369 19.163 -9.521 392 H LYS 142 HN LYS 142 -2.992 14.930 -9.081 393 HA LYS 142 HA LYS 142 -3.873 15.181 -11.740 394 HB2 LYS 142 HB2 LYS 142 -4.732 13.449 -9.411 395 HB3 LYS 142 HB1 LYS 142 -5.333 13.186 -11.049 396 HG2 LYS 142 HG2 LYS 142 -2.933 13.064 -11.823 397 HG3 LYS 142 HG1 LYS 142 -2.448 13.098 -10.127 398 HD2 LYS 142 HD2 LYS 142 -2.539 10.798 -10.586 399 HD3 LYS 142 HD1 LYS 142 -4.116 11.109 -9.859 400 HE2 LYS 142 HE2 LYS 142 -5.146 10.413 -11.751 401 HE3 LYS 142 HE1 LYS 142 -4.253 11.617 -12.702 402 HZ1 LYS 142 HZ1 LYS 142 -2.789 9.281 -11.721 403 HZ2 LYS 142 HZ2 LYS 142 -2.574 10.170 -13.154 404 HZ3 LYS 142 HZ3 LYS 142 -3.843 9.046 -13.029 405 H ASN 143 HN ASN 143 -5.338 16.402 -8.843 406 HA ASN 143 HA ASN 143 -8.069 16.560 -9.835 407 HB2 ASN 143 HB2 ASN 143 -7.616 16.515 -7.468 408 HB3 ASN 143 HB1 ASN 143 -6.503 17.878 -7.598 409 HD21 ASN 143 HD21 ASN 143 -7.836 19.137 -6.073 410 HD22 ASN 143 HD22 ASN 143 -9.313 19.811 -6.567 411 H ASN 144 HN ASN 144 -5.188 18.445 -10.267 412 HA ASN 144 HA ASN 144 -4.797 20.427 -11.490 413 HB2 ASN 144 HB2 ASN 144 -6.255 18.984 -13.031 414 HB3 ASN 144 HB1 ASN 144 -7.612 19.980 -12.505 415 HD21 ASN 144 HD21 ASN 144 -7.281 22.431 -12.825 416 HD22 ASN 144 HD22 ASN 144 -6.398 22.931 -14.187 417 H ASP 145 HN ASP 145 -5.263 21.191 -9.033 418 HA ASP 145 HA ASP 145 -7.453 23.243 -9.169 419 HB2 ASP 145 HB2 ASP 145 -7.667 22.899 -6.743 420 HB3 ASP 145 HB1 ASP 145 -7.833 21.357 -7.584 421 H GLY 146 HN GLY 146 -4.103 22.531 -8.429 422 HA2 GLY 146 HA2 GLY 146 -2.472 24.375 -8.704 423 HA3 GLY 146 HA1 GLY 146 -3.658 25.450 -7.963 424 H ARG 147 HN ARG 147 -3.794 22.547 -6.337 425 HA ARG 147 HA ARG 147 -1.624 23.289 -4.419 426 HB2 ARG 147 HB2 ARG 147 -4.595 22.992 -3.927 427 HB3 ARG 147 HB1 ARG 147 -3.417 22.896 -2.617 428 HG2 ARG 147 HG2 ARG 147 -2.694 25.132 -2.956 429 HG3 ARG 147 HG1 ARG 147 -3.465 25.225 -4.540 430 HD2 ARG 147 HD2 ARG 147 -5.146 26.275 -3.381 431 HD3 ARG 147 HD1 ARG 147 -5.612 24.624 -2.927 432 HE ARG 147 HE ARG 147 -4.803 25.072 -0.757 433 HH11 ARG 147 HH21 ARG 147 -3.442 27.222 -3.092 434 HH12 ARG 147 HH22 ARG 147 -2.583 28.160 -1.917 435 HH21 ARG 147 HH11 ARG 147 -3.686 26.287 0.783 436 HH22 ARG 147 HH12 ARG 147 -2.719 27.631 0.274 437 H ILE 148 HN ILE 148 -0.509 21.468 -3.826 438 HA ILE 148 HA ILE 148 -1.596 18.806 -4.547 439 HB ILE 148 HB ILE 148 1.062 19.910 -3.610 440 HG12 ILE 148 HG12 ILE 148 0.092 18.604 -6.173 441 HG13 ILE 148 HG11 ILE 148 0.523 20.301 -5.957 442 HG21 ILE 148 HG21 ILE 148 0.229 17.034 -4.068 443 HG22 ILE 148 HG22 ILE 148 0.889 17.732 -2.589 444 HG23 ILE 148 HG23 ILE 148 1.911 17.562 -4.017 445 HD11 ILE 148 HD11 ILE 148 2.261 18.454 -6.902 446 HD12 ILE 148 HD12 ILE 148 2.597 18.323 -5.176 447 HD13 ILE 148 HD13 ILE 148 2.772 19.876 -5.992 448 H ASP 149 HN ASP 149 -2.752 17.707 -2.998 449 HA ASP 149 HA ASP 149 -2.246 18.351 -0.121 450 HB2 ASP 149 HB2 ASP 149 -4.524 17.237 0.101 451 HB3 ASP 149 HB1 ASP 149 -4.508 18.719 -0.857 452 H TYR 150 HN TYR 150 -2.364 16.479 1.397 453 HA TYR 150 HA TYR 150 -0.539 14.413 0.867 454 HB2 TYR 150 HB2 TYR 150 -1.319 15.079 3.089 455 HB3 TYR 150 HB1 TYR 150 -2.949 14.521 2.711 456 HD1 TYR 150 HD1 TYR 150 -3.246 12.031 2.089 457 HD2 TYR 150 HD2 TYR 150 0.264 13.597 4.007 458 HE1 TYR 150 HE1 TYR 150 -2.646 9.749 2.855 459 HE2 TYR 150 HE2 TYR 150 0.865 11.316 4.772 460 HH TYR 150 HH TYR 150 -0.769 8.497 3.602 461 H ASP 151 HN ASP 151 -4.109 14.315 0.597 462 HA ASP 151 HA ASP 151 -4.465 11.619 -0.108 463 HB2 ASP 151 HB2 ASP 151 -6.059 13.723 0.216 464 HB3 ASP 151 HB1 ASP 151 -5.960 13.786 -1.544 465 H GLU 152 HN GLU 152 -3.678 14.378 -2.246 466 HA GLU 152 HA GLU 152 -3.480 12.651 -4.613 467 HB2 GLU 152 HB2 GLU 152 -3.480 15.494 -3.890 468 HB3 GLU 152 HB1 GLU 152 -2.332 15.117 -5.175 469 HG2 GLU 152 HG2 GLU 152 -3.992 14.365 -6.625 470 HG3 GLU 152 HG1 GLU 152 -5.104 13.977 -5.312 471 H PHE 153 HN PHE 153 -1.437 13.495 -2.011 472 HA PHE 153 HA PHE 153 1.114 13.490 -3.398 473 HB2 PHE 153 HB2 PHE 153 0.602 14.535 -1.180 474 HB3 PHE 153 HB1 PHE 153 0.403 12.919 -0.502 475 HD1 PHE 153 HD1 PHE 153 2.889 14.150 -3.006 476 HD2 PHE 153 HD2 PHE 153 2.230 12.639 0.960 477 HE1 PHE 153 HE1 PHE 153 5.339 13.987 -2.661 478 HE2 PHE 153 HE2 PHE 153 4.680 12.476 1.305 479 HZ PHE 153 HZ PHE 153 6.235 13.149 -0.505 480 H LEU 154 HN LEU 154 -1.094 11.023 -2.447 481 HA LEU 154 HA LEU 154 0.862 8.888 -2.074 482 HB2 LEU 154 HB2 LEU 154 -2.037 9.336 -2.014 483 HB3 LEU 154 HB1 LEU 154 -1.601 7.756 -2.666 484 HG LEU 154 HG LEU 154 -1.837 7.573 -0.248 485 HD11 LEU 154 HD11 LEU 154 1.135 7.646 -0.560 486 HD12 LEU 154 HD12 LEU 154 0.223 6.598 -1.646 487 HD13 LEU 154 HD13 LEU 154 0.108 6.373 0.099 488 HD21 LEU 154 HD21 LEU 154 -1.504 9.809 0.505 489 HD22 LEU 154 HD22 LEU 154 0.075 9.916 -0.274 490 HD23 LEU 154 HD23 LEU 154 -0.136 8.904 1.154 491 H GLU 155 HN GLU 155 -1.759 9.021 -4.496 492 HA GLU 155 HA GLU 155 -0.671 7.255 -6.369 493 HB2 GLU 155 HB2 GLU 155 -2.942 8.360 -6.324 494 HB3 GLU 155 HB1 GLU 155 -2.183 9.820 -6.962 495 HG2 GLU 155 HG2 GLU 155 -2.770 8.868 -8.966 496 HG3 GLU 155 HG1 GLU 155 -1.232 8.033 -8.739 497 H PHE 156 HN PHE 156 0.330 10.507 -5.618 498 HA PHE 156 HA PHE 156 1.677 11.203 -8.041 499 HB2 PHE 156 HB2 PHE 156 1.162 12.806 -6.299 500 HB3 PHE 156 HB1 PHE 156 2.113 11.901 -5.123 501 HD1 PHE 156 HD2 PHE 156 2.882 12.762 -8.680 502 HD2 PHE 156 HD1 PHE 156 3.920 13.296 -4.546 503 HE1 PHE 156 HE2 PHE 156 4.915 14.014 -9.352 504 HE2 PHE 156 HE1 PHE 156 5.953 14.547 -5.218 505 HZ PHE 156 HZ PHE 156 6.451 14.906 -7.621 506 H MET 157 HN MET 157 3.170 10.065 -4.977 507 HA MET 157 HA MET 157 5.537 9.154 -6.524 508 HB2 MET 157 HB2 MET 157 6.629 9.210 -4.405 509 HB3 MET 157 HB1 MET 157 5.535 10.593 -4.385 510 HG2 MET 157 HG2 MET 157 3.881 8.683 -3.407 511 HG3 MET 157 HG1 MET 157 5.428 8.073 -2.820 512 HE1 MET 157 HE1 MET 157 6.816 11.622 -1.971 513 HE2 MET 157 HE2 MET 157 7.130 10.048 -2.696 514 HE3 MET 157 HE3 MET 157 7.110 10.213 -0.942 515 H LYS 158 HN LYS 158 2.788 7.886 -4.754 516 HA LYS 158 HA LYS 158 2.067 5.658 -4.413 517 HB2 LYS 158 HB2 LYS 158 3.688 5.763 -6.908 518 HB3 LYS 158 HB1 LYS 158 3.352 4.156 -6.266 519 HG2 LYS 158 HG2 LYS 158 0.924 4.745 -6.177 520 HG3 LYS 158 HG1 LYS 158 1.305 6.287 -6.946 521 HD2 LYS 158 HD2 LYS 158 2.088 5.200 -8.938 522 HD3 LYS 158 HD1 LYS 158 2.046 3.616 -8.162 523 HE2 LYS 158 HE2 LYS 158 -0.075 3.364 -8.917 524 HE3 LYS 158 HE1 LYS 158 -0.561 4.730 -7.892 525 HZ1 LYS 158 HZ1 LYS 158 -0.994 5.649 -9.909 526 HZ2 LYS 158 HZ2 LYS 158 0.151 4.696 -10.726 527 HZ3 LYS 158 HZ3 LYS 158 0.653 6.044 -9.823 528 H GLY 159 HN GLY 159 5.229 4.667 -5.603 529 HA2 GLY 159 HA2 GLY 159 6.019 3.959 -2.807 530 HA3 GLY 159 HA1 GLY 159 6.216 2.809 -4.131 531 H VAL 160 HN VAL 160 6.771 5.717 -5.526 532 HA VAL 160 HA VAL 160 8.752 6.775 -6.260 533 HB VAL 160 HB VAL 160 9.621 6.040 -3.447 534 HG11 VAL 160 HG11 VAL 160 11.325 7.517 -3.725 535 HG12 VAL 160 HG12 VAL 160 10.308 8.660 -4.604 536 HG13 VAL 160 HG13 VAL 160 11.033 7.293 -5.450 537 HG21 VAL 160 HG21 VAL 160 7.321 7.423 -4.171 538 HG22 VAL 160 HG22 VAL 160 8.493 8.709 -3.883 539 HG23 VAL 160 HG23 VAL 160 8.139 7.537 -2.613 540 H GLU 161 HN GLU 161 8.529 3.962 -6.878 541 HA GLU 161 HA GLU 161 9.864 2.078 -7.436 542 HB2 GLU 161 HB2 GLU 161 10.550 3.903 -8.976 543 HB3 GLU 161 HB1 GLU 161 11.787 4.397 -7.819 544 HG2 GLU 161 HG2 GLU 161 12.520 1.864 -7.993 545 HG3 GLU 161 HG1 GLU 161 11.674 1.943 -9.539 546 HO1 KDH 1 H1 KDH 1 11.394 8.894 -8.392 547 H21 KDH 1 H21 KDH 1 10.716 9.716 -1.701 548 H33 KDH 1 H33 KDH 1 8.704 13.691 -5.641 549 H4 KDH 1 H4 KDH 1 10.779 9.942 -6.108 550 HO7 KDH 1 H7 KDH 1 8.979 8.530 -10.101 551 H01 KDH 1 H01 KDH 1 10.208 14.759 -3.849 552 H01A KDH 1 H02 KDH 1 8.657 13.987 -3.332 553 HO03 KDH 1 H03 KDH 1 10.462 15.493 -1.971 554 HO10 KDH 1 H10 KDH 1 5.453 10.223 -8.299 555 H12 KDH 1 H12 KDH 1 6.885 11.957 -6.524 556 H15 KDH 1 H15 KDH 1 8.001 11.795 -4.491 557 H26 KDH 1 H26 KDH 1 12.036 13.382 0.319 558 H39 KDH 1 H39 KDH 1 12.713 11.966 -6.340 559 H41 KDH 1 H41 KDH 1 10.800 13.690 -9.911 560 HO02 KDH 1 H42 KDH 1 12.934 10.723 0.432 561 HO44 KDH 1 H44 KDH 1 13.545 13.216 -11.888 562 HO47 KDH 1 H47 KDH 1 14.722 10.363 -10.429 563 HO50 KDH 1 H50 KDH 1 15.640 11.126 -8.211 Start of MODEL 29 1 H1 MET 90 HT1 MET 90 14.344 8.251 1.612 2 H2 MET 90 HT2 MET 90 13.773 7.747 3.131 3 H3 MET 90 HT3 MET 90 12.814 8.749 2.149 4 HA MET 90 HA MET 90 13.100 6.741 0.465 5 HB2 MET 90 HB2 MET 90 14.452 5.904 2.713 6 HB3 MET 90 HB1 MET 90 12.872 5.154 2.940 7 HG2 MET 90 HG2 MET 90 13.769 3.527 1.604 8 HG3 MET 90 HG1 MET 90 13.262 4.619 0.314 9 HE1 MET 90 HE1 MET 90 15.488 2.320 0.598 10 HE2 MET 90 HE2 MET 90 16.195 2.883 2.111 11 HE3 MET 90 HE3 MET 90 17.168 2.873 0.642 12 H GLY 91 HN GLY 91 10.991 7.235 -0.122 13 HA2 GLY 91 HA2 GLY 91 8.869 7.460 1.886 14 HA3 GLY 91 HA1 GLY 91 8.663 7.612 0.140 15 H LYS 92 HN LYS 92 6.978 6.041 1.920 16 HA LYS 92 HA LYS 92 7.263 3.422 0.542 17 HB2 LYS 92 HB2 LYS 92 7.579 4.013 3.455 18 HB3 LYS 92 HB1 LYS 92 6.760 2.515 3.010 19 HG2 LYS 92 HG2 LYS 92 9.459 3.354 1.916 20 HG3 LYS 92 HG1 LYS 92 9.247 2.260 3.283 21 HD2 LYS 92 HD2 LYS 92 7.587 1.086 1.495 22 HD3 LYS 92 HD1 LYS 92 8.771 1.787 0.392 23 HE2 LYS 92 HE2 LYS 92 9.743 -0.300 0.881 24 HE3 LYS 92 HE1 LYS 92 10.519 0.746 2.088 25 HZ1 LYS 92 HZ1 LYS 92 9.499 -1.275 3.063 26 HZ2 LYS 92 HZ2 LYS 92 7.978 -0.728 2.538 27 HZ3 LYS 92 HZ3 LYS 92 8.855 0.165 3.687 28 H SER 93 HN SER 93 5.335 3.923 3.427 29 HA SER 93 HA SER 93 2.873 3.883 1.715 30 HB2 SER 93 HB2 SER 93 3.065 1.877 2.991 31 HB3 SER 93 HB1 SER 93 3.588 2.753 4.427 32 HG SER 93 HG SER 93 1.037 2.481 3.298 33 H GLU 94 HN GLU 94 0.972 4.629 3.489 34 HA GLU 94 HA GLU 94 1.157 7.457 3.653 35 HB2 GLU 94 HB2 GLU 94 -0.514 5.389 5.110 36 HB3 GLU 94 HB1 GLU 94 -0.839 7.122 5.184 37 HG2 GLU 94 HG2 GLU 94 -1.148 7.215 2.771 38 HG3 GLU 94 HG1 GLU 94 -0.688 5.520 2.614 39 H GLU 95 HN GLU 95 2.455 5.010 5.732 40 HA GLU 95 HA GLU 95 2.579 6.616 8.159 41 HB2 GLU 95 HB2 GLU 95 4.050 4.135 7.210 42 HB3 GLU 95 HB1 GLU 95 4.065 4.738 8.868 43 HG2 GLU 95 HG2 GLU 95 1.712 4.367 9.121 44 HG3 GLU 95 HG1 GLU 95 1.509 4.069 7.395 45 H GLU 96 HN GLU 96 4.823 5.874 5.492 46 HA GLU 96 HA GLU 96 6.939 7.547 6.714 47 HB2 GLU 96 HB2 GLU 96 6.894 5.266 5.189 48 HB3 GLU 96 HB1 GLU 96 7.239 6.494 3.970 49 HG2 GLU 96 HG2 GLU 96 9.232 7.155 5.011 50 HG3 GLU 96 HG1 GLU 96 8.750 6.490 6.572 51 H LEU 97 HN LEU 97 4.946 7.506 3.737 52 HA LEU 97 HA LEU 97 5.927 9.863 2.526 53 HB2 LEU 97 HB2 LEU 97 3.109 8.734 2.635 54 HB3 LEU 97 HB1 LEU 97 3.703 9.864 1.420 55 HG LEU 97 HG LEU 97 4.564 7.003 1.878 56 HD11 LEU 97 HD11 LEU 97 3.138 8.561 -0.228 57 HD12 LEU 97 HD12 LEU 97 2.870 6.906 0.320 58 HD13 LEU 97 HD13 LEU 97 4.210 7.269 -0.767 59 HD21 LEU 97 HD21 LEU 97 6.126 7.719 -0.166 60 HD22 LEU 97 HD22 LEU 97 6.664 7.906 1.503 61 HD23 LEU 97 HD23 LEU 97 6.025 9.294 0.623 62 H SER 98 HN SER 98 4.017 9.477 5.399 63 HA SER 98 HA SER 98 2.607 11.934 5.519 64 HB2 SER 98 HB2 SER 98 2.057 10.494 7.231 65 HB3 SER 98 HB1 SER 98 3.706 9.898 7.392 66 HG SER 98 HG SER 98 2.452 12.082 8.566 67 H ASP 99 HN ASP 99 5.755 11.216 7.085 68 HA ASP 99 HA ASP 99 6.385 13.904 7.772 69 HB2 ASP 99 HB2 ASP 99 8.226 11.595 7.067 70 HB3 ASP 99 HB1 ASP 99 8.636 12.980 8.081 71 H LEU 100 HN LEU 100 7.327 11.979 4.901 72 HA LEU 100 HA LEU 100 9.002 13.720 3.546 73 HB2 LEU 100 HB2 LEU 100 7.001 11.661 2.889 74 HB3 LEU 100 HB1 LEU 100 7.313 12.787 1.568 75 HG LEU 100 HG LEU 100 9.845 12.358 2.280 76 HD11 LEU 100 HD11 LEU 100 8.720 9.625 2.804 77 HD12 LEU 100 HD12 LEU 100 8.818 10.782 4.132 78 HD13 LEU 100 HD13 LEU 100 10.281 10.297 3.274 79 HD21 LEU 100 HD21 LEU 100 9.951 11.277 0.281 80 HD22 LEU 100 HD22 LEU 100 8.219 11.597 0.195 81 HD23 LEU 100 HD23 LEU 100 8.799 10.041 0.788 82 H PHE 101 HN PHE 101 5.420 13.776 3.353 83 HA PHE 101 HA PHE 101 5.232 16.168 1.787 84 HB2 PHE 101 HB2 PHE 101 3.474 14.418 2.181 85 HB3 PHE 101 HB1 PHE 101 3.305 15.017 3.831 86 HD1 PHE 101 HD2 PHE 101 2.972 17.663 4.010 87 HD2 PHE 101 HD1 PHE 101 2.057 15.285 0.552 88 HE1 PHE 101 HE2 PHE 101 1.412 19.420 3.214 89 HE2 PHE 101 HE1 PHE 101 0.496 17.041 -0.243 90 HZ PHE 101 HZ PHE 101 0.174 19.108 1.089 91 H ARG 102 HN ARG 102 5.774 15.612 5.193 92 HA ARG 102 HA ARG 102 5.084 18.364 5.985 93 HB2 ARG 102 HB2 ARG 102 4.651 16.438 7.441 94 HB3 ARG 102 HB1 ARG 102 6.360 16.008 7.411 95 HG2 ARG 102 HG2 ARG 102 6.767 18.399 8.325 96 HG3 ARG 102 HG1 ARG 102 5.047 18.387 8.716 97 HD2 ARG 102 HD2 ARG 102 5.316 16.874 10.418 98 HD3 ARG 102 HD1 ARG 102 6.568 15.969 9.544 99 HE ARG 102 HE ARG 102 7.479 18.627 10.261 100 HH11 ARG 102 HH21 ARG 102 6.937 15.409 11.393 101 HH12 ARG 102 HH22 ARG 102 8.139 15.506 12.635 102 HH21 ARG 102 HH11 ARG 102 9.048 18.764 11.880 103 HH22 ARG 102 HH12 ARG 102 9.332 17.402 12.911 104 H MET 103 HN MET 103 7.873 16.623 4.878 105 HA MET 103 HA MET 103 9.762 18.641 5.971 106 HB2 MET 103 HB2 MET 103 10.264 16.229 6.102 107 HB3 MET 103 HB1 MET 103 10.133 16.101 4.348 108 HG2 MET 103 HG2 MET 103 11.935 18.025 4.371 109 HG3 MET 103 HG1 MET 103 12.265 17.421 5.995 110 HE1 MET 103 HE1 MET 103 13.860 16.360 6.403 111 HE2 MET 103 HE2 MET 103 14.885 15.310 5.429 112 HE3 MET 103 HE3 MET 103 13.511 14.629 6.295 113 H PHE 104 HN PHE 104 9.154 17.138 2.766 114 HA PHE 104 HA PHE 104 10.614 18.839 1.131 115 HB2 PHE 104 HB2 PHE 104 7.814 17.772 0.641 116 HB3 PHE 104 HB1 PHE 104 8.987 18.208 -0.599 117 HD1 PHE 104 HD1 PHE 104 11.163 17.027 1.651 118 HD2 PHE 104 HD2 PHE 104 7.885 15.529 -0.689 119 HE1 PHE 104 HE1 PHE 104 12.127 14.746 1.760 120 HE2 PHE 104 HE2 PHE 104 8.850 13.248 -0.579 121 HZ PHE 104 HZ PHE 104 10.970 12.856 0.645 122 H ASP 105 HN ASP 105 7.103 19.332 1.702 123 HA ASP 105 HA ASP 105 6.750 21.841 0.608 124 HB2 ASP 105 HB2 ASP 105 4.993 20.493 1.656 125 HB3 ASP 105 HB1 ASP 105 5.709 20.759 3.246 126 H LYS 106 HN LYS 106 8.619 23.198 0.831 127 HA LYS 106 HA LYS 106 9.804 23.834 3.400 128 HB2 LYS 106 HB2 LYS 106 10.196 24.329 0.599 129 HB3 LYS 106 HB1 LYS 106 10.254 25.873 1.452 130 HG2 LYS 106 HG2 LYS 106 11.980 25.087 2.930 131 HG3 LYS 106 HG1 LYS 106 11.799 23.430 2.352 132 HD2 LYS 106 HD2 LYS 106 12.318 25.316 0.178 133 HD3 LYS 106 HD1 LYS 106 13.613 25.295 1.376 134 HE2 LYS 106 HE2 LYS 106 13.006 22.596 1.053 135 HE3 LYS 106 HE1 LYS 106 12.896 23.253 -0.593 136 HZ1 LYS 106 HZ1 LYS 106 15.158 23.474 1.310 137 HZ2 LYS 106 HZ2 LYS 106 15.013 24.485 -0.048 138 HZ3 LYS 106 HZ3 LYS 106 15.169 22.805 -0.248 139 H ASN 107 HN ASN 107 6.894 24.775 1.903 140 HA ASN 107 HA ASN 107 6.775 27.488 3.029 141 HB2 ASN 107 HB2 ASN 107 5.693 26.411 0.879 142 HB3 ASN 107 HB1 ASN 107 4.437 25.899 2.006 143 HD21 ASN 107 HD21 ASN 107 3.062 27.477 0.665 144 HD22 ASN 107 HD22 ASN 107 3.097 29.118 1.099 145 H ALA 108 HN ALA 108 5.968 24.255 4.028 146 HA ALA 108 HA ALA 108 4.908 23.437 5.978 147 HB1 ALA 108 HB1 ALA 108 6.164 24.325 7.631 148 HB2 ALA 108 HB2 ALA 108 5.217 25.812 7.575 149 HB3 ALA 108 HB3 ALA 108 6.634 25.629 6.541 150 H ASP 109 HN ASP 109 3.107 24.552 4.098 151 HA ASP 109 HA ASP 109 1.186 26.097 5.803 152 HB2 ASP 109 HB2 ASP 109 0.337 26.946 3.704 153 HB3 ASP 109 HB1 ASP 109 2.097 27.048 3.632 154 H GLY 110 HN GLY 110 1.801 23.001 4.657 155 HA2 GLY 110 HA2 GLY 110 0.320 21.153 5.212 156 HA3 GLY 110 HA1 GLY 110 -1.052 22.250 5.052 157 H TYR 111 HN TYR 111 0.498 23.247 2.506 158 HA TYR 111 HA TYR 111 -0.176 20.951 0.714 159 HB2 TYR 111 HB2 TYR 111 -1.065 23.802 0.223 160 HB3 TYR 111 HB1 TYR 111 -1.617 