NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
477489 | 2l25 | 17124 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H GLY 1 19.162 8.224 -6.809 2 HA2 GLY 1 2HA GLY 1 16.764 8.178 -7.241 3 HA3 GLY 1 1HA GLY 1 16.565 7.289 -5.712 4 H MET 2 H MET 2 15.575 9.971 -6.704 5 HA MET 2 HA MET 2 16.228 11.571 -4.312 6 HB2 MET 2 1HB MET 2 16.331 13.597 -5.819 7 HB3 MET 2 2HB MET 2 17.721 12.508 -5.936 8 HG2 MET 2 1HG MET 2 16.840 11.551 -8.007 9 HG3 MET 2 2HG MET 2 15.394 12.548 -7.895 10 HE1 MET 2 3HE MET 2 17.620 13.714 -10.990 11 HE2 MET 2 1HE MET 2 17.621 12.096 -10.276 12 HE3 MET 2 2HE MET 2 16.083 12.946 -10.506 13 H SER 3 H SER 3 14.498 13.133 -3.878 14 HA SER 3 HA SER 3 12.437 13.561 -3.370 15 HB2 SER 3 1HB SER 3 11.888 13.948 -6.300 16 HB3 SER 3 2HB SER 3 11.168 14.742 -4.918 17 HG SER 3 HG SER 3 13.687 15.176 -6.058 18 H GLN 4 H GLN 4 11.580 11.814 -6.363 19 HA GLN 4 HA GLN 4 9.214 10.619 -5.484 20 HB2 GLN 4 1HB GLN 4 10.149 10.732 -7.813 21 HB3 GLN 4 2HB GLN 4 11.260 9.429 -7.418 22 HG2 GLN 4 1HG GLN 4 8.278 9.052 -6.992 23 HG3 GLN 4 2HG GLN 4 8.956 8.988 -8.615 24 HE21 GLN 4 1HE2 GLN 4 9.149 7.409 -5.389 25 HE22 GLN 4 2HE2 GLN 4 9.797 5.896 -5.981 26 H ASP 5 H ASP 5 12.606 9.284 -5.221 27 HA ASP 5 HA ASP 5 11.644 6.806 -4.219 28 HB2 ASP 5 1HB ASP 5 13.935 7.042 -5.090 29 HB3 ASP 5 2HB ASP 5 14.369 8.033 -3.682 30 H LEU 6 H LEU 6 12.317 9.814 -2.573 31 HA LEU 6 HA LEU 6 12.328 8.900 0.143 32 HB2 LEU 6 1HB LEU 6 11.270 11.565 -0.913 33 HB3 LEU 6 2HB LEU 6 11.726 11.196 0.735 34 HG LEU 6 HG LEU 6 13.679 11.136 -1.587 35 HD11 LEU 6 1HD1 LEU 6 12.551 13.413 -1.196 36 HD12 LEU 6 2HD1 LEU 6 14.329 13.349 -1.182 37 HD13 LEU 6 3HD1 LEU 6 13.444 13.454 0.331 38 HD21 LEU 6 3HD2 LEU 6 13.981 11.228 1.450 39 HD22 LEU 6 1HD2 LEU 6 15.333 11.447 0.342 40 HD23 LEU 6 2HD2 LEU 6 14.445 9.897 0.389 41 H ILE 7 H ILE 7 9.752 9.916 -2.084 42 HA ILE 7 HA ILE 7 7.505 9.907 -0.453 43 HB ILE 7 HB ILE 7 7.492 8.828 -3.274 44 HG12 ILE 7 1HG1 ILE 7 8.684 10.990 -3.221 45 HG13 ILE 7 2HG1 ILE 7 7.109 11.063 -4.014 46 HG21 ILE 7 1HG2 ILE 7 5.337 10.061 -1.528 47 HG22 ILE 7 2HG2 ILE 7 5.201 9.773 -3.282 48 HG23 ILE 7 3HG2 ILE 7 5.422 8.416 -2.184 49 HD11 ILE 7 3HD1 ILE 7 7.954 12.078 -1.315 50 HD12 ILE 7 1HD1 ILE 7 7.536 12.988 -2.785 51 HD13 ILE 7 2HD1 ILE 7 6.251 12.121 -1.909 52 H ARG 8 H ARG 8 8.673 7.190 -2.493 53 HA ARG 8 HA ARG 8 6.787 5.341 -1.397 54 HB2 ARG 8 1HB ARG 8 7.895 5.296 -3.685 55 HB3 ARG 8 2HB ARG 8 9.342 4.639 -2.899 56 HG2 ARG 8 1HG ARG 8 8.114 2.651 -2.170 57 HG3 ARG 8 2HG ARG 8 6.569 3.394 -2.623 58 HD2 ARG 8 1HD ARG 8 7.082 1.866 -4.365 59 HD3 ARG 8 2HD ARG 8 7.357 3.503 -4.977 60 HE ARG 8 HE ARG 8 9.621 3.153 -5.115 61 HH11 ARG 8 1HH1 ARG 8 8.402 0.402 -3.209 62 HH12 ARG 8 2HH1 ARG 8 9.707 -0.635 -3.717 63 HH21 ARG 8 1HH2 ARG 8 11.235 1.702 -5.826 64 HH22 ARG 8 2HH2 ARG 8 11.322 0.106 -5.081 65 H ALA 9 H ALA 9 10.160 6.028 -0.647 66 HA ALA 9 HA ALA 9 10.665 3.945 1.161 67 HB1 ALA 9 1HB ALA 9 12.384 5.348 2.097 68 HB2 ALA 9 2HB ALA 9 12.328 5.635 0.365 69 HB3 ALA 9 3HB ALA 9 11.610 6.821 1.478 70 H ALA 10 H ALA 10 8.451 6.738 1.684 71 HA ALA 10 HA ALA 10 8.192 6.256 4.533 72 HB1 ALA 10 1HB ALA 10 6.198 7.530 2.621 73 HB2 ALA 10 2HB ALA 10 6.093 7.502 4.390 74 HB3 ALA 10 3HB ALA 10 7.423 8.361 3.613 75 H PHE 11 H PHE 11 6.547 5.050 1.613 76 HA PHE 11 HA PHE 11 4.349 3.744 2.883 77 HB2 PHE 11 1HB PHE 11 5.718 3.123 0.221 78 HB3 PHE 11 2HB PHE 11 4.282 2.337 0.802 79 HD1 PHE 11 1HD PHE 11 5.268 6.019 0.574 80 HD2 PHE 11 2HD PHE 11 2.463 2.924 -0.498 81 HE1 PHE 11 1HE PHE 11 3.905 7.675 -0.582 82 HE2 PHE 11 2HE PHE 11 1.068 4.616 -1.647 83 HZ PHE 11 HZ PHE 11 1.765 7.002 -1.689 84 H GLU 12 H GLU 12 7.597 2.604 1.855 85 HA GLU 12 HA GLU 12 7.158 -0.051 2.737 86 HB2 GLU 12 1HB GLU 12 9.274 1.363 1.405 87 HB3 GLU 12 2HB GLU 12 10.002 0.632 2.842 88 HG2 GLU 12 1HG GLU 12 8.514 -1.433 2.085 89 HG3 GLU 12 2HG GLU 12 8.642 -0.667 0.493 90 H LYS 13 H LYS 13 8.312 2.759 4.449 91 HA LYS 13 HA LYS 13 9.875 1.652 6.506 92 HB2 LYS 13 1HB LYS 13 9.827 3.924 5.800 93 HB3 LYS 13 2HB LYS 13 8.230 4.181 6.526 94 HG2 LYS 13 1HG LYS 13 9.102 3.883 8.744 95 HG3 LYS 13 2HG LYS 13 10.595 3.144 8.140 96 HD2 LYS 13 1HD LYS 13 10.440 5.641 6.833 97 HD3 LYS 13 2HD LYS 13 9.934 5.985 8.492 98 HE2 LYS 13 1HE LYS 13 12.299 6.326 8.336 99 HE3 LYS 13 2HE LYS 13 12.052 4.857 9.280 100 HZ1 LYS 13 3HZ LYS 13 13.806 4.647 7.610 101 HZ2 LYS 13 1HZ LYS 13 12.748 4.948 6.395 102 HZ3 LYS 13 2HZ LYS 13 12.590 3.579 7.282 103 H ARG 14 H ARG 14 6.420 2.208 6.106 104 HA ARG 14 HA ARG 14 5.951 1.177 8.784 105 HB2 ARG 14 1HB ARG 14 4.843 3.295 7.646 106 HB3 ARG 14 2HB ARG 14 3.720 2.093 7.002 107 HG2 ARG 14 1HG ARG 14 3.115 1.421 9.317 108 HG3 ARG 14 2HG ARG 14 4.390 2.459 9.955 109 HD2 ARG 14 1HD ARG 14 2.684 3.889 10.290 110 HD3 ARG 14 2HD ARG 14 3.055 4.392 8.661 111 HE ARG 14 HE ARG 14 0.688 3.044 9.664 112 HH11 ARG 14 1HH1 ARG 14 2.412 4.006 6.766 113 HH12 ARG 14 2HH1 ARG 14 1.554 2.985 5.681 114 HH21 ARG 14 1HH2 ARG 14 -0.949 2.296 8.196 115 HH22 ARG 14 2HH2 ARG 14 -0.660 2.251 6.486 116 H LEU 15 H LEU 15 5.016 0.370 5.361 117 HA LEU 15 HA LEU 15 3.336 -1.759 6.247 118 HB2 LEU 15 1HB LEU 15 2.971 -0.583 4.112 119 HB3 LEU 15 2HB LEU 15 4.486 -1.237 3.483 120 HG LEU 15 HG LEU 15 3.554 -3.552 3.696 121 HD11 LEU 15 1HD1 LEU 15 1.089 -3.817 4.074 122 HD12 LEU 15 2HD1 LEU 15 1.009 -2.111 4.556 123 HD13 LEU 15 3HD1 LEU 15 1.941 -3.279 5.514 124 HD21 LEU 15 3HD2 LEU 15 2.066 -1.532 2.008 125 HD22 LEU 15 1HD2 LEU 15 1.749 -3.266 1.899 126 HD23 LEU 15 2HD2 LEU 15 3.354 -2.671 1.540 127 H SER 16 H SER 16 6.798 -1.813 5.012 128 HA SER 16 HA SER 16 6.891 -4.682 4.942 129 HB2 SER 16 1HB SER 16 8.968 -2.463 5.100 130 HB3 SER 16 2HB SER 16 9.337 -4.170 5.237 131 HG SER 16 HG SER 16 9.422 -3.241 3.004 132 H ASP 17 H ASP 17 7.611 -2.203 7.408 133 HA ASP 17 HA ASP 17 8.589 -3.976 9.400 134 HB2 ASP 17 1HB ASP 17 8.741 -1.457 9.420 135 HB3 ASP 17 2HB ASP 17 7.038 -1.401 9.886 136 H TRP 18 H TRP 18 5.417 -3.240 8.332 137 HA TRP 18 HA TRP 18 4.028 -4.370 10.716 138 HB2 TRP 18 1HB TRP 18 2.807 -2.687 9.602 139 HB3 TRP 18 2HB TRP 18 3.001 -3.438 8.029 140 HD1 TRP 18 HD TRP 18 0.839 -3.605 11.153 141 HE1 TRP 18 1HE TRP 18 -1.258 -4.975 10.654 142 HE3 TRP 18 3HE TRP 18 2.221 -5.544 6.627 143 HZ2 TRP 18 2HZ TRP 18 -2.076 -6.942 8.699 144 HZ3 TRP 18 3HZ TRP 18 0.795 -7.207 5.496 145 HH2 TRP 18 HH TRP 18 -1.373 -7.912 6.532 146 H ALA 19 H ALA 19 4.804 -5.382 7.383 147 HA ALA 19 HA ALA 19 3.510 -7.878 7.463 148 HB1 ALA 19 1HB ALA 19 6.015 -7.125 5.936 149 HB2 ALA 19 2HB ALA 19 4.961 -8.507 5.630 150 HB3 ALA 19 3HB ALA 19 4.345 -6.852 5.408 151 H LYS 20 H LYS 20 6.857 -7.076 8.486 152 HA LYS 20 HA LYS 20 7.388 -9.814 9.335 153 HB2 LYS 20 1HB LYS 20 9.545 -8.907 10.146 154 HB3 LYS 20 2HB LYS 20 9.200 -8.554 8.469 155 HG2 LYS 20 1HG LYS 20 9.988 -6.498 9.066 156 HG3 LYS 20 2HG LYS 20 8.304 -6.245 9.420 157 HD2 LYS 20 1HD LYS 20 9.011 -5.488 11.416 158 HD3 LYS 20 2HD LYS 20 9.125 -7.199 11.844 159 HE2 LYS 20 1HE LYS 20 11.554 -6.576 10.482 160 HE3 LYS 20 2HE LYS 20 11.206 -5.169 11.496 161 HZ1 LYS 20 3HZ LYS 20 10.985 -6.690 13.369 162 HZ2 LYS 20 1HZ LYS 20 12.501 -6.798 12.697 163 HZ3 LYS 20 2HZ LYS 20 11.380 -7.961 12.411 164 H ALA 21 H ALA 21 6.210 -6.876 10.967 165 HA ALA 21 HA ALA 21 6.651 -7.809 13.651 166 HB1 ALA 21 1HB ALA 21 6.195 -5.446 13.224 167 HB2 ALA 21 2HB ALA 21 4.614 -5.845 12.478 168 HB3 ALA 21 3HB ALA 21 4.886 -6.114 14.205 169 H ARG 22 H ARG 22 4.137 -8.308 11.209 170 HA ARG 22 HA ARG 22 2.159 -9.392 12.825 171 HB2 ARG 22 1HB ARG 22 2.672 -9.272 9.961 172 HB3 ARG 22 2HB ARG 22 2.209 -10.906 10.406 173 HG2 ARG 22 1HG ARG 22 0.249 -9.822 11.694 174 HG3 ARG 22 2HG ARG 22 0.612 -8.347 10.734 175 HD2 ARG 22 1HD ARG 22 0.027 -9.429 8.693 176 HD3 ARG 22 2HD ARG 22 0.287 -11.017 9.369 177 HE ARG 22 HE ARG 22 -1.851 -9.589 10.716 178 HH11 ARG 22 1HH1 ARG 22 -1.299 -11.734 7.924 179 HH12 ARG 22 2HH1 ARG 22 -2.570 -12.834 8.417 180 HH21 ARG 22 1HH2 ARG 22 -3.661 -10.690 10.991 181 HH22 ARG 22 2HH2 ARG 22 -4.083 -12.129 10.124 182 H THR 23 H THR 23 1.679 -11.376 13.538 183 HA THR 23 HA THR 23 3.708 -13.184 14.213 184 HB THR 23 HB THR 23 2.100 -13.139 15.711 185 HG1 THR 23 1HG THR 23 1.090 -14.981 15.870 186 HG21 THR 23 3HG2 THR 23 -0.358 -13.214 15.361 187 HG22 THR 23 1HG2 THR 23 -0.063 -13.053 13.616 188 HG23 THR 23 2HG2 THR 23 0.426 -11.775 14.729 189 HA PRO 24 HA PRO 24 2.708 -16.172 10.670 190 HB2 PRO 24 1HB PRO 24 1.374 -15.222 8.437 191 HB3 PRO 24 2HB PRO 24 0.649 -16.191 9.769 192 HG2 PRO 24 1HG PRO 24 0.612 -13.209 9.324 193 HG3 PRO 24 2HG PRO 24 -0.735 -14.260 9.854 194 HD2 PRO 24 1HD PRO 24 0.693 -12.763 11.594 195 HD3 PRO 24 2HD PRO 24 0.117 -14.411 12.023 196 H ALA 25 H ALA 25 3.483 -12.954 10.450 197 HA ALA 25 HA ALA 25 4.980 -11.676 9.295 198 HB1 ALA 25 1HB ALA 25 6.340 -12.889 10.829 199 HB2 ALA 25 2HB ALA 25 6.636 -14.160 9.611 200 HB3 ALA 25 3HB ALA 25 7.203 -12.482 9.326 201 H LEU 26 H LEU 26 4.310 -11.144 7.288 202 HA LEU 26 HA LEU 26 4.246 -13.295 5.234 203 HB2 LEU 26 1HB LEU 26 2.971 -10.523 5.215 204 HB3 LEU 26 2HB LEU 26 2.865 -11.682 3.904 205 HG LEU 26 HG LEU 26 0.843 -11.865 4.971 206 HD11 LEU 26 1HD1 LEU 26 2.419 -14.146 6.236 207 HD12 LEU 26 2HD1 LEU 26 1.850 -14.102 4.550 208 HD13 LEU 26 3HD1 LEU 26 0.688 -14.107 5.893 209 HD21 LEU 26 3HD2 LEU 26 1.379 -10.651 7.034 210 HD22 LEU 26 1HD2 LEU 26 2.117 -12.133 7.702 211 HD23 LEU 26 2HD2 LEU 26 0.387 -12.096 7.275 212 HA PRO 27 HA PRO 27 7.465 -11.316 2.759 213 HB2 PRO 27 1HB PRO 27 6.775 -12.305 0.275 214 HB3 PRO 27 2HB PRO 27 7.637 -13.276 1.522 215 HG2 PRO 27 1HG PRO 27 4.687 -13.197 0.865 216 HG3 PRO 27 2HG PRO 27 5.733 -14.636 1.124 217 HD2 PRO 27 1HD PRO 27 4.131 -13.661 3.096 218 HD3 PRO 27 2HD PRO 27 5.768 -14.304 3.448 219 H VAL 28 H VAL 28 7.566 -9.469 1.416 220 HA VAL 28 HA VAL 28 4.964 -8.111 0.998 221 HB VAL 28 HB VAL 28 5.981 -7.596 3.095 222 HG11 VAL 28 1HG1 VAL 28 8.007 -6.380 3.448 223 HG12 VAL 28 2HG1 VAL 28 8.333 -7.959 2.756 224 HG13 VAL 28 3HG1 VAL 28 8.435 -6.509 1.728 225 HG21 VAL 28 3HG2 VAL 28 5.772 -5.306 3.189 226 HG22 VAL 28 1HG2 VAL 28 6.243 -5.110 1.509 227 HG23 VAL 28 2HG2 VAL 28 4.688 -5.849 1.904 228 H ALA 29 H ALA 29 5.121 -8.893 -1.209 229 HA ALA 29 HA ALA 29 7.340 -8.245 -2.901 230 HB1 ALA 29 1HB ALA 29 5.929 -9.156 -4.695 231 HB2 ALA 29 2HB ALA 29 5.934 -10.221 -3.275 232 HB3 ALA 29 3HB ALA 29 4.538 -9.187 -3.597 233 H TRP 30 H TRP 30 7.762 -6.071 -3.062 234 HA TRP 30 HA TRP 30 5.768 -4.100 -3.885 235 HB2 TRP 30 1HB TRP 30 8.804 -3.936 -3.598 236 HB3 TRP 30 2HB TRP 30 7.747 -2.574 -3.856 237 HD1 TRP 30 HD TRP 30 9.080 -4.709 -1.049 238 HE1 TRP 30 1HE TRP 30 8.049 -4.002 1.183 239 HE3 TRP 30 3HE TRP 30 5.493 -1.496 -2.798 240 HZ2 TRP 30 2HZ TRP 30 6.109 -2.085 2.096 241 HZ3 TRP 30 3HZ TRP 30 4.113 -0.186 -1.221 242 HH2 TRP 30 HH TRP 30 4.399 -0.457 1.212 243 H GLN 31 H GLN 31 6.468 -2.548 -5.660 244 HA GLN 31 HA GLN 31 6.585 -3.554 -8.284 245 HB2 GLN 31 1HB GLN 31 7.511 -0.904 -7.108 246 HB3 GLN 31 2HB GLN 31 7.526 -1.268 -8.839 247 HG2 GLN 31 1HG GLN 31 5.098 -1.741 -8.781 248 HG3 GLN 31 2HG GLN 31 5.069 -1.279 -7.064 249 HE21 GLN 31 1HE2 GLN 31 5.394 0.956 -6.509 250 HE22 GLN 31 2HE2 GLN 31 5.393 2.225 -7.700 251 H ASN 32 H ASN 32 8.230 -3.845 -9.713 252 HA ASN 32 HA ASN 32 10.073 -4.796 -10.504 253 HB2 ASN 32 1HB ASN 32 11.336 -2.429 -9.122 254 HB3 ASN 32 2HB ASN 32 12.215 -3.525 -10.178 255 HD21 ASN 32 1HD2 ASN 32 10.040 -0.813 -10.142 256 HD22 ASN 32 2HD2 ASN 32 9.957 -0.667 -11.886 257 H THR 33 H THR 33 9.483 -5.287 -7.333 258 HA THR 33 HA THR 33 12.010 -6.668 -6.694 259 HB THR 33 HB THR 33 9.653 -5.878 -4.916 260 HG1 THR 33 1HG THR 33 10.510 -4.004 -5.853 261 HG21 THR 33 3HG2 THR 33 11.205 -7.496 -3.874 262 HG22 THR 33 1HG2 THR 33 11.337 -5.904 -3.124 263 HG23 THR 33 2HG2 THR 33 12.581 -6.445 -4.275 264 H LYS 34 H LYS 34 11.692 -8.890 -5.689 265 HA LYS 34 HA LYS 34 9.108 -10.158 -6.259 266 HB2 LYS 34 1HB LYS 34 11.876 -11.212 -7.025 267 HB3 LYS 34 2HB LYS 34 10.514 -12.267 -6.689 268 HG2 LYS 34 1HG LYS 34 10.069 -12.166 -8.820 269 HG3 LYS 34 2HG LYS 34 9.332 -10.607 -8.505 270 HD2 LYS 34 1HD LYS 34 12.148 -11.137 -9.573 271 HD3 LYS 34 2HD LYS 34 10.735 -10.564 -10.479 272 HE2 LYS 34 1HE LYS 34 10.669 -8.607 -8.832 273 HE3 LYS 34 2HE LYS 34 12.317 -9.083 -8.357 274 HZ1 LYS 34 3HZ LYS 34 11.338 -8.231 -11.005 275 HZ2 LYS 34 1HZ LYS 34 12.863 -8.812 -10.766 276 HZ3 LYS 34 2HZ LYS 34 12.372 -7.407 -10.039 277 H PHE 35 H PHE 35 8.717 -11.823 -4.727 278 HA PHE 35 HA PHE 35 10.615 -12.151 -2.504 279 HB2 PHE 35 1HB PHE 35 7.796 -11.056 -2.311 280 HB3 PHE 35 2HB PHE 35 8.357 -12.222 -1.139 281 HD1 PHE 35 1HD PHE 35 9.507 -8.933 -2.636 282 HD2 PHE 35 2HD PHE 35 9.396 -11.554 0.805 283 HE1 PHE 35 1HE PHE 35 10.515 -7.157 -1.220 284 HE2 PHE 35 2HE PHE 35 10.347 -9.772 2.192 285 HZ PHE 35 HZ PHE 35 10.922 -7.562 1.189 286 H THR 36 H THR 36 10.751 -14.337 -2.195 287 HA THR 36 HA THR 36 8.526 -16.030 -2.341 288 HB THR 36 HB THR 36 9.026 -15.625 -4.777 289 HG1 THR 36 1HG THR 36 7.906 -17.374 -4.539 290 HG21 THR 36 3HG2 THR 36 11.484 -17.290 -4.255 291 HG22 THR 36 1HG2 THR 36 11.431 -15.580 -4.760 292 HG23 THR 36 2HG2 THR 36 10.821 -16.841 -5.846 293 HA PRO 37 HA PRO 37 8.590 -18.751 -2.289 294 HB2 PRO 37 1HB PRO 37 8.241 -20.223 -0.010 295 HB3 PRO 37 2HB PRO 37 9.451 -20.626 -1.265 296 HG2 PRO 37 1HG PRO 37 9.874 -19.067 1.307 297 HG3 PRO 37 2HG PRO 37 10.820 -20.459 0.684 298 HD2 PRO 37 1HD PRO 37 11.639 -17.905 0.279 299 HD3 PRO 37 2HD PRO 37 11.820 -19.125 -1.020 300 HA PRO 38 HA PRO 38 5.525 -16.365 -0.031 301 HB2 PRO 38 1HB PRO 38 3.441 -18.108 0.311 302 HB3 PRO 38 2HB PRO 38 3.787 -17.248 -1.230 303 HG2 PRO 38 1HG PRO 38 4.480 -20.079 -0.467 304 HG3 PRO 38 2HG PRO 38 3.878 -19.471 -2.035 305 HD2 PRO 38 1HD PRO 38 6.526 -20.000 -1.565 306 HD3 PRO 38 2HD PRO 38 6.001 -18.677 -2.646 307 H ALA 39 H ALA 39 4.045 -16.738 2.036 308 HA ALA 39 HA ALA 39 5.508 -18.191 4.118 309 HB1 ALA 39 1HB ALA 39 3.316 -16.075 4.312 310 HB2 ALA 39 2HB ALA 39 3.999 -16.974 5.685 311 HB3 ALA 39 3HB ALA 39 5.031 -15.881 4.770 312 H ALA 40 H ALA 40 4.946 -19.998 2.971 313 HA ALA 40 HA ALA 40 3.827 -22.036 2.831 314 HB1 ALA 40 1HB ALA 40 3.538 -21.602 5.296 315 HB2 ALA 40 2HB ALA 40 1.931 -20.942 4.941 316 HB3 ALA 40 3HB ALA 40 2.287 -22.635 4.578 317 H GLY 41 H GLY 41 2.993 -19.788 1.107 318 HA2 GLY 41 2HA GLY 41 1.595 -19.927 -0.798 319 HA3 GLY 41 1HA GLY 41 0.422 -20.900 0.097 320 H VAL 42 H VAL 42 1.227 -18.528 2.209 321 HA VAL 42 HA VAL 42 -0.853 -16.611 1.360 322 HB VAL 42 HB VAL 42 0.796 -16.631 3.931 323 HG11 VAL 42 1HG1 VAL 42 -0.282 -14.498 3.384 324 HG12 VAL 42 2HG1 VAL 42 -1.834 -15.333 3.171 325 HG13 VAL 42 3HG1 VAL 42 -1.068 -15.254 4.773 326 HG21 VAL 42 3HG2 VAL 42 -0.473 -18.771 3.874 327 HG22 VAL 42 1HG2 VAL 42 -1.145 -17.651 5.056 328 HG23 VAL 42 2HG2 VAL 42 -1.963 -17.861 3.506 329 H TYR 43 H TYR 43 -0.186 -14.615 0.493 330 HA TYR 43 HA TYR 43 2.336 -13.481 1.189 331 HB2 TYR 43 1HB TYR 43 3.302 -13.312 -1.072 332 HB3 TYR 43 2HB TYR 43 3.320 -14.920 -0.426 333 HD1 TYR 43 2HD TYR 43 1.283 -16.529 -1.211 334 HD2 TYR 43 1HD TYR 43 2.840 -13.117 -3.346 335 HE1 TYR 43 2HE TYR 43 0.253 -17.359 -3.273 336 HE2 TYR 43 1HE TYR 43 1.977 -14.090 -5.451 337 HH TYR 43 HH TYR 43 -0.222 -16.907 -5.530 338 H LEU 44 H LEU 44 2.621 -11.359 -0.304 339 HA LEU 44 HA LEU 44 -0.040 -10.117 -0.722 340 HB2 LEU 44 1HB LEU 44 2.177 -9.200 1.144 341 HB3 LEU 44 2HB LEU 44 0.914 -8.129 0.557 342 HG LEU 44 HG LEU 44 0.229 -10.676 2.044 343 HD11 LEU 44 1HD1 LEU 44 0.068 -9.399 4.091 344 HD12 LEU 44 2HD1 LEU 44 0.614 -7.925 3.260 345 HD13 LEU 44 3HD1 LEU 44 1.723 -9.295 3.469 346 HD21 LEU 44 3HD2 LEU 44 -1.872 -9.606 2.448 347 HD22 LEU 44 1HD2 LEU 44 -1.549 -9.455 0.716 348 HD23 LEU 44 2HD2 LEU 44 -1.300 -8.058 1.773 349 H ARG 45 H ARG 45 0.048 -9.449 -2.745 350 HA ARG 45 HA ARG 45 2.557 -8.319 -3.924 351 HB2 ARG 45 1HB ARG 45 -0.101 -9.284 -5.075 352 HB3 ARG 45 2HB ARG 45 0.966 -8.207 -5.973 353 HG2 ARG 45 1HG ARG 45 2.298 -9.871 -6.621 354 HG3 ARG 45 2HG ARG 45 2.586 -10.372 -4.968 355 HD2 ARG 45 1HD ARG 45 1.773 -12.210 -6.267 356 HD3 ARG 45 2HD ARG 45 0.592 -11.812 -4.997 357 HE ARG 45 HE ARG 45 -0.329 -10.436 -7.176 358 HH11 ARG 45 1HH1 ARG 45 0.248 -13.952 -6.560 359 HH12 ARG 45 2HH1 ARG 45 -0.851 -14.417 -7.785 360 HH21 ARG 45 1HH2 ARG 45 -1.886 -11.107 -8.528 361 HH22 ARG 45 2HH2 ARG 45 -2.320 -12.789 -8.717 362 H ALA 46 H ALA 46 2.794 -6.123 -3.796 363 HA ALA 46 HA ALA 46 0.388 -4.474 -3.152 364 HB1 ALA 46 1HB ALA 46 1.965 -3.262 -1.595 365 HB2 ALA 46 2HB ALA 46 1.584 -4.917 -1.119 366 HB3 ALA 46 3HB ALA 46 3.133 -4.518 -1.917 367 H TYR 47 H TYR 47 0.067 -3.272 -4.890 368 HA TYR 47 HA TYR 47 2.368 -2.288 -6.454 369 HB2 TYR 47 1HB TYR 47 0.692 -3.744 -7.601 370 HB3 TYR 47 2HB TYR 47 -0.543 -2.549 -7.226 371 HD1 TYR 47 1HD TYR 47 2.816 -1.304 -8.216 372 HD2 TYR 47 2HD TYR 47 -1.103 -2.432 -9.614 373 HE1 TYR 47 1HE TYR 47 3.169 0.065 -10.155 374 HE2 TYR 47 2HE TYR 47 -0.717 -1.090 -11.685 375 HH TYR 47 HH TYR 47 0.815 0.466 -12.832 376 H VAL 48 H VAL 48 2.907 -0.322 -5.908 