22.340 -0.594 161 HD1 TYR 111 HD1 TYR 111 -3.036 20.681 0.618 162 HD2 TYR 111 HD2 TYR 111 -1.979 24.471 2.342 163 HE1 TYR 111 HE1 TYR 111 -4.844 20.423 2.297 164 HE2 TYR 111 HE2 TYR 111 -3.785 24.211 4.021 165 HH TYR 111 HH TYR 111 -6.243 22.517 3.827 166 H ILE 112 HN ILE 112 1.170 20.836 -1.094 167 HA ILE 112 HA ILE 112 3.416 22.794 -1.198 168 HB ILE 112 HB ILE 112 2.906 19.977 -2.161 169 HG12 ILE 112 HG12 ILE 112 5.176 21.164 -0.539 170 HG13 ILE 112 HG11 ILE 112 3.713 20.495 0.185 171 HG21 ILE 112 HG21 ILE 112 4.743 21.997 -3.286 172 HG22 ILE 112 HG22 ILE 112 4.158 20.490 -3.991 173 HG23 ILE 112 HG23 ILE 112 5.509 20.467 -2.859 174 HD11 ILE 112 HD11 ILE 112 5.992 19.104 -1.094 175 HD12 ILE 112 HD12 ILE 112 4.397 18.473 -1.503 176 HD13 ILE 112 HD13 ILE 112 4.909 18.551 0.183 177 H ASP 113 HN ASP 113 3.366 24.345 -2.780 178 HA ASP 113 HA ASP 113 1.378 24.153 -4.960 179 HB2 ASP 113 HB2 ASP 113 2.159 26.174 -3.408 180 HB3 ASP 113 HB1 ASP 113 3.378 26.364 -4.669 181 H LEU 114 HN LEU 114 2.444 25.233 -7.123 182 HA LEU 114 HA LEU 114 4.186 23.223 -8.223 183 HB2 LEU 114 HB2 LEU 114 2.785 25.683 -9.010 184 HB3 LEU 114 HB1 LEU 114 4.291 25.430 -9.893 185 HG LEU 114 HG LEU 114 2.263 23.219 -9.544 186 HD11 LEU 114 HD11 LEU 114 2.052 24.129 -12.161 187 HD12 LEU 114 HD12 LEU 114 2.112 25.616 -11.216 188 HD13 LEU 114 HD13 LEU 114 0.875 24.406 -10.878 189 HD21 LEU 114 HD21 LEU 114 3.626 23.014 -11.975 190 HD22 LEU 114 HD22 LEU 114 3.967 22.090 -10.512 191 HD23 LEU 114 HD23 LEU 114 4.854 23.578 -10.841 192 H ASP 115 HN ASP 115 4.752 26.424 -6.825 193 HA ASP 115 HA ASP 115 7.479 26.719 -7.722 194 HB2 ASP 115 HB2 ASP 115 5.600 27.942 -5.758 195 HB3 ASP 115 HB1 ASP 115 7.319 28.245 -5.504 196 H GLU 116 HN GLU 116 6.157 25.825 -4.504 197 HA GLU 116 HA GLU 116 8.672 25.131 -3.335 198 HB2 GLU 116 HB2 GLU 116 5.798 24.324 -2.817 199 HB3 GLU 116 HB1 GLU 116 7.123 23.868 -1.747 200 HG2 GLU 116 HG2 GLU 116 7.030 25.883 -0.758 201 HG3 GLU 116 HG1 GLU 116 7.358 26.663 -2.306 202 H LEU 117 HN LEU 117 6.822 23.520 -5.733 203 HA LEU 117 HA LEU 117 7.476 20.779 -5.096 204 HB2 LEU 117 HB2 LEU 117 6.401 22.373 -7.371 205 HB3 LEU 117 HB1 LEU 117 7.056 20.784 -7.764 206 HG LEU 117 HG LEU 117 4.936 21.344 -5.667 207 HD11 LEU 117 HD11 LEU 117 4.081 19.562 -7.716 208 HD12 LEU 117 HD12 LEU 117 4.791 20.968 -8.508 209 HD13 LEU 117 HD13 LEU 117 3.466 21.177 -7.363 210 HD21 LEU 117 HD21 LEU 117 6.193 19.441 -4.952 211 HD22 LEU 117 HD22 LEU 117 6.324 18.820 -6.597 212 HD23 LEU 117 HD23 LEU 117 4.770 18.787 -5.762 213 H LYS 118 HN LYS 118 9.037 23.267 -7.117 214 HA LYS 118 HA LYS 118 11.186 21.397 -7.905 215 HB2 LYS 118 HB2 LYS 118 11.814 23.172 -9.380 216 HB3 LYS 118 HB1 LYS 118 10.051 23.181 -9.353 217 HG2 LYS 118 HG2 LYS 118 10.128 24.953 -7.594 218 HG3 LYS 118 HG1 LYS 118 11.883 24.996 -7.760 219 HD2 LYS 118 HD2 LYS 118 11.348 25.335 -10.313 220 HD3 LYS 118 HD1 LYS 118 9.777 25.869 -9.713 221 HE2 LYS 118 HE2 LYS 118 11.168 27.841 -9.861 222 HE3 LYS 118 HE1 LYS 118 11.065 27.433 -8.137 223 HZ1 LYS 118 HZ1 LYS 118 13.383 27.777 -9.262 224 HZ2 LYS 118 HZ2 LYS 118 13.152 26.174 -9.774 225 HZ3 LYS 118 HZ3 LYS 118 13.162 26.547 -8.116 226 H ILE 119 HN ILE 119 10.573 23.716 -5.415 227 HA ILE 119 HA ILE 119 13.444 24.217 -4.885 228 HB ILE 119 HB ILE 119 10.919 25.051 -3.419 229 HG12 ILE 119 HG12 ILE 119 12.514 26.827 -5.244 230 HG13 ILE 119 HG11 ILE 119 11.330 25.719 -5.939 231 HG21 ILE 119 HG21 ILE 119 13.535 26.525 -3.406 232 HG22 ILE 119 HG22 ILE 119 13.315 25.141 -2.335 233 HG23 ILE 119 HG23 ILE 119 12.245 26.537 -2.204 234 HD11 ILE 119 HD11 ILE 119 10.372 27.975 -5.439 235 HD12 ILE 119 HD12 ILE 119 10.724 27.707 -3.731 236 HD13 ILE 119 HD13 ILE 119 9.561 26.675 -4.565 237 H MET 120 HN MET 120 10.722 22.393 -3.530 238 HA MET 120 HA MET 120 11.834 21.679 -1.017 239 HB2 MET 120 HB2 MET 120 10.173 19.901 -1.106 240 HB3 MET 120 HB1 MET 120 9.491 21.336 -1.873 241 HG2 MET 120 HG2 MET 120 10.060 20.459 -4.087 242 HG3 MET 120 HG1 MET 120 10.823 19.049 -3.353 243 HE1 MET 120 HE1 MET 120 9.636 16.962 -3.800 244 HE2 MET 120 HE2 MET 120 8.238 16.588 -2.795 245 HE3 MET 120 HE3 MET 120 9.694 17.250 -2.055 246 H LEU 121 HN LEU 121 12.692 20.655 -4.223 247 HA LEU 121 HA LEU 121 13.992 18.161 -3.362 248 HB2 LEU 121 HB2 LEU 121 13.017 19.362 -5.741 249 HB3 LEU 121 HB1 LEU 121 14.747 19.106 -5.978 250 HG LEU 121 HG LEU 121 13.685 17.083 -6.681 251 HD11 LEU 121 HD11 LEU 121 15.039 15.688 -5.511 252 HD12 LEU 121 HD12 LEU 121 14.273 16.093 -3.974 253 HD13 LEU 121 HD13 LEU 121 15.531 17.138 -4.636 254 HD21 LEU 121 HD21 LEU 121 11.955 15.974 -5.481 255 HD22 LEU 121 HD22 LEU 121 11.531 17.684 -5.403 256 HD23 LEU 121 HD23 LEU 121 12.277 16.896 -4.012 257 H GLN 122 HN GLN 122 14.826 21.451 -3.312 258 HA GLN 122 HA GLN 122 17.408 21.824 -4.118 259 HB2 GLN 122 HB2 GLN 122 15.655 22.829 -2.111 260 HB3 GLN 122 HB1 GLN 122 17.244 22.643 -1.370 261 HG2 GLN 122 HG2 GLN 122 18.141 24.323 -2.600 262 HG3 GLN 122 HG1 GLN 122 17.340 23.784 -4.076 263 HE21 GLN 122 HE21 GLN 122 16.498 25.354 -0.932 264 HE22 GLN 122 HE22 GLN 122 15.315 26.376 -1.595 265 H ALA 123 HN ALA 123 16.398 19.638 -1.539 266 HA ALA 123 HA ALA 123 18.802 19.178 -0.167 267 HB1 ALA 123 HB1 ALA 123 16.251 18.029 -0.440 268 HB2 ALA 123 HB2 ALA 123 17.481 17.580 0.742 269 HB3 ALA 123 HB3 ALA 123 17.378 16.719 -0.794 270 H THR 124 HN THR 124 17.755 17.875 -3.314 271 HA THR 124 HA THR 124 20.417 16.550 -3.621 272 HB THR 124 HB THR 124 19.298 15.162 -5.218 273 HG1 THR 124 HG1 THR 124 16.922 15.913 -5.525 274 HG21 THR 124 HG21 THR 124 17.882 14.085 -3.788 275 HG22 THR 124 HG22 THR 124 16.951 15.544 -3.451 276 HG23 THR 124 HG23 THR 124 18.489 15.271 -2.632 277 H GLY 125 HN GLY 125 19.718 19.526 -4.000 278 HA2 GLY 125 HA2 GLY 125 20.735 21.132 -5.427 279 HA3 GLY 125 HA1 GLY 125 21.183 19.829 -6.527 280 H GLU 126 HN GLU 126 17.991 19.377 -5.800 281 HA GLU 126 HA GLU 126 16.168 19.421 -7.347 282 HB2 GLU 126 HB2 GLU 126 15.124 21.544 -7.053 283 HB3 GLU 126 HB1 GLU 126 16.134 21.316 -5.628 284 HG2 GLU 126 HG2 GLU 126 17.326 23.163 -6.112 285 HG3 GLU 126 HG1 GLU 126 17.660 22.581 -7.739 286 H THR 127 HN THR 127 18.268 18.946 -9.017 287 HA THR 127 HA THR 127 18.223 21.068 -11.117 288 HB THR 127 HB THR 127 20.409 20.308 -10.437 289 HG1 THR 127 HG1 THR 127 20.239 20.528 -12.650 290 HG21 THR 127 HG21 THR 127 20.732 17.676 -10.985 291 HG22 THR 127 HG22 THR 127 19.050 17.673 -10.454 292 HG23 THR 127 HG23 THR 127 20.311 18.283 -9.383 293 H ILE 128 HN ILE 128 16.174 20.657 -12.096 294 HA ILE 128 HA ILE 128 16.017 18.067 -13.593 295 HB ILE 128 HB ILE 128 14.593 17.920 -11.620 296 HG12 ILE 128 HG12 ILE 128 13.055 18.518 -14.166 297 HG13 ILE 128 HG11 ILE 128 13.636 16.943 -13.625 298 HG21 ILE 128 HG21 ILE 128 14.465 20.442 -11.344 299 HG22 ILE 128 HG22 ILE 128 12.948 19.584 -11.070 300 HG23 ILE 128 HG23 ILE 128 13.217 20.437 -12.591 301 HD11 ILE 128 HD11 ILE 128 11.808 16.636 -12.346 302 HD12 ILE 128 HD12 ILE 128 11.131 18.096 -13.069 303 HD13 ILE 128 HD13 ILE 128 12.038 18.198 -11.560 304 H THR 129 HN THR 129 14.583 18.249 -15.522 305 HA THR 129 HA THR 129 15.038 20.669 -17.017 306 HB THR 129 HB THR 129 13.405 19.459 -18.592 307 HG1 THR 129 HG1 THR 129 13.007 17.282 -17.910 308 HG21 THR 129 HG21 THR 129 15.870 18.112 -17.474 309 HG22 THR 129 HG22 THR 129 15.758 19.143 -18.900 310 HG23 THR 129 HG23 THR 129 15.034 17.535 -18.915 311 H GLU 130 HN GLU 130 13.529 22.301 -17.607 312 HA GLU 130 HA GLU 130 11.538 23.006 -15.642 313 HB2 GLU 130 HB2 GLU 130 11.161 24.879 -17.152 314 HB3 GLU 130 HB1 GLU 130 12.891 24.539 -17.110 315 HG2 GLU 130 HG2 GLU 130 12.698 23.237 -19.191 316 HG3 GLU 130 HG1 GLU 130 10.963 23.551 -19.233 317 H ASP 131 HN ASP 131 11.455 20.855 -18.303 318 HA ASP 131 HA