377 HA VAL 48 HA VAL 48 0.995 1.721 -4.954 378 HB VAL 48 HB VAL 48 3.862 2.356 -5.656 379 HG11 VAL 48 1HG1 VAL 48 3.588 3.863 -3.696 380 HG12 VAL 48 2HG1 VAL 48 2.411 4.171 -4.982 381 HG13 VAL 48 3HG1 VAL 48 1.924 3.286 -3.514 382 HG21 VAL 48 3HG2 VAL 48 4.229 0.339 -4.308 383 HG22 VAL 48 1HG2 VAL 48 4.679 1.791 -3.414 384 HG23 VAL 48 2HG2 VAL 48 3.158 0.977 -3.046 385 H MET 49 H MET 49 0.224 3.342 -6.362 386 HA MET 49 HA MET 49 1.092 3.242 -9.205 387 HB2 MET 49 1HB MET 49 -1.585 2.853 -7.985 388 HB3 MET 49 2HB MET 49 -1.501 3.847 -9.460 389 HG2 MET 49 1HG MET 49 -0.409 2.137 -10.693 390 HG3 MET 49 2HG MET 49 -0.150 1.148 -9.254 391 HE1 MET 49 3HE MET 49 -1.552 -0.411 -8.257 392 HE2 MET 49 1HE MET 49 -2.750 0.739 -7.687 393 HE3 MET 49 2HE MET 49 -3.270 -0.718 -8.559 394 HA PRO 50 HA PRO 50 1.471 7.547 -7.654 395 HB2 PRO 50 1HB PRO 50 3.558 8.305 -9.251 396 HB3 PRO 50 2HB PRO 50 3.776 7.330 -7.770 397 HG2 PRO 50 1HG PRO 50 3.583 6.320 -10.620 398 HG3 PRO 50 2HG PRO 50 4.840 5.950 -9.388 399 HD2 PRO 50 1HD PRO 50 2.743 4.304 -9.796 400 HD3 PRO 50 2HD PRO 50 3.367 4.588 -8.147 401 H ALA 51 H ALA 51 1.279 9.600 -8.841 402 HA ALA 51 HA ALA 51 -0.293 9.559 -11.328 403 HB1 ALA 51 1HB ALA 51 0.180 12.089 -11.190 404 HB2 ALA 51 2HB ALA 51 -0.824 11.406 -9.916 405 HB3 ALA 51 3HB ALA 51 0.884 11.756 -9.584 406 H ALA 52 H ALA 52 0.495 9.993 -13.350 407 HA ALA 52 HA ALA 52 3.287 10.807 -13.773 408 HB1 ALA 52 1HB ALA 52 2.042 8.297 -15.000 409 HB2 ALA 52 2HB ALA 52 3.606 9.006 -15.431 410 HB3 ALA 52 3HB ALA 52 3.366 8.347 -13.806 411 H THR 53 H THR 53 2.652 12.764 -14.628 412 HA THR 53 HA THR 53 0.292 13.108 -16.273 413 HB THR 53 HB THR 53 1.099 15.430 -16.423 414 HG1 THR 53 1HG THR 53 3.077 15.992 -15.449 415 HG21 THR 53 3HG2 THR 53 1.561 14.393 -13.582 416 HG22 THR 53 1HG2 THR 53 -0.029 14.691 -14.303 417 HG23 THR 53 2HG2 THR 53 1.093 16.032 -14.066 418 H ILE 54 H ILE 54 0.962 14.579 -18.450 419 HA ILE 54 HA ILE 54 2.954 12.956 -19.958 420 HB ILE 54 HB ILE 54 1.380 15.140 -21.259 421 HG12 ILE 54 1HG1 ILE 54 0.226 12.387 -20.635 422 HG13 ILE 54 2HG1 ILE 54 -0.392 13.940 -20.076 423 HG21 ILE 54 1HG2 ILE 54 3.209 13.848 -22.441 424 HG22 ILE 54 2HG2 ILE 54 2.299 12.367 -22.163 425 HG23 ILE 54 3HG2 ILE 54 1.649 13.646 -23.226 426 HD11 ILE 54 3HD1 ILE 54 -1.830 13.249 -21.796 427 HD12 ILE 54 1HD1 ILE 54 -0.850 14.572 -22.464 428 HD13 ILE 54 2HD1 ILE 54 -0.496 12.868 -22.887 429 H SER 55 H SER 55 3.365 15.042 -17.841 430 HA SER 55 HA SER 55 4.647 16.884 -17.368 431 HB2 SER 55 1HB SER 55 6.275 15.095 -18.286 432 HB3 SER 55 2HB SER 55 6.364 16.096 -19.726 433 HG SER 55 HG SER 55 7.974 16.620 -18.170 434 H ARG 56 H ARG 56 6.135 18.514 -19.411 435 HA ARG 56 HA ARG 56 5.845 20.540 -20.302 436 HB2 ARG 56 1HB ARG 56 4.076 18.804 -21.963 437 HB3 ARG 56 2HB ARG 56 3.879 20.529 -22.146 438 HG2 ARG 56 1HG ARG 56 6.619 19.259 -22.321 439 HG3 ARG 56 2HG ARG 56 5.529 19.312 -23.699 440 HD2 ARG 56 1HD ARG 56 6.424 21.741 -22.121 441 HD3 ARG 56 2HD ARG 56 7.196 21.180 -23.619 442 HE ARG 56 HE ARG 56 4.676 21.362 -24.450 443 HH11 ARG 56 1HH1 ARG 56 6.729 23.810 -22.871 444 HH12 ARG 56 2HH1 ARG 56 5.524 25.060 -22.950 445 HH21 ARG 56 1HH2 ARG 56 3.312 23.124 -24.960 446 HH22 ARG 56 2HH2 ARG 56 3.680 24.718 -24.426 447 H ASP 57 H ASP 57 5.298 22.038 -18.895 448 HA ASP 57 HA ASP 57 2.444 22.654 -18.490 449 HB2 ASP 57 1HB ASP 57 4.484 22.300 -16.264 450 HB3 ASP 57 2HB ASP 57 2.884 23.026 -16.070 451 H ALA 58 H ALA 58 2.666 24.986 -17.101 452 HA ALA 58 HA ALA 58 4.568 26.628 -18.696 453 HB1 ALA 58 1HB ALA 58 2.779 28.273 -19.001 454 HB2 ALA 58 2HB ALA 58 2.228 26.703 -19.600 455 HB3 ALA 58 3HB ALA 58 1.673 27.304 -18.016 456 H ALA 59 H ALA 59 4.261 25.686 -15.817 457 HA ALA 59 HA ALA 59 5.851 27.769 -14.770 458 HB1 ALA 59 1HB ALA 59 4.601 28.164 -12.635 459 HB2 ALA 59 2HB ALA 59 3.737 28.778 -14.049 460 HB3 ALA 59 3HB ALA 59 3.217 27.267 -13.294 461 H GLY 60 H GLY 60 6.070 26.782 -12.134 462 HA2 GLY 60 2HA GLY 60 6.496 23.860 -12.453 463 HA3 GLY 60 1HA GLY 60 7.828 24.904 -11.906 464 H ASP 61 H ASP 61 4.307 25.097 -11.161 465 HA ASP 61 HA ASP 61 4.688 24.408 -8.333 466 HB2 ASP 61 1HB ASP 61 5.315 26.709 -8.197 467 HB3 ASP 61 2HB ASP 61 4.131 27.162 -9.431 468 H HIS 62 H HIS 62 3.055 22.976 -8.260 469 HA HIS 62 HA HIS 62 0.394 23.513 -8.572 470 HB2 HIS 62 1HB HIS 62 1.587 23.145 -11.185 471 HB3 HIS 62 2HB HIS 62 0.713 21.698 -10.866 472 HD1 HIS 62 1HD HIS 62 -0.217 25.445 -10.152 473 HD2 HIS 62 2HD HIS 62 -1.620 21.863 -11.928 474 HE1 HIS 62 1HE HIS 62 -2.554 25.939 -11.012 475 H ARG 63 H ARG 63 -0.809 21.255 -8.943 476 HA ARG 63 HA ARG 63 -1.041 19.029 -8.954 477 HB2 ARG 63 1HB ARG 63 1.181 19.366 -10.320 478 HB3 ARG 63 2HB ARG 63 1.950 18.691 -8.894 479 HG2 ARG 63 1HG ARG 63 -0.142 16.904 -9.608 480 HG3 ARG 63 2HG ARG 63 0.595 17.379 -11.121 481 HD2 ARG 63 1HD ARG 63 2.602 16.700 -8.997 482 HD3 ARG 63 2HD ARG 63 1.471 15.410 -9.377 483 HE ARG 63 HE ARG 63 2.722 14.937 -11.156 484 HH11 ARG 63 1HH1 ARG 63 3.285 18.500 -10.728 485 HH12 ARG 63 2HH1 ARG 63 4.076 18.608 -12.217 486 HH21 ARG 63 1HH2 ARG 63 4.022 15.138 -12.984 487 HH22 ARG 63 2HH2 ARG 63 4.436 16.727 -13.541 488 H GLN 64 H GLN 64 -0.541 16.959 -7.688 489 HA GLN 64 HA GLN 64 0.097 17.484 -4.831 490 HB2 GLN 64 1HB GLN 64 -2.478 17.072 -6.263 491 HB3 GLN 64 2HB GLN 64 -2.212 15.805 -5.100 492 HG2 GLN 64 1HG GLN 64 -1.648 18.618 -4.179 493 HG3 GLN 64 2HG GLN 64 -3.317 18.253 -4.567 494 HE21 GLN 64 1HE2 GLN 64 -4.584 17.495 -2.969 495 HE22 GLN 64 2HE2 GLN 64 -3.899 16.619 -1.568 496 H TYR 65 H TYR 65 1.054 15.913 -7.238 497 HA TYR 65 HA TYR 65 1.320 13.831 -7.997 498 HB2 TYR 65 1HB TYR 65 3.333 14.919 -6.843 499 HB3 TYR 65 2HB TYR 65 3.111 13.689 -5.593 500 HD1 TYR 65 1HD TYR 65 2.761 13.451 -9.340 501 HD2 TYR 65 2HD TYR 65 4.984 12.275 -5.827 502 HE1 TYR 65 1HE TYR 65 4.268 12.117 -10.755 503 HE2 TYR 65 2HE TYR 65 6.430 10.854 -7.207 504 HH TYR 65 HH TYR 65 6.003 10.635 -10.790 505 H ARG 66 H ARG 66 -0.888 13.452 -7.333 506 HA ARG 66 HA ARG 66 -1.109 11.546 -5.081 507 HB2 ARG 66 1HB ARG 66 -3.500 11.645 -5.270 508 HB3 ARG 66 2HB ARG 66 -2.795 13.231 -5.147 509 HG2 ARG 66 1HG ARG 66 -4.519 13.500 -6.505 510 HG3 ARG 66 2HG ARG 66 -3.206 13.437 -7.672 511 HD2 ARG 66 1HD ARG 66 -4.474 10.823 -7.050 512 HD3 ARG 66 2HD ARG 66 -5.566 11.995 -7.800 513 HE ARG 66 HE ARG 66 -3.609 12.249 -9.525 514 HH11 ARG 66 1HH1 ARG 66 -4.898 9.158 -8.298 515 HH12 ARG 66 2HH1 ARG 66 -4.198 8.243 -9.598 516 HH21 ARG 66 1HH2 ARG 66 -2.966 11.134 -11.270 517 HH22 ARG 66 2HH2 ARG 66 -2.996 9.380 -11.301 518 H GLY 67 H GLY 67 -2.666 9.557 -5.298 519 HA2 GLY 67 2HA GLY 67 -2.350 8.122 -7.806 520 HA3 GLY 67 1HA GLY 67 -1.138 7.749 -6.588 521 H VAL 68 H VAL 68 -2.213 5.615 -6.830 522 HA VAL 68 HA VAL 68 -4.086 5.306 -4.591 523 HB VAL 68 HB VAL 68 -5.393 5.119 -6.672 524 HG11 VAL 68 1HG1 VAL 68 -3.626 4.248 -8.181 525 HG12 VAL 68 2HG1 VAL 68 -3.737 2.675 -7.350 526 HG13 VAL 68 3HG1 VAL 68 -5.123 3.312 -8.249 527 HG21 VAL 68 3HG2 VAL 68 -6.488 2.973 -6.342 528 HG22 VAL 68 1HG2 VAL 68 -5.220 2.437 -5.242 529 HG23 VAL 68 2HG2 VAL 68 -6.252 3.838 -4.835 530 H PHE 69 H PHE 69 -3.856 3.020 -3.720 531 HA PHE 69 HA PHE 69 -1.409 1.631 -4.522 532 HB2 PHE 69 1HB PHE 69 -0.503 2.795 -2.679 533 HB3 PHE 69 2HB PHE 69 -1.989 2.713 -1.755 534 HD1 PHE 69 2HD PHE 69 -2.728 0.601 -0.649 535 HD2 PHE 69 1HD PHE 69 1.023 0.940 -2.739 536 HE1 PHE 69 2HE PHE 69 -2.040 -1.620 0.221 537 HE2 PHE 69 1HE PHE 69 1.778 -1.191 -1.763 538 HZ PHE 69 HZ PHE 69 0.208 -2.521 -0.303 539 H GLN 70 H GLN 70 -1.708 -0.574 -4.393 540 HA GLN 70 HA GLN 70 -4.458 -1.548 -3.832 541 HB2 GLN 70 1HB GLN 70 -2.818 -1.277 -6.342 542 HB3 GLN 70 2HB GLN 70 -3.747 -2.716 -6.252 543 HG2 GLN 70 1HG GLN 70 -5.340 -0.297 -5.474 544 HG3 GLN 70 2HG GLN 70 -4.664 -0.125 -7.039 545 HE21 GLN 70 1HE2 GLN 70 -5.774 -3.198 -5.613 546 HE22 GLN 70 2HE2 GLN 70 -7.159 -3.406 -6.683 547 H VAL 71 H VAL 71 -4.313 -3.490 -2.700 548 HA VAL 71 HA VAL 71 -1.798 -5.056 -2.949 549 HB VAL 71 HB VAL 71 -1.697 -3.995 -0.830 550 HG11 VAL 71 1HG1 VAL 71 -4.467 -5.074 -0.195 551 HG12 VAL 71 2HG1 VAL 71 -3.389 -4.234 0.935 552 HG13 VAL 71 3HG1 VAL 71 -4.039 -3.363 -0.453 553 HG21 VAL 71 3HG2 VAL 71 -1.591 -5.872 0.702 554 HG22 VAL 71 1HG2 VAL 71 -2.608 -6.866 -0.344 555 HG23 VAL 71 2HG2 VAL 71 -0.981 -6.364 -0.878 556 H ASN 72 H ASN 72 -2.074 -7.300 -3.042 557 HA ASN 72 HA ASN 72 -4.886 -8.253 -3.118 558 HB2 ASN 72 1HB ASN 72 -2.891 -8.505 -5.237 559 HB3 ASN 72 2HB ASN 72 -3.314 -10.079 -4.594 560 HD21 ASN 72 1HD2 ASN 72 -4.380 -7.954 -6.978 561 HD22 ASN 72 2HD2 ASN 72 -6.092 -8.203 -6.805 562 H VAL 73 H VAL 73 -5.286 -9.320 -1.425 563 HA VAL 73 HA VAL 73 -3.223 -10.681 0.178 564 HB VAL 73 HB VAL 73 -6.213 -10.291 0.599 565 HG11 VAL 73 1HG1 VAL 73 -5.781 -10.905 2.914 566 HG12 VAL 73 2HG1 VAL 73 -5.350 -12.241 1.837 567 HG13 VAL 73 3HG1 VAL 73 -4.077 -11.221 2.548 568 HG21 VAL 73 3HG2 VAL 73 -3.917 -8.769 1.894 569 HG22 VAL 73 1HG2 VAL 73 -5.009 -8.111 0.670 570 HG23 VAL 73 2HG2 VAL 73 -5.645 -8.599 2.246 571 H VAL 74 H VAL 74 -2.638 -12.552 -0.765 572 HA VAL 74 HA VAL 74 -4.749 -14.394 -1.751 573 HB VAL 74 HB VAL 74 -3.374 -13.891 -3.529 574 HG11 VAL 74 1HG1 VAL 74 -0.890 -14.275 -1.844 575 HG12 VAL 74 2HG1 VAL 74 -0.921 -13.990 -3.591 576 HG13 VAL 74 3HG1 VAL 74 -1.485 -12.731 -2.502 577 HG21 VAL 74 3HG2 VAL 74 -2.313 -15.952 -4.150 578 HG22 VAL 74 1HG2 VAL 74 -2.187 -16.462 -2.458 579 HG23 VAL 74 2HG2 VAL 74 -3.783 -16.292 -3.232 580 H MET 75 H MET 75 -4.959 -16.337 -0.752 581 HA MET 75 HA MET 75 -2.962 -17.339 1.034 582 HB2 MET 75 1HB MET 75 -4.948 -17.702 2.811 583 HB3 MET 75 2HB MET 75 -3.818 -16.389 2.829 584 HG2 MET 75 1HG MET 75 -5.825 -15.474 3.380 585 HG3 MET 75 2HG MET 75 -5.453 -14.882 1.787 586 HE1 MET 75 3HE MET 75 -8.627 -15.290 0.011 587 HE2 MET 75 1HE MET 75 -7.210 -14.317 0.393 588 HE3 MET 75 2HE MET 75 -7.022 -15.858 -0.476 589 HA PRO 76 HA PRO 76 -4.258 -20.858 -1.057 590 HB2 PRO 76 1HB PRO 76 -3.442 -22.922 0.517 591 HB3 PRO 76 2HB PRO 76 -2.270 -21.733 -0.116 592 HG2 PRO 76 1HG PRO 76 -3.564 -21.755 2.621 593 HG3 PRO 76 2HG PRO 76 -1.826 -21.592 2.223 594 HD2 PRO 76 1HD PRO 76 -3.430 -19.441 2.695 595 HD3 PRO 76 2HD PRO 76 -2.098 -19.378 1.501 596 H ILE 77 H ILE 77 -5.879 -22.560 -1.201 597 HA ILE 77 HA ILE 77 -8.023 -22.361 0.819 598 HB ILE 77 HB ILE 77 -8.009 -24.042 -1.705 599 HG12 ILE 77 1HG1 ILE 77 -9.222 -21.316 -1.108 600 HG13 ILE 77 2HG1 ILE 77 -7.825 -21.551 -2.123 601 HG21 ILE 77 1HG2 ILE 77 -10.244 -23.121 0.215 602 HG22 ILE 77 2HG2 ILE 77 -10.474 -24.082 -1.260 603 HG23 ILE 77 3HG2 ILE 77 -9.613 -24.783 0.089 604 HD11 ILE 77 3HD1 ILE 77 -10.639 -22.455 -2.757 605 HD12 ILE 77 1HD1 ILE 77 -9.731 -21.150 -3.514 606 HD13 ILE 77 2HD1 ILE 77 -9.205 -22.836 -3.749 607 H GLY 78 H GLY 78 -6.700 -23.091 2.517 608 HA2 GLY 78 2HA GLY 78 -5.857 -25.855 2.760 609 HA3 GLY 78 1HA GLY 78 -6.061 -24.683 4.068 610 H ASP 79 H ASP 79 -8.818 -25.178 2.024 611 HA ASP 79 HA ASP 79 -10.918 -25.301 2.466 612 HB2 ASP 79 1HB ASP 79 -10.708 -27.651 2.626 613 HB3 ASP 79 2HB ASP 79 -10.130 -27.519 4.289 614 H GLY 80 H GLY 80 -12.191 -23.921 3.467 615 HA2 GLY 80 2HA GLY 80 -13.041 -22.500 5.078 616 HA3 GLY 80 1HA GLY 80 -12.220 -23.478 6.289 617 H SER 81 H SER 81 -10.177 -22.178 3.853 618 HA SER 81 HA SER 81 -8.821 -20.401 5.712 619 HB2 SER 81 1HB SER 81 -7.654 -21.803 4.066 620 HB3 SER 81 2HB SER 81 -8.412 -20.895 2.740 621 HG SER 81 HG SER 81 -6.459 -20.115 3.015 622 H ARG 82 H ARG 82 -9.966 -18.658 6.232 623 HA ARG 82 HA ARG 82 -11.249 -16.977 4.120 624 HB2 ARG 82 1HB ARG 82 -12.034 -17.694 6.965 625 HB3 ARG 82 2HB ARG 82 -12.519 -16.151 6.313 626 HG2 ARG 82 1HG ARG 82 -14.332 -17.554 5.929 627 HG3 ARG 82 2HG ARG 82 -13.585 -17.325 4.348 628 HD2 ARG 82 1HD ARG 82 -12.586 -19.562 4.444 629 HD3 ARG 82 2HD ARG 82 -13.119 -19.741 6.133 630 HE ARG 82 HE ARG 82 -14.822 -19.672 3.687 631 HH11 ARG 82 1HH1 ARG 82 -14.420 -20.917 7.096 632 HH12 ARG 82 2HH1 ARG 82 -15.922 -21.766 6.936 633 HH21 ARG 82 1HH2 ARG 82 -16.973 -20.511 3.888 634 HH22 ARG 82 2HH2 ARG 82 -17.257 -21.633 5.203 635 H SER 83 H SER 83 -8.337 -17.087 5.469 636 HA SER 83 HA SER 83 -8.078 -15.064 7.283 637 HB2 SER 83 1HB SER 83 -5.761 -15.203 5.530 638 HB3 SER 83 2HB SER 83 -5.908 -15.653 7.218 639 HG SER 83 HG SER 83 -5.296 -17.250 5.653 640 H ALA 84 H ALA 84 -8.644 -14.529 3.934 641 HA ALA 84 HA ALA 84 -7.478 -12.097 3.265 642 HB1 ALA 84 1HB ALA 84 -9.665 -11.731 2.023 643 HB2 ALA 84 2HB ALA 84 -8.890 -13.298 1.717 644 HB3 ALA 84 3HB ALA 84 -10.293 -13.184 2.805 645 H GLU 85 H GLU 85 -10.300 -12.699 5.367 646 HA GLU 85 HA GLU 85 -11.055 -9.966 5.761 647 HB2 GLU 85 1HB GLU 85 -11.522 -12.572 7.294 648 HB3 GLU 85 2HB GLU 85 -12.216 -11.027 7.781 649 HG2 GLU 85 1HG GLU 85 -13.119 -10.836 5.377 650 HG3 GLU 85 2HG GLU 85 -12.651 -12.499 5.166 651 H GLN 86 H GLN 86 -9.307 -12.222 7.933 652 HA GLN 86 HA GLN 86 -8.673 -10.495 9.996 653 HB2 GLN 86 1HB GLN 86 -7.837 -13.088 9.030 654 HB3 GLN 86 2HB GLN 86 -6.369 -12.204 9.399 655 HG2 GLN 86 1HG GLN 86 -8.630 -12.184 11.402 656 HG3 GLN 86 2HG GLN 86 -7.702 -13.648 11.186 657 HE21 GLN 86 1HE2 GLN 86 -7.785 -10.665 12.880 658 HE22 GLN 86 2HE2 GLN 86 -6.158 -10.801 13.550 659 H VAL 87 H VAL 87 -6.883 -10.968 6.948 660 HA VAL 87 HA VAL 87 -4.863 -9.000 7.611 661 HB VAL 87 HB VAL 87 -5.707 -10.403 5.035 662 HG11 VAL 87 1HG1 VAL 87 -3.372 -8.515 5.519 663 HG12 VAL 87 2HG1 VAL 87 -3.433 -9.670 4.165 664 HG13 VAL 87 3HG1 VAL 87 -4.647 -8.395 4.292 665 HG21 VAL 87 3HG2 VAL 87 -3.501 -10.792 7.060 666 HG22 VAL 87 1HG2 VAL 87 -4.780 -11.936 6.669 667 HG23 VAL 87 2HG2 VAL 87 -3.484 -11.621 5.498 668 H ALA 88 H ALA 88 -7.891 -8.737 5.647 669 HA ALA 88 HA ALA 88 -7.469 -6.056 4.864 670 HB1 ALA 88 1HB ALA 88 -10.083 -7.458 5.597 671 HB2 ALA 88 2HB ALA 88 -9.920 -5.984 4.633 672 HB3 ALA 88 3HB ALA 88 -9.291 -7.512 4.008 673 H ALA 89 H ALA 89 -8.693 -7.461 7.885 674 HA ALA 89 HA ALA 89 -9.532 -4.945 9.018 675 HB1 ALA 89 1HB ALA 89 -10.581 -7.179 9.454 676 HB2 ALA 89 2HB ALA 89 -9.125 -7.646 10.365 677 HB3 ALA 89 3HB ALA 89 -10.145 -6.298 10.919 678 H GLU 90 H GLU 90 -6.650 -7.067 9.506 679 HA GLU 90 HA GLU 90 -5.475 -5.459 11.579 680 HB2 GLU 90 1HB GLU 90 -4.211 -7.334 9.536 681 HB3 GLU 90 2HB GLU 90 -3.330 -6.565 10.859 682 HG2 GLU 90 1HG GLU 90 -5.662 -7.812 12.010 683 HG3 GLU 90 2HG GLU 90 -4.978 -8.953 10.879 684 H LEU 91 H LEU 91 -5.232 -5.387 8.016 685 HA LEU 91 HA LEU 91 -3.332 -3.202 7.965 686 HB2 LEU 91 1HB LEU 91 -5.224 -4.410 5.914 687 HB3 LEU 91 2HB LEU 91 -4.242 -3.002 5.526 688 HG LEU 91 HG LEU 91 -2.970 -5.521 6.629 689 HD11 LEU 91 1HD1 LEU 91 -2.521 -6.246 4.328 690 HD12 LEU 91 2HD1 LEU 91 -3.545 -4.920 3.711 691 HD13 LEU 91 3HD1 LEU 91 -4.249 -6.217 4.709 692 HD21 LEU 91 3HD2 LEU 91 -1.924 -3.232 4.896 693 HD22 LEU 91 1HD2 LEU 91 -0.981 -4.650 5.410 694 HD23 LEU 91 2HD2 LEU 91 -1.555 -3.502 6.616 695 H ASP 92 H ASP 92 -6.886 -3.369 8.216 696 HA ASP 92 HA ASP 92 -7.385 -0.592 7.590 697 HB2 ASP 92 1HB ASP 92 -9.279 -2.017 7.555 698 HB3 ASP 92 2HB ASP 92 -8.897 -2.712 9.119 699 H ALA 93 H ALA 93 -6.828 -2.358 10.662 700 HA ALA 93 HA ALA 93 -6.892 -0.147 12.406 701 HB1 ALA 93 1HB ALA 93 -5.257 -2.728 12.511 702 HB2 ALA 93 2HB ALA 93 -5.449 -1.605 13.857 703 HB3 ALA 93 3HB ALA 93 -6.869 -2.452 13.212 704 H LEU 94 H LEU 94 -4.249 -1.419 10.359 705 HA LEU 94 HA LEU 94 -2.375 0.482 11.419 706 HB2 LEU 94 1HB LEU 94 -1.813 -1.792 10.393 707 HB3 LEU 94 2HB LEU 94 -2.047 -1.040 8.827 708 HG LEU 94 HG LEU 94 -0.268 0.742 9.711 709 HD11 LEU 94 1HD1 LEU 94 1.364 -0.211 11.289 710 HD12 LEU 94 2HD1 LEU 94 0.262 -1.578 11.581 711 HD13 LEU 94 3HD1 LEU 94 -0.220 0.058 12.040 712 HD21 LEU 94 3HD2 LEU 94 1.611 -0.772 9.009 713 HD22 LEU 94 1HD2 LEU 94 0.305 -0.510 7.862 714 HD23 LEU 94 2HD2 LEU 94 0.364 -2.026 8.771 715 H PHE 95 H PHE 95 -4.830 0.864 8.872 716 HA PHE 95 HA PHE 95 -3.318 3.221 7.848 717 HB2 PHE 95 1HB PHE 95 -4.952 1.218 6.281 718 HB3 PHE 95 2HB PHE 95 -4.610 2.837 5.713 719 HD1 PHE 95 2HD PHE 95 -2.748 -0.183 6.992 720 HD2 PHE 95 1HD PHE 95 -2.815 3.152 4.257 721 HE1 PHE 95 2HE PHE 95 -0.676 -1.008 5.945 722 HE2 PHE 95 1HE PHE 95 -0.726 2.327 3.245 723 HZ PHE 95 HZ PHE 95 0.406 0.309 4.131 724 HA PRO 96 HA PRO 96 -7.274 4.962 9.447 725 HB2 PRO 96 1HB PRO 96 -6.234 7.170 10.695 726 HB3 PRO 96 2HB PRO 96 -6.296 5.555 11.472 727 HG2 PRO 96 1HG PRO 96 -3.967 6.817 9.964 728 HG3 PRO 96 2HG PRO 96 -3.939 6.090 11.597 729 HD2 PRO 96 1HD PRO 96 -3.193 4.670 9.436 730 HD3 PRO 96 2HD PRO 96 -4.160 3.893 10.722 731 H VAL 97 H VAL 97 -8.300 7.006 8.794 732 HA VAL 97 HA VAL 97 -7.711 7.618 6.101 733 HB VAL 97 HB VAL 97 -9.926 7.498 7.324 734 HG11 VAL 97 1HG1 VAL 97 -9.252 9.169 9.128 735 HG12 VAL 97 2HG1 VAL 97 -9.462 10.440 7.919 736 HG13 VAL 97 3HG1 VAL 97 -10.834 9.397 8.365 737 HG21 VAL 97 3HG2 VAL 97 -9.721 8.295 4.973 738 HG22 VAL 97 1HG2 VAL 97 -11.116 8.942 5.844 739 HG23 VAL 97 2HG2 VAL 97 -9.676 9.952 5.573 740 H ASN 98 H ASN 98 -6.190 8.899 8.688 741 HA ASN 98 HA ASN 98 -5.588 11.524 7.346 742 HB2 ASN 98 1HB ASN 98 -4.898 10.565 10.174 743 HB3 ASN 98 2HB ASN 98 -4.457 12.120 