ASP 131 8.607 21.205 -18.934 319 HB2 ASP 131 HB2 ASP 131 10.966 19.811 -19.928 320 HB3 ASP 131 HB1 ASP 131 9.547 18.764 -19.939 321 H ASP 132 HN ASP 132 10.578 19.162 -16.849 322 HA ASP 132 HA ASP 132 8.370 17.289 -16.299 323 HB2 ASP 132 HB2 ASP 132 11.237 17.674 -15.474 324 HB3 ASP 132 HB1 ASP 132 10.209 16.566 -14.564 325 H ILE 133 HN ILE 133 9.555 20.287 -15.040 326 HA ILE 133 HA ILE 133 8.821 20.081 -12.294 327 HB ILE 133 HB ILE 133 8.861 22.390 -14.262 328 HG12 ILE 133 HG12 ILE 133 11.010 21.193 -13.898 329 HG13 ILE 133 HG11 ILE 133 11.059 22.836 -13.258 330 HG21 ILE 133 HG21 ILE 133 7.510 22.577 -11.990 331 HG22 ILE 133 HG22 ILE 133 8.568 23.888 -12.511 332 HG23 ILE 133 HG23 ILE 133 9.124 22.736 -11.296 333 HD11 ILE 133 HD11 ILE 133 11.193 20.260 -11.832 334 HD12 ILE 133 HD12 ILE 133 10.096 21.434 -11.105 335 HD13 ILE 133 HD13 ILE 133 11.794 21.847 -11.349 336 H GLU 134 HN GLU 134 6.912 20.887 -15.181 337 HA GLU 134 HA GLU 134 4.485 21.362 -13.555 338 HB2 GLU 134 HB2 GLU 134 5.249 21.510 -16.477 339 HB3 GLU 134 HB1 GLU 134 3.576 21.703 -15.952 340 HG2 GLU 134 HG2 GLU 134 4.740 23.401 -14.227 341 HG3 GLU 134 HG1 GLU 134 5.911 23.508 -15.542 342 H GLU 135 HN GLU 135 5.993 18.814 -15.392 343 HA GLU 135 HA GLU 135 3.634 17.251 -15.971 344 HB2 GLU 135 HB2 GLU 135 6.439 17.204 -16.397 345 HB3 GLU 135 HB1 GLU 135 6.031 15.686 -15.596 346 HG2 GLU 135 HG2 GLU 135 4.769 14.938 -17.358 347 HG3 GLU 135 HG1 GLU 135 4.204 16.556 -17.773 348 H LEU 136 HN LEU 136 6.068 17.090 -13.347 349 HA LEU 136 HA LEU 136 4.992 14.868 -11.942 350 HB2 LEU 136 HB2 LEU 136 6.467 17.366 -11.053 351 HB3 LEU 136 HB1 LEU 136 6.206 15.968 -10.009 352 HG LEU 136 HG LEU 136 7.310 15.330 -12.673 353 HD11 LEU 136 HD11 LEU 136 9.378 16.295 -10.803 354 HD12 LEU 136 HD12 LEU 136 8.384 17.567 -11.512 355 HD13 LEU 136 HD13 LEU 136 9.280 16.463 -12.556 356 HD21 LEU 136 HD21 LEU 136 7.720 13.471 -11.465 357 HD22 LEU 136 HD22 LEU 136 7.226 14.288 -9.982 358 HD23 LEU 136 HD23 LEU 136 8.900 14.385 -10.527 359 H MET 137 HN MET 137 3.940 18.210 -12.106 360 HA MET 137 HA MET 137 2.429 18.526 -9.769 361 HB2 MET 137 HB2 MET 137 2.762 19.748 -12.280 362 HB3 MET 137 HB1 MET 137 1.028 19.463 -12.138 363 HG2 MET 137 HG2 MET 137 2.598 20.670 -9.864 364 HG3 MET 137 HG1 MET 137 1.960 21.674 -11.166 365 HE1 MET 137 HE1 MET 137 1.133 22.013 -8.045 366 HE2 MET 137 HE2 MET 137 1.548 20.306 -7.902 367 HE3 MET 137 HE3 MET 137 -0.068 20.853 -7.462 368 H LYS 138 HN LYS 138 1.325 17.065 -12.854 369 HA LYS 138 HA LYS 138 -1.308 16.405 -12.174 370 HB2 LYS 138 HB2 LYS 138 0.838 15.075 -13.828 371 HB3 LYS 138 HB1 LYS 138 -0.786 14.393 -13.738 372 HG2 LYS 138 HG2 LYS 138 -1.761 16.436 -14.594 373 HG3 LYS 138 HG1 LYS 138 -0.203 17.262 -14.519 374 HD2 LYS 138 HD2 LYS 138 0.645 16.126 -16.356 375 HD3 LYS 138 HD1 LYS 138 -0.407 14.732 -16.109 376 HE2 LYS 138 HE2 LYS 138 -2.188 15.707 -17.221 377 HE3 LYS 138 HE1 LYS 138 -1.702 17.353 -16.767 378 HZ1 LYS 138 HZ1 LYS 138 0.195 15.839 -18.370 379 HZ2 LYS 138 HZ2 LYS 138 -0.216 17.486 -18.443 380 HZ3 LYS 138 HZ3 LYS 138 -1.221 16.324 -19.169 381 H ASP 139 HN ASP 139 1.476 14.162 -11.863 382 HA ASP 139 HA ASP 139 0.258 12.074 -10.485 383 HB2 ASP 139 HB2 ASP 139 3.000 13.339 -10.251 384 HB3 ASP 139 HB1 ASP 139 2.594 11.805 -9.481 385 H GLY 140 HN GLY 140 1.155 15.246 -9.236 386 HA2 GLY 140 HA2 GLY 140 0.258 14.376 -6.519 387 HA3 GLY 140 HA1 GLY 140 1.354 15.727 -6.813 388 H ASP 141 HN ASP 141 -1.065 15.682 -9.155 389 HA ASP 141 HA ASP 141 -3.132 17.091 -7.633 390 HB2 ASP 141 HB2 ASP 141 -0.886 18.523 -8.323 391 HB3 ASP 141 HB1 ASP 141 -1.958 18.854 -9.685 392 H LYS 142 HN LYS 142 -4.196 15.245 -8.854 393 HA LYS 142 HA LYS 142 -4.368 15.378 -11.761 394 HB2 LYS 142 HB2 LYS 142 -5.273 13.730 -9.521 395 HB3 LYS 142 HB1 LYS 142 -6.507 13.886 -10.771 396 HG2 LYS 142 HG2 LYS 142 -3.812 13.438 -11.848 397 HG3 LYS 142 HG1 LYS 142 -4.395 12.109 -10.845 398 HD2 LYS 142 HD2 LYS 142 -5.523 11.417 -12.680 399 HD3 LYS 142 HD1 LYS 142 -6.617 12.765 -12.367 400 HE2 LYS 142 HE2 LYS 142 -5.845 13.944 -14.158 401 HE3 LYS 142 HE1 LYS 142 -4.154 13.546 -13.794 402 HZ1 LYS 142 HZ1 LYS 142 -4.951 11.161 -14.449 403 HZ2 LYS 142 HZ2 LYS 142 -4.489 12.270 -15.650 404 HZ3 LYS 142 HZ3 LYS 142 -6.135 12.007 -15.321 405 H ASN 143 HN ASN 143 -5.898 17.028 -9.163 406 HA ASN 143 HA ASN 143 -8.176 17.844 -10.923 407 HB2 ASN 143 HB2 ASN 143 -9.444 17.958 -8.989 408 HB3 ASN 143 HB1 ASN 143 -8.267 16.754 -8.477 409 HD21 ASN 143 HD21 ASN 143 -6.071 18.077 -7.657 410 HD22 ASN 143 HD22 ASN 143 -6.424 19.269 -6.503 411 H ASN 144 HN ASN 144 -5.222 18.906 -9.582 412 HA ASN 144 HA ASN 144 -4.192 21.031 -9.475 413 HB2 ASN 144 HB2 ASN 144 -5.934 20.842 -11.850 414 HB3 ASN 144 HB1 ASN 144 -5.504 22.492 -11.398 415 HD21 ASN 144 HD21 ASN 144 -4.414 19.842 -13.178 416 HD22 ASN 144 HD22 ASN 144 -2.765 20.240 -13.249 417 H ASP 145 HN ASP 145 -5.795 20.937 -7.357 418 HA ASP 145 HA ASP 145 -7.946 22.913 -7.387 419 HB2 ASP 145 HB2 ASP 145 -7.850 22.444 -4.908 420 HB3 ASP 145 HB1 ASP 145 -8.004 20.994 -5.899 421 H GLY 146 HN GLY 146 -4.645 23.253 -7.537 422 HA2 GLY 146 HA2 GLY 146 -3.762 25.570 -7.558 423 HA3 GLY 146 HA1 GLY 146 -4.777 25.900 -6.152 424 H ARG 147 HN ARG 147 -3.935 23.025 -5.265 425 HA ARG 147 HA ARG 147 -1.107 23.488 -4.522 426 HB2 ARG 147 HB2 ARG 147 -1.666 23.419 -2.114 427 HB3 ARG 147 HB1 ARG 147 -2.464 24.778 -2.905 428 HG2 ARG 147 HG2 ARG 147 -4.389 22.952 -3.251 429 HG3 ARG 147 HG1 ARG 147 -3.643 22.265 -1.807 430 HD2 ARG 147 HD2 ARG 147 -3.884 24.442 -0.645 431 HD3 ARG 147 HD1 ARG 147 -4.663 25.117 -2.090 432 HE ARG 147 HE ARG 147 -5.882 23.225 -0.222 433 HH11 ARG 147 HH21 ARG 147 -5.760 24.448 -3.450 434 HH12 ARG 147 HH22 ARG 147 -7.392 24.000 -3.818 435 HH21 ARG 147 HH11 ARG 147 -8.010 22.639 -0.691 436 HH22 ARG 147 HH12 ARG 147 -8.664 22.977 -2.259 437 H ILE 148 HN ILE 148 -0.250 21.556 -3.301 438 HA ILE 148 HA ILE 148 -1.626 19.074 -4.232 439 HB ILE 148 HB ILE 148 1.209 19.723 -3.367 440 HG12 ILE 148 HG12 ILE 148 -0.026 19.049 -6.058 441 HG13 ILE 148 HG11 ILE 148 0.585 20.628 -5.563 442 HG21 ILE 148 HG21 ILE 148 -0.001 17.129 -4.372 443 HG22 ILE 148 HG22 ILE 148 0.676 17.415 -2.768 444 HG23 ILE 148 HG23 ILE 148 1.729 17.424 -4.184 445 HD11 ILE 148 HD11 ILE 148 2.717 20.045 -6.018 446 HD12 ILE 148 HD12 ILE 148 2.055 18.628 -6.834 447 HD13 ILE 148 HD13 ILE 148 2.558 18.520 -5.147 448 H ASP 149 HN ASP 149 -3.000 18.407 -2.577 449 HA ASP 149 HA ASP 149 -2.328 18.739 0.247 450 HB2 ASP 149 HB2 ASP 149 -4.460 17.100 -1.168 451 HB3 ASP 149 HB1 ASP 149 -4.469 17.557 0.536 452 H TYR 150 HN TYR 150 -2.482 16.651 1.670 453 HA TYR 150 HA TYR 150 -0.356 14.843 0.851 454 HB2 TYR 150 HB2 TYR 150 -0.749 15.597 3.171 455 HB3 TYR 150 HB1 TYR 150 -2.317 14.788 3.169 456 HD1 TYR 150 HD2 TYR 150 0.876 13.594 1.657 457 HD2 TYR 150 HD1 TYR 150 -2.028 13.068 4.779 458 HE1 TYR 150 HE2 TYR 150 1.966 11.465 2.313 459 HE2 TYR 150 HE1 TYR 150 -0.937 10.939 5.435 460 HH TYR 150 HH TYR 150 0.504 9.226 4.421 461 H ASP 151 HN ASP 151 -3.897 14.548 1.228 462 HA ASP 151 HA ASP 151 -4.257 11.804 0.831 463 HB2 ASP 151 HB2 ASP 151 -6.464 12.430 0.105 464 HB3 ASP 151 HB1 ASP 151 -5.949 13.668 1.252 465 H GLU 152 HN GLU 152 -3.491 14.300 -1.567 466 HA GLU 152 HA GLU 152 -3.728 12.427 -3.830 467 HB2 GLU 152 HB2 GLU 152 -3.383 15.301 -3.307 468 HB3 GLU 152 HB1 GLU 152 -2.446 14.728 -4.687 469 HG2 GLU 152 HG2 GLU 152 -4.329 14.114 -5.890 470 HG3 GLU 152 HG1 GLU 152 -5.295 13.845 -4.438 471 H PHE 153 HN PHE 153 -1.198 13.866 -1.822 472 HA PHE 153 HA PHE 153 1.131 13.389 -3.264 473 HB2 PHE 153 HB2 PHE 153 0.625 14.267 -0.843 474 HB3 PHE 153 HB1 PHE 153 0.890 12.588 -0.371 475 HD1 PHE 153 HD1 PHE 153 2.478 15.034 -2.742 476 HD2 PHE 153 HD2 PHE 153 3.044 12.123 0.366 477 HE1 PHE 153 HE1 PHE 153 4.929 15.390 -2.854 478 HE2 PHE 153 HE2 PHE 153 5.495 12.479 0.253 479 HZ PHE 153 HZ PHE 153 6.438 14.113 -1.357 480 H LEU 154 HN LEU 154 -0.668 11.011 -1.282 481 HA LEU 154 HA LEU 154 0.955 8.767 -1.469 482 HB2 LEU 154 HB2 LEU 154 -1.969 9.329 -1.397 483 HB3 LEU 154 HB1 LEU 154 -1.498 7.679 -1.806 484 HG LEU 154 HG LEU 154 -1.780 7.914 0.628 485 HD11 LEU 154 HD11 LEU 154 0.211 6.626 -0.599 486 HD12 LEU 154 HD12 LEU 154 0.113 6.700 1.161 487 HD13 LEU 154 HD13 LEU 154 1.188 7.794 0.290 488 HD21 LEU 154 HD21 LEU 154 -1.186 10.379 0.627 489 HD22 LEU 154 HD22 LEU 154 0.506 9.900 0.488 490 HD23 LEU 154 HD23 LEU 154 -0.426 9.442 1.914 491 H GLU 155 HN GLU 155 -1.353 9.922 -3.952 492 HA GLU 155 HA GLU 155 -0.759 7.816 -5.843 493 HB2 GLU 155 HB2 GLU 155 -2.816 9.256 -5.755 494 HB3 GLU 155 HB1 GLU 155 -1.834 10.621 -6.290 495 HG2 GLU 155 HG2 GLU 155 -2.414 9.941 -8.382 496 HG3 GLU 155 HG1 GLU 155 -1.168 8.716 -8.144 497 H PHE 156 HN PHE 156 0.464 11.123 -5.351 498 HA PHE 156 HA PHE 156 2.048 11.418 -7.666 499 HB2 PHE 156 HB2 PHE 156 1.748 13.252 -6.181 500 HB3 PHE 156 HB1 PHE 156 2.303 12.319 -4.791 501 HD1 PHE 156 HD2 PHE 156 3.715 12.824 -8.233 502 HD2 PHE 156 HD1 PHE 156 4.298 13.232 -3.997 503 HE1 PHE 156 HE2 PHE 156 6.032 13.617 -8.628 504 HE2 PHE 156 HE1 PHE 156 6.614 14.024 -4.392 505 HZ PHE 156 HZ PHE 156 7.481 14.217 -6.707 506 H MET 157 HN MET 157 2.756 9.705 -4.626 507 HA MET 157 HA MET 157 5.483 9.007 -5.455 508 HB2 MET 157 HB2 MET 157 3.747 7.892 -3.231 509 HB3 MET 157 HB1 MET 157 5.509 7.876 -3.310 510 HG2 MET 157 HG2 MET 157 3.711 10.296 -3.016 511 HG3 MET 157 HG1 MET 157 4.881 9.684 -1.846 512 HE1 MET 157 HE1 MET 157 7.786 9.303 -4.033 513 HE2 MET 157 HE2 MET 157 7.047 9.052 -2.454 514 HE3 MET 157 HE3 MET 157 8.122 10.424 -2.707 515 H LYS 158 HN LYS 158 2.282 7.507 -5.477 516 HA LYS 158 HA LYS 158 3.248 4.846 -6.189 517 HB2 LYS 158 HB2 LYS 158 0.986 5.853 -5.119 518 HB3 LYS 158 HB1 LYS 158 0.480 5.766 -6.807 519 HG2 LYS 158 HG2 LYS 158 -0.064 3.619 -6.207 520 HG3 LYS 158 HG1 LYS 158 1.638 3.343 -6.581 521 HD2 LYS 158 HD2 LYS 158 1.974 4.075 -4.056 522 HD3 LYS 158 HD1 LYS 158 0.295 3.554 -3.913 523 HE2 LYS 158 HE2 LYS 158 1.427 1.547 -3.484 524 HE3 LYS 158 HE1 LYS 158 1.191 1.426 -5.240 525 HZ1 LYS 158 HZ1 LYS 158 3.363 2.800 -5.320 526 HZ2 LYS 158 HZ2 LYS 158 3.458 1.126 -5.043 527 HZ3 LYS 158 HZ3 LYS 158 3.606 2.215 -3.747 528 H GLY 159 HN GLY 159 2.319 7.761 -7.907 529 HA2 GLY 159 HA2 GLY 159 2.035 6.446 -10.497 530 HA3 GLY 159 HA1 GLY 159 2.094 8.189 -10.220 531 H VAL 160 HN VAL 160 4.622 7.878 -8.633 532 HA VAL 160 HA VAL 160 6.471 7.686 -10.973 533 HB VAL 160 HB VAL 160 7.874 9.168 -9.662 534 HG11 VAL 160 HG11 VAL 160 6.460 10.723 -10.505 535 HG12 VAL 160 HG12 VAL 160 5.756 10.775 -8.889 536 HG13 VAL 160 HG13 VAL 160 5.038 9.749 -10.131 537 HG21 VAL 160 HG21 VAL 160 5.984 8.383 -7.448 538 HG22 VAL 160 HG22 VAL 160 6.907 9.883 -7.356 539 HG23 VAL 160 HG23 VAL 160 7.747 8.336 -7.460 540 H GLU 161 HN GLU 161 7.585 5.774 -11.071 541 HA GLU 161 HA GLU 161 8.706 4.641 -8.555 542 HB2 GLU 161 HB2 GLU 161 6.345 3.745 -9.671 543 HB3 GLU 161 HB1 GLU 161 7.533 2.650 -10.380 544 HG2 GLU 161 HG2 GLU 161 7.402 3.253 -7.416 545 HG3 GLU 161 HG1 GLU 161 6.576 1.884 -8.160 546 HO1 KDH 1 H1 KDH 1 13.777 7.850 -9.538 547 H21 KDH 1 H21 KDH 1 13.067 8.698 -3.233 548 H33 KDH 1 H33 KDH 1 9.989 12.558 -6.554 549 H4 KDH 1 H4 KDH 1 13.219 9.530 -7.339 550 HO7 KDH 1 H7 KDH 1 11.219 8.361 -11.835 551 H01 KDH 1 H01 KDH 1 10.833 13.602 -4.371 552 H01A KDH 1 H02 KDH 1 9.683 12.211 -4.265 553 HO03 KDH 1 H03 KDH 1 10.871 13.998 -2.645 554 HO10 KDH 1 H10 KDH 1 8.411 10.749 -10.303 555 H12 KDH 1 H12 KDH 1 9.086 10.841 -8.125 556 H15 KDH 1 H15 KDH 1 9.967 10.312 -5.937 557 H26 KDH 1 H26 KDH 1 12.928 12.050 -0.406 558 H39 KDH 1 H39 KDH 1 9.335 13.862 -7.885 559 H41 KDH 1 H41 KDH 1 13.371 15.586 -8.211 560 HO02 KDH 1 H42 KDH 1 14.436 8.922 -1.340 561 HO44 KDH 1 H44 KDH 1 13.339 17.837 -9.120 562 HO47 KDH 1 H47 KDH 1 10.121 18.794 -9.522 563 HO50 KDH 1 H50 KDH 1 7.660 15.984 -7.460 Start of MODEL 30 1 H1 MET 90 HT1 MET 90 12.630 8.837 2.380 2 H2 MET 90 HT2 MET 90 14.261 8.393 2.557 3 H3 MET 90 HT3 MET 90 13.063 7.631 3.491 4 HA MET 90 HA MET 90 13.884 7.110 0.754 5 HB2 MET 90 HB2 MET 90 12.679 5.691 3.138 6 HB3 MET 90 HB1 MET 90 12.905 4.876 1.590 7 HG2 MET 90 HG2 MET 90 15.149 6.324 3.011 8 HG3 MET 90 HG1 MET 90 14.815 4.610 3.261 9 HE1 MET 90 HE1 MET 90 17.948 4.637 1.577 10 HE2 MET 90 HE2 MET 90 17.036 3.132 1.485 11 HE3 MET 90 HE3 MET 90 16.883 4.161 2.907 12 H GLY 91 HN GLY 91 10.890 6.018 2.281 13 HA2 GLY 91 HA2 GLY 91 8.759 7.272 1.482 14 HA3 GLY 91 HA1 GLY 91 9.417 6.984 -0.129 15 H LYS 92 HN LYS 92 7.448 5.696 2.307 16 HA LYS 92 HA LYS 92 7.167 3.173 0.764 17 HB2 LYS 92 HB2 LYS 92 8.828 3.302 2.934 18 HB3 LYS 92 HB1 LYS 92 7.308 2.840 3.701 19 HG2 LYS 92 HG2 LYS 92 7.560 0.732 2.965 20 HG3 LYS 92 HG1 LYS 92 7.601 1.311 1.299 21 HD2 LYS 92 HD2 LYS 92 9.661 0.035 1.985 22 HD3 LYS 92 HD1 LYS 92 9.991 1.672 1.415 23 HE2 LYS 92 HE2 LYS 92 10.429 2.477 3.586 24 HE3 LYS 92 HE1 LYS 92 9.563 1.132 4.357 25 HZ1 LYS 92 HZ1 LYS 92 11.687 0.360 4.533 26 HZ2 LYS 92 HZ2 LYS 92 12.228 1.172 3.142 27 HZ3 LYS 92 HZ3 LYS 92 11.314 -0.253 2.996 28 H SER 93 HN SER 93 5.666 2.109 3.180 29 HA SER 93 HA SER 93 3.030 2.745 2.495 30 HB2 SER 93 HB2 SER 93 4.466 1.357 4.531 31 HB3 SER 93 HB1 SER 93 3.240 2.337 5.330 32 HG SER 93 HG SER 93 2.950 0.080 3.913 33 H GLU 94 HN GLU 94 1.461 3.941 4.090 34 HA GLU 94 HA GLU 94 2.030 6.726 4.086 35 HB2 GLU 94 HB2 GLU 94 -0.048 4.892 4.855 36 HB3 GLU 94 HB1 GLU 94 0.140 6.103 6.124 37 HG2 GLU 94 HG2 GLU 94 -1.001 7.558 4.842 38 HG3 GLU 94 HG1 GLU 94 0.318 7.500 3.671 39 H GLU 95 HN GLU 95 3.111 4.263 6.225 40 HA GLU 95 HA GLU 95 3.308 5.556 8.723 41 HB2 GLU 95 HB2 GLU 95 3.859 3.213 8.336 42 HB3 GLU 95 HB1 GLU 95 5.189 3.668 7.270 43 HG2 GLU 95 HG2 GLU 95 6.582 3.938 9.016 44 HG3 GLU 95 HG1 GLU 95 5.436 5.008 9.826 45 H GLU 96 HN GLU 96 5.936 5.364 6.292 46 HA GLU 96 HA GLU 96 7.265 7.699 7.521 47 HB2 GLU 96 HB2 GLU 96 7.868 5.512 5.585 48 HB3 GLU 96 HB1 GLU 96 8.796 7.003 5.415 49 HG2 GLU 96 HG2 GLU 96 9.489 6.882 7.756 50 HG3 GLU 96 HG1 GLU 96 8.493 5.447 7.999 51 H LEU 97 HN LEU 97 5.077 7.053 4.943 52 HA LEU 97 HA LEU 97 5.815 9.034 3.031 53 HB2 LEU 97 HB2 LEU 97 3.765 7.160 3.519 54 HB3 LEU 97 HB1 LEU 97 2.948 8.714 3.355 55 HG LEU 97 HG LEU 97 3.275 7.481 1.176 56 HD11 LEU 97 HD11 LEU 97 3.238 10.098 1.617 57 HD12 LEU 97 HD12 LEU 97 3.590 9.462 0.009 58 HD13 LEU 97 HD13 LEU 97 4.907 9.990 1.056 59 HD21 LEU 97 HD21 LEU 97 5.929 7.286 2.217 60 HD22 LEU 97 HD22 LEU 97 5.999 8.251 0.743 61 HD23 LEU 97 HD23 LEU 97 5.307 6.629 0.703 62 H SER 98 HN SER 98 4.113 9.271 6.109 63 HA SER 98 HA SER 98 3.061 11.941 5.705 64 HB2 SER 98 HB2 SER 98 2.599 9.930 7.424 65 HB3 SER 98 HB1 SER 98 3.717 10.864 8.413 66 HG SER 98 HG SER 98 1.486 12.002 7.087 67 H ASP 99 HN ASP 99 6.214 10.759 6.269 68 HA ASP 99 HA ASP 99 7.131 13.220 7.657 69 HB2 ASP 99 HB2 ASP 99 7.774 10.614 7.923 70 HB3 ASP 99 HB1 ASP 99 8.986 11.079 6.728 71 H LEU 100 HN LEU 100 7.305 11.618 4.512 72 HA LEU 100 HA LEU 100 9.370 13.310 3.393 73 HB2 LEU 100 HB2 LEU 100 7.351 11.308 2.488 74 HB3 LEU 100 HB1 LEU 100 8.031 12.371 1.256 75 HG LEU 100 HG LEU 100 10.006 11.234 3.137 76 HD11 LEU 100 HD11 LEU 100 8.125 9.441 2.448 77 HD12 LEU 100 HD12 LEU 100 9.832 9.012 2.569 78 HD13 LEU 100 HD13 LEU 100 9.120 9.363 0.994 79 HD21 LEU 100 HD21 LEU 100 9.754 12.100 0.333 80 HD22 LEU 100 HD22 LEU 100 10.761 10.668 0.549 81 HD23 LEU 100 HD23 LEU 100 11.152 12.160 1.405 82 H PHE 101 HN PHE 101 5.956 13.696 3.939 83 HA PHE 101 HA PHE 101 5.476 15.724 1.910 84 HB2 PHE 101 HB2 