9.496 744 HD21 ASN 98 1HD2 ASN 98 -6.439 13.465 8.664 745 HD22 ASN 98 2HD2 ASN 98 -7.899 13.377 9.623 746 H LEU 99 H LEU 99 -4.244 8.431 8.215 747 HA LEU 99 HA LEU 99 -2.196 7.507 8.064 748 HB2 LEU 99 1HB LEU 99 -3.665 7.714 5.828 749 HB3 LEU 99 2HB LEU 99 -2.207 8.449 5.216 750 HG LEU 99 HG LEU 99 -1.911 6.220 4.671 751 HD11 LEU 99 1HD1 LEU 99 0.023 6.796 5.893 752 HD12 LEU 99 2HD1 LEU 99 -0.332 5.078 5.976 753 HD13 LEU 99 3HD1 LEU 99 -0.651 6.100 7.387 754 HD21 LEU 99 3HD2 LEU 99 -3.930 5.343 5.713 755 HD22 LEU 99 1HD2 LEU 99 -3.198 5.517 7.319 756 HD23 LEU 99 2HD2 LEU 99 -2.542 4.337 6.179 757 H VAL 100 H VAL 100 -1.446 9.715 9.402 758 HA VAL 100 HA VAL 100 0.239 11.465 7.913 759 HB VAL 100 HB VAL 100 0.095 10.882 10.904 760 HG11 VAL 100 1HG1 VAL 100 1.390 13.228 9.441 761 HG12 VAL 100 2HG1 VAL 100 1.134 13.122 11.198 762 HG13 VAL 100 3HG1 VAL 100 2.231 11.993 10.402 763 HG21 VAL 100 3HG2 VAL 100 -2.036 11.722 9.995 764 HG22 VAL 100 1HG2 VAL 100 -1.259 12.955 10.988 765 HG23 VAL 100 2HG2 VAL 100 -1.192 13.075 9.213 766 H MET 101 H MET 101 1.811 10.368 6.656 767 HA MET 101 HA MET 101 4.128 9.511 8.264 768 HB2 MET 101 1HB MET 101 4.668 8.075 6.163 769 HB3 MET 101 2HB MET 101 3.742 7.423 7.512 770 HG2 MET 101 1HG MET 101 1.634 7.814 6.319 771 HG3 MET 101 2HG MET 101 2.513 8.652 5.053 772 HE1 MET 101 3HE MET 101 1.960 6.228 2.593 773 HE2 MET 101 1HE MET 101 1.394 7.684 3.506 774 HE3 MET 101 2HE MET 101 3.080 7.557 2.968 775 H GLN 102 H GLN 102 5.788 10.881 7.917 776 HA GLN 102 HA GLN 102 5.808 12.584 5.535 777 HB2 GLN 102 1HB GLN 102 7.243 12.618 8.223 778 HB3 GLN 102 2HB GLN 102 7.723 13.605 6.835 779 HG2 GLN 102 1HG GLN 102 6.424 15.023 8.022 780 HG3 GLN 102 2HG GLN 102 5.325 14.506 6.758 781 HE21 GLN 102 1HE2 GLN 102 4.251 15.815 8.913 782 HE22 GLN 102 2HE2 GLN 102 3.646 14.692 10.138 783 H SER 103 H SER 103 6.826 11.854 3.884 784 HA SER 103 HA SER 103 9.003 9.884 3.936 785 HB2 SER 103 1HB SER 103 9.145 10.950 1.501 786 HB3 SER 103 2HB SER 103 7.954 9.715 1.915 787 HG SER 103 HG SER 103 7.223 12.427 2.249 788 H GLY 104 H GLY 104 11.159 10.586 3.129 789 HA2 GLY 104 2HA GLY 104 12.153 12.847 4.554 790 HA3 GLY 104 1HA GLY 104 13.033 11.923 3.336 791 H GLY 105 H GLY 105 10.446 12.812 1.517 792 HA2 GLY 105 2HA GLY 105 11.566 15.420 0.672 793 HA3 GLY 105 1HA GLY 105 10.386 14.395 -0.176 794 H LEU 106 H LEU 106 8.204 14.227 0.758 795 HA LEU 106 HA LEU 106 7.312 16.670 2.120 796 HB2 LEU 106 1HB LEU 106 5.766 14.833 0.258 797 HB3 LEU 106 2HB LEU 106 5.415 16.499 0.674 798 HG LEU 106 HG LEU 106 6.070 16.271 -1.585 799 HD11 LEU 106 1HD1 LEU 106 6.663 18.374 -0.450 800 HD12 LEU 106 2HD1 LEU 106 7.807 17.997 -1.739 801 HD13 LEU 106 3HD1 LEU 106 8.251 17.701 -0.046 802 HD21 LEU 106 3HD2 LEU 106 8.898 15.613 -1.222 803 HD22 LEU 106 1HD2 LEU 106 7.793 15.247 -2.542 804 HD23 LEU 106 2HD2 LEU 106 7.688 14.315 -1.027 805 H ALA 107 H ALA 107 4.832 16.006 2.386 806 HA ALA 107 HA ALA 107 4.607 13.657 4.238 807 HB1 ALA 107 1HB ALA 107 2.666 15.993 4.072 808 HB2 ALA 107 2HB ALA 107 2.540 14.578 5.128 809 HB3 ALA 107 3HB ALA 107 3.855 15.739 5.376 810 H VAL 108 H VAL 108 2.863 12.241 3.835 811 HA VAL 108 HA VAL 108 1.403 12.522 1.320 812 HB VAL 108 HB VAL 108 3.115 11.137 0.584 813 HG11 VAL 108 1HG1 VAL 108 4.372 10.714 2.606 814 HG12 VAL 108 2HG1 VAL 108 3.067 9.724 3.267 815 HG13 VAL 108 3HG1 VAL 108 4.023 9.176 1.856 816 HG21 VAL 108 3HG2 VAL 108 2.247 8.840 0.389 817 HG22 VAL 108 1HG2 VAL 108 1.108 9.126 1.710 818 HG23 VAL 108 2HG2 VAL 108 0.936 9.973 0.166 819 H ARG 109 H ARG 109 -0.693 11.453 1.354 820 HA ARG 109 HA ARG 109 -1.734 10.893 4.086 821 HB2 ARG 109 1HB ARG 109 -1.826 13.521 2.859 822 HB3 ARG 109 2HB ARG 109 -3.466 12.839 2.807 823 HG2 ARG 109 1HG ARG 109 -3.593 12.551 5.120 824 HG3 ARG 109 2HG ARG 109 -1.869 12.895 5.368 825 HD2 ARG 109 1HD ARG 109 -3.342 14.801 6.014 826 HD3 ARG 109 2HD ARG 109 -2.174 15.206 4.763 827 HE ARG 109 HE ARG 109 -3.826 15.713 3.325 828 HH11 ARG 109 1HH1 ARG 109 -5.388 14.127 6.081 829 HH12 ARG 109 2HH1 ARG 109 -6.979 14.228 5.418 830 HH21 ARG 109 1HH2 ARG 109 -5.909 15.789 2.407 831 HH22 ARG 109 2HH2 ARG 109 -7.279 15.137 3.260 832 H VAL 110 H VAL 110 -3.424 9.396 3.910 833 HA VAL 110 HA VAL 110 -3.805 8.160 1.440 834 HB VAL 110 HB VAL 110 -3.936 7.137 3.624 835 HG11 VAL 110 1HG1 VAL 110 -6.716 8.331 3.851 836 HG12 VAL 110 2HG1 VAL 110 -5.925 7.204 4.968 837 HG13 VAL 110 3HG1 VAL 110 -5.301 8.854 4.781 838 HG21 VAL 110 3HG2 VAL 110 -6.345 6.609 1.887 839 HG22 VAL 110 1HG2 VAL 110 -4.739 5.846 1.821 840 HG23 VAL 110 2HG2 VAL 110 -5.793 5.570 3.219 841 H ARG 111 H ARG 111 -5.790 10.632 2.943 842 HA ARG 111 HA ARG 111 -7.585 11.848 2.324 843 HB2 ARG 111 1HB ARG 111 -6.958 10.908 -0.456 844 HB3 ARG 111 2HB ARG 111 -8.569 11.515 -0.094 845 HG2 ARG 111 1HG ARG 111 -7.902 13.636 0.090 846 HG3 ARG 111 2HG ARG 111 -6.513 13.212 1.102 847 HD2 ARG 111 1HD ARG 111 -5.908 14.323 -0.836 848 HD3 ARG 111 2HD ARG 111 -5.130 12.721 -0.718 849 HE ARG 111 HE ARG 111 -7.168 12.187 -2.367 850 HH11 ARG 111 1HH1 ARG 111 -4.945 14.938 -2.516 851 HH12 ARG 111 2HH1 ARG 111 -5.406 15.425 -4.121 852 HH21 ARG 111 1HH2 ARG 111 -7.530 12.546 -4.509 853 HH22 ARG 111 2HH2 ARG 111 -6.821 13.873 -5.390 854 H THR 112 H THR 112 -7.902 8.618 0.733 855 HA THR 112 HA THR 112 -10.749 8.676 1.416 856 HB THR 112 HB THR 112 -10.735 6.495 0.201 857 HG1 THR 112 1HG THR 112 -8.675 5.822 0.603 858 HG21 THR 112 3HG2 THR 112 -9.347 8.801 -1.265 859 HG22 THR 112 1HG2 THR 112 -11.098 8.614 -1.032 860 HG23 THR 112 2HG2 THR 112 -10.211 7.450 -2.033 861 HA PRO 113 HA PRO 113 -10.198 5.842 4.909 862 HB2 PRO 113 1HB PRO 113 -12.581 4.541 4.991 863 HB3 PRO 113 2HB PRO 113 -12.446 6.273 5.421 864 HG2 PRO 113 1HG PRO 113 -13.314 5.077 2.778 865 HG3 PRO 113 2HG PRO 113 -14.093 6.380 3.740 866 HD2 PRO 113 1HD PRO 113 -12.395 6.850 1.617 867 HD3 PRO 113 2HD PRO 113 -12.541 7.970 3.003 868 H ILE 114 H ILE 114 -10.434 3.379 5.220 869 HA ILE 114 HA ILE 114 -9.149 1.969 3.057 870 HB ILE 114 HB ILE 114 -10.212 1.350 5.839 871 HG12 ILE 114 1HG1 ILE 114 -8.075 2.596 5.516 872 HG13 ILE 114 2HG1 ILE 114 -7.908 1.131 6.441 873 HG21 ILE 114 1HG2 ILE 114 -10.679 -0.725 4.768 874 HG22 ILE 114 2HG2 ILE 114 -9.082 -0.761 3.976 875 HG23 ILE 114 3HG2 ILE 114 -9.210 -0.897 5.733 876 HD11 ILE 114 3HD1 ILE 114 -6.636 0.072 4.813 877 HD12 ILE 114 1HD1 ILE 114 -7.375 0.960 3.470 878 HD13 ILE 114 2HD1 ILE 114 -6.200 1.766 4.484 879 H SER 115 H SER 115 -9.982 0.271 1.759 880 HA SER 115 HA SER 115 -12.856 -0.309 1.932 881 HB2 SER 115 1HB SER 115 -11.636 1.392 0.021 882 HB3 SER 115 2HB SER 115 -11.759 -0.195 -0.755 883 HG SER 115 HG SER 115 -13.949 1.059 0.603 884 H ASN 116 H ASN 116 -13.389 -2.333 0.959 885 HA ASN 116 HA ASN 116 -11.304 -4.192 0.143 886 HB2 ASN 116 1HB ASN 116 -11.624 -5.703 1.869 887 HB3 ASN 116 2HB ASN 116 -11.715 -4.200 2.759 888 HD21 ASN 116 1HD2 ASN 116 -13.282 -7.011 1.880 889 HD22 ASN 116 2HD2 ASN 116 -14.793 -6.836 2.747 890 H GLY 117 H GLY 117 -12.605 -6.371 -0.599 891 HA2 GLY 117 2HA GLY 117 -15.484 -6.097 -0.727 892 HA3 GLY 117 1HA GLY 117 -14.716 -6.061 -2.320 893 H GLN 118 H GLN 118 -16.271 -8.076 -2.297 894 HA GLN 118 HA GLN 118 -15.396 -10.502 -1.053 895 HB2 GLN 118 1HB GLN 118 -17.365 -9.614 -3.087 896 HB3 GLN 118 2HB GLN 118 -16.726 -11.162 -3.451 897 HG2 GLN 118 1HG GLN 118 -17.505 -10.921 -0.604 898 HG3 GLN 118 2HG GLN 118 -18.833 -10.658 -1.716 899 HE21 GLN 118 1HE2 GLN 118 -17.450 -13.088 0.074 900 HE22 GLN 118 2HE2 GLN 118 -18.205 -14.358 -0.823 901 HA PRO 119 HA PRO 119 -12.209 -11.468 -3.980 902 HB2 PRO 119 1HB PRO 119 -11.908 -14.186 -3.601 903 HB3 PRO 119 2HB PRO 119 -11.459 -13.011 -2.337 904 HG2 PRO 119 1HG PRO 119 -14.022 -14.594 -2.601 905 HG3 PRO 119 2HG PRO 119 -13.016 -14.346 -1.132 906 HD2 PRO 119 1HD PRO 119 -15.282 -12.890 -1.754 907 HD3 PRO 119 2HD PRO 119 -13.942 -12.209 -0.799 908 H THR 120 H THR 120 -11.712 -12.870 -5.946 909 HA THR 120 HA THR 120 -14.231 -13.870 -7.167 910 HB THR 120 HB THR 120 -13.174 -12.029 -8.369 911 HG1 THR 120 1HG THR 120 -13.314 -14.572 -9.571 912 HG21 THR 120 3HG2 THR 120 -10.789 -12.598 -7.908 913 HG22 THR 120 1HG2 THR 120 -11.109 -12.405 -9.634 914 HG23 THR 120 2HG2 THR 120 -10.942 -14.026 -8.941 915 H THR 121 H THR 121 -12.115 -15.287 -5.427 916 HA THR 121 HA THR 121 -11.290 -17.424 -5.166 917 HB THR 121 HB THR 121 -12.983 -18.364 -7.506 918 HG1 THR 121 1HG THR 121 -14.372 -17.118 -6.316 919 HG21 THR 121 3HG2 THR 121 -13.409 -20.292 -5.935 920 HG22 THR 121 1HG2 THR 121 -12.164 -19.627 -4.857 921 HG23 THR 121 2HG2 THR 121 -11.742 -20.176 -6.482 922 H GLY 122 H GLY 122 -9.952 -19.215 -6.263 923 HA2 GLY 122 2HA GLY 122 -8.633 -18.487 -8.745 924 HA3 GLY 122 1HA GLY 122 -7.704 -18.479 -7.239 925 H ASP 123 H ASP 123 -6.667 -20.205 -8.738 926 HA ASP 123 HA ASP 123 -7.955 -22.660 -9.355 927 HB2 ASP 123 1HB ASP 123 -5.903 -21.454 -10.334 928 HB3 ASP 123 2HB ASP 123 -5.003 -22.107 -9.002 929 H ALA 124 H ALA 124 -6.224 -21.607 -6.612 930 HA ALA 124 HA ALA 124 -7.009 -23.805 -4.878 931 HB1 ALA 124 1HB ALA 124 -5.110 -24.934 -5.890 932 HB2 ALA 124 2HB ALA 124 -4.085 -23.502 -5.700 933 HB3 ALA 124 3HB ALA 124 -4.618 -24.429 -4.272 934 H ASP 125 H ASP 125 -7.026 -20.720 -5.197 935 HA ASP 125 HA ASP 125 -6.203 -19.930 -2.556 936 HB2 ASP 125 1HB ASP 125 -5.241 -17.852 -3.811 937 HB3 ASP 125 2HB ASP 125 -4.205 -19.251 -3.495 938 H HIS 126 H HIS 126 -7.065 -17.558 -2.384 939 HA HIS 126 HA HIS 126 -9.063 -16.859 -4.411 940 HB2 HIS 126 1HB HIS 126 -9.607 -16.456 -1.437 941 HB3 HIS 126 2HB HIS 126 -10.563 -15.832 -2.762 942 HD1 HIS 126 1HD HIS 126 -12.851 -17.156 -2.948 943 HD2 HIS 126 2HD HIS 126 -9.596 -19.247 -1.296 944 HE1 HIS 126 1HE HIS 126 -13.736 -19.370 -2.278 945 H THR 127 H THR 127 -9.425 -14.333 -4.199 946 HA THR 127 HA THR 127 -7.210 -12.846 -3.003 947 HB THR 127 HB THR 127 -7.546 -11.796 -5.588 948 HG1 THR 127 1HG THR 127 -6.857 -14.444 -6.126 949 HG21 THR 127 3HG2 THR 127 -5.355 -13.731 -4.718 950 HG22 THR 127 1HG2 THR 127 -5.423 -12.029 -4.209 951 HG23 THR 127 2HG2 THR 127 -5.225 -12.423 -5.920 952 H VAL 128 H VAL 128 -7.978 -11.007 -2.168 953 HA VAL 128 HA VAL 128 -10.760 -10.217 -2.864 954 HB VAL 128 HB VAL 128 -10.459 -8.981 -0.618 955 HG11 VAL 128 1HG1 VAL 128 -11.370 -10.807 0.634 956 HG12 VAL 128 2HG1 VAL 128 -12.014 -10.839 -1.003 957 HG13 VAL 128 3HG1 VAL 128 -10.731 -11.988 -0.525 958 HG21 VAL 128 3HG2 VAL 128 -8.035 -9.434 -0.349 959 HG22 VAL 128 1HG2 VAL 128 -9.040 -9.870 1.039 960 HG23 VAL 128 2HG2 VAL 128 -8.425 -11.150 -0.038 961 HA PRO 129 HA PRO 129 -9.010 -6.387 -4.459 962 HB2 PRO 129 1HB PRO 129 -11.307 -4.950 -4.753 963 HB3 PRO 129 2HB PRO 129 -10.918 -6.371 -5.763 964 HG2 PRO 129 1HG PRO 129 -12.708 -6.283 -3.334 965 HG3 PRO 129 2HG PRO 129 -13.019 -7.062 -4.930 966 HD2 PRO 129 1HD PRO 129 -12.109 -8.427 -2.760 967 HD3 PRO 129 2HD PRO 129 -11.645 -8.853 -4.431 968 H ILE 130 H ILE 130 -7.766 -5.171 -3.041 969 HA ILE 130 HA ILE 130 -9.132 -3.611 -0.943 970 HB ILE 130 HB ILE 130 -6.707 -5.430 -0.639 971 HG12 ILE 130 1HG1 ILE 130 -9.341 -5.361 0.910 972 HG13 ILE 130 2HG1 ILE 130 -8.982 -6.505 -0.375 973 HG21 ILE 130 1HG2 ILE 130 -6.540 -4.527 1.701 974 HG22 ILE 130 2HG2 ILE 130 -6.252 -3.284 0.501 975 HG23 ILE 130 3HG2 ILE 130 -7.826 -3.367 1.282 976 HD11 ILE 130 3HD1 ILE 130 -8.687 -7.594 1.732 977 HD12 ILE 130 1HD1 ILE 130 -7.149 -7.467 0.876 978 HD13 ILE 130 2HD1 ILE 130 -7.487 -6.413 2.269 979 H SER 131 H SER 131 -8.437 -1.527 -0.916 980 HA SER 131 HA SER 131 -5.828 -0.686 -1.798 981 HB2 SER 131 1HB SER 131 -6.802 0.769 -3.673 982 HB3 SER 131 2HB SER 131 -6.667 -0.953 -3.973 983 HG SER 131 HG SER 131 -8.907 0.655 -3.686 984 H LEU 132 H LEU 132 -5.587 1.702 -1.692 985 HA LEU 132 HA LEU 132 -7.879 3.286 -0.898 986 HB2 LEU 132 1HB LEU 132 -6.434 4.510 0.748 987 HB3 LEU 132 2HB LEU 132 -7.088 2.990 1.263 988 HG LEU 132 HG LEU 132 -4.813 3.463 2.002 989 HD11 LEU 132 1HD1 LEU 132 -4.063 1.325 2.127 990 HD12 LEU 132 2HD1 LEU 132 -4.696 0.887 0.517 991 HD13 LEU 132 3HD1 LEU 132 -5.789 1.168 1.876 992 HD21 LEU 132 3HD2 LEU 132 -3.815 3.064 -0.783 993 HD22 LEU 132 1HD2 LEU 132 -2.825 3.110 0.674 994 HD23 LEU 132 2HD2 LEU 132 -3.659 4.560 0.154 995 H GLY 133 H GLY 133 -7.325 5.646 -1.184 996 HA2 GLY 133 2HA GLY 133 -5.586 6.159 -3.505 997 HA3 GLY 133 1HA GLY 133 -6.658 7.273 -2.651 998 H TYR 134 H TYR 134 -4.138 8.252 -3.212 999 HA TYR 134 HA TYR 134 -3.402 8.980 -0.531 1000 HB2 TYR 134 1HB TYR 134 -1.546 7.293 -2.272 1001 HB3 TYR 134 2HB TYR 134 -0.873 8.496 -1.287 1002 HD1 TYR 134 2HD TYR 134 -1.375 8.674 1.168 1003 HD2 TYR 134 1HD TYR 134 -1.402 5.126 -1.243 1004 HE1 TYR 134 2HE TYR 134 -0.722 7.371 3.144 1005 HE2 TYR 134 1HE TYR 134 -0.619 3.799 0.695 1006 HH TYR 134 HH TYR 134 0.094 5.300 3.869 1007 H ASP 135 H ASP 135 -2.063 10.987 -0.584 1008 HA ASP 135 HA ASP 135 -1.516 12.188 -3.221 1009 HB2 ASP 135 1HB ASP 135 -2.450 14.177 -2.877 1010 HB3 ASP 135 2HB ASP 135 -3.652 13.069 -2.301 1011 H VAL 136 H VAL 136 -0.098 14.295 -2.822 1012 HA VAL 136 HA VAL 136 1.906 13.825 -0.716 1013 HB VAL 136 HB VAL 136 2.451 14.307 -3.672 1014 HG11 VAL 136 1HG1 VAL 136 4.302 13.982 -1.277 1015 HG12 VAL 136 2HG1 VAL 136 4.852 14.057 -2.978 1016 HG13 VAL 136 3HG1 VAL 136 4.060 15.454 -2.235 1017 HG21 VAL 136 3HG2 VAL 136 3.050 11.830 -1.973 1018 HG22 VAL 136 1HG2 VAL 136 1.865 11.922 -3.288 1019 HG23 VAL 136 2HG2 VAL 136 3.588 12.088 -3.654 1020 H GLN 137 H GLN 137 2.265 15.627 0.309 1021 HA GLN 137 HA GLN 137 1.027 18.151 -0.474 1022 HB2 GLN 137 1HB GLN 137 2.715 17.170 1.874 1023 HB3 GLN 137 2HB GLN 137 2.385 18.889 1.602 1024 HG2 GLN 137 1HG GLN 137 -0.035 18.382 1.444 1025 HG3 GLN 137 2HG GLN 137 0.310 16.653 1.664 1026 HE21 GLN 137 1HE2 GLN 137 -0.264 15.969 3.691 1027 HE22 GLN 137 2HE2 GLN 137 -0.268 16.974 5.139 1028 H PHE 138 H PHE 138 2.192 20.202 -0.254 1029 HA PHE 138 HA PHE 138 5.010 20.334 -0.961 1030 HB2 PHE 138 1HB PHE 138 2.968 20.341 -2.892 1031 HB3 PHE 138 2HB PHE 138 3.245 22.039 -2.588 1032 HD1 PHE 138 2HD PHE 138 5.322 18.995 -2.680 1033 HD2 PHE 138 1HD PHE 138 4.831 22.984 -4.160 1034 HE1 PHE 138 2HE PHE 138 7.445 18.752 -3.979 1035 HE2 PHE 138 1HE PHE 138 6.958 22.801 -5.431 1036 HZ PHE 138 HZ PHE 138 8.274 20.693 -5.355 1037 H TYR 139 H TYR 139 3.879 20.820 1.381 1038 HA TYR 139 HA TYR 139 3.188 23.578 1.965 1039 HB2 TYR 139 1HB TYR 139 3.901 23.032 4.301 1040 HB3 TYR 139 2HB TYR 139 2.668 21.980 3.641 1041 HD1 TYR 139 1HD TYR 139 6.348 22.125 4.514 1042 HD2 TYR 139 2HD TYR 139 2.948 19.670 3.559 1043 HE1 TYR 139 1HE TYR 139 7.629 20.113 5.143 1044 HE2 TYR 139 2HE TYR 139 4.236 17.651 4.128 1045 HH TYR 139 HH TYR 139 7.690 17.693 5.013 1046 HA PRO 140 HA PRO 140 7.198 25.290 1.419 1047 HB2 PRO 140 1HB PRO 140 7.220 27.476 3.054 1048 HB3 PRO 140 2HB PRO 140 6.217 27.368 1.579 1049 HG2 PRO 140 1HG PRO 140 5.366 26.853 4.441 1050 HG3 PRO 140 2HG PRO 140 4.523 27.818 3.189 1051 HD2 PRO 140 1HD PRO 140 3.849 25.229 3.738 1052 HD3 PRO 140 2HD PRO 140 3.750 25.906 2.085 1053 H GLU 141 H GLU 141 9.259 25.384 2.353 1054 HA GLU 141 HA GLU 141 9.746 23.926 4.882 1055 HB2 GLU 141 1HB GLU 141 12.093 24.095 4.279 1056 HB3 GLU 141 2HB GLU 141 11.199 23.505 2.886 1057 HG2 GLU 141 1HG GLU 141 11.217 25.811 1.920 1058 HG3 GLU 141 2HG GLU 141 12.164 26.383 3.302 Start of MODEL 2 1 H1 GLY 1 H GLY 1 16.486 16.946 -9.730 2 HA2 GLY 1 2HA GLY 1 15.820 16.157 -7.473 3 HA3 GLY 1 1HA GLY 1 14.438 16.646 -8.483 4 H MET 2 H MET 2 13.990 14.860 -6.367 5 HA MET 2 HA MET 2 13.407 12.354 -7.873 6 HB2 MET 2 1HB MET 2 14.739 12.678 -5.185 7 HB3 MET 2 2HB MET 2 13.630 11.336 -5.447 8 HG2 MET 2 1HG MET 2 15.989 11.943 -7.241 9 HG3 MET 2 2HG MET 2 15.986 10.750 -5.934 10 HE1 MET 2 3HE MET 2 16.077 8.467 -9.067 11 HE2 MET 2 1HE MET 2 16.918 10.007 -8.787 12 HE3 MET 2 2HE MET 2 16.783 8.817 -7.476 13 H SER 3 H SER 3 12.508 13.691 -4.632 14 HA SER 3 HA SER 3 10.537 13.864 -3.628 15 HB2 SER 3 1HB SER 3 9.241 14.043 -6.340 16 HB3 SER 3 2HB SER 3 8.564 14.541 -4.786 17 HG SER 3 HG SER 3 9.592 16.155 -6.199 18 H GLN 4 H GLN 4 9.592 11.785 -6.479 19 HA GLN 4 HA GLN 4 7.780 10.303 -4.901 20 HB2 GLN 4 1HB GLN 4 7.569 10.491 -7.307 21 HB3 GLN 4 2HB GLN 4 9.057 9.586 -7.549 22 HG2 GLN 4 1HG GLN 4 7.025 8.240 -7.946 23 HG3 GLN 4 2HG GLN 4 8.084 7.562 -6.714 24 HE21 GLN 4 1HE2 GLN 4 6.410 6.323 -5.765 25 HE22 GLN 4 2HE2 GLN 4 5.137 7.067 -4.810 26 H ASP 5 H ASP 5 11.185 9.567 -5.727 27 HA ASP 5 HA ASP 5 11.714 7.186 -4.556 28 HB2 ASP 5 1HB ASP 5 13.333 8.921 -5.515 29 HB3 ASP 5 2HB ASP 5 13.310 9.705 -3.936 30 H LEU 6 H LEU 6 10.925 10.115 -2.860 31 HA LEU 6 HA LEU 6 11.735 9.198 -0.190 32 HB2 LEU 6 1HB LEU 6 10.355 11.802 -0.967 33 HB3 LEU 6 2HB LEU 6 11.334 11.493 0.457 34 HG LEU 6 HG LEU 6 12.457 11.485 -2.392 35 HD11 LEU 6 1HD1 LEU 6 12.633 13.816 -0.513 36 HD12 LEU 6 2HD1 LEU 6 11.353 13.654 -1.748 37 HD13 LEU 6 3HD1 LEU 6 13.063 13.722 -2.222 38 HD21 LEU 6 3HD2 LEU 6 13.840 10.333 -0.687 39 HD22 LEU 6 1HD2 LEU 6 13.811 11.803 0.316 40 HD23 LEU 6 2HD2 LEU 6 14.588 11.817 -1.278 41 H ILE 7 H ILE 7 8.838 10.406 -1.892 42 HA ILE 7 HA ILE 7 6.822 9.931 0.016 43 HB ILE 7 HB ILE 7 6.864 9.783 -3.008 44 HG12 ILE 7 1HG1 ILE 7 5.350 11.887 -1.484 45 HG13 ILE 7 2HG1 ILE 7 7.110 11.973 -1.408 46 HG21 ILE 7 1HG2 ILE 7 4.391 9.972 -3.009 47 HG22 ILE 7 2HG2 ILE 7 4.942 8.424 -2.359 48 HG23 ILE 7 3HG2 ILE 7 4.394 9.701 -1.249 49 HD11 ILE 7 3HD1 ILE 7 5.709 11.773 -4.088 50 HD12 ILE 7 1HD1 ILE 7 5.917 13.322 -3.242 51 HD13 ILE 7 2HD1 ILE 7 7.337 12.390 -3.680 52 H ARG 8 H ARG 8 8.015 7.693 -2.503 53 HA ARG 8 HA ARG 8 6.429 5.455 -1.822 54 HB2 ARG 8 1HB ARG 8 7.827 6.095 -3.903 55 HB3 ARG 8 2HB ARG 8 9.216 5.434 -3.072 56 HG2 ARG 8 1HG ARG 8 8.151 3.203 -3.097 57 HG3 ARG 8 2HG ARG 8 6.665 3.906 -3.783 58 HD2 ARG 8 1HD ARG 8 7.992 4.740 -5.746 59 HD3 ARG 8 2HD ARG 8 9.431 3.983 -5.101 60 HE ARG 8 HE ARG 8 7.316 2.773 -6.622 61 HH11 ARG 8 1HH1 ARG 8 9.972 2.100 -4.380 62 HH12 ARG 8 2HH1 ARG 8 10.021 0.424 -4.709 63 HH21 ARG 8 1HH2 ARG 8 7.192 0.522 -6.900 64 HH22 ARG 8 2HH2 ARG 8 8.581 -0.445 -6.448 65 H ALA 9 H ALA 9 9.639 6.494 -0.557 66 HA ALA 9 HA ALA 9 10.278 4.093 0.756 67 HB1 ALA 9 1HB ALA 9 11.829 5.428 2.084 68 HB2 ALA 9 2HB ALA 9 11.874 5.963 0.399 69 HB3 ALA 9 3HB ALA 9 11.006 6.928 1.622 70 H ALA 10 H ALA 10 8.101 6.754 1.839 71 HA ALA 10 HA ALA 10 8.028 5.929 4.579 72 HB1 ALA 10 1HB ALA 10 7.152 8.119 3.727 73 HB2 ALA 10 2HB ALA 10 5.767 7.262 3.026 74 HB3 ALA 10 3HB ALA 10 6.007 7.269 4.786 75 H PHE 11 H PHE 11 6.416 4.659 1.740 76 HA PHE 11 HA PHE 11 4.350 3.125 3.084 77 HB2 PHE 11 1HB PHE 11 5.508 2.785 0.275 78 HB3 PHE 11 2HB PHE 11 4.088 2.021 0.908 79 HD1 PHE 11 2HD PHE 11 5.057 5.735 1.002 80 HD2 PHE 11 1HD PHE 11 2.411 2.696 -0.562 81 HE1 PHE 11 2HE PHE 11 3.785 7.436 -0.082 82 HE2 PHE 11 1HE PHE 11 1.144 4.474 -1.727 83 HZ PHE 11 HZ PHE 11 1.779 6.861 -1.463 84 H GLU 12 H GLU 12 7.465 2.454 1.442 85 HA GLU 12 HA GLU 12 7.660 -0.301 2.026 86 HB2 GLU 12 1HB GLU 12 9.621 1.877 1.341 87 HB3 GLU 12 2HB GLU 12 10.185 0.242 1.704 88 HG2 GLU 12 1HG GLU 12 8.959 -0.779 -0.016 89 HG3 GLU 12 2HG GLU 12 7.986 0.634 -0.327 90 H LYS 13 H LYS 13 8.431 2.496 4.043 91 HA LYS 13 HA LYS 13 9.892 0.873 5.932 92 HB2 LYS 13 1HB LYS 13 9.057 3.745 5.768 93 HB3 LYS 13 2HB LYS 13 9.224 3.076 7.377 94 HG2 LYS 13 1HG LYS 13 11.329 4.096 6.613 95 HG3 LYS 13 2HG LYS 13 11.474 2.385 7.004 96 HD2 LYS 13 1HD LYS 13 11.451 1.820 4.580 97 HD3 LYS 13 2HD LYS 13 11.318 3.549 4.189 98 HE2 LYS 13 1HE LYS 13 13.506 3.993 5.128 99 HE3 LYS 13 2HE LYS 13 13.629 2.344 5.758 100 HZ1 LYS 13 3HZ LYS 13 14.850 2.602 3.694 101 HZ2 LYS 13 1HZ LYS 13 13.488 2.997 2.856 102 HZ3 LYS 13 2HZ LYS 13 13.684 1.512 3.529 103 H ARG 14 H ARG 14 6.694 2.551 6.080 104 HA ARG 14 HA ARG 14 5.973 1.309 8.440 105 HB2 ARG 14 1HB ARG 14 4.710 3.256 7.589 106 HB3 ARG 14 2HB ARG 14 4.115 2.291 6.246 107 HG2 ARG 14 1HG ARG 14 2.287 2.261 7.598 108 HG3 ARG 14 2HG ARG 14 3.002 0.768 8.110 109 HD2 ARG 14 1HD ARG 14 2.860 3.392 9.566 110 HD3 ARG 14 2HD ARG 14 2.237 1.844 10.080 111 HE ARG 14 HE ARG 14 4.974 2.913 10.265 112 HH11 ARG 14 1HH1 ARG 14 2.951 0.065 11.038 113 HH12 ARG 14 2HH1 ARG 14 4.005 -0.453 12.298 114 HH21 ARG 14 1HH2 ARG 14 6.283 2.269 11.842 115 HH22 ARG 14 2HH2 ARG 14 5.930 0.879 12.827 116 H LEU 15 H LEU 15 5.072 0.136 5.142 117 HA LEU 15 HA LEU 15 3.369 -1.912 6.038 118 HB2 LEU 15 1HB LEU 15 3.303 -1.273 3.753 119 HB3 LEU 15 2HB LEU 15 5.017 -1.619 3.518 120 HG LEU 15 HG LEU 15 4.680 -3.978 3.612 121 HD11 LEU 15 1HD1 LEU 15 2.400 -5.020 3.758 122 HD12 LEU 15 2HD1 LEU 15 1.746 -3.447 4.260 123 HD13 LEU 15 3HD1 LEU 15 2.907 -4.290 5.273 124 HD21 LEU 15 3HD2 LEU 15 3.987 -2.544 1.526 125 HD22 LEU 15 1HD2 LEU 15 2.357 -3.067 1.910 126 HD23 LEU 15 2HD2 LEU 15 3.639 -4.263 1.567 127 H SER 16 H SER 16 6.961 -2.239 5.215 128 HA SER 16 HA SER 16 6.990 -4.933 6.073 129 HB2 SER 16 1HB SER 16 9.165 -2.852 5.850 130 HB3 SER 16 2HB SER 16 9.426 -4.602 6.010 131 HG SER 16 HG SER 16 9.250 -4.644 3.954 132 H ASP 17 H ASP 17 7.480 -1.886 7.871 133 HA ASP 17 HA ASP 17 8.544 -3.062 10.233 134 HB2 ASP 17 1HB ASP 17 8.364 -0.563 9.440 135 HB3 ASP 17 2HB ASP 17 6.826 -0.576 10.293 136 H TRP 18 H TRP 18 5.249 -2.698 9.053 137 HA TRP 18 HA TRP 18 3.955 -3.905 11.421 138 HB2 TRP 18 1HB TRP 18 2.554 -2.518 10.136 139 HB3 TRP 18 2HB TRP 18 3.027 -3.256 8.628 140 HD1 TRP 18 HD TRP 18 0.625 -3.722 11.529 141 HE1 TRP 18 1HE TRP 18 -1.197 -5.385 10.876 142 HE3 TRP 18 3HE TRP 18 2.643 -5.403 7.167 143 HZ2 TRP 18 2HZ TRP 18 -1.628 -7.358 8.800 144 HZ3 TRP 18 3HZ TRP 18 1.497 -7.143 5.835 145 HH2 TRP 18 HH TRP 18 -0.676 -8.109 6.649 146 H ALA 19 H ALA 19 4.895 -4.996 8.132 147 HA ALA 19 HA ALA 19 3.826 -7.546 8.483 148 HB1 ALA 19 1HB ALA 19 4.439 -6.503 6.265 149 HB2 ALA 19 2HB ALA 19 6.141 -6.865 6.639 150 HB3 ALA 19 3HB ALA 19 4.968 -8.185 6.460 151 H LYS 20 H LYS 20 6.866 -6.380 9.728 152 HA LYS 20 HA LYS 20 7.514 -9.182 10.506 153 HB2 LYS 20 1HB LYS 20 9.746 -8.413 10.965 154 HB3 LYS 20 2HB LYS 20 9.260 -7.849 9.370 155 HG2 LYS 20 1HG LYS 20 9.971 -5.829 9.966 156 HG3 LYS 20 2HG LYS 20 8.556 -5.675 10.987 157 HD2 LYS 20 1HD LYS 20 9.815 -6.500 12.931 158 HD3 LYS 20 2HD LYS 20 11.223 -6.837 11.902 159 HE2 LYS 20 1HE LYS 20 11.375 -4.438 11.317 160 HE3 LYS 20 2HE LYS 20 10.001 -4.083 12.384 161 HZ1 LYS 20 3HZ LYS 20 12.067 -3.656 13.513 162 HZ2 LYS 20 1HZ LYS 20 12.635 -5.154 13.185 163 HZ3 LYS 20 2HZ LYS 20 11.340 -4.933 14.217 164 H ALA 21 H ALA 21 6.161 -6.300 11.851 165 HA ALA 21 HA ALA 21 6.687 -7.007 14.654 166 HB1 ALA 21 1HB ALA 21 4.566 -5.232 13.374 167 HB2 ALA 21 2HB ALA 21 4.796 -5.447 15.119 168 HB3 ALA 21 3HB ALA 21 6.067 -4.691 14.167 169 H ARG 22 H ARG 22 4.198 -7.614 12.176 170 HA ARG 22 HA ARG 22 2.243 -8.757 13.801 171 HB2 ARG 22 1HB ARG 22 2.482 -8.326 11.068 172 HB3 ARG 22 2HB ARG 22 2.655 -10.097 11.190 173 HG2 ARG 22 1HG ARG 22 0.516 -9.901 12.708 174 HG3 ARG 22 2HG ARG 22 0.308 -8.352 11.875 175 HD2 ARG 22 1HD ARG 22 -0.072 -9.394 9.788 176 HD3 ARG 22 2HD ARG 22 0.760 -10.891 10.275 177 HE ARG 22 HE ARG 22 -1.673 -10.098 11.731 178 HH11 ARG 22 1HH1 ARG 22 -0.686 -12.123 8.928 179 HH12 ARG 22 2HH1 ARG 22 -1.918 -13.297 9.294 180 HH21 ARG 22 1HH2 ARG 22 -3.251 -11.582 11.971 181 HH22 ARG 22 2HH2 ARG 22 -3.294 -13.048 11.016 182 H THR 23 H THR 23 1.674 -10.917 14.150 183 HA THR 23 HA THR 23 3.737 -12.435 15.268 184 HB THR 23 HB THR 23 0.837 -13.151 14.673 185 HG1 THR 23 1HG THR 23 2.114 -12.116 16.965 186 HG21 THR 23 3HG2 THR 23 2.865 -14.449 16.520 187 HG22 THR 23 1HG2 THR 23 2.147 -15.135 15.047 188 HG23 THR 23 2HG2 THR 23 1.114 -14.817 16.470 189 HA PRO 24 HA PRO 24 3.611 -15.812 11.892 190 HB2 PRO 24 1HB PRO 24 2.269 -15.335 9.537 191 HB3 PRO 24 2HB PRO 24 1.625 -16.248 10.934 192 HG2 PRO 24 1HG PRO 24 1.192 -13.359 10.134 193 HG3 PRO 24 2HG PRO 24 -0.038 -14.543 10.709 194 HD2 PRO 24 1HD PRO 24 1.029 -12.678 12.361 195 HD3 PRO 24 2HD PRO 24 0.673 -14.342 12.925 196 H ALA 25 H ALA 25 3.894 -12.620 11.439 197 HA ALA 25 HA ALA 25 4.905 -11.087 10.037 198 HB1 ALA 25 1HB ALA 25 7.043 -13.159 10.476 199 HB2 ALA 25 2HB ALA 25 7.345 -11.523 9.830 200 HB3 ALA 25 3HB ALA 25 6.674 -11.724 11.466 201 H LEU 26 H LEU 26 4.042 -10.837 8.096 202 HA LEU 26 HA LEU 26 3.895 -13.088 6.230 203 HB2 LEU 26 1HB LEU 26 2.870 -10.219 6.084 204 HB3 LEU 26 2HB LEU 26 2.656 -11.345 4.751 205 HG LEU 26 HG LEU 26 1.611 -11.875 7.572 206 HD11 LEU 26 1HD1 LEU 26 0.506 -9.941 6.492 207 HD12 LEU 26 2HD1 LEU 26 -0.600 -11.310 6.691 208 HD13 LEU 26 3HD1 LEU 26 0.090 -10.958 5.102 209 HD21 LEU 26 3HD2 LEU 26 1.933 -13.953 6.296 210 HD22 LEU 26 1HD2 LEU 26 1.059 -13.264 4.909 211 HD23 LEU 26 2HD2 LEU 26 0.212 -13.564 6.432 212 HA PRO 27 HA PRO 27 7.124 -11.687 3.409 213 HB2 PRO 27 1HB PRO 27 6.496 -12.988 1.129 214 HB3 PRO 27 2HB PRO 27 6.986 -13.895 2.597 215 HG2 PRO 27 1HG PRO 27 4.187 -13.332 1.627 216 HG3 PRO 27 2HG PRO 27 4.881 -14.911 2.098 217 HD2 PRO 27 1HD PRO 27 3.423 -13.367 3.838 218 HD3 PRO 27 2HD PRO 27 4.805 -14.354 4.405 219 H VAL 28 H VAL 28 7.368 -10.188 1.617 220 HA VAL 28 HA VAL 28 4.937 -8.531 1.118 221 HB VAL 28 HB VAL 28 7.618 -7.637 2.261 222 HG11 VAL 28 1HG1 VAL 28 5.039 -6.093 1.813 223 HG12 VAL 28 2HG1 VAL 28 6.457 -5.473 2.697 224 HG13 VAL 28 3HG1 VAL 28 6.601 -5.844 0.987 225 HG21 VAL 28 3HG2 VAL 28 6.470 -8.807 4.013 226 HG22 VAL 28 1HG2 VAL 28 6.318 -7.088 4.316 227 HG23 VAL 28 2HG2 VAL 28 4.935 -7.986 3.639 228 H ALA 29 H ALA 29 5.022 -9.395 -1.089 229 HA ALA 29 HA ALA 29 7.369 -8.797 -2.740 230 HB1 ALA 29 1HB ALA 29 6.057 -9.655 -4.577 231 HB2 ALA 29 2HB ALA 29 6.050 -10.786 -3.196 232 HB3 ALA 29 3HB ALA 29 4.623 -9.784 -3.525 233 H TRP 30 H TRP 30 7.706 -6.692 -3.254 234 HA TRP 30 HA TRP 30 5.599 -4.697 -3.723 235 HB2 TRP 30 1HB TRP 30 8.623 -4.672 -4.164 236 HB3 TRP 30 2HB TRP 30 7.573 -3.275 -4.270 237 HD1 TRP 30 HD TRP 30 9.207 -5.518 -1.603 238 HE1 TRP 30 1HE TRP 30 8.835 -4.489 0.705 239 HE3 TRP 30 3HE TRP 30 6.064 -1.786 -2.935 240 HZ2 TRP 30 2HZ TRP 30 7.023 -2.535 1.881 241 HZ3 TRP 30 3HZ TRP 30 4.893 -0.398 -1.217 242 HH2 TRP 30 HH TRP 30 5.389 -0.752 1.190 243 H GLN 31 H GLN 31 5.820 -3.408 -5.877 244 HA GLN 31 HA GLN 31 5.843 -4.806 -8.345 245 HB2 GLN 31 1HB GLN 31 6.940 -2.078 -7.580 246 HB3 GLN 31 2HB GLN 31 6.703 -2.582 -9.237 247 HG2 GLN 31 1HG GLN 31 4.347 -2.556 -9.068 248 HG3 GLN 31 2HG GLN 31 4.385 -2.502 -7.303 249 HE21 GLN 31 1HE2 GLN 31 4.219 -0.561 -10.100 250 HE22 GLN 31 2HE2 GLN 31 4.578 0.977 -9.347 251 H ASN 32 H ASN 32 7.474 -5.343 -9.719 252 HA ASN 32 HA ASN 32 9.445 -5.941 -10.622 253 HB2 ASN 32 1HB ASN 32 10.194 -3.266 -9.408 254 HB3 ASN 32 2HB ASN 32 11.313 -4.218 -10.364 255 HD21 ASN 32 1HD2 ASN 32 7.812 -4.135 -11.366 256 HD22 ASN 32 2HD2 ASN 32 8.216 -3.244 -12.799 257 H THR 33 H THR 33 9.423 -5.938 -7.184 258 HA THR 33 HA THR 33 12.106 -6.673 -6.720 259 HB THR 33 HB THR 33 10.298 -5.941 -5.035 260 HG1 THR 33 1HG THR 33 11.534 -6.682 -3.501 261 HG21 THR 33 3HG2 THR 33 9.136 -7.664 -3.802 262 HG22 THR 33 1HG2 THR 33 9.748 -8.911 -4.887 263 HG23 THR 33 2HG2 THR 33 8.620 -7.712 -5.508 264 H LYS 34 H LYS 34 12.837 -8.772 -6.023 265 HA LYS 34 HA LYS 34 11.968 -11.032 -7.768 266 HB2 LYS 34 1HB LYS 34 14.282 -10.595 -5.821 267 HB3 LYS 34 2HB LYS 34 13.815 -12.189 -6.404 268 HG2 LYS 34 1HG LYS 34 15.555 -11.571 -7.791 269 HG3 LYS 34 2HG LYS 34 14.117 -11.386 -8.767 270 HD2 LYS 34 1HD LYS 34 15.321 -8.992 -7.351 271 HD3 LYS 34 2HD LYS 34 16.097 -9.637 -8.783 272 HE2 LYS 34 1HE LYS 34 13.233 -8.581 -8.718 273 HE3 LYS 34 2HE LYS 34 14.651 -7.694 -9.264 274 HZ1 LYS 34 3HZ LYS 34 13.594 -8.528 -11.133 275 HZ2 LYS 34 1HZ LYS 34 13.490 -10.079 -10.555 276 HZ3 LYS 34 2HZ LYS 34 14.929 -9.433 -10.996 277 H PHE 35 H PHE 35 10.437 -12.481 -6.911 278 HA PHE 35 HA PHE 35 10.065 -12.500 -4.018 279 HB2 PHE 35 1HB PHE 35 7.828 -12.020 -4.090 280 HB3 PHE 35 2HB PHE 35 8.509 -10.792 -5.099 281 HD1 PHE 35 2HD PHE 35 8.519 -11.492 -7.781 282 HD2 PHE 35 1HD PHE 35 5.825 -12.934 -4.733 283 HE1 PHE 35 2HE PHE 35 6.875 -12.131 -9.521 284 HE2 PHE 35 1HE PHE 35 4.191 -13.577 -6.492 285 HZ PHE 35 HZ PHE 35 4.712 -13.179 -8.885 286 H THR 36 H THR 36 8.299 -14.233 -3.566 287 HA THR 36 HA THR 36 7.814 -16.365 -3.434 288 HB THR 36 HB THR 36 8.126 -16.240 -6.185 289 HG1 THR 36 1HG THR 36 7.323 -18.658 -5.236 290 HG21 THR 36 3HG2 THR 36 9.581 -18.761 -5.345 291 HG22 THR 36 1HG2 THR 36 10.380 -17.340 -6.048 292 HG23 THR 36 2HG2 THR 36 9.167 -18.207 -6.978 293 HA PRO 37 HA PRO 37 8.226 -18.952 -3.340 294 HB2 PRO 37 1HB PRO 37 8.570 -20.417 -1.079 295 HB3 PRO 37 2HB PRO 37 9.536 -20.662 -2.558 296 HG2 PRO 37 1HG PRO 37 10.281 -19.001 -0.117 297 HG3 PRO 37 2HG PRO 37 11.246 -20.293 -0.908 298 HD2 PRO 37 1HD PRO 37 11.676 -17.707 -1.552 299 HD3 PRO 37 2HD PRO 37 11.645 -18.950 -2.825 300 HA PRO 38 HA PRO 38 5.362 -16.863 -0.610 301 HB2 PRO 38 1HB PRO 38 3.324 -18.628 -0.306 302 HB3 PRO 38 2HB PRO 38 3.754 -17.957 -1.919 303 HG2 PRO 38 1HG PRO 38 4.621 -20.623 -0.736 304 HG3 PRO 38 2HG PRO 38 3.860 -20.315 -2.331 305 HD2 PRO 38 1HD PRO 38 6.550 -20.511 -2.071 306 HD3 PRO 38 2HD PRO 38 5.815 -19.319 -3.187 307 H ALA 39 H ALA 39 3.887 -17.342 1.450 308 HA ALA 39 HA ALA 39 5.373 -18.812 3.494 309 HB1 ALA 39 1HB ALA 39 3.934 -17.589 5.108 310 HB2 ALA 39 2HB ALA 39 5.032 -16.529 4.213 311 HB3 ALA 39 3HB ALA 39 3.298 -16.600 3.782 312 H ALA 40 H ALA 40 4.697 -20.622 2.399 313 HA ALA 40 HA ALA 40 3.466 -22.557 2.235 314 HB1 ALA 40 1HB ALA 40 2.126 -23.130 4.147 315 HB2 ALA 40 2HB ALA 40 3.488 -22.161 4.717 316 HB3 ALA 40 3HB ALA 40 1.873 -21.429 4.573 317 H GLY 41 H GLY 41 2.604 -20.356 0.592 318 HA2 GLY 41 2HA GLY 41 1.087 -20.538 -1.219 319 HA3 GLY 41 1HA GLY 41 -0.114 -21.321 -0.178 320 H VAL 42 H VAL 42 1.052 -18.901 1.688 321 HA VAL 42 HA VAL 42 -0.939 -16.907 0.787 322 HB VAL 42 HB VAL 42 0.410 -17.309 3.519 323 HG11 VAL 42 1HG1 VAL 42 -1.396 -15.834 4.373 324 HG12 VAL 42 2HG1 VAL 42 -0.268 -15.015 3.296 325 HG13 VAL 42 3HG1 VAL 42 -1.867 -15.487 2.690 326 HG21 VAL 42 3HG2 VAL 42 -1.170 -19.194 2.997 327 HG22 VAL 42 1HG2 VAL 42 -1.640 -18.223 4.362 328 HG23 VAL 42 2HG2 VAL 42 -2.466 -17.968 2.828 329 H TYR 43 H TYR 43 -0.310 -14.813 0.370 330 HA TYR 43 HA TYR 43 2.125 -13.729 1.381 331 HB2 TYR 43 1HB TYR 43 3.170 -13.311 -0.926 332 HB3 TYR 43 2HB TYR 43 3.324 -14.929 -0.311 333 HD1 TYR 43 2HD TYR 43 1.839 -16.805 -1.222 334 HD2 TYR 43 1HD TYR 43 1.858 -12.836 -2.897 335 HE1 TYR 43 2HE TYR 43 0.850 -17.686 -3.258 336 HE2 TYR 43 1HE TYR 43 0.637 -13.675 -4.868 337 HH TYR 43 HH TYR 43 -0.533 -17.027 -5.017 338 H LEU 44 H LEU 44 2.501 -11.489 0.459 339 HA LEU 44 HA LEU 44 -0.072 -10.205 -0.305 340 HB2 LEU 44 1HB LEU 44 2.323 -8.980 1.125 341 HB3 LEU 44 2HB LEU 44 0.803 -8.184 0.685 342 HG LEU 44 HG LEU 44 1.096 -10.406 2.732 343 HD11 LEU 44 1HD1 LEU 44 0.604 -8.664 4.382 344 HD12 LEU 44 2HD1 LEU 44 0.573 -7.438 3.099 345 HD13 LEU 44 3HD1 LEU 44 2.086 -8.288 3.477 346 HD21 LEU 44 3HD2 LEU 44 -1.252 -9.819 3.348 347 HD22 LEU 44 1HD2 LEU 44 -1.094 -10.543 1.747 348 HD23 LEU 44 2HD2 LEU 44 -1.338 -8.785 1.906 349 H ARG 45 H ARG 45 -0.019 -8.862 -2.036 350 HA ARG 45 HA ARG 45 2.559 -8.300 -3.422 351 HB2 ARG 45 1HB ARG 45 -0.015 -9.371 -4.631 352 HB3 ARG 45 2HB ARG 45 1.168 -8.446 -5.568 353 HG2 ARG 45 1HG ARG 45 2.943 -10.072 -4.989 354 HG3 ARG 45 2HG ARG 45 1.808 -10.988 -4.012 355 HD2 ARG 45 1HD ARG 45 2.030 -12.103 -6.128 356 HD3 ARG 45 2HD ARG 45 0.416 -11.363 -6.081 357 HE ARG 45 HE ARG 45 2.285 -9.518 -7.205 358 HH11 ARG 45 1HH1 ARG 45 0.676 -12.584 -8.154 359 HH12 ARG 45 2HH1 ARG 45 0.709 -12.178 -9.838 360 HH21 ARG 45 1HH2 ARG 45 2.334 -9.053 -9.307 361 HH22 ARG 45 2HH2 ARG 45 1.810 -10.150 -10.546 362 H ALA 46 H ALA 46 2.769 -6.236 -2.824 363 HA ALA 46 HA ALA 46 0.497 -4.376 -2.721 364 HB1 ALA 46 1HB ALA 46 3.501 -3.870 -2.583 365 HB2 ALA 46 2HB ALA 46 2.220 -2.709 -2.224 366 HB3 ALA 46 3HB ALA 46 2.441 -4.111 -1.170 367 H TYR 47 H TYR 47 0.372 -2.513 -4.212 368 HA TYR 47 HA TYR 47 2.334 -2.375 -6.358 369 HB2 TYR 47 1HB TYR 47 0.242 -3.719 -7.136 370 HB3 TYR 47 2HB TYR 47 -0.633 -2.213 -7.014 371 HD1 TYR 47 1HD TYR 47 0.395 -0.181 -8.230 372 HD2 TYR 47 2HD TYR 47 1.543 -4.218 -9.034 373 HE1 TYR 47 1HE TYR 47 1.416 0.556 -10.397 374 HE2 TYR 47 2HE TYR 47 2.383 -3.566 -11.270 375 HH TYR 47 HH TYR 47 1.672 -1.010 -12.873 376 H VAL 48 H VAL 48 3.071 -0.297 -6.076 377 HA VAL 48 HA VAL 48 1.271 1.842 -5.077 378 HB VAL 48 HB VAL 48 4.230 2.001 -5.833 379 HG11 VAL 48 1HG1 VAL 48 2.443 3.855 -4.192 380 HG12 VAL 48 2HG1 VAL 48 4.170 4.095 -4.517 381 HG13 VAL 48 3HG1 VAL 48 3.006 4.159 -5.844 382 HG21 VAL 48 3HG2 VAL 48 4.775 2.012 -3.446 383 HG22 VAL 48 1HG2 VAL 48 3.086 1.714 -3.017 384 HG23 VAL 48 2HG2 VAL 48 4.029 0.478 -3.874 385 H MET 49 H MET 49 0.360 3.174 -6.680 386 HA MET 49 HA MET 49 1.349 2.994 -9.498 387 HB2 MET 49 1HB MET 49 -1.192 3.254 -10.058 388 HB3 MET 49 2HB MET 49 -0.456 1.684 -9.832 389 HG2 MET 49 1HG MET 49 -1.090 1.833 -7.438 390 HG3 MET 49 2HG MET 49 -1.969 3.283 -7.828 391 HE1 MET 49 3HE MET 49 -1.921 -0.517 -7.754 392 HE2 MET 49 1HE MET 49 -3.201 -1.046 -8.880 393 HE3 MET 49 2HE MET 49 -1.709 -0.350 -9.531 394 HA PRO 50 HA PRO 50 1.205 7.249 -7.771 395 HB2 PRO 50 1HB PRO 50 3.786 7.920 -8.497 396 HB3 PRO 50 2HB PRO 50 3.371 7.089 -6.992 397 HG2 PRO 50 1HG PRO 50 4.618 5.968 -9.440 398 HG3 PRO 50 2HG PRO 50 4.725 5.385 -7.762 399 HD2 PRO 50 1HD PRO 50 3.063 4.398 -9.853 400 HD3 PRO 50 2HD PRO 50 2.921 3.876 -8.168 401 H ALA 51 H ALA 51 0.737 9.148 -8.923 402 HA ALA 51 HA ALA 51 0.042 8.884 -11.657 403 HB1 ALA 51 1HB ALA 51 -0.986 10.535 -10.131 404 HB2 ALA 51 2HB ALA 51 0.563 11.407 -10.007 405 HB3 ALA 51 3HB ALA 51 -0.315 11.339 -11.546 406 H ALA 52 H ALA 52 0.948 9.730 -13.536 407 HA ALA 52 HA ALA 52 3.719 10.750 -13.456 408 HB1 ALA 52 1HB ALA 52 4.465 9.152 -15.144 409 HB2 ALA 52 2HB ALA 52 3.752 8.222 -13.815 410 HB3 ALA 52 3HB ALA 52 2.816 8.500 -15.295 411 H THR 53 H THR 53 0.931 11.676 -14.146 412 HA THR 53 HA THR 53 1.126 12.400 -16.988 413 HB THR 53 HB THR 53 -1.224 13.388 -16.370 414 HG1 THR 53 1HG THR 53 -1.606 13.292 -14.363 415 HG21 THR 53 3HG2 THR 53 -2.228 11.102 -16.457 416 HG22 THR 53 1HG2 THR 53 -0.597 10.407 -16.261 417 HG23 THR 53 2HG2 THR 53 -0.980 11.386 -17.669 418 H ILE 54 H ILE 54 3.215 13.530 -15.668 