PHE 101 3.881 14.128 3.231 85 HB3 PHE 101 HB1 PHE 101 3.945 15.367 4.483 86 HD1 PHE 101 HD2 PHE 101 3.612 17.858 3.585 87 HD2 PHE 101 HD1 PHE 101 2.241 14.309 1.589 88 HE1 PHE 101 HE2 PHE 101 1.940 19.203 2.342 89 HE2 PHE 101 HE1 PHE 101 0.568 15.655 0.347 90 HZ PHE 101 HZ PHE 101 0.418 18.102 0.724 91 H ARG 102 HN ARG 102 5.986 15.837 5.451 92 HA ARG 102 HA ARG 102 5.973 18.720 5.628 93 HB2 ARG 102 HB2 ARG 102 7.013 18.153 7.887 94 HB3 ARG 102 HB1 ARG 102 5.481 17.349 7.544 95 HG2 ARG 102 HG2 ARG 102 6.465 15.281 7.278 96 HG3 ARG 102 HG1 ARG 102 7.982 15.962 6.689 97 HD2 ARG 102 HD2 ARG 102 8.335 15.023 8.927 98 HD3 ARG 102 HD1 ARG 102 8.441 16.792 9.027 99 HE ARG 102 HE ARG 102 5.778 16.382 9.446 100 HH11 ARG 102 HH21 ARG 102 8.632 14.926 10.750 101 HH12 ARG 102 HH22 ARG 102 7.894 14.544 12.268 102 HH21 ARG 102 HH11 ARG 102 4.814 15.888 11.424 103 HH22 ARG 102 HH12 ARG 102 5.739 15.087 12.650 104 H MET 103 HN MET 103 8.278 16.549 4.376 105 HA MET 103 HA MET 103 10.638 18.168 5.110 106 HB2 MET 103 HB2 MET 103 10.073 15.504 4.436 107 HB3 MET 103 HB1 MET 103 10.995 16.127 3.067 108 HG2 MET 103 HG2 MET 103 12.904 16.292 4.279 109 HG3 MET 103 HG1 MET 103 12.061 16.954 5.680 110 HE1 MET 103 HE1 MET 103 13.344 14.386 3.684 111 HE2 MET 103 HE2 MET 103 12.259 13.017 3.916 112 HE3 MET 103 HE3 MET 103 13.778 13.089 4.806 113 H PHE 104 HN PHE 104 8.845 17.299 2.133 114 HA PHE 104 HA PHE 104 10.466 18.941 0.390 115 HB2 PHE 104 HB2 PHE 104 7.653 17.825 0.143 116 HB3 PHE 104 HB1 PHE 104 8.616 18.447 -1.198 117 HD1 PHE 104 HD1 PHE 104 11.320 17.443 -0.436 118 HD2 PHE 104 HD2 PHE 104 7.486 15.507 -0.343 119 HE1 PHE 104 HE1 PHE 104 12.429 15.236 -0.662 120 HE2 PHE 104 HE2 PHE 104 8.596 13.301 -0.570 121 HZ PHE 104 HZ PHE 104 11.067 13.165 -0.728 122 H ASP 105 HN ASP 105 7.190 19.406 1.776 123 HA ASP 105 HA ASP 105 6.587 21.934 0.727 124 HB2 ASP 105 HB2 ASP 105 5.065 20.545 2.056 125 HB3 ASP 105 HB1 ASP 105 6.072 20.776 3.486 126 H LYS 106 HN LYS 106 8.509 23.256 0.627 127 HA LYS 106 HA LYS 106 10.146 23.828 2.942 128 HB2 LYS 106 HB2 LYS 106 11.092 24.120 0.786 129 HB3 LYS 106 HB1 LYS 106 9.704 25.047 0.213 130 HG2 LYS 106 HG2 LYS 106 10.310 26.953 1.495 131 HG3 LYS 106 HG1 LYS 106 11.445 26.029 2.478 132 HD2 LYS 106 HD2 LYS 106 12.907 25.706 0.542 133 HD3 LYS 106 HD1 LYS 106 11.755 26.552 -0.493 134 HE2 LYS 106 HE2 LYS 106 12.440 28.606 0.235 135 HE3 LYS 106 HE1 LYS 106 12.564 28.064 1.920 136 HZ1 LYS 106 HZ1 LYS 106 14.509 26.662 1.049 137 HZ2 LYS 106 HZ2 LYS 106 14.770 28.323 1.293 138 HZ3 LYS 106 HZ3 LYS 106 14.509 27.722 -0.274 139 H ASN 107 HN ASN 107 7.098 25.054 1.788 140 HA ASN 107 HA ASN 107 7.215 27.634 3.120 141 HB2 ASN 107 HB2 ASN 107 5.766 26.835 1.149 142 HB3 ASN 107 HB1 ASN 107 4.757 26.043 2.361 143 HD21 ASN 107 HD21 ASN 107 2.956 27.357 2.703 144 HD22 ASN 107 HD22 ASN 107 3.006 29.042 2.900 145 H ALA 108 HN ALA 108 6.762 24.423 4.224 146 HA ALA 108 HA ALA 108 6.034 23.538 6.295 147 HB1 ALA 108 HB1 ALA 108 7.273 24.543 7.929 148 HB2 ALA 108 HB2 ALA 108 6.550 26.124 7.633 149 HB3 ALA 108 HB3 ALA 108 7.866 25.551 6.609 150 H ASP 109 HN ASP 109 3.819 24.276 4.896 151 HA ASP 109 HA ASP 109 2.157 25.786 6.889 152 HB2 ASP 109 HB2 ASP 109 0.962 26.708 5.026 153 HB3 ASP 109 HB1 ASP 109 2.671 26.839 4.613 154 H GLY 110 HN GLY 110 2.635 22.847 5.168 155 HA2 GLY 110 HA2 GLY 110 1.375 20.881 6.060 156 HA3 GLY 110 HA1 GLY 110 -0.064 21.902 6.053 157 H TYR 111 HN TYR 111 0.978 23.057 3.396 158 HA TYR 111 HA TYR 111 0.170 20.740 1.668 159 HB2 TYR 111 HB2 TYR 111 -0.545 23.681 1.425 160 HB3 TYR 111 HB1 TYR 111 -1.100 22.395 0.353 161 HD1 TYR 111 HD1 TYR 111 -2.722 20.723 1.112 162 HD2 TYR 111 HD2 TYR 111 -1.401 23.885 3.702 163 HE1 TYR 111 HE1 TYR 111 -4.593 20.232 2.664 164 HE2 TYR 111 HE2 TYR 111 -3.272 23.395 5.255 165 HH TYR 111 HH TYR 111 -5.274 20.567 4.885 166 H ILE 112 HN ILE 112 0.799 21.252 -0.716 167 HA ILE 112 HA ILE 112 3.461 22.640 -0.777 168 HB ILE 112 HB ILE 112 2.498 19.995 -1.872 169 HG12 ILE 112 HG12 ILE 112 5.050 20.720 -0.413 170 HG13 ILE 112 HG11 ILE 112 3.571 20.255 0.429 171 HG21 ILE 112 HG21 ILE 112 4.998 20.100 -2.837 172 HG22 ILE 112 HG22 ILE 112 4.611 21.819 -2.925 173 HG23 ILE 112 HG23 ILE 112 3.612 20.645 -3.782 174 HD11 ILE 112 HD11 ILE 112 4.528 18.169 0.228 175 HD12 ILE 112 HD12 ILE 112 5.405 18.597 -1.240 176 HD13 ILE 112 HD13 ILE 112 3.682 18.226 -1.318 177 H ASP 113 HN ASP 113 3.726 24.071 -2.475 178 HA ASP 113 HA ASP 113 1.462 24.316 -4.414 179 HB2 ASP 113 HB2 ASP 113 3.115 26.108 -2.832 180 HB3 ASP 113 HB1 ASP 113 3.160 26.556 -4.538 181 H LEU 114 HN LEU 114 2.243 25.200 -6.630 182 HA LEU 114 HA LEU 114 4.017 23.330 -7.863 183 HB2 LEU 114 HB2 LEU 114 2.903 26.038 -8.635 184 HB3 LEU 114 HB1 LEU 114 3.860 25.059 -9.748 185 HG LEU 114 HG LEU 114 1.918 23.338 -8.591 186 HD11 LEU 114 HD11 LEU 114 0.991 26.082 -8.864 187 HD12 LEU 114 HD12 LEU 114 0.158 24.688 -8.178 188 HD13 LEU 114 HD13 LEU 114 0.084 24.993 -9.913 189 HD21 LEU 114 HD21 LEU 114 2.659 24.440 -11.254 190 HD22 LEU 114 HD22 LEU 114 1.049 23.730 -11.122 191 HD23 LEU 114 HD23 LEU 114 2.474 22.762 -10.742 192 H ASP 115 HN ASP 115 4.559 26.536 -6.472 193 HA ASP 115 HA ASP 115 7.251 26.839 -7.547 194 HB2 ASP 115 HB2 ASP 115 5.870 28.169 -5.192 195 HB3 ASP 115 HB1 ASP 115 7.261 28.796 -6.078 196 H GLU 116 HN GLU 116 5.844 25.226 -4.800 197 HA GLU 116 HA GLU 116 8.345 25.144 -3.253 198 HB2 GLU 116 HB2 GLU 116 5.815 23.522 -2.888 199 HB3 GLU 116 HB1 GLU 116 6.981 23.998 -1.653 200 HG2 GLU 116 HG2 GLU 116 6.386 26.422 -2.246 201 HG3 GLU 116 HG1 GLU 116 5.011 25.754 -3.125 202 H LEU 117 HN LEU 117 6.391 22.863 -5.199 203 HA LEU 117 HA LEU 117 7.952 20.524 -4.762 204 HB2 LEU 117 HB2 LEU 117 6.487 21.439 -7.263 205 HB3 LEU 117 HB1 LEU 117 6.886 19.772 -6.850 206 HG LEU 117 HG LEU 117 5.336 21.372 -4.856 207 HD11 LEU 117 HD11 LEU 117 3.794 19.914 -6.950 208 HD12 LEU 117 HD12 LEU 117 4.432 21.501 -7.381 209 HD13 LEU 117 HD13 LEU 117 3.341 21.333 -6.005 210 HD21 LEU 117 HD21 LEU 117 5.486 18.492 -5.772 211 HD22 LEU 117 HD22 LEU 117 4.234 19.063 -4.668 212 HD23 LEU 117 HD23 LEU 117 5.933 19.153 -4.199 213 H LYS 118 HN LYS 118 8.590 23.392 -6.615 214 HA LYS 118 HA LYS 118 10.620 22.223 -8.360 215 HB2 LYS 118 HB2 LYS 118 9.481 24.146 -9.149 216 HB3 LYS 118 HB1 LYS 118 9.651 24.983 -7.606 217 HG2 LYS 118 HG2 LYS 118 11.921 25.467 -7.974 218 HG3 LYS 118 HG1 LYS 118 12.088 24.206 -9.196 219 HD2 LYS 118 HD2 LYS 118 11.311 25.546 -10.863 220 HD3 LYS 118 HD1 LYS 118 10.078 26.273 -9.831 221 HE2 LYS 118 HE2 LYS 118 12.213 27.376 -8.661 222 HE3 LYS 118 HE1 LYS 118 12.913 27.122 -10.272 223 HZ1 LYS 118 HZ1 LYS 118 10.421 28.575 -9.585 224 HZ2 LYS 118 HZ2 LYS 118 10.791 28.086 -11.169 225 HZ3 LYS 118 HZ3 LYS 118 11.798 29.190 -10.360 226 H ILE 119 HN ILE 119 10.531 23.608 -5.144 227 HA ILE 119 HA ILE 119 13.498 23.840 -5.061 228 HB ILE 119 HB ILE 119 11.173 24.729 -3.353 229 HG12 ILE 119 HG12 ILE 119 13.192 26.699 -3.847 230 HG13 ILE 119 HG11 ILE 119 12.837 25.884 -5.370 231 HG21 ILE 119 HG21 ILE 119 14.025 24.319 -2.568 232 HG22 ILE 119 HG22 ILE 119 12.565 24.221 -1.584 233 HG23 ILE 119 HG23 ILE 119 13.234 25.795 -2.015 234 HD11 ILE 119 HD11 ILE 119 10.358 26.325 -4.031 235 HD12 ILE 119 HD12 ILE 119 10.920 27.046 -5.540 236 HD13 ILE 119 HD13 ILE 119 11.259 27.841 -4.002 237 H MET 120 HN MET 120 10.821 22.033 -3.538 238 HA MET 120 HA MET 120 12.267 20.688 -1.517 239 HB2 MET 120 HB2 MET 120 10.396 19.237 -1.487 240 HB3 MET 120 HB1 MET 120 9.747 20.728 -2.167 241 HG2 MET 120 HG2 MET 120 8.958 19.286 -3.768 242 HG3 MET 120 HG1 MET 120 10.568 19.533 -4.443 243 HE1 MET 120 HE1 MET 120 8.160 17.156 -4.275 244 HE2 MET 120 HE2 MET 120 8.151 17.193 -2.514 245 HE3 MET 120 HE3 MET 120 8.648 15.727 -3.355 