419 HA ILE 54 HA ILE 54 2.549 16.229 -14.751 420 HB ILE 54 HB ILE 54 5.236 15.337 -15.772 421 HG12 ILE 54 1HG1 ILE 54 4.161 15.105 -12.927 422 HG13 ILE 54 2HG1 ILE 54 4.570 13.753 -13.985 423 HG21 ILE 54 1HG2 ILE 54 4.933 17.753 -15.542 424 HG22 ILE 54 2HG2 ILE 54 4.457 17.546 -13.840 425 HG23 ILE 54 3HG2 ILE 54 6.114 17.179 -14.386 426 HD11 ILE 54 3HD1 ILE 54 6.372 13.982 -12.435 427 HD12 ILE 54 1HD1 ILE 54 6.965 14.529 -14.012 428 HD13 ILE 54 2HD1 ILE 54 6.534 15.710 -12.745 429 H SER 55 H SER 55 2.110 17.770 -15.992 430 HA SER 55 HA SER 55 1.770 19.261 -17.657 431 HB2 SER 55 1HB SER 55 4.272 18.913 -18.060 432 HB3 SER 55 2HB SER 55 3.799 17.764 -19.301 433 HG SER 55 HG SER 55 3.606 20.538 -19.188 434 H ARG 56 H ARG 56 1.269 19.154 -20.221 435 HA ARG 56 HA ARG 56 -0.412 18.715 -21.664 436 HB2 ARG 56 1HB ARG 56 -0.012 15.834 -20.820 437 HB3 ARG 56 2HB ARG 56 -0.962 16.334 -22.210 438 HG2 ARG 56 1HG ARG 56 0.854 16.751 -23.513 439 HG3 ARG 56 2HG ARG 56 1.864 17.255 -22.153 440 HD2 ARG 56 1HD ARG 56 2.552 15.108 -23.284 441 HD3 ARG 56 2HD ARG 56 2.418 15.081 -21.532 442 HE ARG 56 HE ARG 56 0.057 14.094 -21.991 443 HH11 ARG 56 1HH1 ARG 56 2.970 13.289 -23.815 444 HH12 ARG 56 2HH1 ARG 56 2.746 11.576 -23.736 445 HH21 ARG 56 1HH2 ARG 56 -0.305 11.842 -21.907 446 HH22 ARG 56 2HH2 ARG 56 0.781 10.777 -22.702 447 H ASP 57 H ASP 57 -0.984 19.034 -18.652 448 HA ASP 57 HA ASP 57 -3.724 17.903 -18.567 449 HB2 ASP 57 1HB ASP 57 -2.499 19.635 -16.441 450 HB3 ASP 57 2HB ASP 57 -3.810 18.506 -16.322 451 H ALA 58 H ALA 58 -5.472 19.237 -18.190 452 HA ALA 58 HA ALA 58 -5.328 22.165 -18.164 453 HB1 ALA 58 1HB ALA 58 -4.958 21.882 -20.509 454 HB2 ALA 58 2HB ALA 58 -6.190 20.624 -20.630 455 HB3 ALA 58 3HB ALA 58 -6.681 22.296 -20.334 456 H ALA 59 H ALA 59 -6.342 21.065 -16.141 457 HA ALA 59 HA ALA 59 -9.222 21.539 -16.269 458 HB1 ALA 59 1HB ALA 59 -9.119 19.160 -16.941 459 HB2 ALA 59 2HB ALA 59 -8.233 18.761 -15.462 460 HB3 ALA 59 3HB ALA 59 -9.910 19.350 -15.379 461 H GLY 60 H GLY 60 -6.557 22.324 -14.785 462 HA2 GLY 60 2HA GLY 60 -5.939 22.850 -12.656 463 HA3 GLY 60 1HA GLY 60 -7.480 22.261 -12.013 464 H ASP 61 H ASP 61 -5.200 20.591 -14.148 465 HA ASP 61 HA ASP 61 -4.734 18.444 -12.126 466 HB2 ASP 61 1HB ASP 61 -6.045 18.163 -14.526 467 HB3 ASP 61 2HB ASP 61 -4.392 17.438 -14.580 468 H HIS 62 H HIS 62 -3.311 20.826 -14.165 469 HA HIS 62 HA HIS 62 -0.740 19.727 -14.573 470 HB2 HIS 62 1HB HIS 62 -1.932 22.325 -14.854 471 HB3 HIS 62 2HB HIS 62 -0.469 22.470 -13.908 472 HD1 HIS 62 1HD HIS 62 -1.635 21.650 -17.527 473 HD2 HIS 62 2HD HIS 62 1.866 21.956 -15.127 474 HE1 HIS 62 1HE HIS 62 0.333 21.763 -19.083 475 H ARG 63 H ARG 63 0.727 19.101 -13.179 476 HA ARG 63 HA ARG 63 1.985 18.835 -11.378 477 HB2 ARG 63 1HB ARG 63 2.489 21.169 -11.889 478 HB3 ARG 63 2HB ARG 63 1.188 21.727 -10.863 479 HG2 ARG 63 1HG ARG 63 2.472 20.913 -8.869 480 HG3 ARG 63 2HG ARG 63 3.648 20.133 -9.932 481 HD2 ARG 63 1HD ARG 63 4.649 22.158 -9.157 482 HD3 ARG 63 2HD ARG 63 4.213 22.402 -10.838 483 HE ARG 63 HE ARG 63 2.948 24.168 -10.224 484 HH11 ARG 63 1HH1 ARG 63 3.475 22.312 -7.216 485 HH12 ARG 63 2HH1 ARG 63 2.234 23.183 -6.360 486 HH21 ARG 63 1HH2 ARG 63 1.512 25.475 -8.919 487 HH22 ARG 63 2HH2 ARG 63 1.309 25.063 -7.258 488 H GLN 64 H GLN 64 -0.952 18.203 -11.241 489 HA GLN 64 HA GLN 64 -1.236 18.066 -8.284 490 HB2 GLN 64 1HB GLN 64 -3.081 17.119 -10.504 491 HB3 GLN 64 2HB GLN 64 -3.375 16.863 -8.806 492 HG2 GLN 64 1HG GLN 64 -2.777 19.688 -9.137 493 HG3 GLN 64 2HG GLN 64 -3.962 19.238 -10.347 494 HE21 GLN 64 1HE2 GLN 64 -6.133 19.155 -9.623 495 HE22 GLN 64 2HE2 GLN 64 -6.598 19.211 -7.925 496 H TYR 65 H TYR 65 -0.075 16.566 -7.383 497 HA TYR 65 HA TYR 65 0.614 14.026 -8.768 498 HB2 TYR 65 1HB TYR 65 2.001 15.677 -6.874 499 HB3 TYR 65 2HB TYR 65 1.611 14.168 -6.096 500 HD1 TYR 65 2HD TYR 65 2.888 15.329 -9.361 501 HD2 TYR 65 1HD TYR 65 3.175 12.388 -6.241 502 HE1 TYR 65 2HE TYR 65 4.950 14.378 -10.450 503 HE2 TYR 65 1HE TYR 65 5.209 11.452 -7.254 504 HH TYR 65 HH TYR 65 6.144 12.121 -10.371 505 H ARG 66 H ARG 66 -0.172 12.081 -8.046 506 HA ARG 66 HA ARG 66 -2.000 11.858 -5.813 507 HB2 ARG 66 1HB ARG 66 -3.038 12.807 -8.042 508 HB3 ARG 66 2HB ARG 66 -2.776 11.167 -8.668 509 HG2 ARG 66 1HG ARG 66 -4.195 10.279 -6.826 510 HG3 ARG 66 2HG ARG 66 -4.312 11.927 -6.187 511 HD2 ARG 66 1HD ARG 66 -5.200 11.175 -9.006 512 HD3 ARG 66 2HD ARG 66 -6.288 10.996 -7.634 513 HE ARG 66 HE ARG 66 -5.219 13.537 -8.788 514 HH11 ARG 66 1HH1 ARG 66 -7.607 11.946 -6.713 515 HH12 ARG 66 2HH1 ARG 66 -8.366 13.406 -6.196 516 HH21 ARG 66 1HH2 ARG 66 -6.476 15.451 -8.397 517 HH22 ARG 66 2HH2 ARG 66 -7.816 15.367 -7.316 518 H GLY 67 H GLY 67 -2.709 9.354 -5.827 519 HA2 GLY 67 2HA GLY 67 -1.612 7.652 -7.683 520 HA3 GLY 67 1HA GLY 67 -0.519 7.584 -6.306 521 H VAL 68 H VAL 68 -1.749 5.248 -6.842 522 HA VAL 68 HA VAL 68 -3.691 5.010 -4.622 523 HB VAL 68 HB VAL 68 -3.846 3.853 -7.424 524 HG11 VAL 68 1HG1 VAL 68 -4.302 1.965 -5.936 525 HG12 VAL 68 2HG1 VAL 68 -5.486 2.943 -5.041 526 HG13 VAL 68 3HG1 VAL 68 -5.769 2.525 -6.738 527 HG21 VAL 68 3HG2 VAL 68 -5.763 5.512 -5.799 528 HG22 VAL 68 1HG2 VAL 68 -4.827 6.021 -7.222 529 HG23 VAL 68 2HG2 VAL 68 -6.085 4.812 -7.396 530 H PHE 69 H PHE 69 -3.514 2.964 -3.523 531 HA PHE 69 HA PHE 69 -0.996 1.494 -3.981 532 HB2 PHE 69 1HB PHE 69 -0.372 3.217 -2.477 533 HB3 PHE 69 2HB PHE 69 -1.763 2.962 -1.448 534 HD1 PHE 69 1HD PHE 69 0.936 0.705 -2.877 535 HD2 PHE 69 2HD PHE 69 -1.129 2.124 0.641 536 HE1 PHE 69 1HE PHE 69 2.373 -0.715 -1.434 537 HE2 PHE 69 2HE PHE 69 0.240 0.627 2.048 538 HZ PHE 69 HZ PHE 69 1.988 -0.787 1.027 539 H GLN 70 H GLN 70 -1.690 -0.433 -4.336 540 HA GLN 70 HA GLN 70 -4.217 -1.469 -3.154 541 HB2 GLN 70 1HB GLN 70 -4.060 -1.128 -5.596 542 HB3 GLN 70 2HB GLN 70 -2.598 -2.110 -5.687 543 HG2 GLN 70 1HG GLN 70 -3.783 -4.135 -5.299 544 HG3 GLN 70 2HG GLN 70 -5.171 -3.286 -4.593 545 HE21 GLN 70 1HE2 GLN 70 -6.952 -3.548 -5.974 546 HE22 GLN 70 2HE2 GLN 70 -6.868 -3.256 -7.695 547 H VAL 71 H VAL 71 -4.096 -3.556 -2.080 548 HA VAL 71 HA VAL 71 -1.555 -5.020 -2.258 549 HB VAL 71 HB VAL 71 -2.908 -4.517 0.426 550 HG11 VAL 71 1HG1 VAL 71 -0.427 -6.163 -0.317 551 HG12 VAL 71 2HG1 VAL 71 -0.995 -5.847 1.328 552 HG13 VAL 71 3HG1 VAL 71 -1.966 -6.826 0.240 553 HG21 VAL 71 3HG2 VAL 71 -0.169 -3.629 -0.580 554 HG22 VAL 71 1HG2 VAL 71 -1.552 -2.575 -0.244 555 HG23 VAL 71 2HG2 VAL 71 -0.783 -3.451 1.073 556 H ASN 72 H ASN 72 -2.066 -6.901 -3.053 557 HA ASN 72 HA ASN 72 -4.749 -8.124 -2.588 558 HB2 ASN 72 1HB ASN 72 -2.425 -8.698 -4.494 559 HB3 ASN 72 2HB ASN 72 -3.713 -9.858 -4.197 560 HD21 ASN 72 1HD2 ASN 72 -3.971 -9.633 -6.566 561 HD22 ASN 72 2HD2 ASN 72 -5.031 -8.351 -7.168 562 H VAL 73 H VAL 73 -4.744 -9.104 -0.595 563 HA VAL 73 HA VAL 73 -2.505 -10.888 0.118 564 HB VAL 73 HB VAL 73 -3.636 -9.825 1.950 565 HG11 VAL 73 1HG1 VAL 73 -5.869 -9.403 1.024 566 HG12 VAL 73 2HG1 VAL 73 -6.244 -11.138 1.153 567 HG13 VAL 73 3HG1 VAL 73 -5.933 -10.174 2.608 568 HG21 VAL 73 3HG2 VAL 73 -4.307 -11.874 3.251 569 HG22 VAL 73 1HG2 VAL 73 -4.334 -12.794 1.746 570 HG23 VAL 73 2HG2 VAL 73 -2.806 -12.112 2.316 571 H VAL 74 H VAL 74 -2.363 -12.855 -0.780 572 HA VAL 74 HA VAL 74 -4.750 -14.102 -2.029 573 HB VAL 74 HB VAL 74 -1.795 -14.503 -2.680 574 HG11 VAL 74 1HG1 VAL 74 -4.327 -15.597 -4.002 575 HG12 VAL 74 2HG1 VAL 74 -2.645 -15.876 -4.546 576 HG13 VAL 74 3HG1 VAL 74 -3.183 -16.506 -2.994 577 HG21 VAL 74 3HG2 VAL 74 -3.849 -13.272 -4.553 578 HG22 VAL 74 1HG2 VAL 74 -2.753 -12.291 -3.585 579 HG23 VAL 74 2HG2 VAL 74 -2.095 -13.417 -4.771 580 H MET 75 H MET 75 -5.246 -16.196 -1.089 581 HA MET 75 HA MET 75 -3.237 -17.384 0.735 582 HB2 MET 75 1HB MET 75 -6.155 -16.882 1.465 583 HB3 MET 75 2HB MET 75 -5.030 -17.791 2.436 584 HG2 MET 75 1HG MET 75 -4.310 -15.931 3.429 585 HG3 MET 75 2HG MET 75 -3.981 -15.121 1.917 586 HE1 MET 75 3HE MET 75 -5.851 -13.947 0.414 587 HE2 MET 75 1HE MET 75 -7.181 -15.106 0.617 588 HE3 MET 75 2HE MET 75 -7.412 -13.395 1.036 589 HA PRO 76 HA PRO 76 -4.558 -20.900 -1.522 590 HB2 PRO 76 1HB PRO 76 -4.037 -23.044 0.083 591 HB3 PRO 76 2HB PRO 76 -2.726 -21.954 -0.458 592 HG2 PRO 76 1HG PRO 76 -4.219 -21.860 2.173 593 HG3 PRO 76 2HG PRO 76 -2.445 -21.865 1.904 594 HD2 PRO 76 1HD PRO 76 -3.849 -19.573 2.263 595 HD3 PRO 76 2HD PRO 76 -2.462 -19.641 1.127 596 H ILE 77 H ILE 77 -6.062 -22.793 -1.558 597 HA ILE 77 HA ILE 77 -8.395 -22.472 0.257 598 HB ILE 77 HB ILE 77 -8.420 -23.372 -2.630 599 HG12 ILE 77 1HG1 ILE 77 -9.356 -20.729 -1.421 600 HG13 ILE 77 2HG1 ILE 77 -7.884 -20.919 -2.353 601 HG21 ILE 77 1HG2 ILE 77 -10.878 -23.276 -2.361 602 HG22 ILE 77 2HG2 ILE 77 -10.203 -24.364 -1.165 603 HG23 ILE 77 3HG2 ILE 77 -10.693 -22.717 -0.680 604 HD11 ILE 77 3HD1 ILE 77 -9.526 -20.038 -3.804 605 HD12 ILE 77 1HD1 ILE 77 -9.210 -21.703 -4.310 606 HD13 ILE 77 2HD1 ILE 77 -10.693 -21.314 -3.400 607 H GLY 78 H GLY 78 -8.191 -24.001 1.726 608 HA2 GLY 78 2HA GLY 78 -8.810 -26.443 1.886 609 HA3 GLY 78 1HA GLY 78 -7.389 -26.772 0.903 610 H ASP 79 H ASP 79 -6.063 -24.387 2.493 611 HA ASP 79 HA ASP 79 -5.193 -26.117 4.751 612 HB2 ASP 79 1HB ASP 79 -3.750 -25.554 2.498 613 HB3 ASP 79 2HB ASP 79 -3.223 -24.210 3.514 614 H GLY 80 H GLY 80 -7.212 -24.706 5.348 615 HA2 GLY 80 2HA GLY 80 -8.060 -23.143 6.814 616 HA3 GLY 80 1HA GLY 80 -6.411 -22.613 7.209 617 H SER 81 H SER 81 -8.839 -22.571 4.469 618 HA SER 81 HA SER 81 -7.708 -20.243 3.226 619 HB2 SER 81 1HB SER 81 -10.507 -20.822 2.650 620 HB3 SER 81 2HB SER 81 -9.113 -20.863 1.603 621 HG SER 81 HG SER 81 -10.426 -22.873 2.034 622 H ARG 82 H ARG 82 -9.890 -18.547 2.957 623 HA ARG 82 HA ARG 82 -11.148 -16.911 3.918 624 HB2 ARG 82 1HB ARG 82 -11.558 -18.764 6.275 625 HB3 ARG 82 2HB ARG 82 -12.506 -17.379 5.807 626 HG2 ARG 82 1HG ARG 82 -13.853 -18.955 4.953 627 HG3 ARG 82 2HG ARG 82 -12.845 -18.740 3.532 628 HD2 ARG 82 1HD ARG 82 -12.228 -20.942 3.614 629 HD3 ARG 82 2HD ARG 82 -11.678 -20.768 5.279 630 HE ARG 82 HE ARG 82 -13.524 -21.785 6.012 631 HH11 ARG 82 1HH1 ARG 82 -14.632 -20.375 2.929 632 HH12 ARG 82 2HH1 ARG 82 -15.851 -21.580 2.691 633 HH21 ARG 82 1HH2 ARG 82 -15.224 -23.179 5.786 634 HH22 ARG 82 2HH2 ARG 82 -16.471 -22.911 4.607 635 H SER 83 H SER 83 -8.128 -17.395 4.819 636 HA SER 83 HA SER 83 -7.813 -15.901 7.233 637 HB2 SER 83 1HB SER 83 -6.055 -16.453 4.825 638 HB3 SER 83 2HB SER 83 -5.462 -15.654 6.285 639 HG SER 83 HG SER 83 -6.855 -18.119 6.494 640 H ALA 84 H ALA 84 -8.817 -14.831 4.118 641 HA ALA 84 HA ALA 84 -7.844 -12.330 3.749 642 HB1 ALA 84 1HB ALA 84 -10.025 -11.814 2.625 643 HB2 ALA 84 2HB ALA 84 -9.397 -13.407 2.174 644 HB3 ALA 84 3HB ALA 84 -10.722 -13.268 3.355 645 H GLU 85 H GLU 85 -10.573 -13.143 5.945 646 HA GLU 85 HA GLU 85 -11.382 -10.526 6.494 647 HB2 GLU 85 1HB GLU 85 -11.497 -13.071 8.204 648 HB3 GLU 85 2HB GLU 85 -12.350 -11.564 8.553 649 HG2 GLU 85 1HG GLU 85 -14.010 -12.471 7.448 650 HG3 GLU 85 2HG GLU 85 -13.179 -11.914 5.985 651 H GLN 86 H GLN 86 -9.284 -12.618 8.476 652 HA GLN 86 HA GLN 86 -8.561 -10.853 10.473 653 HB2 GLN 86 1HB GLN 86 -7.581 -13.350 9.276 654 HB3 GLN 86 2HB GLN 86 -6.227 -12.385 9.758 655 HG2 GLN 86 1HG GLN 86 -8.591 -12.949 11.618 656 HG3 GLN 86 2HG GLN 86 -7.235 -14.030 11.390 657 HE21 GLN 86 1HE2 GLN 86 -5.601 -11.252 11.166 658 HE22 GLN 86 2HE2 GLN 86 -5.302 -10.938 12.852 659 H VAL 87 H VAL 87 -7.032 -11.114 7.194 660 HA VAL 87 HA VAL 87 -5.059 -9.107 7.970 661 HB VAL 87 HB VAL 87 -5.755 -10.495 5.312 662 HG11 VAL 87 1HG1 VAL 87 -3.555 -9.823 4.457 663 HG12 VAL 87 2HG1 VAL 87 -4.518 -8.392 4.822 664 HG13 VAL 87 3HG1 VAL 87 -3.234 -8.914 5.940 665 HG21 VAL 87 3HG2 VAL 87 -3.771 -11.853 5.736 666 HG22 VAL 87 1HG2 VAL 87 -3.449 -10.978 7.244 667 HG23 VAL 87 2HG2 VAL 87 -4.878 -12.023 7.094 668 H ALA 88 H ALA 88 -8.162 -9.005 6.135 669 HA ALA 88 HA ALA 88 -7.798 -6.335 5.198 670 HB1 ALA 88 1HB ALA 88 -9.672 -7.781 4.471 671 HB2 ALA 88 2HB ALA 88 -10.364 -7.718 6.108 672 HB3 ALA 88 3HB ALA 88 -10.256 -6.238 5.134 673 H ALA 89 H ALA 89 -8.893 -7.637 8.344 674 HA ALA 89 HA ALA 89 -9.570 -5.174 9.578 675 HB1 ALA 89 1HB ALA 89 -8.691 -7.896 10.652 676 HB2 ALA 89 2HB ALA 89 -9.262 -6.591 11.677 677 HB3 ALA 89 3HB ALA 89 -10.343 -7.294 10.456 678 H GLU 90 H GLU 90 -6.487 -6.970 9.407 679 HA GLU 90 HA GLU 90 -5.135 -5.198 11.286 680 HB2 GLU 90 1HB GLU 90 -4.081 -7.338 9.371 681 HB3 GLU 90 2HB GLU 90 -3.062 -6.372 10.474 682 HG2 GLU 90 1HG GLU 90 -4.974 -7.172 12.203 683 HG3 GLU 90 2HG GLU 90 -5.188 -8.426 11.101 684 H LEU 91 H LEU 91 -4.863 -5.645 7.783 685 HA LEU 91 HA LEU 91 -3.239 -3.465 7.138 686 HB2 LEU 91 1HB LEU 91 -5.423 -4.923 5.633 687 HB3 LEU 91 2HB LEU 91 -4.722 -3.512 4.920 688 HG LEU 91 HG LEU 91 -3.806 -5.742 4.173 689 HD11 LEU 91 1HD1 LEU 91 -2.713 -3.630 3.608 690 HD12 LEU 91 2HD1 LEU 91 -1.521 -4.904 3.928 691 HD13 LEU 91 3HD1 LEU 91 -1.831 -3.650 5.159 692 HD21 LEU 91 3HD2 LEU 91 -3.422 -6.704 6.475 693 HD22 LEU 91 1HD2 LEU 91 -2.115 -5.531 6.687 694 HD23 LEU 91 2HD2 LEU 91 -2.026 -6.753 5.391 695 H ASP 92 H ASP 92 -6.810 -3.486 7.723 696 HA ASP 92 HA ASP 92 -7.259 -0.790 6.823 697 HB2 ASP 92 1HB ASP 92 -9.182 -2.199 7.058 698 HB3 ASP 92 2HB ASP 92 -8.803 -2.587 8.746 699 H ALA 93 H ALA 93 -6.974 -2.132 10.140 700 HA ALA 93 HA ALA 93 -7.002 0.498 11.250 701 HB1 ALA 93 1HB ALA 93 -7.831 -1.608 12.333 702 HB2 ALA 93 2HB ALA 93 -6.145 -2.115 12.539 703 HB3 ALA 93 3HB ALA 93 -6.756 -0.641 13.355 704 H LEU 94 H LEU 94 -4.429 -1.350 9.914 705 HA LEU 94 HA LEU 94 -2.219 0.007 11.182 706 HB2 LEU 94 1HB LEU 94 -1.897 -2.104 10.015 707 HB3 LEU 94 2HB LEU 94 -2.574 -1.430 8.532 708 HG LEU 94 HG LEU 94 -0.613 0.116 8.351 709 HD11 LEU 94 1HD1 LEU 94 0.425 -1.424 10.751 710 HD12 LEU 94 2HD1 LEU 94 0.094 0.316 10.683 711 HD13 LEU 94 3HD1 LEU 94 1.409 -0.374 9.703 712 HD21 LEU 94 3HD2 LEU 94 0.970 -1.636 7.654 713 HD22 LEU 94 1HD2 LEU 94 -0.705 -2.041 7.190 714 HD23 LEU 94 2HD2 LEU 94 0.004 -2.828 8.568 715 H PHE 95 H PHE 95 -4.480 0.805 8.505 716 HA PHE 95 HA PHE 95 -2.909 3.244 7.900 717 HB2 PHE 95 1HB PHE 95 -4.274 1.288 6.037 718 HB3 PHE 95 2HB PHE 95 -3.931 2.936 5.557 719 HD1 PHE 95 2HD PHE 95 -1.663 3.759 5.162 720 HD2 PHE 95 1HD PHE 95 -2.411 -0.366 6.168 721 HE1 PHE 95 2HE PHE 95 0.636 3.200 4.491 722 HE2 PHE 95 1HE PHE 95 -0.108 -0.924 5.406 723 HZ PHE 95 HZ PHE 95 1.428 0.834 4.628 724 HA PRO 96 HA PRO 96 -7.207 4.572 9.188 725 HB2 PRO 96 1HB PRO 96 -6.470 6.640 10.816 726 HB3 PRO 96 2HB PRO 96 -6.438 4.940 11.354 727 HG2 PRO 96 1HG PRO 96 -4.111 6.561 10.299 728 HG3 PRO 96 2HG PRO 96 -4.203 5.616 11.824 729 HD2 PRO 96 1HD PRO 96 -3.121 4.566 9.568 730 HD3 PRO 96 2HD PRO 96 -4.129 3.562 10.659 731 H VAL 97 H VAL 97 -8.267 6.631 8.636 732 HA VAL 97 HA VAL 97 -7.575 7.532 6.060 733 HB VAL 97 HB VAL 97 -9.790 7.112 7.097 734 HG11 VAL 97 1HG1 VAL 97 -9.477 8.412 9.210 735 HG12 VAL 97 2HG1 VAL 97 -9.545 9.906 8.287 736 HG13 VAL 97 3HG1 VAL 97 -10.965 8.838 8.346 737 HG21 VAL 97 3HG2 VAL 97 -9.394 8.440 4.937 738 HG22 VAL 97 1HG2 VAL 97 -10.998 8.484 5.687 739 HG23 VAL 97 2HG2 VAL 97 -9.880 9.855 5.874 740 H ASN 98 H ASN 98 -5.730 8.423 8.181 741 HA ASN 98 HA ASN 98 -5.570 11.357 7.494 742 HB2 ASN 98 1HB ASN 98 -4.393 10.063 9.979 743 HB3 ASN 98 2HB ASN 98 -4.424 11.780 9.584 744 HD21 ASN 98 1HD2 ASN 98 -6.398 9.020 10.724 745 HD22 ASN 98 2HD2 ASN 98 -7.749 10.012 11.226 746 H LEU 99 H LEU 99 -3.593 8.445 8.342 747 HA LEU 99 HA LEU 99 -1.462 8.016 8.219 748 HB2 LEU 99 1HB LEU 99 -2.424 8.475 5.471 749 HB3 LEU 99 2HB LEU 99 -0.697 8.581 5.635 750 HG LEU 99 HG LEU 99 -1.353 6.350 5.003 751 HD11 LEU 99 1HD1 LEU 99 0.675 6.755 6.430 752 HD12 LEU 99 2HD1 LEU 99 0.030 5.123 6.458 753 HD13 LEU 99 3HD1 LEU 99 -0.267 6.218 7.833 754 HD21 LEU 99 3HD2 LEU 99 -2.465 4.869 6.690 755 HD22 LEU 99 1HD2 LEU 99 -3.521 6.123 6.040 756 HD23 LEU 99 2HD2 LEU 99 -2.821 6.267 7.677 757 H VAL 100 H VAL 100 -0.801 9.537 9.742 758 HA VAL 100 HA VAL 100 0.583 11.917 8.664 759 HB VAL 100 HB VAL 100 -0.615 12.320 10.620 760 HG11 VAL 100 1HG1 VAL 100 -0.881 10.131 11.648 761 HG12 VAL 100 2HG1 VAL 100 0.841 10.088 12.069 762 HG13 VAL 100 3HG1 VAL 100 -0.236 11.299 12.795 763 HG21 VAL 100 3HG2 VAL 100 1.123 13.200 12.076 764 HG22 VAL 100 1HG2 VAL 100 2.335 12.155 11.319 765 HG23 VAL 100 2HG2 VAL 100 1.542 13.432 10.368 766 H MET 101 H MET 101 1.939 10.804 7.214 767 HA MET 101 HA MET 101 4.406 10.034 8.550 768 HB2 MET 101 1HB MET 101 5.016 8.376 6.836 769 HB3 MET 101 2HB MET 101 3.813 7.843 7.998 770 HG2 MET 101 1HG MET 101 2.024 8.358 6.452 771 HG3 MET 101 2HG MET 101 3.156 9.060 5.328 772 HE1 MET 101 3HE MET 101 1.381 7.960 4.413 773 HE2 MET 101 1HE MET 101 2.563 7.630 3.135 774 HE3 MET 101 2HE MET 101 1.429 6.338 3.625 775 H GLN 102 H GLN 102 6.351 10.358 7.059 776 HA GLN 102 HA GLN 102 5.974 11.916 4.693 777 HB2 GLN 102 1HB GLN 102 7.576 13.542 5.594 778 HB3 GLN 102 2HB GLN 102 6.070 13.622 6.509 779 HG2 GLN 102 1HG GLN 102 7.054 12.511 8.386 780 HG3 GLN 102 2HG GLN 102 8.485 12.053 7.453 781 HE21 GLN 102 1HE2 GLN 102 9.994 13.712 6.791 782 HE22 GLN 102 2HE2 GLN 102 10.131 15.166 7.719 783 H SER 103 H SER 103 8.492 12.382 4.128 784 HA SER 103 HA SER 103 10.341 10.447 5.172 785 HB2 SER 103 1HB SER 103 9.283 9.329 3.137 786 HB3 SER 103 2HB SER 103 9.982 10.631 2.155 787 HG SER 103 HG SER 103 11.297 8.753 3.854 788 H GLY 104 H GLY 104 12.306 11.258 3.137 789 HA2 GLY 104 2HA GLY 104 13.253 13.678 4.306 790 HA3 GLY 104 1HA GLY 104 13.878 12.891 2.858 791 H GLY 105 H GLY 105 10.703 13.432 1.969 792 HA2 GLY 105 2HA GLY 105 11.573 15.841 0.452 793 HA3 GLY 105 1HA GLY 105 10.344 14.649 -0.001 794 H LEU 106 H LEU 106 8.752 14.524 2.205 795 HA LEU 106 HA LEU 106 7.488 16.848 3.080 796 HB2 LEU 106 1HB LEU 106 5.558 16.631 1.302 797 HB3 LEU 106 2HB LEU 106 6.896 17.719 1.075 798 HG LEU 106 HG LEU 106 7.916 16.271 -0.580 799 HD11 LEU 106 1HD1 LEU 106 6.864 14.257 -1.414 800 HD12 LEU 106 2HD1 LEU 106 5.650 14.308 -0.103 801 HD13 LEU 106 3HD1 LEU 106 7.368 14.024 0.246 802 HD21 LEU 106 3HD2 LEU 106 6.147 17.852 -1.268 803 HD22 LEU 106 1HD2 LEU 106 4.975 16.522 -1.162 804 HD23 LEU 106 2HD2 LEU 106 6.311 16.444 -2.339 805 H ALA 107 H ALA 107 5.281 16.312 3.754 806 HA ALA 107 HA ALA 107 4.831 13.721 4.814 807 HB1 ALA 107 1HB ALA 107 2.598 14.560 5.324 808 HB2 ALA 107 2HB ALA 107 3.813 15.811 5.648 809 HB3 ALA 107 3HB ALA 107 2.825 15.904 4.181 810 H VAL 108 H VAL 108 2.948 12.288 4.340 811 HA VAL 108 HA VAL 108 1.753 12.492 1.721 812 HB VAL 108 HB VAL 108 3.611 11.292 0.962 813 HG11 VAL 108 1HG1 VAL 108 4.791 10.643 2.887 814 HG12 VAL 108 2HG1 VAL 108 3.511 9.540 3.388 815 HG13 VAL 108 3HG1 VAL 108 4.480 9.183 1.940 816 HG21 VAL 108 3HG2 VAL 108 2.676 9.243 0.162 817 HG22 VAL 108 1HG2 VAL 108 1.627 9.067 1.571 818 HG23 VAL 108 2HG2 VAL 108 1.307 10.330 0.384 819 H ARG 109 H ARG 109 -0.344 12.172 1.887 820 HA ARG 109 HA ARG 109 -1.353 10.851 4.382 821 HB2 ARG 109 1HB ARG 109 -2.360 13.235 2.809 822 HB3 ARG 109 2HB ARG 109 -3.331 12.405 4.024 823 HG2 ARG 109 1HG ARG 109 -1.810 12.959 5.800 824 HG3 ARG 109 2HG ARG 109 -0.643 13.597 4.653 825 HD2 ARG 109 1HD ARG 109 -3.441 14.710 5.180 826 HD3 ARG 109 2HD ARG 109 -1.936 15.420 5.807 827 HE ARG 109 HE ARG 109 -1.556 15.309 3.071 828 HH11 ARG 109 1HH1 ARG 109 -3.873 17.075 5.182 829 HH12 ARG 109 2HH1 ARG 109 -4.170 18.271 3.969 830 HH21 ARG 109 1HH2 ARG 109 -2.096 16.736 1.534 831 HH22 ARG 109 2HH2 ARG 109 -3.032 18.165 1.875 832 H VAL 110 H VAL 110 -3.438 9.943 4.147 833 HA VAL 110 HA VAL 110 -3.374 8.291 1.736 834 HB VAL 110 HB VAL 110 -3.434 7.329 3.937 835 HG11 VAL 110 1HG1 VAL 110 -4.900 8.900 5.110 836 HG12 VAL 110 2HG1 VAL 110 -6.277 8.385 4.114 837 HG13 VAL 110 3HG1 VAL 110 -5.520 7.248 5.238 838 HG21 VAL 110 3HG2 VAL 110 -4.188 6.022 2.038 839 HG22 VAL 110 1HG2 VAL 110 -4.960 5.540 3.561 840 HG23 VAL 110 2HG2 VAL 110 -5.868 6.492 2.373 841 H ARG 111 H ARG 111 -5.496 10.816 2.850 842 HA ARG 111 HA ARG 111 -7.225 11.899 1.995 843 HB2 ARG 111 1HB ARG 111 -6.142 10.720 -0.502 844 HB3 ARG 111 2HB ARG 111 -7.876 10.953 -0.557 845 HG2 ARG 111 1HG ARG 111 -5.771 13.060 -0.121 846 HG3 ARG 111 2HG ARG 111 -6.824 12.828 -1.517 847 HD2 ARG 111 1HD ARG 111 -8.769 13.159 0.241 848 HD3 ARG 111 2HD ARG 111 -7.520 13.936 1.207 849 HE ARG 111 HE ARG 111 -8.925 14.970 -1.014 850 HH11 ARG 111 1HH1 ARG 111 -5.694 15.097 0.445 851 HH12 ARG 111 2HH1 ARG 111 -5.084 16.234 -0.683 852 HH21 ARG 111 1HH2 ARG 111 -8.316 17.020 -1.999 853 HH22 ARG 111 2HH2 ARG 111 -6.652 17.545 -1.903 854 H THR 112 H THR 112 -7.516 8.567 0.774 855 HA THR 112 HA THR 112 -10.421 8.679 1.301 856 HB THR 112 HB THR 112 -10.510 6.543 0.155 857 HG1 THR 112 1HG THR 112 -8.680 5.551 0.713 858 HG21 THR 112 3HG2 THR 112 -8.708 8.458 -1.398 859 HG22 THR 112 1HG2 THR 112 -10.477 8.561 -1.267 860 HG23 THR 112 2HG2 THR 112 -9.718 7.175 -2.081 861 HA PRO 113 HA PRO 113 -9.780 5.758 4.754 862 HB2 PRO 113 1HB PRO 113 -12.166 4.487 4.858 863 HB3 PRO 113 2HB PRO 113 -11.996 6.193 5.378 864 HG2 PRO 113 1HG PRO 113 -12.941 5.133 2.715 865 HG3 PRO 113 2HG PRO 113 -13.712 6.383 3.727 866 HD2 PRO 113 1HD PRO 113 -12.050 6.962 1.610 867 HD3 PRO 113 2HD PRO 113 -12.160 8.016 3.044 868 H ILE 114 H ILE 114 -10.589 3.175 4.662 869 HA ILE 114 HA ILE 114 -9.020 1.899 2.595 870 HB ILE 114 HB ILE 114 -10.948 0.861 4.731 871 HG12 ILE 114 1HG1 ILE 114 -9.106 1.970 5.779 872 HG13 ILE 114 2HG1 ILE 114 -8.904 0.258 5.944 873 HG21 ILE 114 1HG2 ILE 114 -9.835 -1.329 4.548 874 HG22 ILE 114 2HG2 ILE 114 -10.814 -0.936 3.165 875 HG23 ILE 114 3HG2 ILE 114 -9.045 -0.798 3.038 876 HD11 ILE 114 3HD1 ILE 114 -7.227 0.316 4.032 877 HD12 ILE 114 1HD1 ILE 114 -7.354 2.088 4.087 878 HD13 ILE 114 2HD1 ILE 114 -6.751 1.178 5.489 879 H SER 115 H SER 115 -9.932 0.179 1.173 880 HA SER 115 HA SER 115 -12.748 0.422 0.439 881 HB2 SER 115 1HB SER 115 -10.873 -0.210 -1.753 882 HB3 SER 115 2HB SER 115 -12.387 0.699 -1.824 883 HG SER 115 HG SER 115 -9.850 1.635 -0.919 884 H ASN 116 H ASN 116 -13.416 -1.710 -0.573 885 HA ASN 116 HA ASN 116 -11.619 -3.985 -0.331 886 HB2 ASN 116 1HB ASN 116 -13.705 -3.234 1.646 887 HB3 ASN 116 2HB ASN 116 -13.889 -4.888 1.070 888 HD21 ASN 116 1HD2 ASN 116 -11.039 -5.586 0.728 889 HD22 ASN 116 2HD2 ASN 116 -10.349 -5.375 2.314 890 H GLY 117 H GLY 117 -13.034 -6.098 -0.993 891 HA2 GLY 117 2HA GLY 117 -15.610 -5.605 -2.123 892 HA3 GLY 117 1HA GLY 117 -14.380 -5.950 -3.356 893 H GLN 118 H GLN 118 -16.257 -7.810 -3.351 894 HA GLN 118 HA GLN 118 -15.748 -9.999 -1.543 895 HB2 GLN 118 1HB GLN 118 -17.538 -9.363 -3.809 896 HB3 GLN 118 2HB GLN 118 -16.962 -11.016 -3.867 897 HG2 GLN 118 1HG GLN 118 -17.796 -11.499 -1.661 898 HG3 GLN 118 2HG GLN 118 -18.100 -9.785 -1.335 899 HE21 GLN 118 1HE2 GLN 118 -19.328 -12.670 -3.010 900 HE22 GLN 118 2HE2 GLN 118 -20.942 -11.988 -3.225 901 HA PRO 119 HA PRO 119 -12.132 -11.346 -3.382 902 HB2 PRO 119 1HB PRO 119 -12.077 -14.095 -2.903 903 HB3 PRO 119 2HB PRO 119 -11.826 -12.845 -1.658 904 HG2 PRO 119 1HG PRO 119 -14.358 -14.352 -2.338 905 HG3 PRO 119 2HG PRO 119 -13.701 -13.952 -0.715 906 HD2 PRO 119 1HD PRO 119 -15.701 -12.517 -1.881 907 HD3 PRO 119 2HD PRO 119 -14.482 -11.743 -0.831 908 H THR 120 H THR 120 -11.077 -12.377 -5.076 909 HA THR 120 HA THR 120 -12.662 -13.751 -7.182 910 HB THR 120 HB THR 120 -9.661 -13.147 -7.026 911 HG1 THR 120 1HG THR 120 -10.604 -11.205 -7.178 912 HG21 THR 120 3HG2 THR 120 -10.149 -14.919 -8.630 913 HG22 THR 120 1HG2 THR 120 -9.912 -13.421 -9.543 914 HG23 THR 120 2HG2 THR 120 -11.548 -14.026 -9.255 915 H THR 121 H THR 121 -12.914 -15.951 -6.908 916 HA THR 121 HA THR 121 -10.873 -17.474 -5.371 917 HB THR 121 HB THR 121 -13.213 -18.705 -6.900 918 HG1 THR 121 1HG THR 121 -14.011 -18.555 -4.473 919 HG21 THR 121 3HG2 THR 121 -11.514 -20.208 -5.896 920 HG22 THR 121 1HG2 THR 121 -13.061 -20.369 -5.058 921 HG23 THR 121 2HG2 THR 121 -11.744 -19.423 -4.322 922 H GLY 122 H GLY 122 -9.481 -18.857 -6.531 923 HA2 GLY 122 2HA GLY 122 -9.744 -19.151 -9.413 924 HA3 GLY 122 1HA GLY 122 -8.211 -18.597 -8.808 925 H ASP 123 H ASP 123 -7.437 -20.655 -9.743 926 HA ASP 123 HA ASP 123 -8.446 -23.145 -9.627 927 HB2 ASP 123 1HB ASP 123 -6.386 -22.518 -10.815 928 HB3 ASP 123 2HB ASP 123 -5.512 -22.487 -9.288 929 H ALA 124 H ALA 124 -6.096 -21.983 -7.194 930 HA ALA 124 HA ALA 124 -7.441 -23.552 -5.096 931 HB1 ALA 124 1HB ALA 124 -5.679 -25.021 -6.089 932 HB2 ALA 124 2HB ALA 124 -4.456 -23.765 -5.739 933 HB3 ALA 124 3HB ALA 124 -5.333 -24.559 -4.409 934 H ASP 125 H ASP 125 -6.898 -20.495 -5.951 935 HA ASP 125 HA ASP 125 -5.915 -19.829 -3.231 936 HB2 ASP 125 1HB ASP 125 -4.997 -17.861 -5.182 937 HB3 ASP 125 2HB ASP 125 -4.248 -18.484 -3.736 938 H HIS 126 H HIS 126 -6.672 -17.784 -2.525 939 HA HIS 126 HA HIS 126 -8.736 -16.546 -4.248 940 HB2 HIS 126 1HB HIS 126 -10.427 -16.633 -2.687 941 HB3 HIS 126 2HB HIS 126 -9.667 -18.221 -2.574 942 HD1 HIS 126 1HD HIS 126 -10.917 -15.624 -0.419 943 HD2 HIS 126 2HD HIS 126 -8.076 -18.710 -0.373 944 HE1 HIS 126 1HE HIS 126 -10.364 -15.996 2.029 945 H THR 127 H THR 127 -9.095 -14.403 -3.928 946 HA THR 127 HA THR 127 -7.103 -12.871 -2.326 947 HB THR 127 HB THR 127 -7.786 -12.349 -5.260 948 HG1 THR 127 1HG THR 127 -5.985 -13.477 -5.898 949 HG21 THR 127 3HG2 THR 127 -6.631 -10.560 -3.983 950 HG22 THR 127 1HG2 THR 127 -5.639 -11.182 -5.306 951 HG23 THR 127 2HG2 THR 127 -5.296 -11.678 -3.635 952 H VAL 128 H VAL 128 -7.998 -11.290 -1.275 953 HA VAL 128 HA VAL 128 -10.627 -10.282 -2.219 954 HB VAL 128 HB VAL 128 -10.385 -8.962 -0.039 955 HG11 VAL 128 1HG1 VAL 128 -11.602 -10.594 1.186 956 HG12 VAL 128 2HG1 VAL 128 -12.079 -10.673 -0.505 957 HG13 VAL 128 3HG1 VAL 128 -10.965 -11.905 0.170 958 HG21 VAL 128 3HG2 VAL 128 -9.244 -9.888 1.815 959 HG22 VAL 128 1HG2 VAL 128 -8.575 -11.198 0.819 960 HG23 VAL 128 2HG2 VAL 128 -8.096 -9.505 0.530 961 HA PRO 129 HA PRO 129 -8.234 -6.776 -3.712 962 HB2 PRO 129 1HB PRO 129 -10.322 -5.175 -4.488 963 HB3 PRO 129 2HB PRO 129 -9.865 -6.665 -5.363 964 HG2 PRO 129 1HG PRO 129 -12.061 -6.274 -3.351 965 HG3 PRO 129 2HG PRO 129 -12.141 -7.151 -4.908 966 HD2 PRO 129 1HD PRO 129 -11.781 -8.373 -2.481 967 HD3 PRO 129 2HD PRO 129 -11.129 -9.020 -4.014 968 H ILE 130 H ILE 130 -7.294 -5.132 -2.470 969 HA ILE 130 HA ILE 130 -8.998 -3.438 -0.814 970 HB ILE 130 HB ILE 130 -6.376 -4.228 0.420 971 HG12 ILE 130 1HG1 ILE 130 -8.801 -6.044 0.537 972 HG13 ILE 130 2HG1 ILE 130 -7.152 -6.409 0.063 973 HG21 ILE 130 1HG2 ILE 130 -9.091 -3.622 1.680 974 HG22 ILE 130 2HG2 ILE 130 -7.491 -3.619 2.454 975 HG23 ILE 130 3HG2 ILE 130 -7.885 -2.385 1.267 976 HD11 ILE 130 3HD1 ILE 130 -6.504 -5.939 2.501 977 HD12 ILE 130 1HD1 ILE 130 -8.255 -5.857 2.835 978 HD13 ILE 130 2HD1 ILE 130 -7.543 -7.362 2.233 979 H SER 131 H SER 131 -8.259 -1.364 -0.895 980 HA SER 131 HA SER 131 -5.609 -0.600 -1.460 981 HB2 SER 131 1HB SER 131 -7.267 0.699 -3.569 982 HB3 SER 131 2HB SER 131 -5.563 0.307 -3.576 983 HG SER 131 HG SER 131 -7.741 -1.024 -4.530 984 H LEU 132 H LEU 132 -5.409 1.888 -1.580 985 HA LEU 132 HA LEU 132 -7.779 3.478 -1.019 986 HB2 LEU 132 1HB LEU 132 -6.265 4.846 0.562 987 HB3 LEU 132 2HB LEU 132 -7.140 3.454 1.184 988 HG LEU 132 HG LEU 132 -4.905 3.772 2.083 989 HD11 LEU 132 1HD1 LEU 132 -4.160 1.571 2.212 990 HD12 LEU 132 2HD1 LEU 132 -4.886 1.128 0.666 991 HD13 LEU 132 3HD1 LEU 132 -5.921 1.511 2.047 992 HD21 LEU 132 3HD2 LEU 132 -3.778 3.041 -0.612 993 HD22 LEU 132 1HD2 LEU 132 -2.883 3.444 0.869 994 HD23 LEU 132 2HD2 LEU 132 -3.819 4.694 0.049 995 H GLY 133 H GLY 133 -7.059 5.935 -1.310 996 HA2 GLY 133 2HA GLY 133 -5.244 6.068 -3.688 997 HA3 GLY 133 1HA GLY 133 -6.854 6.748 -3.673 998 H TYR 134 H TYR 134 -3.649 7.079 -2.661 999 HA TYR 134 HA TYR 134 -3.954 9.257 -0.726 1000 HB2 TYR 134 1HB TYR 134 -1.553 9.051 -0.476 1001 HB3 TYR 134 2HB TYR 134 -2.290 7.499 -0.418 1002 HD1 TYR 134 2HD TYR 134 -0.165 9.824 -2.328 1003 HD2 TYR 134 1HD TYR 134 -1.817 5.838 -2.179 1004 HE1 TYR 134 2HE TYR 134 1.470 9.114 -4.044 1005 HE2 TYR 134 1HE TYR 134 -0.133 5.106 -3.897 1006 HH TYR 134 HH TYR 134 2.301 7.335 -5.246 1007 H ASP 135 H ASP 135 -2.346 11.171 -0.972 1008 HA ASP 135 HA ASP 135 -2.155 12.185 -3.692 1009 HB2 ASP 135 1HB ASP 135 -3.501 13.955 -3.561 1010 HB3 ASP 135 2HB ASP 135 -4.446 12.876 -2.564 1011 H VAL 136 H VAL 136 -1.214 14.749 -3.234 1012 HA VAL 136 HA VAL 136 0.937 14.490 -1.268 1013 HB VAL 136 HB VAL 136 1.532 15.149 -4.164 1014 HG11 VAL 136 1HG1 VAL 136 3.178 16.053 -2.667 1015 HG12 VAL 136 2HG1 VAL 136 3.371 14.508 -1.838 1016 HG13 VAL 136 3HG1 VAL 136 3.900 14.695 -3.521 1017 HG21 VAL 136 3HG2 VAL 136 0.940 12.855 -4.395 1018 HG22 VAL 136 1HG2 VAL 136 2.717 12.877 -4.271 1019 HG23 VAL 136 2HG2 VAL 136 1.741 12.383 -2.912 1020 H GLN 137 H GLN 137 1.873 16.393 -0.697 1021 HA GLN 137 HA GLN 137 0.960 18.971 -1.725 1022 HB2 GLN 137 1HB GLN 137 0.117 19.648 0.432 1023 HB3 GLN 137 2HB GLN 137 -0.800 18.240 -0.090 1024 HG2 GLN 137 1HG GLN 137 1.467 18.265 1.971 1025 HG3 GLN 137 2HG GLN 137 -0.242 18.175 2.322 1026 HE21 GLN 137 1HE2 GLN 137 2.615 16.393 1.427 1027 HE22 GLN 137 2HE2 GLN 137 1.938 14.810 1.422 1028 H PHE 138 H PHE 138 2.367 20.678 -0.900 1029 HA PHE 138 HA PHE 138 4.974 19.865 0.173 1030 HB2 PHE 138 1HB PHE 138 3.716 22.348 -0.971 1031 HB3 PHE 138 2HB PHE 138 5.123 22.507 0.047 1032 HD1 PHE 138 1HD PHE 138 4.144 20.082 -2.709 1033 HD2 PHE 138 2HD PHE 138 7.028 22.900 -1.156 1034 HE1 PHE 138 1HE PHE 138 5.609 19.707 -4.681 1035 HE2 PHE 138 2HE PHE 138 8.455 22.525 -3.129 1036 HZ PHE 138 HZ PHE 138 7.718 20.973 -4.930 1037 H TYR 139 H TYR 139 2.167 20.095 1.720 1038 HA TYR 139 HA TYR 139 1.319 20.547 3.683 1039 HB2 TYR 139 1HB TYR 139 3.951 19.541 3.946 1040 HB3 TYR 139 2HB TYR 139 3.868 20.890 5.000 1041 HD1 TYR 139 1HD TYR 139 1.082 18.439 4.239 1042 HD2 TYR 139 2HD TYR 139 4.094 19.627 7.081 1043 HE1 TYR 139 1HE TYR 139 0.340 16.651 5.752 1044 HE2 TYR 139 2HE TYR 139 3.389 17.809 8.586 1045 HH TYR 139 HH TYR 139 2.263 15.629 8.487 1046 HA PRO 140 HA PRO 140 1.352 24.969 4.373 1047 HB2 PRO 140 1HB PRO 140 0.689 25.362 6.965 1048 HB3 PRO 140 2HB PRO 140 -0.468 24.643 5.807 1049 HG2 PRO 140 1HG PRO 140 1.330 23.221 7.791 1050 HG3 PRO 140 2HG PRO 140 -0.422 22.956 7.502 1051 HD2 PRO 140 1HD PRO 140 1.545 21.408 6.362 1052 HD3 PRO 140 2HD PRO 140 -0.005 21.742 5.536 1053 H GLU 141 H GLU 141 2.396 26.678 5.702 1054 HA GLU 141 HA GLU 141 4.182 27.777 6.459 1055 HB2 GLU 141 1HB GLU 141 4.313 25.732 8.198 1056 HB3 GLU 141 2HB GLU 141 5.792 25.392 7.277 1057 HG2 GLU 141 1HG GLU 141 6.269 27.945 7.621 1058 HG3 GLU 141 2HG GLU 141 5.033 27.863 8.871 Start of MODEL 3 1 H1 GLY 1 H GLY 1 18.158 12.622 -2.449 2 HA2 GLY 1 2HA GLY 1 16.042 10.539 -2.441 3 HA3 GLY 1 1HA GLY 1 16.178 11.818 -1.211 4 H MET 2 H MET 2 15.264 11.109 -4.606 5 HA MET 2 HA MET 2 15.184 13.897 -5.300 6 HB2 MET 2 1HB MET 2 15.964 11.826 -6.676 7 HB3 MET 2 2HB MET 2 14.252 11.557 -6.988 8 HG2 MET 2 1HG MET 2 14.145 13.945 -7.846 9 HG3 MET 2 2HG MET 2 15.891 14.043 -7.628 10 HE1 MET 2 3HE MET 2 15.693 14.950 -10.165 11 HE2 MET 2 1HE MET 2 15.189 13.937 -11.539 12 HE3 MET 2 2HE MET 2 13.994 14.501 -10.350 13 H SER 3 H SER 3 13.370 13.628 -3.254 14 HA SER 3 HA SER 3 11.288 13.897 -2.529 15 HB2 SER 3 1HB SER 3 10.988 15.749 -3.861 16 HB3 SER 3 2HB SER 3 10.858 14.814 -5.347 17 HG SER 3 HG SER 3 8.891 15.143 -5.060 18 H GLN 4 H GLN 4 10.663 12.287 -5.726 19 HA GLN 4 HA GLN 4 8.552 10.791 -4.592 20 HB2 GLN 4 1HB GLN 4 8.963 11.371 -7.043 21 HB3 GLN 4 2HB GLN 4 10.018 9.964 -7.114 22 HG2 GLN 4 1HG GLN 4 7.350 9.395 -5.900 23 HG3 GLN 4 2HG GLN 4 7.268 10.040 -7.531 24 HE21 GLN 4 1HE2 GLN 4 9.395 7.611 -5.827 25 HE22 GLN 4 2HE2 GLN 4 9.487 6.563 -7.226 26 H ASP 5 H ASP 5 11.993 10.038 -4.789 27 HA ASP 5 HA ASP 5 11.943 7.260 -4.142 28 HB2 ASP 5 1HB ASP 5 13.885 9.417 -3.194 29 HB3 ASP 5 2HB ASP 5 14.130 7.688 -3.000 30 H LEU 6 H LEU 6 11.739 10.158 -2.115 31 HA LEU 6 HA LEU 6 11.898 8.884 0.456 32 HB2 LEU 6 1HB LEU 6 10.572 11.539 -0.204 33 HB3 LEU 6 2HB LEU 6 11.289 11.057 1.320 34 HG LEU 6 HG LEU 6 12.920 11.429 -1.252 35 HD11 LEU 6 1HD1 LEU 6 13.378 13.646 -0.679 36 HD12 LEU 6 2HD1 LEU 6 12.711 13.475 0.939 37 HD13 LEU 6 3HD1 LEU 6 11.623 13.495 -0.475 38 HD21 LEU 6 3HD2 LEU 6 13.611 11.241 1.705 39 HD22 LEU 6 1HD2 LEU 6 14.776 11.682 0.439 40 HD23 LEU 6 2HD2 LEU 6 14.036 10.062 0.451 41 H ILE 7 H ILE 7 9.251 10.240 -1.469 42 HA ILE 7 HA ILE 7 7.036 9.442 0.063 43 HB ILE 7 HB ILE 7 7.510 9.901 -2.886 44 HG12 ILE 7 1HG1 ILE 7 5.732 11.593 -1.124 45 HG13 ILE 7 2HG1 ILE 7 7.468 11.731 -0.898 46 HG21 ILE 7 1HG2 ILE 7 5.008 10.113 -3.152 47 HG22 ILE 7 2HG2 ILE 7 5.623 8.464 -2.950 48 HG23 ILE 7 3HG2 ILE 7 4.839 9.303 -1.577 49 HD11 ILE 7 3HD1 ILE 7 7.864 12.626 -2.980 50 HD12 ILE 7 1HD1 ILE 7 6.368 11.961 -3.700 51 HD13 ILE 7 2HD1 ILE 7 6.288 13.327 -2.588 52 H ARG 8 H ARG 8 8.932 7.360 -2.240 53 HA ARG 8 HA ARG 8 7.092 5.079 -1.894 54 HB2 ARG 8 1HB ARG 8 9.900 5.394 -3.060 55 HB3 ARG 8 2HB ARG 8 9.056 3.848 -2.940 56 HG2 ARG 8 1HG ARG 8 7.763 6.200 -4.325 57 HG3 ARG 8 2HG ARG 8 8.903 5.146 -5.157 58 HD2 ARG 8 1HD ARG 8 7.541 3.204 -4.878 59 HD3 ARG 8 2HD ARG 8 6.502 3.981 -3.691 60 HE ARG 8 HE ARG 8 6.398 4.204 -6.592 61 HH11 ARG 8 1HH1 ARG 8 5.407 5.693 -3.528 62 HH12 ARG 8 2HH1 ARG 8 4.017 6.447 -4.146 63 HH21 ARG 8 1HH2 ARG 8 4.568 5.258 -7.450 64 HH22 ARG 8 2HH2 ARG 8 3.659 6.426 -6.513 65 H ALA 9 H ALA 9 10.362 6.007 -0.676 66 HA ALA 9 HA ALA 9 10.810 3.788 0.955 67 HB1 ALA 9 1HB ALA 9 11.679 6.671 1.444 68 HB2 ALA 9 2HB ALA 9 12.441 5.211 2.108 69 HB3 ALA 9 3HB ALA 9 12.495 5.515 0.364 70 H ALA 10 H ALA 10 8.739 6.613 1.599 71 HA ALA 10 HA ALA 10 8.355 6.174 4.381 72 HB1 ALA 10 1HB ALA 10 6.418 7.603 4.097 73 HB2 ALA 10 2HB ALA 10 7.640 8.171 2.930 74 HB3 ALA 10 3HB ALA 10 6.284 7.207 2.373 75 H PHE 11 H PHE 11 6.827 4.715 1.522 76 HA PHE 11 HA PHE 11 4.604 3.579 2.975 77 HB2 PHE 11 1HB PHE 11 5.650 3.489 0.140 78 HB3 PHE 11 2HB PHE 11 4.544 2.252 0.663 79 HD1 PHE 11 1HD PHE 11 4.614 6.066 1.329 80 HD2 PHE 11 2HD PHE 11 2.450 2.633 -0.222 81 HE1 PHE 11 1HE PHE 11 2.679 7.466 0.913 82 HE2 PHE 11 2HE PHE 11 0.475 4.092 -0.584 83 HZ PHE 11 HZ PHE 11 0.587 6.510 -0.050 84 H GLU 12 H GLU 12 7.801 2.295 1.830 85 HA GLU 12 HA GLU 12 7.220 -0.258 3.082 86 HB2 GLU 12 1HB GLU 12 9.401 -0.883 2.378 87 HB3 GLU 12 2HB GLU 12 8.436 -0.189 1.049 88 HG2 GLU 12 1HG GLU 