246 H LEU 121 HN LEU 121 12.219 20.183 -4.994 247 HA LEU 121 HA LEU 121 13.713 17.636 -4.812 248 HB2 LEU 121 HB2 LEU 121 11.952 18.925 -6.610 249 HB3 LEU 121 HB1 LEU 121 13.504 18.817 -7.444 250 HG LEU 121 HG LEU 121 13.590 16.381 -6.776 251 HD11 LEU 121 HD11 LEU 121 11.258 15.436 -6.253 252 HD12 LEU 121 HD12 LEU 121 10.805 17.091 -5.844 253 HD13 LEU 121 HD13 LEU 121 12.083 16.277 -4.940 254 HD21 LEU 121 HD21 LEU 121 11.563 17.588 -8.622 255 HD22 LEU 121 HD22 LEU 121 11.534 15.842 -8.375 256 HD23 LEU 121 HD23 LEU 121 12.987 16.619 -9.004 257 H GLN 122 HN GLN 122 14.308 21.051 -5.390 258 HA GLN 122 HA GLN 122 16.688 21.136 -6.804 259 HB2 GLN 122 HB2 GLN 122 15.472 22.645 -4.544 260 HB3 GLN 122 HB1 GLN 122 17.175 22.962 -4.869 261 HG2 GLN 122 HG2 GLN 122 15.359 22.874 -7.226 262 HG3 GLN 122 HG1 GLN 122 15.201 24.265 -6.153 263 HE21 GLN 122 HE21 GLN 122 16.280 25.870 -7.390 264 HE22 GLN 122 HE22 GLN 122 17.900 25.744 -7.881 265 H ALA 123 HN ALA 123 16.326 20.327 -3.340 266 HA ALA 123 HA ALA 123 19.024 20.108 -2.591 267 HB1 ALA 123 HB1 ALA 123 16.529 18.547 -1.887 268 HB2 ALA 123 HB2 ALA 123 17.276 19.862 -0.980 269 HB3 ALA 123 HB3 ALA 123 18.059 18.283 -1.050 270 H THR 124 HN THR 124 17.178 18.118 -4.768 271 HA THR 124 HA THR 124 19.210 15.946 -4.735 272 HB THR 124 HB THR 124 16.914 15.926 -6.615 273 HG1 THR 124 HG1 THR 124 15.558 15.379 -4.731 274 HG21 THR 124 HG21 THR 124 17.968 14.006 -4.523 275 HG22 THR 124 HG22 THR 124 18.309 13.951 -6.252 276 HG23 THR 124 HG23 THR 124 16.673 13.647 -5.665 277 H GLY 125 HN GLY 125 19.105 18.891 -6.095 278 HA2 GLY 125 HA2 GLY 125 20.229 19.811 -7.944 279 HA3 GLY 125 HA1 GLY 125 20.904 18.208 -8.250 280 H GLU 126 HN GLU 126 17.452 18.759 -8.008 281 HA GLU 126 HA GLU 126 16.792 17.416 -10.404 282 HB2 GLU 126 HB2 GLU 126 14.595 18.495 -10.058 283 HB3 GLU 126 HB1 GLU 126 15.268 17.944 -8.524 284 HG2 GLU 126 HG2 GLU 126 15.167 20.041 -7.720 285 HG3 GLU 126 HG1 GLU 126 16.233 20.591 -9.014 286 H THR 127 HN THR 127 18.179 18.218 -12.111 287 HA THR 127 HA THR 127 17.789 21.062 -12.922 288 HB THR 127 HB THR 127 19.696 20.438 -14.477 289 HG1 THR 127 HG1 THR 127 20.584 18.452 -14.273 290 HG21 THR 127 HG21 THR 127 20.844 19.617 -11.945 291 HG22 THR 127 HG22 THR 127 19.696 20.936 -11.715 292 HG23 THR 127 HG23 THR 127 21.054 21.132 -12.823 293 H ILE 128 HN ILE 128 15.677 20.896 -13.854 294 HA ILE 128 HA ILE 128 15.587 19.345 -16.411 295 HB ILE 128 HB ILE 128 13.397 18.529 -15.797 296 HG12 ILE 128 HG12 ILE 128 13.689 20.314 -13.358 297 HG13 ILE 128 HG11 ILE 128 12.568 20.564 -14.697 298 HG21 ILE 128 HG21 ILE 128 15.133 18.335 -13.323 299 HG22 ILE 128 HG22 ILE 128 15.424 17.405 -14.793 300 HG23 ILE 128 HG23 ILE 128 13.934 17.167 -13.879 301 HD11 ILE 128 HD11 ILE 128 12.247 17.886 -13.705 302 HD12 ILE 128 HD12 ILE 128 11.066 19.196 -13.732 303 HD13 ILE 128 HD13 ILE 128 12.149 19.014 -12.352 304 H THR 129 HN THR 129 13.772 20.173 -17.835 305 HA THR 129 HA THR 129 13.847 23.061 -18.032 306 HB THR 129 HB THR 129 11.751 21.538 -19.461 307 HG1 THR 129 HG1 THR 129 13.840 20.741 -20.686 308 HG21 THR 129 HG21 THR 129 13.918 23.517 -20.035 309 HG22 THR 129 HG22 THR 129 12.212 23.560 -20.482 310 HG23 THR 129 HG23 THR 129 13.328 22.520 -21.366 311 H GLU 130 HN GLU 130 11.880 24.445 -17.968 312 HA GLU 130 HA GLU 130 10.379 24.199 -15.560 313 HB2 GLU 130 HB2 GLU 130 9.163 26.109 -16.473 314 HB3 GLU 130 HB1 GLU 130 10.868 26.264 -16.898 315 HG2 GLU 130 HG2 GLU 130 9.793 24.750 -18.978 316 HG3 GLU 130 HG1 GLU 130 8.554 25.961 -18.646 317 H ASP 131 HN ASP 131 9.987 22.593 -18.560 318 HA ASP 131 HA ASP 131 7.079 22.236 -18.379 319 HB2 ASP 131 HB2 ASP 131 9.284 21.016 -20.069 320 HB3 ASP 131 HB1 ASP 131 7.565 20.709 -20.323 321 H ASP 132 HN ASP 132 9.961 20.540 -17.319 322 HA ASP 132 HA ASP 132 8.585 18.000 -16.815 323 HB2 ASP 132 HB2 ASP 132 11.107 18.632 -17.344 324 HB3 ASP 132 HB1 ASP 132 11.202 18.809 -15.592 325 H ILE 133 HN ILE 133 8.798 20.999 -15.203 326 HA ILE 133 HA ILE 133 8.788 20.087 -12.454 327 HB ILE 133 HB ILE 133 7.767 22.631 -13.760 328 HG12 ILE 133 HG12 ILE 133 10.150 22.046 -14.272 329 HG13 ILE 133 HG11 ILE 133 9.990 23.522 -13.321 330 HG21 ILE 133 HG21 ILE 133 8.772 22.224 -10.934 331 HG22 ILE 133 HG22 ILE 133 7.062 22.148 -11.360 332 HG23 ILE 133 HG23 ILE 133 7.965 23.644 -11.597 333 HD11 ILE 133 HD11 ILE 133 11.511 21.242 -12.664 334 HD12 ILE 133 HD12 ILE 133 10.124 21.220 -11.574 335 HD13 ILE 133 HD13 ILE 133 11.180 22.632 -11.630 336 H GLU 134 HN GLU 134 6.128 21.686 -14.239 337 HA GLU 134 HA GLU 134 4.031 20.961 -12.517 338 HB2 GLU 134 HB2 GLU 134 4.326 21.617 -15.430 339 HB3 GLU 134 HB1 GLU 134 2.746 21.108 -14.834 340 HG2 GLU 134 HG2 GLU 134 2.476 22.990 -13.530 341 HG3 GLU 134 HG1 GLU 134 4.208 23.172 -13.250 342 H GLU 135 HN GLU 135 5.711 19.012 -14.898 343 HA GLU 135 HA GLU 135 3.946 16.978 -15.553 344 HB2 GLU 135 HB2 GLU 135 6.259 17.077 -16.300 345 HB3 GLU 135 HB1 GLU 135 6.840 16.842 -14.651 346 HG2 GLU 135 HG2 GLU 135 6.965 14.657 -15.340 347 HG3 GLU 135 HG1 GLU 135 5.266 14.665 -14.864 348 H LEU 136 HN LEU 136 5.903 17.106 -12.550 349 HA LEU 136 HA LEU 136 4.645 14.767 -11.388 350 HB2 LEU 136 HB2 LEU 136 6.188 17.048 -10.108 351 HB3 LEU 136 HB1 LEU 136 5.968 15.430 -9.439 352 HG LEU 136 HG LEU 136 7.027 15.359 -12.159 353 HD11 LEU 136 HD11 LEU 136 8.760 16.792 -12.028 354 HD12 LEU 136 HD12 LEU 136 9.222 16.167 -10.445 355 HD13 LEU 136 HD13 LEU 136 8.023 17.454 -10.569 356 HD21 LEU 136 HD21 LEU 136 7.055 13.418 -10.710 357 HD22 LEU 136 HD22 LEU 136 7.911 14.311 -9.453 358 HD23 LEU 136 HD23 LEU 136 8.727 13.919 -10.967 359 H MET 137 HN MET 137 4.030 18.252 -11.239 360 HA MET 137 HA MET 137 2.334 18.357 -8.970 361 HB2 MET 137 HB2 MET 137 3.280 20.055 -10.927 362 HB3 MET 137 HB1 MET 137 1.550 20.015 -11.273 363 HG2 MET 137 HG2 MET 137 2.067 20.214 -8.413 364 HG3 MET 137 HG1 MET 137 2.798 21.550 -9.302 365 HE1 MET 137 HE1 MET 137 0.859 22.184 -7.249 366 HE2 MET 137 HE2 MET 137 -0.146 20.738 -7.330 367 HE3 MET 137 HE3 MET 137 -0.862 22.319 -7.636 368 H LYS 138 HN LYS 138 1.373 17.974 -12.411 369 HA LYS 138 HA LYS 138 -1.361 17.722 -12.236 370 HB2 LYS 138 HB2 LYS 138 0.795 16.400 -13.823 371 HB3 LYS 138 HB1 LYS 138 -0.835 15.742 -13.974 372 HG2 LYS 138 HG2 LYS 138 -1.695 17.713 -14.875 373 HG3 LYS 138 HG1 LYS 138 -0.429 18.711 -14.158 374 HD2 LYS 138 HD2 LYS 138 1.206 17.911 -15.730 375 HD3 LYS 138 HD1 LYS 138 0.104 16.672 -16.332 376 HE2 LYS 138 HE2 LYS 138 -1.417 18.889 -16.748 377 HE3 LYS 138 HE1 LYS 138 0.208 19.566 -16.975 378 HZ1 LYS 138 HZ1 LYS 138 -1.153 17.470 -18.486 379 HZ2 LYS 138 HZ2 LYS 138 0.514 17.269 -18.225 380 HZ3 LYS 138 HZ3 LYS 138 -0.063 18.653 -19.022 381 H ASP 139 HN ASP 139 0.946 15.047 -11.606 382 HA ASP 139 HA ASP 139 -1.076 13.145 -10.823 383 HB2 ASP 139 HB2 ASP 139 1.687 13.252 -11.305 384 HB3 ASP 139 HB1 ASP 139 1.547 12.774 -9.613 385 H GLY 140 HN GLY 140 0.931 15.462 -9.017 386 HA2 GLY 140 HA2 GLY 140 -0.122 14.550 -6.434 387 HA3 GLY 140 HA1 GLY 140 0.976 15.908 -6.685 388 H ASP 141 HN ASP 141 -1.358 16.414 -8.905 389 HA ASP 141 HA ASP 141 -3.326 17.662 -7.056 390 HB2 ASP 141 HB2 ASP 141 -1.193 19.092 -7.830 391 HB3 ASP 141 HB1 ASP 141 -2.202 19.345 -9.255 392 H LYS 142 HN LYS 142 -3.810 15.461 -8.724 393 HA LYS 142 HA LYS 142 -4.667 15.958 -11.368 394 HB2 LYS 142 HB2 LYS 142 -5.029 13.997 -9.242 395 HB3 LYS 142 HB1 LYS 142 -6.484 14.153 -10.228 396 HG2 LYS 142 HG2 LYS 142 -4.068 14.138 -11.862 397 HG3 LYS 142 HG1 LYS 142 -4.210 12.676 -10.883 398 HD2 LYS 142 HD2 LYS 142 -6.768 12.903 -11.739 399 HD3 LYS 142 HD1 LYS 142 -5.928 13.637 -13.105 400 HE2 LYS 142 HE2 LYS 142 -4.800 11.084 -12.032 401 HE3 LYS 142 HE1 LYS 142 -6.297 10.988 -12.981 402 HZ1 LYS 142 HZ1 LYS 142 -5.317 12.002 -14.800 