12 9.681 1.715 0.921 89 HG3 GLU 12 2HG GLU 12 10.553 1.396 2.435 90 H LYS 13 H LYS 13 8.198 2.660 4.360 91 HA LYS 13 HA LYS 13 9.669 1.327 6.532 92 HB2 LYS 13 1HB LYS 13 10.439 3.469 5.591 93 HB3 LYS 13 2HB LYS 13 8.991 4.265 6.257 94 HG2 LYS 13 1HG LYS 13 9.794 4.053 8.466 95 HG3 LYS 13 2HG LYS 13 10.718 2.590 8.084 96 HD2 LYS 13 1HD LYS 13 12.305 4.038 6.749 97 HD3 LYS 13 2HD LYS 13 11.481 5.457 7.432 98 HE2 LYS 13 1HE LYS 13 12.127 4.826 9.686 99 HE3 LYS 13 2HE LYS 13 12.621 3.209 9.147 100 HZ1 LYS 13 3HZ LYS 13 14.550 4.598 9.454 101 HZ2 LYS 13 1HZ LYS 13 13.979 5.714 8.392 102 HZ3 LYS 13 2HZ LYS 13 14.385 4.191 7.885 103 H ARG 14 H ARG 14 6.527 1.599 5.822 104 HA ARG 14 HA ARG 14 5.882 1.126 8.699 105 HB2 ARG 14 1HB ARG 14 4.570 3.068 7.722 106 HB3 ARG 14 2HB ARG 14 3.811 1.916 6.619 107 HG2 ARG 14 1HG ARG 14 2.262 1.769 8.285 108 HG3 ARG 14 2HG ARG 14 3.364 0.613 8.978 109 HD2 ARG 14 1HD ARG 14 2.864 2.045 10.765 110 HD3 ARG 14 2HD ARG 14 4.466 2.560 10.219 111 HE ARG 14 HE ARG 14 2.179 3.985 9.038 112 HH11 ARG 14 1HH1 ARG 14 4.471 4.006 11.814 113 HH12 ARG 14 2HH1 ARG 14 4.236 5.719 12.072 114 HH21 ARG 14 1HH2 ARG 14 1.893 6.199 9.508 115 HH22 ARG 14 2HH2 ARG 14 2.814 6.934 10.799 116 H LEU 15 H LEU 15 4.989 0.122 5.342 117 HA LEU 15 HA LEU 15 3.276 -1.884 6.209 118 HB2 LEU 15 1HB LEU 15 3.667 -0.840 3.864 119 HB3 LEU 15 2HB LEU 15 4.839 -2.131 3.617 120 HG LEU 15 HG LEU 15 1.843 -2.401 4.163 121 HD11 LEU 15 1HD1 LEU 15 2.497 -1.630 1.916 122 HD12 LEU 15 2HD1 LEU 15 1.757 -3.220 1.870 123 HD13 LEU 15 3HD1 LEU 15 3.520 -3.065 1.698 124 HD21 LEU 15 3HD2 LEU 15 2.267 -4.867 3.526 125 HD22 LEU 15 1HD2 LEU 15 2.680 -4.367 5.152 126 HD23 LEU 15 2HD2 LEU 15 3.956 -4.555 3.930 127 H SER 16 H SER 16 6.725 -2.265 5.283 128 HA SER 16 HA SER 16 6.878 -5.073 5.583 129 HB2 SER 16 1HB SER 16 8.547 -3.680 4.428 130 HB3 SER 16 2HB SER 16 9.016 -2.934 5.953 131 HG SER 16 HG SER 16 9.958 -4.698 6.609 132 H ASP 17 H ASP 17 7.347 -2.425 7.900 133 HA ASP 17 HA ASP 17 8.371 -4.000 10.031 134 HB2 ASP 17 1HB ASP 17 7.216 -1.214 9.872 135 HB3 ASP 17 2HB ASP 17 7.608 -1.948 11.425 136 H TRP 18 H TRP 18 5.052 -3.368 9.028 137 HA TRP 18 HA TRP 18 3.929 -4.709 11.413 138 HB2 TRP 18 1HB TRP 18 2.498 -3.152 10.451 139 HB3 TRP 18 2HB TRP 18 2.811 -3.693 8.808 140 HD1 TRP 18 HD TRP 18 0.674 -4.583 11.860 141 HE1 TRP 18 1HE TRP 18 -1.223 -6.135 11.140 142 HE3 TRP 18 3HE TRP 18 2.199 -5.516 7.074 143 HZ2 TRP 18 2HZ TRP 18 -1.993 -7.614 8.726 144 HZ3 TRP 18 3HZ TRP 18 0.839 -6.948 5.564 145 HH2 TRP 18 HH TRP 18 -1.331 -7.903 6.388 146 H ALA 19 H ALA 19 4.670 -5.518 7.979 147 HA ALA 19 HA ALA 19 3.464 -8.064 8.013 148 HB1 ALA 19 1HB ALA 19 4.164 -6.861 5.969 149 HB2 ALA 19 2HB ALA 19 5.872 -7.191 6.366 150 HB3 ALA 19 3HB ALA 19 4.764 -8.529 6.011 151 H LYS 20 H LYS 20 6.842 -7.191 8.748 152 HA LYS 20 HA LYS 20 7.667 -9.837 9.518 153 HB2 LYS 20 1HB LYS 20 9.612 -8.668 10.565 154 HB3 LYS 20 2HB LYS 20 9.313 -8.199 8.898 155 HG2 LYS 20 1HG LYS 20 9.329 -6.062 9.502 156 HG3 LYS 20 2HG LYS 20 7.839 -6.331 10.369 157 HD2 LYS 20 1HD LYS 20 8.945 -5.393 12.038 158 HD3 LYS 20 2HD LYS 20 9.479 -7.045 12.356 159 HE2 LYS 20 1HE LYS 20 11.608 -6.633 11.286 160 HE3 LYS 20 2HE LYS 20 11.009 -5.141 10.534 161 HZ1 LYS 20 3HZ LYS 20 10.871 -4.140 12.734 162 HZ2 LYS 20 1HZ LYS 20 12.401 -4.659 12.426 163 HZ3 LYS 20 2HZ LYS 20 11.426 -5.498 13.439 164 H ALA 21 H ALA 21 5.911 -7.296 11.299 165 HA ALA 21 HA ALA 21 6.495 -8.535 13.896 166 HB1 ALA 21 1HB ALA 21 5.163 -6.689 14.796 167 HB2 ALA 21 2HB ALA 21 6.433 -6.089 13.723 168 HB3 ALA 21 3HB ALA 21 4.744 -6.161 13.154 169 H ARG 22 H ARG 22 4.165 -9.032 11.404 170 HA ARG 22 HA ARG 22 2.053 -10.040 13.129 171 HB2 ARG 22 1HB ARG 22 2.490 -9.862 10.299 172 HB3 ARG 22 2HB ARG 22 2.380 -11.585 10.663 173 HG2 ARG 22 1HG ARG 22 0.248 -10.834 12.076 174 HG3 ARG 22 2HG ARG 22 0.313 -9.422 11.018 175 HD2 ARG 22 1HD ARG 22 -0.786 -10.555 9.472 176 HD3 ARG 22 2HD ARG 22 0.590 -11.620 9.278 177 HE ARG 22 HE ARG 22 -0.835 -12.530 11.548 178 HH11 ARG 22 1HH1 ARG 22 -2.285 -11.677 8.581 179 HH12 ARG 22 2HH1 ARG 22 -3.232 -13.103 8.422 180 HH21 ARG 22 1HH2 ARG 22 -1.923 -14.627 11.326 181 HH22 ARG 22 2HH2 ARG 22 -3.129 -14.721 10.115 182 H THR 23 H THR 23 1.762 -12.313 13.726 183 HA THR 23 HA THR 23 4.118 -13.712 14.390 184 HB THR 23 HB THR 23 1.226 -14.573 14.182 185 HG1 THR 23 1HG THR 23 3.047 -13.872 16.223 186 HG21 THR 23 3HG2 THR 23 2.507 -16.569 13.731 187 HG22 THR 23 1HG2 THR 23 1.979 -16.627 15.414 188 HG23 THR 23 2HG2 THR 23 3.659 -16.193 15.021 189 HA PRO 24 HA PRO 24 3.728 -16.741 10.935 190 HB2 PRO 24 1HB PRO 24 2.209 -16.310 8.677 191 HB3 PRO 24 2HB PRO 24 1.611 -17.134 10.164 192 HG2 PRO 24 1HG PRO 24 1.283 -14.238 9.323 193 HG3 PRO 24 2HG PRO 24 0.038 -15.366 9.957 194 HD2 PRO 24 1HD PRO 24 1.268 -13.572 11.585 195 HD3 PRO 24 2HD PRO 24 0.909 -15.228 12.156 196 H ALA 25 H ALA 25 3.904 -13.508 10.375 197 HA ALA 25 HA ALA 25 5.239 -12.039 9.283 198 HB1 ALA 25 1HB ALA 25 7.155 -14.376 9.156 199 HB2 ALA 25 2HB ALA 25 7.565 -12.662 8.945 200 HB3 ALA 25 3HB ALA 25 6.939 -13.240 10.507 201 H LEU 26 H LEU 26 4.561 -11.235 7.371 202 HA LEU 26 HA LEU 26 4.291 -13.144 5.093 203 HB2 LEU 26 1HB LEU 26 3.110 -10.363 5.467 204 HB3 LEU 26 2HB LEU 26 2.803 -11.444 4.109 205 HG LEU 26 HG LEU 26 2.037 -11.956 7.025 206 HD11 LEU 26 1HD1 LEU 26 0.693 -10.252 5.819 207 HD12 LEU 26 2HD1 LEU 26 -0.241 -11.693 6.225 208 HD13 LEU 26 3HD1 LEU 26 0.337 -11.444 4.553 209 HD21 LEU 26 3HD2 LEU 26 0.777 -13.924 6.138 210 HD22 LEU 26 1HD2 LEU 26 2.519 -14.128 5.986 211 HD23 LEU 26 2HD2 LEU 26 1.550 -13.693 4.555 212 HA PRO 27 HA PRO 27 7.462 -10.816 2.827 213 HB2 PRO 27 1HB PRO 27 6.903 -11.573 0.260 214 HB3 PRO 27 2HB PRO 27 7.648 -12.710 1.428 215 HG2 PRO 27 1HG PRO 27 4.744 -12.442 0.641 216 HG3 PRO 27 2HG PRO 27 5.721 -13.944 0.770 217 HD2 PRO 27 1HD PRO 27 4.063 -13.112 2.785 218 HD3 PRO 27 2HD PRO 27 5.629 -13.916 3.115 219 H VAL 28 H VAL 28 7.504 -8.878 1.554 220 HA VAL 28 HA VAL 28 4.875 -7.750 0.750 221 HB VAL 28 HB VAL 28 7.118 -6.293 2.171 222 HG11 VAL 28 1HG1 VAL 28 5.912 -4.858 0.547 223 HG12 VAL 28 2HG1 VAL 28 4.373 -5.311 1.313 224 HG13 VAL 28 3HG1 VAL 28 5.601 -4.387 2.217 225 HG21 VAL 28 3HG2 VAL 28 5.938 -7.749 3.734 226 HG22 VAL 28 1HG2 VAL 28 5.556 -6.068 4.032 227 HG23 VAL 28 2HG2 VAL 28 4.376 -7.104 3.187 228 H ALA 29 H ALA 29 4.953 -7.983 -1.352 229 HA ALA 29 HA ALA 29 7.491 -7.689 -2.859 230 HB1 ALA 29 1HB ALA 29 6.277 -9.773 -3.122 231 HB2 ALA 29 2HB ALA 29 4.803 -8.895 -3.617 232 HB3 ALA 29 3HB ALA 29 6.252 -8.842 -4.642 233 H TRP 30 H TRP 30 7.685 -5.495 -3.069 234 HA TRP 30 HA TRP 30 5.712 -3.688 -4.031 235 HB2 TRP 30 1HB TRP 30 8.743 -3.562 -4.271 236 HB3 TRP 30 2HB TRP 30 7.676 -2.204 -4.387 237 HD1 TRP 30 HD TRP 30 9.739 -3.968 -1.914 238 HE1 TRP 30 1HE TRP 30 9.205 -3.292 0.449 239 HE3 TRP 30 3HE TRP 30 5.373 -1.470 -2.833 240 HZ2 TRP 30 2HZ TRP 30 6.997 -2.006 1.836 241 HZ3 TRP 30 3HZ TRP 30 4.097 -0.448 -0.954 242 HH2 TRP 30 HH TRP 30 4.870 -0.756 1.391 243 H GLN 31 H GLN 31 6.416 -2.362 -6.149 244 HA GLN 31 HA GLN 31 5.562 -3.741 -8.416 245 HB2 GLN 31 1HB GLN 31 7.189 -1.204 -8.013 246 HB3 GLN 31 2HB GLN 31 6.759 -1.795 -9.622 247 HG2 GLN 31 1HG GLN 31 4.303 -1.649 -8.839 248 HG3 GLN 31 2HG GLN 31 4.940 -0.709 -7.471 249 HE21 GLN 31 1HE2 GLN 31 4.881 -0.923 -11.056 250 HE22 GLN 31 2HE2 GLN 31 5.291 0.751 -11.370 251 H ASN 32 H ASN 32 8.900 -2.392 -8.200 252 HA ASN 32 HA ASN 32 9.654 -4.226 -10.380 253 HB2 ASN 32 1HB ASN 32 11.236 -1.941 -9.141 254 HB3 ASN 32 2HB ASN 32 11.578 -2.753 -10.656 255 HD21 ASN 32 1HD2 ASN 32 8.967 -2.679 -11.987 256 HD22 ASN 32 2HD2 ASN 32 8.623 -0.996 -12.228 257 H THR 33 H THR 33 9.973 -4.040 -6.999 258 HA THR 33 HA THR 33 12.395 -5.591 -6.648 259 HB THR 33 HB THR 33 10.096 -5.013 -4.744 260 HG1 THR 33 1HG THR 33 11.386 -3.136 -4.163 261 HG21 THR 33 3HG2 THR 33 13.044 -5.495 -4.185 262 HG22 THR 33 1HG2 THR 33 11.669 -6.526 -3.701 263 HG23 THR 33 2HG2 THR 33 11.845 -4.925 -2.996 264 H LYS 34 H LYS 34 11.982 -7.700 -5.202 265 HA LYS 34 HA LYS 34 9.746 -9.330 -6.057 266 HB2 LYS 34 1HB LYS 34 11.074 -11.112 -6.789 267 HB3 LYS 34 2HB LYS 34 11.383 -9.680 -7.779 268 HG2 LYS 34 1HG LYS 34 13.083 -10.180 -5.426 269 HG3 LYS 34 2HG LYS 34 13.293 -11.273 -6.794 270 HD2 LYS 34 1HD LYS 34 14.811 -9.817 -7.545 271 HD3 LYS 34 2HD LYS 34 13.455 -8.821 -8.046 272 HE2 LYS 34 1HE LYS 34 14.374 -7.186 -6.804 273 HE3 LYS 34 2HE LYS 34 13.809 -8.076 -5.375 274 HZ1 LYS 34 3HZ LYS 34 15.974 -9.242 -5.435 275 HZ2 LYS 34 1HZ LYS 34 16.099 -7.625 -5.147 276 HZ3 LYS 34 2HZ LYS 34 16.476 -8.234 -6.625 277 H PHE 35 H PHE 35 9.358 -11.105 -4.494 278 HA PHE 35 HA PHE 35 11.198 -11.208 -2.197 279 HB2 PHE 35 1HB PHE 35 8.520 -9.976 -2.095 280 HB3 PHE 35 2HB PHE 35 8.630 -11.400 -1.075 281 HD1 PHE 35 1HD PHE 35 10.242 -8.105 -1.790 282 HD2 PHE 35 2HD PHE 35 9.863 -11.391 0.968 283 HE1 PHE 35 1HE PHE 35 11.771 -6.953 -0.201 284 HE2 PHE 35 2HE PHE 35 11.372 -10.238 2.563 285 HZ PHE 35 HZ PHE 35 12.340 -8.008 1.963 286 H THR 36 H THR 36 11.690 -13.357 -1.913 287 HA THR 36 HA THR 36 9.759 -15.445 -2.414 288 HB THR 36 HB THR 36 11.895 -14.579 -4.365 289 HG1 THR 36 1HG THR 36 9.504 -14.361 -4.478 290 HG21 THR 36 3HG2 THR 36 10.955 -17.469 -4.403 291 HG22 THR 36 1HG2 THR 36 12.589 -16.929 -3.921 292 HG23 THR 36 2HG2 THR 36 12.002 -16.637 -5.548 293 HA PRO 37 HA PRO 37 10.020 -17.784 -2.574 294 HB2 PRO 37 1HB PRO 37 9.894 -19.870 -0.831 295 HB3 PRO 37 2HB PRO 37 11.106 -19.763 -2.141 296 HG2 PRO 37 1HG PRO 37 11.435 -19.024 0.776 297 HG3 PRO 37 2HG PRO 37 12.513 -20.039 -0.246 298 HD2 PRO 37 1HD PRO 37 13.003 -17.405 0.203 299 HD3 PRO 37 2HD PRO 37 13.347 -18.150 -1.382 300 HA PRO 38 HA PRO 38 6.726 -16.149 -0.252 301 HB2 PRO 38 1HB PRO 38 4.749 -18.092 -0.274 302 HB3 PRO 38 2HB PRO 38 5.137 -17.014 -1.666 303 HG2 PRO 38 1HG PRO 38 5.997 -19.864 -1.157 304 HG3 PRO 38 2HG PRO 38 5.497 -19.119 -2.707 305 HD2 PRO 38 1HD PRO 38 8.107 -19.517 -2.055 306 HD3 PRO 38 2HD PRO 38 7.604 -18.099 -2.994 307 H ALA 39 H ALA 39 5.026 -16.661 1.491 308 HA ALA 39 HA ALA 39 6.294 -17.956 3.776 309 HB1 ALA 39 1HB ALA 39 3.948 -16.023 3.462 310 HB2 ALA 39 2HB ALA 39 4.329 -16.838 4.982 311 HB3 ALA 39 3HB ALA 39 5.513 -15.739 4.279 312 H ALA 40 H ALA 40 6.040 -19.853 2.520 313 HA ALA 40 HA ALA 40 5.121 -21.904 1.969 314 HB1 ALA 40 1HB ALA 40 3.362 -21.408 4.391 315 HB2 ALA 40 2HB ALA 40 3.695 -22.973 3.623 316 HB3 ALA 40 3HB ALA 40 5.010 -22.084 4.420 317 H GLY 41 H GLY 41 4.393 -20.440 0.154 318 HA2 GLY 41 2HA GLY 41 2.948 -20.231 -1.574 319 HA3 GLY 41 1HA GLY 41 1.819 -21.310 -0.739 320 H VAL 42 H VAL 42 2.278 -18.874 1.400 321 HA VAL 42 HA VAL 42 0.100 -17.158 0.353 322 HB VAL 42 HB VAL 42 1.469 -16.858 3.049 323 HG11 VAL 42 1HG1 VAL 42 -1.332 -16.226 2.085 324 HG12 VAL 42 2HG1 VAL 42 -0.670 -15.858 3.692 325 HG13 VAL 42 3HG1 VAL 42 -0.012 -15.049 2.279 326 HG21 VAL 42 3HG2 VAL 42 0.725 -19.197 3.056 327 HG22 VAL 42 1HG2 VAL 42 -0.298 -18.225 4.096 328 HG23 VAL 42 2HG2 VAL 42 -0.871 -18.695 2.484 329 H TYR 43 H TYR 43 0.491 -14.963 -0.109 330 HA TYR 43 HA TYR 43 2.899 -13.670 0.634 331 HB2 TYR 43 1HB TYR 43 3.584 -13.079 -1.745 332 HB3 TYR 43 2HB TYR 43 3.967 -14.695 -1.217 333 HD1 TYR 43 2HD TYR 43 2.552 -16.664 -1.955 334 HD2 TYR 43 1HD TYR 43 2.176 -12.740 -3.727 335 HE1 TYR 43 2HE TYR 43 1.332 -17.637 -3.811 336 HE2 TYR 43 1HE TYR 43 1.007 -13.732 -5.663 337 HH TYR 43 HH TYR 43 0.404 -17.296 -5.880 338 H LEU 44 H LEU 44 2.819 -11.427 -0.702 339 HA LEU 44 HA LEU 44 0.020 -10.533 -1.033 340 HB2 LEU 44 1HB LEU 44 2.333 -9.104 0.349 341 HB3 LEU 44 2HB LEU 44 0.851 -8.290 -0.155 342 HG LEU 44 HG LEU 44 0.883 -10.606 1.813 343 HD11 LEU 44 1HD1 LEU 44 0.696 -9.018 3.637 344 HD12 LEU 44 2HD1 LEU 44 0.806 -7.652 2.519 345 HD13 LEU 44 3HD1 LEU 44 2.204 -8.732 2.755 346 HD21 LEU 44 3HD2 LEU 44 -1.296 -10.126 0.720 347 HD22 LEU 44 1HD2 LEU 44 -1.197 -8.438 1.277 348 HD23 LEU 44 2HD2 LEU 44 -1.337 -9.762 2.446 349 H ARG 45 H ARG 45 -0.045 -8.752 -2.633 350 HA ARG 45 HA ARG 45 2.388 -8.461 -4.322 351 HB2 ARG 45 1HB ARG 45 -0.182 -9.646 -5.115 352 HB3 ARG 45 2HB ARG 45 0.085 -8.137 -5.984 353 HG2 ARG 45 1HG ARG 45 2.429 -9.042 -6.535 354 HG3 ARG 45 2HG ARG 45 1.834 -10.615 -5.986 355 HD2 ARG 45 1HD ARG 45 0.168 -10.689 -7.721 356 HD3 ARG 45 2HD ARG 45 0.337 -8.958 -8.059 357 HE ARG 45 HE ARG 45 2.638 -10.783 -8.485 358 HH11 ARG 45 1HH1 ARG 45 0.290 -8.632 -10.085 359 HH12 ARG 45 2HH1 ARG 45 1.381 -8.187 -11.355 360 HH21 ARG 45 1HH2 ARG 45 3.981 -10.308 -10.098 361 HH22 ARG 45 2HH2 ARG 45 3.550 -9.154 -11.355 362 H ALA 46 H ALA 46 2.954 -6.420 -3.667 363 HA ALA 46 HA ALA 46 0.865 -4.384 -3.094 364 HB1 ALA 46 1HB ALA 46 2.972 -3.176 -2.171 365 HB2 ALA 46 2HB ALA 46 2.352 -4.536 -1.253 366 HB3 ALA 46 3HB ALA 46 3.795 -4.705 -2.301 367 H TYR 47 H TYR 47 0.380 -3.999 -5.361 368 HA TYR 47 HA TYR 47 2.637 -2.954 -6.999 369 HB2 TYR 47 1HB TYR 47 0.593 -4.333 -7.945 370 HB3 TYR 47 2HB TYR 47 -0.208 -2.779 -7.941 371 HD1 TYR 47 2HD TYR 47 2.722 -4.700 -9.275 372 HD2 TYR 47 1HD TYR 47 0.533 -1.002 -9.455 373 HE1 TYR 47 2HE TYR 47 3.995 -4.055 -11.287 374 HE2 TYR 47 1HE TYR 47 1.843 -0.303 -11.443 375 HH TYR 47 HH TYR 47 3.364 -1.139 -13.187 376 H VAL 48 H VAL 48 2.600 -0.769 -7.768 377 HA VAL 48 HA VAL 48 1.069 1.153 -6.118 378 HB VAL 48 HB VAL 48 4.036 1.317 -6.821 379 HG11 VAL 48 1HG1 VAL 48 2.127 3.113 -5.316 380 HG12 VAL 48 2HG1 VAL 48 3.890 3.230 -5.121 381 HG13 VAL 48 3HG1 VAL 48 3.131 3.497 -6.717 382 HG21 VAL 48 3HG2 VAL 48 4.612 1.024 -4.517 383 HG22 VAL 48 1HG2 VAL 48 2.930 0.973 -4.008 384 HG23 VAL 48 2HG2 VAL 48 3.623 -0.367 -4.953 385 H MET 49 H MET 49 0.020 2.592 -7.440 386 HA MET 49 HA MET 49 0.749 2.668 -10.323 387 HB2 MET 49 1HB MET 49 -1.661 1.669 -9.025 388 HB3 MET 49 2HB MET 49 -2.007 2.852 -10.303 389 HG2 MET 49 1HG MET 49 -0.749 1.666 -11.904 390 HG3 MET 49 2HG MET 49 -0.032 0.610 -10.692 391 HE1 MET 49 3HE MET 49 -3.218 -1.667 -9.839 392 HE2 MET 49 1HE MET 49 -1.661 -1.129 -9.194 393 HE3 MET 49 2HE MET 49 -3.091 -0.072 -9.101 394 HA PRO 50 HA PRO 50 0.784 6.836 -8.478 395 HB2 PRO 50 1HB PRO 50 2.868 7.877 -9.927 396 HB3 PRO 50 2HB PRO 50 3.094 6.731 -8.589 397 HG2 PRO 50 1HG PRO 50 2.938 6.095 -11.558 398 HG3 PRO 50 2HG PRO 50 4.224 5.622 -10.400 399 HD2 PRO 50 1HD PRO 50 2.174 3.942 -10.994 400 HD3 PRO 50 2HD PRO 50 2.788 4.068 -9.319 401 H ALA 51 H ALA 51 0.862 9.110 -9.594 402 HA ALA 51 HA ALA 51 -0.779 9.104 -12.040 403 HB1 ALA 51 1HB ALA 51 0.031 11.407 -10.213 404 HB2 ALA 51 2HB ALA 51 -1.115 11.481 -11.569 405 HB3 ALA 51 3HB ALA 51 -1.523 10.529 -10.130 406 H ALA 52 H ALA 52 2.238 8.623 -11.629 407 HA ALA 52 HA ALA 52 4.164 8.838 -12.705 408 HB1 ALA 52 1HB ALA 52 2.760 10.487 -14.828 409 HB2 ALA 52 2HB ALA 52 4.380 9.778 -14.918 410 HB3 ALA 52 3HB ALA 52 2.959 8.724 -14.825 411 H THR 53 H THR 53 5.896 9.996 -12.366 412 HA THR 53 HA THR 53 5.691 12.504 -10.902 413 HB THR 53 HB THR 53 7.187 10.847 -10.041 414 HG1 THR 53 1HG THR 53 9.180 11.929 -10.077 415 HG21 THR 53 3HG2 THR 53 9.184 9.987 -11.269 416 HG22 THR 53 1HG2 THR 53 8.534 10.677 -12.761 417 HG23 THR 53 2HG2 THR 53 7.659 9.400 -11.910 418 H ILE 54 H ILE 54 4.528 13.554 -13.144 419 HA ILE 54 HA ILE 54 6.400 14.750 -14.580 420 HB ILE 54 HB ILE 54 5.719 13.800 -16.128 421 HG12 ILE 54 1HG1 ILE 54 3.293 15.476 -15.977 422 HG13 ILE 54 2HG1 ILE 54 4.909 16.125 -15.999 423 HG21 ILE 54 1HG2 ILE 54 3.314 13.253 -14.512 424 HG22 ILE 54 2HG2 ILE 54 3.459 12.665 -16.221 425 HG23 ILE 54 3HG2 ILE 54 4.752 12.279 -15.017 426 HD11 ILE 54 3HD1 ILE 54 5.358 15.052 -18.214 427 HD12 ILE 54 1HD1 ILE 54 3.723 14.342 -18.195 428 HD13 ILE 54 2HD1 ILE 54 3.929 16.105 -18.312 429 H SER 55 H SER 55 6.562 16.755 -13.628 430 HA SER 55 HA SER 55 4.322 18.422 -12.986 431 HB2 SER 55 1HB SER 55 3.831 17.019 -11.195 432 HB3 SER 55 2HB SER 55 5.493 16.625 -10.895 433 HG SER 55 HG SER 55 5.305 18.132 -9.373 434 H ARG 56 H ARG 56 5.365 20.155 -11.266 435 HA ARG 56 HA ARG 56 7.955 21.058 -12.400 436 HB2 ARG 56 1HB ARG 56 6.144 22.635 -13.090 437 HB3 ARG 56 2HB ARG 56 5.656 22.782 -11.397 438 HG2 ARG 56 1HG ARG 56 7.913 23.647 -10.816 439 HG3 ARG 56 2HG ARG 56 8.378 23.554 -12.527 440 HD2 ARG 56 1HD ARG 56 6.773 25.255 -13.112 441 HD3 ARG 56 2HD ARG 56 6.056 25.223 -11.484 442 HE ARG 56 HE ARG 56 8.717 25.742 -11.036 443 HH11 ARG 56 1HH1 ARG 56 6.352 27.437 -13.097 444 HH12 ARG 56 2HH1 ARG 56 6.847 29.007 -12.598 445 HH21 ARG 56 1HH2 ARG 56 9.496 27.687 -10.547 446 HH22 ARG 56 2HH2 ARG 56 8.811 29.177 -11.125 447 H ASP 57 H ASP 57 8.988 19.821 -10.863 448 HA ASP 57 HA ASP 57 8.528 20.050 -7.989 449 HB2 ASP 57 1HB ASP 57 10.331 18.620 -9.650 450 HB3 ASP 57 2HB ASP 57 11.306 19.851 -8.833 451 H ALA 58 H ALA 58 10.238 21.237 -6.604 452 HA ALA 58 HA ALA 58 11.084 23.171 -5.876 453 HB1 ALA 58 1HB ALA 58 12.914 22.476 -7.365 454 HB2 ALA 58 2HB ALA 58 12.206 23.429 -8.683 455 HB3 ALA 58 3HB ALA 58 12.809 24.248 -7.221 456 H ALA 59 H ALA 59 8.416 23.149 -7.172 457 HA ALA 59 HA ALA 59 7.974 25.897 -6.335 458 HB1 ALA 59 1HB ALA 59 6.862 24.987 -9.031 459 HB2 ALA 59 2HB ALA 59 6.434 26.492 -8.187 