403 HZ2 LYS 142 HZ2 LYS 142 -4.064 11.004 -14.233 404 HZ3 LYS 142 HZ3 LYS 142 -4.050 12.668 -13.890 405 H ASN 143 HN ASN 143 -6.151 16.842 -8.312 406 HA ASN 143 HA ASN 143 -8.794 17.418 -9.387 407 HB2 ASN 143 HB2 ASN 143 -8.598 16.931 -7.067 408 HB3 ASN 143 HB1 ASN 143 -7.251 18.052 -6.865 409 HD21 ASN 143 HD21 ASN 143 -8.031 19.718 -5.553 410 HD22 ASN 143 HD22 ASN 143 -9.496 20.540 -5.801 411 H ASN 144 HN ASN 144 -5.752 19.072 -9.316 412 HA ASN 144 HA ASN 144 -5.116 21.214 -10.076 413 HB2 ASN 144 HB2 ASN 144 -6.531 20.138 -11.961 414 HB3 ASN 144 HB1 ASN 144 -7.814 21.227 -11.432 415 HD21 ASN 144 HD21 ASN 144 -6.175 21.264 -13.991 416 HD22 ASN 144 HD22 ASN 144 -5.494 22.818 -14.048 417 H ASP 145 HN ASP 145 -5.449 21.986 -7.792 418 HA ASP 145 HA ASP 145 -7.769 23.885 -7.632 419 HB2 ASP 145 HB2 ASP 145 -8.008 23.283 -5.325 420 HB3 ASP 145 HB1 ASP 145 -7.829 21.763 -6.201 421 H GLY 146 HN GLY 146 -4.378 23.486 -7.572 422 HA2 GLY 146 HA2 GLY 146 -2.982 25.511 -7.673 423 HA3 GLY 146 HA1 GLY 146 -4.080 26.263 -6.517 424 H ARG 147 HN ARG 147 -4.062 23.488 -5.103 425 HA ARG 147 HA ARG 147 -1.352 23.693 -3.850 426 HB2 ARG 147 HB2 ARG 147 -4.004 24.335 -2.769 427 HB3 ARG 147 HB1 ARG 147 -3.099 23.211 -1.753 428 HG2 ARG 147 HG2 ARG 147 -1.203 24.734 -1.672 429 HG3 ARG 147 HG1 ARG 147 -1.993 25.829 -2.808 430 HD2 ARG 147 HD2 ARG 147 -3.644 26.467 -1.221 431 HD3 ARG 147 HD1 ARG 147 -3.275 25.088 -0.166 432 HE ARG 147 HE ARG 147 -0.902 26.650 -0.551 433 HH11 ARG 147 HH21 ARG 147 -3.988 26.676 0.999 434 HH12 ARG 147 HH22 ARG 147 -3.470 27.694 2.299 435 HH21 ARG 147 HH11 ARG 147 -0.215 27.977 1.140 436 HH22 ARG 147 HH12 ARG 147 -1.336 28.430 2.380 437 H ILE 148 HN ILE 148 -0.554 21.697 -3.113 438 HA ILE 148 HA ILE 148 -2.120 19.297 -3.927 439 HB ILE 148 HB ILE 148 0.780 19.755 -3.151 440 HG12 ILE 148 HG12 ILE 148 -0.648 19.422 -5.804 441 HG13 ILE 148 HG11 ILE 148 0.289 20.813 -5.259 442 HG21 ILE 148 HG21 ILE 148 0.312 17.364 -4.676 443 HG22 ILE 148 HG22 ILE 148 -0.729 17.346 -3.253 444 HG23 ILE 148 HG23 ILE 148 1.016 17.519 -3.067 445 HD11 ILE 148 HD11 ILE 148 1.215 18.254 -6.399 446 HD12 ILE 148 HD12 ILE 148 2.121 18.797 -4.986 447 HD13 ILE 148 HD13 ILE 148 1.992 19.837 -6.406 448 H ASP 149 HN ASP 149 -2.922 17.888 -2.397 449 HA ASP 149 HA ASP 149 -2.275 18.451 0.474 450 HB2 ASP 149 HB2 ASP 149 -4.487 17.220 0.788 451 HB3 ASP 149 HB1 ASP 149 -4.601 18.753 -0.076 452 H TYR 150 HN TYR 150 -2.855 16.190 1.738 453 HA TYR 150 HA TYR 150 -0.736 14.353 1.019 454 HB2 TYR 150 HB2 TYR 150 -1.766 14.968 3.309 455 HB3 TYR 150 HB1 TYR 150 -3.050 13.832 2.893 456 HD1 TYR 150 HD2 TYR 150 0.622 14.161 3.391 457 HD2 TYR 150 HD1 TYR 150 -2.708 11.477 3.010 458 HE1 TYR 150 HE2 TYR 150 2.066 12.271 4.092 459 HE2 TYR 150 HE1 TYR 150 -1.266 9.587 3.711 460 HH TYR 150 HH TYR 150 1.536 9.890 5.258 461 H ASP 151 HN ASP 151 -4.310 14.128 0.925 462 HA ASP 151 HA ASP 151 -4.693 11.529 0.023 463 HB2 ASP 151 HB2 ASP 151 -5.988 14.158 -0.742 464 HB3 ASP 151 HB1 ASP 151 -6.640 12.603 -1.259 465 H GLU 152 HN GLU 152 -3.525 14.311 -1.836 466 HA GLU 152 HA GLU 152 -3.525 12.828 -4.375 467 HB2 GLU 152 HB2 GLU 152 -2.852 15.562 -3.357 468 HB3 GLU 152 HB1 GLU 152 -2.173 15.065 -4.908 469 HG2 GLU 152 HG2 GLU 152 -4.209 15.056 -5.950 470 HG3 GLU 152 HG1 GLU 152 -5.055 14.481 -4.512 471 H PHE 153 HN PHE 153 -1.133 13.919 -1.966 472 HA PHE 153 HA PHE 153 1.280 13.386 -3.244 473 HB2 PHE 153 HB2 PHE 153 0.686 14.159 -0.836 474 HB3 PHE 153 HB1 PHE 153 0.693 12.442 -0.437 475 HD1 PHE 153 HD1 PHE 153 2.810 14.664 -2.607 476 HD2 PHE 153 HD2 PHE 153 2.684 11.771 0.568 477 HE1 PHE 153 HE1 PHE 153 5.286 14.704 -2.471 478 HE2 PHE 153 HE2 PHE 153 5.160 11.812 0.703 479 HZ PHE 153 HZ PHE 153 6.461 13.278 -0.816 480 H LEU 154 HN LEU 154 -1.001 11.034 -1.858 481 HA LEU 154 HA LEU 154 0.656 8.709 -2.149 482 HB2 LEU 154 HB2 LEU 154 -2.255 9.355 -1.850 483 HB3 LEU 154 HB1 LEU 154 -1.810 7.705 -2.289 484 HG LEU 154 HG LEU 154 -1.991 8.158 0.214 485 HD11 LEU 154 HD11 LEU 154 -0.561 6.424 0.479 486 HD12 LEU 154 HD12 LEU 154 0.811 7.369 -0.100 487 HD13 LEU 154 HD13 LEU 154 -0.252 6.560 -1.252 488 HD21 LEU 154 HD21 LEU 154 0.016 9.280 1.207 489 HD22 LEU 154 HD22 LEU 154 -0.975 10.379 0.249 490 HD23 LEU 154 HD23 LEU 154 0.525 9.734 -0.420 491 H GLU 155 HN GLU 155 -1.800 10.169 -4.301 492 HA GLU 155 HA GLU 155 -1.473 8.216 -6.411 493 HB2 GLU 155 HB2 GLU 155 -3.316 10.052 -5.787 494 HB3 GLU 155 HB1 GLU 155 -2.372 11.027 -6.914 495 HG2 GLU 155 HG2 GLU 155 -3.853 10.011 -8.385 496 HG3 GLU 155 HG1 GLU 155 -2.526 8.849 -8.416 497 H PHE 156 HN PHE 156 0.520 10.716 -5.286 498 HA PHE 156 HA PHE 156 1.696 11.416 -7.899 499 HB2 PHE 156 HB2 PHE 156 1.511 13.158 -6.278 500 HB3 PHE 156 HB1 PHE 156 2.163 12.137 -4.997 501 HD1 PHE 156 HD1 PHE 156 3.487 12.371 -8.459 502 HD2 PHE 156 HD2 PHE 156 4.043 13.467 -4.343 503 HE1 PHE 156 HE1 PHE 156 5.775 13.176 -8.981 504 HE2 PHE 156 HE2 PHE 156 6.330 14.271 -4.865 505 HZ PHE 156 HZ PHE 156 7.195 14.126 -7.184 506 H MET 157 HN MET 157 3.109 10.172 -4.836 507 HA MET 157 HA MET 157 5.206 8.796 -6.442 508 HB2 MET 157 HB2 MET 157 6.251 8.593 -4.143 509 HB3 MET 157 HB1 MET 157 5.965 10.253 -4.663 510 HG2 MET 157 HG2 MET 157 4.428 10.621 -3.036 511 HG3 MET 157 HG1 MET 157 3.681 9.040 -3.262 512 HE1 MET 157 HE1 MET 157 7.262 10.417 -1.051 513 HE2 MET 157 HE2 MET 157 6.937 10.488 -2.781 514 HE3 MET 157 HE3 MET 157 7.821 9.118 -2.113 515 H LYS 158 HN LYS 158 2.447 8.198 -4.388 516 HA LYS 158 HA LYS 158 1.625 6.175 -3.421 517 HB2 LYS 158 HB2 LYS 158 1.432 4.551 -5.551 518 HB3 LYS 158 HB1 LYS 158 0.454 6.007 -5.397 519 HG2 LYS 158 HG2 LYS 158 1.959 7.256 -6.812 520 HG3 LYS 158 HG1 LYS 158 3.132 5.941 -6.815 521 HD2 LYS 158 HD2 LYS 158 1.947 4.700 -8.333 522 HD3 LYS 158 HD1 LYS 158 0.388 5.249 -7.717 523 HE2 LYS 158 HE2 LYS 158 1.363 7.590 -8.728 524 HE3 LYS 158 HE1 LYS 158 2.077 6.417 -9.852 525 HZ1 LYS 158 HZ1 LYS 158 -0.765 6.861 -9.205 526 HZ2 LYS 158 HZ2 LYS 158 -0.247 5.339 -9.754 527 HZ3 LYS 158 HZ3 LYS 158 -0.030 6.715 -10.726 528 H GLY 159 HN GLY 159 3.444 4.404 -5.830 529 HA2 GLY 159 HA2 GLY 159 5.246 3.368 -3.686 530 HA3 GLY 159 HA1 GLY 159 4.383 2.249 -4.742 531 H VAL 160 HN VAL 160 6.524 5.110 -5.004 532 HA VAL 160 HA VAL 160 7.437 4.396 -7.670 533 HB VAL 160 HB VAL 160 8.630 6.241 -5.574 534 HG11 VAL 160 HG11 VAL 160 9.083 7.422 -7.961 535 HG12 VAL 160 HG12 VAL 160 9.107 5.732 -8.465 536 HG13 VAL 160 HG13 VAL 160 10.224 6.298 -7.223 537 HG21 VAL 160 HG21 VAL 160 7.185 7.736 -7.445 538 HG22 VAL 160 HG22 VAL 160 6.700 7.401 -5.783 539 HG23 VAL 160 HG23 VAL 160 6.141 6.359 -7.091 540 H GLU 161 HN GLU 161 9.667 3.738 -8.177 541 HA GLU 161 HA GLU 161 11.531 2.311 -7.892 542 HB2 GLU 161 HB2 GLU 161 11.407 4.254 -5.852 543 HB3 GLU 161 HB1 GLU 161 11.819 2.743 -5.039 544 HG2 GLU 161 HG2 GLU 161 13.931 3.476 -5.672 545 HG3 GLU 161 HG1 GLU 161 13.501 2.480 -7.063 546 HO1 KDH 1 H1 KDH 1 6.253 8.620 -9.800 547 H21 KDH 1 H21 KDH 1 12.430 8.003 -3.891 548 H33 KDH 1 H33 KDH 1 9.108 12.366 -6.209 549 H4 KDH 1 H4 KDH 1 7.361 10.499 -7.402 550 HO7 KDH 1 H7 KDH 1 8.961 7.589 -11.434 551 H01 KDH 1 H01 KDH 1 10.762 13.222 -4.453 552 H01A KDH 1 H02 KDH 1 9.493 12.046 -3.927 553 HO03 KDH 1 H03 KDH 1 11.814 13.688 -3.224 554 HO10 KDH 1 H10 KDH 1 11.716 7.628 -9.886 555 H12 KDH 1 H12 KDH 1 11.600 9.391 -7.857 556 H15 KDH 1 H15 KDH 1 8.895 10.154 -5.534 557 H26 KDH 1 H26 KDH 1 13.713 11.286 -1.280 558 H39 KDH 1 H39 KDH 1 9.420 11.675 -9.602 559 H41 KDH 1 H41 KDH 1 13.002 14.137 -8.925 560 HO02 KDH 1 H42 KDH 1 14.236 7.907 -2.474 561 HO44 KDH 1 H44 KDH 1 14.005 13.662 -12.421 562 HO47 KDH 1 H47 KDH 1 13.054 11.619 -13.150 563 HO50 KDH 1 H50 KDH 1 9.007 11.503 -12.142
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