460 HB3 ALA 59 3HB ALA 59 8.089 26.262 -8.777 461 H GLY 60 H GLY 60 5.922 26.133 -5.366 462 HA2 GLY 60 2HA GLY 60 4.534 23.634 -4.766 463 HA3 GLY 60 1HA GLY 60 4.441 25.164 -3.885 464 H ASP 61 H ASP 61 4.116 25.563 -7.253 465 HA ASP 61 HA ASP 61 1.156 25.860 -7.006 466 HB2 ASP 61 1HB ASP 61 3.343 27.893 -7.233 467 HB3 ASP 61 2HB ASP 61 1.727 28.264 -7.899 468 H HIS 62 H HIS 62 2.453 23.857 -8.515 469 HA HIS 62 HA HIS 62 1.099 24.376 -10.956 470 HB2 HIS 62 1HB HIS 62 4.025 24.649 -10.969 471 HB3 HIS 62 2HB HIS 62 3.514 23.298 -11.975 472 HD1 HIS 62 1HD HIS 62 2.391 26.970 -11.590 473 HD2 HIS 62 2HD HIS 62 2.743 23.835 -14.354 474 HE1 HIS 62 1HE HIS 62 1.904 27.998 -13.910 475 H ARG 63 H ARG 63 0.557 22.464 -11.930 476 HA ARG 63 HA ARG 63 -0.095 20.328 -12.008 477 HB2 ARG 63 1HB ARG 63 2.802 20.378 -12.220 478 HB3 ARG 63 2HB ARG 63 2.316 18.867 -11.488 479 HG2 ARG 63 1HG ARG 63 2.490 18.731 -13.949 480 HG3 ARG 63 2HG ARG 63 0.903 18.299 -13.355 481 HD2 ARG 63 1HD ARG 63 1.288 21.177 -14.143 482 HD3 ARG 63 2HD ARG 63 1.400 19.993 -15.452 483 HE ARG 63 HE ARG 63 -0.851 19.178 -14.166 484 HH11 ARG 63 1HH1 ARG 63 0.012 22.460 -15.298 485 HH12 ARG 63 2HH1 ARG 63 -1.632 22.827 -15.704 486 HH21 ARG 63 1HH2 ARG 63 -2.977 19.808 -14.592 487 HH22 ARG 63 2HH2 ARG 63 -3.304 21.408 -15.212 488 H GLN 64 H GLN 64 0.572 17.876 -10.581 489 HA GLN 64 HA GLN 64 0.590 18.293 -7.802 490 HB2 GLN 64 1HB GLN 64 -1.708 17.256 -7.532 491 HB3 GLN 64 2HB GLN 64 -1.689 18.958 -7.925 492 HG2 GLN 64 1HG GLN 64 -1.888 17.350 -10.385 493 HG3 GLN 64 2HG GLN 64 -3.093 16.846 -9.218 494 HE21 GLN 64 1HE2 GLN 64 -4.416 18.583 -8.172 495 HE22 GLN 64 2HE2 GLN 64 -5.048 19.770 -9.281 496 H TYR 65 H TYR 65 0.122 16.089 -6.767 497 HA TYR 65 HA TYR 65 0.856 13.802 -8.548 498 HB2 TYR 65 1HB TYR 65 1.691 14.701 -5.842 499 HB3 TYR 65 2HB TYR 65 1.261 13.007 -5.925 500 HD1 TYR 65 1HD TYR 65 2.948 14.907 -8.717 501 HD2 TYR 65 2HD TYR 65 3.369 12.100 -5.454 502 HE1 TYR 65 1HE TYR 65 5.228 14.432 -9.427 503 HE2 TYR 65 2HE TYR 65 5.726 11.691 -6.125 504 HH TYR 65 HH TYR 65 7.273 13.525 -8.754 505 H ARG 66 H ARG 66 0.031 11.678 -7.702 506 HA ARG 66 HA ARG 66 -1.957 11.421 -5.819 507 HB2 ARG 66 1HB ARG 66 -3.047 12.357 -8.249 508 HB3 ARG 66 2HB ARG 66 -3.197 10.622 -8.412 509 HG2 ARG 66 1HG ARG 66 -4.903 10.514 -6.983 510 HG3 ARG 66 2HG ARG 66 -4.047 11.442 -5.746 511 HD2 ARG 66 1HD ARG 66 -5.193 12.859 -8.159 512 HD3 ARG 66 2HD ARG 66 -6.251 12.401 -6.841 513 HE ARG 66 HE ARG 66 -3.853 14.175 -6.586 514 HH11 ARG 66 1HH1 ARG 66 -6.958 13.020 -5.166 515 HH12 ARG 66 2HH1 ARG 66 -7.069 14.387 -4.084 516 HH21 ARG 66 1HH2 ARG 66 -3.959 15.800 -5.009 517 HH22 ARG 66 2HH2 ARG 66 -5.076 15.622 -3.706 518 H GLY 67 H GLY 67 -2.815 8.948 -6.016 519 HA2 GLY 67 2HA GLY 67 -2.018 7.331 -8.118 520 HA3 GLY 67 1HA GLY 67 -0.744 7.178 -6.887 521 H VAL 68 H VAL 68 -2.114 4.929 -7.452 522 HA VAL 68 HA VAL 68 -3.738 4.567 -4.993 523 HB VAL 68 HB VAL 68 -5.146 4.379 -6.945 524 HG11 VAL 68 1HG1 VAL 68 -3.425 2.054 -7.850 525 HG12 VAL 68 2HG1 VAL 68 -4.904 2.629 -8.623 526 HG13 VAL 68 3HG1 VAL 68 -3.480 3.666 -8.637 527 HG21 VAL 68 3HG2 VAL 68 -6.140 2.181 -6.634 528 HG22 VAL 68 1HG2 VAL 68 -4.720 1.605 -5.776 529 HG23 VAL 68 2HG2 VAL 68 -5.730 2.902 -5.078 530 H PHE 69 H PHE 69 -3.474 2.520 -3.963 531 HA PHE 69 HA PHE 69 -0.964 1.079 -4.542 532 HB2 PHE 69 1HB PHE 69 -0.866 2.549 -2.431 533 HB3 PHE 69 2HB PHE 69 -2.215 1.600 -1.809 534 HD1 PHE 69 2HD PHE 69 0.841 0.460 -3.667 535 HD2 PHE 69 1HD PHE 69 -1.278 0.516 0.086 536 HE1 PHE 69 2HE PHE 69 2.434 -1.166 -2.761 537 HE2 PHE 69 1HE PHE 69 0.355 -1.094 1.012 538 HZ PHE 69 HZ PHE 69 2.188 -1.975 -0.406 539 H GLN 70 H GLN 70 -1.311 -1.184 -4.574 540 HA GLN 70 HA GLN 70 -4.111 -2.124 -4.188 541 HB2 GLN 70 1HB GLN 70 -3.679 -1.599 -6.572 542 HB3 GLN 70 2HB GLN 70 -2.245 -2.613 -6.568 543 HG2 GLN 70 1HG GLN 70 -3.437 -4.533 -6.794 544 HG3 GLN 70 2HG GLN 70 -4.639 -4.057 -5.592 545 HE21 GLN 70 1HE2 GLN 70 -6.655 -3.996 -6.452 546 HE22 GLN 70 2HE2 GLN 70 -7.066 -3.325 -8.026 547 H VAL 71 H VAL 71 -4.099 -3.856 -2.821 548 HA VAL 71 HA VAL 71 -1.648 -5.498 -2.709 549 HB VAL 71 HB VAL 71 -3.100 -4.582 -0.255 550 HG11 VAL 71 1HG1 VAL 71 -0.458 -6.061 -0.736 551 HG12 VAL 71 2HG1 VAL 71 -1.138 -5.630 0.855 552 HG13 VAL 71 3HG1 VAL 71 -1.957 -6.803 -0.145 553 HG21 VAL 71 3HG2 VAL 71 -2.062 -2.622 -1.059 554 HG22 VAL 71 1HG2 VAL 71 -1.058 -3.252 0.242 555 HG23 VAL 71 2HG2 VAL 71 -0.549 -3.485 -1.451 556 H ASN 72 H ASN 72 -2.477 -7.151 -3.801 557 HA ASN 72 HA ASN 72 -5.137 -8.239 -3.219 558 HB2 ASN 72 1HB ASN 72 -2.990 -8.599 -5.279 559 HB3 ASN 72 2HB ASN 72 -3.836 -10.061 -4.843 560 HD21 ASN 72 1HD2 ASN 72 -4.019 -9.072 -7.393 561 HD22 ASN 72 2HD2 ASN 72 -5.693 -8.618 -7.700 562 H VAL 73 H VAL 73 -5.309 -9.170 -1.285 563 HA VAL 73 HA VAL 73 -3.211 -10.812 -0.090 564 HB VAL 73 HB VAL 73 -6.120 -10.433 0.712 565 HG11 VAL 73 1HG1 VAL 73 -5.177 -12.464 1.692 566 HG12 VAL 73 2HG1 VAL 73 -3.768 -11.536 2.287 567 HG13 VAL 73 3HG1 VAL 73 -5.397 -11.225 2.928 568 HG21 VAL 73 3HG2 VAL 73 -4.998 -8.291 0.781 569 HG22 VAL 73 1HG2 VAL 73 -5.223 -8.891 2.420 570 HG23 VAL 73 2HG2 VAL 73 -3.624 -8.984 1.671 571 H VAL 74 H VAL 74 -2.759 -12.625 -1.236 572 HA VAL 74 HA VAL 74 -4.960 -14.427 -2.089 573 HB VAL 74 HB VAL 74 -3.556 -13.829 -3.903 574 HG11 VAL 74 1HG1 VAL 74 -1.129 -14.159 -3.973 575 HG12 VAL 74 2HG1 VAL 74 -1.564 -12.932 -2.795 576 HG13 VAL 74 3HG1 VAL 74 -1.105 -14.567 -2.251 577 HG21 VAL 74 3HG2 VAL 74 -2.662 -15.958 -4.637 578 HG22 VAL 74 1HG2 VAL 74 -2.624 -16.577 -2.981 579 HG23 VAL 74 2HG2 VAL 74 -4.183 -16.209 -3.774 580 H MET 75 H MET 75 -5.042 -16.498 -1.119 581 HA MET 75 HA MET 75 -2.853 -17.424 0.507 582 HB2 MET 75 1HB MET 75 -4.714 -18.108 2.302 583 HB3 MET 75 2HB MET 75 -3.695 -16.690 2.445 584 HG2 MET 75 1HG MET 75 -5.961 -16.259 3.099 585 HG3 MET 75 2HG MET 75 -5.337 -15.219 1.846 586 HE1 MET 75 3HE MET 75 -8.144 -14.694 -0.210 587 HE2 MET 75 1HE MET 75 -7.063 -14.112 1.076 588 HE3 MET 75 2HE MET 75 -6.382 -14.806 -0.392 589 HA PRO 76 HA PRO 76 -4.732 -21.175 -1.209 590 HB2 PRO 76 1HB PRO 76 -3.329 -23.078 0.155 591 HB3 PRO 76 2HB PRO 76 -2.482 -21.964 -0.964 592 HG2 PRO 76 1HG PRO 76 -2.737 -21.726 2.046 593 HG3 PRO 76 2HG PRO 76 -1.255 -21.592 1.051 594 HD2 PRO 76 1HD PRO 76 -2.775 -19.395 1.844 595 HD3 PRO 76 2HD PRO 76 -1.810 -19.447 0.327 596 H ILE 77 H ILE 77 -6.480 -22.415 -0.755 597 HA ILE 77 HA ILE 77 -7.838 -21.955 1.684 598 HB ILE 77 HB ILE 77 -8.491 -23.409 -0.878 599 HG12 ILE 77 1HG1 ILE 77 -9.486 -21.471 -1.626 600 HG13 ILE 77 2HG1 ILE 77 -9.828 -20.932 -0.017 601 HG21 ILE 77 1HG2 ILE 77 -10.856 -23.287 -0.037 602 HG22 ILE 77 2HG2 ILE 77 -9.858 -24.321 0.979 603 HG23 ILE 77 3HG2 ILE 77 -10.248 -22.680 1.534 604 HD11 ILE 77 3HD1 ILE 77 -8.481 -19.369 -1.096 605 HD12 ILE 77 1HD1 ILE 77 -7.837 -19.950 0.449 606 HD13 ILE 77 2HD1 ILE 77 -7.163 -20.528 -1.101 607 H GLY 78 H GLY 78 -6.472 -23.233 3.170 608 HA2 GLY 78 2HA GLY 78 -5.710 -26.007 2.563 609 HA3 GLY 78 1HA GLY 78 -5.345 -25.093 4.039 610 H ASP 79 H ASP 79 -6.820 -25.013 5.715 611 HA ASP 79 HA ASP 79 -9.525 -26.114 5.318 612 HB2 ASP 79 1HB ASP 79 -8.481 -27.472 6.990 613 HB3 ASP 79 2HB ASP 79 -7.854 -26.060 7.847 614 H GLY 80 H GLY 80 -10.535 -24.302 4.769 615 HA2 GLY 80 2HA GLY 80 -11.729 -22.383 5.111 616 HA3 GLY 80 1HA GLY 80 -11.118 -22.372 6.758 617 H SER 81 H SER 81 -8.568 -21.797 6.625 618 HA SER 81 HA SER 81 -7.139 -20.120 6.820 619 HB2 SER 81 1HB SER 81 -6.608 -20.246 4.539 620 HB3 SER 81 2HB SER 81 -8.167 -19.641 4.068 621 HG SER 81 HG SER 81 -5.877 -18.254 4.839 622 H ARG 82 H ARG 82 -10.030 -18.516 5.340 623 HA ARG 82 HA ARG 82 -11.033 -16.618 5.718 624 HB2 ARG 82 1HB ARG 82 -10.957 -16.838 8.673 625 HB3 ARG 82 2HB ARG 82 -12.258 -16.504 7.540 626 HG2 ARG 82 1HG ARG 82 -11.175 -19.218 8.308 627 HG3 ARG 82 2HG ARG 82 -12.721 -18.516 8.735 628 HD2 ARG 82 1HD ARG 82 -12.531 -18.537 5.856 629 HD3 ARG 82 2HD ARG 82 -12.031 -20.122 6.473 630 HE ARG 82 HE ARG 82 -14.254 -19.817 7.853 631 HH11 ARG 82 1HH1 ARG 82 -13.688 -19.615 4.288 632 HH12 ARG 82 2HH1 ARG 82 -15.383 -19.518 3.949 633 HH21 ARG 82 1HH2 ARG 82 -16.490 -19.896 7.257 634 HH22 ARG 82 2HH2 ARG 82 -16.961 -19.850 5.596 635 H SER 83 H SER 83 -7.857 -16.675 6.399 636 HA SER 83 HA SER 83 -7.234 -14.502 7.926 637 HB2 SER 83 1HB SER 83 -5.728 -16.245 6.741 638 HB3 SER 83 2HB SER 83 -5.737 -15.131 5.357 639 HG SER 83 HG SER 83 -4.010 -14.544 6.591 640 H ALA 84 H ALA 84 -8.420 -14.390 4.540 641 HA ALA 84 HA ALA 84 -7.709 -11.740 3.873 642 HB1 ALA 84 1HB ALA 84 -10.124 -13.439 3.125 643 HB2 ALA 84 2HB ALA 84 -9.787 -11.875 2.374 644 HB3 ALA 84 3HB ALA 84 -8.617 -13.210 2.210 645 H GLU 85 H GLU 85 -10.133 -12.761 6.248 646 HA GLU 85 HA GLU 85 -11.544 -10.189 6.196 647 HB2 GLU 85 1HB GLU 85 -11.739 -12.603 8.065 648 HB3 GLU 85 2HB GLU 85 -12.894 -11.274 7.911 649 HG2 GLU 85 1HG GLU 85 -13.286 -11.938 5.526 650 HG3 GLU 85 2HG GLU 85 -12.246 -13.336 5.753 651 H GLN 86 H GLN 86 -9.572 -12.074 8.549 652 HA GLN 86 HA GLN 86 -9.214 -10.072 10.452 653 HB2 GLN 86 1HB GLN 86 -7.591 -12.470 9.524 654 HB3 GLN 86 2HB GLN 86 -7.017 -11.428 10.814 655 HG2 GLN 86 1HG GLN 86 -9.763 -12.706 10.909 656 HG3 GLN 86 2HG GLN 86 -8.313 -13.498 11.525 657 HE21 GLN 86 1HE2 GLN 86 -6.877 -11.922 13.031 658 HE22 GLN 86 2HE2 GLN 86 -7.821 -11.059 14.211 659 H VAL 87 H VAL 87 -7.229 -10.781 7.547 660 HA VAL 87 HA VAL 87 -5.167 -8.920 8.077 661 HB VAL 87 HB VAL 87 -6.236 -10.255 5.559 662 HG11 VAL 87 1HG1 VAL 87 -5.041 -8.317 4.737 663 HG12 VAL 87 2HG1 VAL 87 -3.650 -8.669 5.795 664 HG13 VAL 87 3HG1 VAL 87 -4.066 -9.754 4.444 665 HG21 VAL 87 3HG2 VAL 87 -4.590 -11.871 5.790 666 HG22 VAL 87 1HG2 VAL 87 -3.575 -10.859 6.840 667 HG23 VAL 87 2HG2 VAL 87 -5.058 -11.608 7.476 668 H ALA 88 H ALA 88 -8.292 -8.506 6.341 669 HA ALA 88 HA ALA 88 -7.678 -5.893 5.325 670 HB1 ALA 88 1HB ALA 88 -10.127 -5.657 5.083 671 HB2 ALA 88 2HB ALA 88 -9.601 -7.238 4.492 672 HB3 ALA 88 3HB ALA 88 -10.395 -7.102 6.074 673 H ALA 89 H ALA 89 -8.851 -7.101 8.443 674 HA ALA 89 HA ALA 89 -9.473 -4.454 9.495 675 HB1 ALA 89 1HB ALA 89 -9.761 -5.823 11.616 676 HB2 ALA 89 2HB ALA 89 -10.823 -6.263 10.264 677 HB3 ALA 89 3HB ALA 89 -9.416 -7.268 10.655 678 H GLU 90 H GLU 90 -6.767 -6.787 9.850 679 HA GLU 90 HA GLU 90 -5.357 -5.354 11.898 680 HB2 GLU 90 1HB GLU 90 -4.355 -7.171 9.645 681 HB3 GLU 90 2HB GLU 90 -3.301 -6.435 10.846 682 HG2 GLU 90 1HG GLU 90 -5.136 -7.598 12.499 683 HG3 GLU 90 2HG GLU 90 -5.209 -8.705 11.146 684 H LEU 91 H LEU 91 -5.011 -5.306 8.337 685 HA LEU 91 HA LEU 91 -3.100 -3.244 8.265 686 HB2 LEU 91 1HB LEU 91 -5.081 -4.333 6.270 687 HB3 LEU 91 2HB LEU 91 -4.055 -2.961 5.845 688 HG LEU 91 HG LEU 91 -2.784 -5.415 7.073 689 HD11 LEU 91 1HD1 LEU 91 -2.415 -6.269 4.715 690 HD12 LEU 91 2HD1 LEU 91 -3.699 -5.136 4.208 691 HD13 LEU 91 3HD1 LEU 91 -4.062 -6.397 5.356 692 HD21 LEU 91 3HD2 LEU 91 -1.413 -3.395 6.795 693 HD22 LEU 91 1HD2 LEU 91 -1.815 -3.335 5.060 694 HD23 LEU 91 2HD2 LEU 91 -0.858 -4.684 5.734 695 H ASP 92 H ASP 92 -6.689 -2.987 8.389 696 HA ASP 92 HA ASP 92 -6.882 -0.222 7.661 697 HB2 ASP 92 1HB ASP 92 -8.823 -1.665 7.704 698 HB3 ASP 92 2HB ASP 92 -8.605 -1.977 9.428 699 H ALA 93 H ALA 93 -6.462 -1.803 10.875 700 HA ALA 93 HA ALA 93 -6.401 0.650 12.370 701 HB1 ALA 93 1HB ALA 93 -6.808 -1.370 13.531 702 HB2 ALA 93 2HB ALA 93 -5.364 -2.161 12.877 703 HB3 ALA 93 3HB ALA 93 -5.196 -0.842 14.057 704 H LEU 94 H LEU 94 -4.058 -0.781 10.258 705 HA LEU 94 HA LEU 94 -1.839 0.777 11.444 706 HB2 LEU 94 1HB LEU 94 -1.496 -1.573 10.645 707 HB3 LEU 94 2HB LEU 94 -1.879 -1.037 9.012 708 HG LEU 94 HG LEU 94 0.108 0.530 9.096 709 HD11 LEU 94 1HD1 LEU 94 1.826 0.014 10.895 710 HD12 LEU 94 2HD1 LEU 94 0.584 -0.895 11.763 711 HD13 LEU 94 3HD1 LEU 94 0.400 0.854 11.513 712 HD21 LEU 94 3HD2 LEU 94 1.762 -1.323 8.896 713 HD22 LEU 94 1HD2 LEU 94 0.239 -1.678 8.063 714 HD23 LEU 94 2HD2 LEU 94 0.542 -2.410 9.623 715 H PHE 95 H PHE 95 -4.218 0.914 8.831 716 HA PHE 95 HA PHE 95 -2.918 3.326 7.764 717 HB2 PHE 95 1HB PHE 95 -4.142 1.036 6.205 718 HB3 PHE 95 2HB PHE 95 -3.755 2.575 5.488 719 HD1 PHE 95 1HD PHE 95 -2.343 -0.600 6.741 720 HD2 PHE 95 2HD PHE 95 -1.457 3.192 4.858 721 HE1 PHE 95 1HE PHE 95 -0.167 -1.470 5.948 722 HE2 PHE 95 2HE PHE 95 0.733 2.325 4.213 723 HZ PHE 95 HZ PHE 95 1.398 0.010 4.727 724 HA PRO 96 HA PRO 96 -7.372 4.315 8.625 725 HB2 PRO 96 1HB PRO 96 -7.055 6.397 10.362 726 HB3 PRO 96 2HB PRO 96 -6.994 4.688 10.901 727 HG2 PRO 96 1HG PRO 96 -4.649 6.487 10.198 728 HG3 PRO 96 2HG PRO 96 -4.892 5.532 11.697 729 HD2 PRO 96 1HD PRO 96 -3.413 4.572 9.624 730 HD3 PRO 96 2HD PRO 96 -4.476 3.491 10.579 731 H VAL 97 H VAL 97 -8.361 6.434 8.168 732 HA VAL 97 HA VAL 97 -7.710 7.461 5.665 733 HB VAL 97 HB VAL 97 -9.864 7.076 6.801 734 HG11 VAL 97 1HG1 VAL 97 -9.121 9.566 8.328 735 HG12 VAL 97 2HG1 VAL 97 -10.807 9.196 8.003 736 HG13 VAL 97 3HG1 VAL 97 -9.811 8.037 8.891 737 HG21 VAL 97 3HG2 VAL 97 -11.112 8.670 5.571 738 HG22 VAL 97 1HG2 VAL 97 -9.735 9.784 5.472 739 HG23 VAL 97 2HG2 VAL 97 -9.683 8.211 4.649 740 H ASN 98 H ASN 98 -5.748 8.168 7.904 741 HA ASN 98 HA ASN 98 -5.421 11.101 7.315 742 HB2 ASN 98 1HB ASN 98 -4.404 9.586 9.766 743 HB3 ASN 98 2HB ASN 98 -4.213 11.308 9.437 744 HD21 ASN 98 1HD2 ASN 98 -6.348 12.625 9.269 745 HD22 ASN 98 2HD2 ASN 98 -7.699 12.021 10.192 746 H LEU 99 H LEU 99 -3.610 8.141 8.211 747 HA LEU 99 HA LEU 99 -1.495 7.441 7.638 748 HB2 LEU 99 1HB LEU 99 -3.280 7.492 5.555 749 HB3 LEU 99 2HB LEU 99 -1.891 8.267 4.802 750 HG LEU 99 HG LEU 99 -0.599 6.195 5.742 751 HD11 LEU 99 1HD1 LEU 99 -1.718 4.419 6.526 752 HD12 LEU 99 2HD1 LEU 99 -3.275 4.872 5.745 753 HD13 LEU 99 3HD1 LEU 99 -2.712 5.688 7.197 754 HD21 LEU 99 3HD2 LEU 99 -0.738 5.008 3.814 755 HD22 LEU 99 1HD2 LEU 99 -1.290 6.595 3.282 756 HD23 LEU 99 2HD2 LEU 99 -2.466 5.297 3.595 757 H VAL 100 H VAL 100 -1.367 10.018 8.711 758 HA VAL 100 HA VAL 100 0.237 11.786 7.127 759 HB VAL 100 HB VAL 100 -1.184 12.697 8.754 760 HG11 VAL 100 1HG1 VAL 100 -1.474 10.887 10.379 761 HG12 VAL 100 2HG1 VAL 100 0.178 11.136 10.980 762 HG13 VAL 100 3HG1 VAL 100 -1.048 12.394 11.172 763 HG21 VAL 100 3HG2 VAL 100 1.642 13.013 9.831 764 HG22 VAL 100 1HG2 VAL 100 0.953 13.879 8.440 765 HG23 VAL 100 2HG2 VAL 100 0.285 14.122 10.061 766 H MET 101 H MET 101 1.913 10.525 6.314 767 HA MET 101 HA MET 101 3.835 9.249 8.152 768 HB2 MET 101 1HB MET 101 4.319 9.766 5.209 769 HB3 MET 101 2HB MET 101 5.079 8.569 6.255 770 HG2 MET 101 1HG MET 101 2.902 7.384 6.453 771 HG3 MET 101 2HG MET 101 2.175 8.654 5.467 772 HE1 MET 101 3HE MET 101 1.371 6.500 2.816 773 HE2 MET 101 1HE MET 101 1.030 6.698 4.535 774 HE3 MET 101 2HE MET 101 1.193 8.122 3.500 775 H GLN 102 H GLN 102 5.244 10.497 9.227 776 HA GLN 102 HA GLN 102 6.465 12.884 7.990 777 HB2 GLN 102 1HB GLN 102 8.173 12.588 9.768 778 HB3 GLN 102 2HB GLN 102 6.574 13.023 10.324 779 HG2 GLN 102 1HG GLN 102 6.169 10.958 11.332 780 HG3 GLN 102 2HG GLN 102 7.354 10.100 10.348 781 HE21 GLN 102 1HE2 GLN 102 8.439 9.167 12.141 782 HE22 GLN 102 2HE2 GLN 102 9.460 10.138 13.159 783 H SER 103 H SER 103 7.607 12.537 6.173 784 HA SER 103 HA SER 103 9.598 10.438 6.129 785 HB2 SER 103 1HB SER 103 8.769 10.563 3.462 786 HB3 SER 103 2HB SER 103 8.625 9.220 4.575 787 HG SER 103 HG SER 103 6.675 10.658 3.445 788 H GLY 104 H GLY 104 11.302 11.048 4.590 789 HA2 GLY 104 2HA GLY 104 12.194 13.453 5.575 790 HA3 GLY 104 1HA GLY 104 12.991 12.569 4.275 791 H GLY 105 H GLY 105 10.331 13.087 2.644 792 HA2 GLY 105 2HA GLY 105 11.216 15.593 1.410 793 HA3 GLY 105 1HA GLY 105 9.911 14.510 0.884 794 H LEU 106 H LEU 106 8.102 14.322 2.648 795 HA LEU 106 HA LEU 106 7.088 16.817 3.686 796 HB2 LEU 106 1HB LEU 106 5.389 16.826 1.621 797 HB3 LEU 106 2HB LEU 106 6.871 17.755 1.629 798 HG LEU 106 HG LEU 106 8.010 16.206 0.199 799 HD11 LEU 106 1HD1 LEU 106 6.991 14.038 0.957 800 HD12 LEU 106 2HD1 LEU 106 7.106 14.251 -0.774 801 HD13 LEU 106 3HD1 LEU 106 5.531 14.447 0.052 802 HD21 LEU 106 3HD2 LEU 106 5.257 16.805 -0.919 803 HD22 LEU 106 1HD2 LEU 106 6.737 16.455 -1.847 804 HD23 LEU 106 2HD2 LEU 106 6.654 17.913 -0.857 805 H ALA 107 H ALA 107 4.824 16.581 4.329 806 HA ALA 107 HA ALA 107 4.282 13.849 5.120 807 HB1 ALA 107 1HB ALA 107 2.715 16.405 5.612 808 HB2 ALA 107 2HB ALA 107 2.448 14.841 6.422 809 HB3 ALA 107 3HB ALA 107 3.976 15.700 6.669 810 H VAL 108 H VAL 108 3.093 12.361 3.992 811 HA VAL 108 HA VAL 108 1.379 13.171 1.722 812 HB VAL 108 HB VAL 108 3.014 11.564 1.286 813 HG11 VAL 108 1HG1 VAL 108 3.689 10.676 3.319 814 HG12 VAL 108 2HG1 VAL 108 2.078 10.039 3.679 815 HG13 VAL 108 3HG1 VAL 108 3.089 9.318 2.383 816 HG21 VAL 108 3HG2 VAL 108 1.862 9.720 0.348 817 HG22 VAL 108 1HG2 VAL 108 0.443 9.974 1.385 818 HG23 VAL 108 2HG2 VAL 108 0.896 11.168 0.137 819 H ARG 109 H ARG 109 -0.878 11.865 1.610 820 HA ARG 109 HA ARG 109 -1.938 11.201 4.249 821 HB2 ARG 109 1HB ARG 109 -2.602 13.623 3.791 822 HB3 ARG 109 2HB ARG 109 -3.464 13.054 2.356 823 HG2 ARG 109 1HG ARG 109 -4.714 11.500 4.123 824 HG3 ARG 109 2HG ARG 109 -4.066 12.642 5.304 825 HD2 ARG 109 1HD ARG 109 -5.690 13.501 2.910 826 HD3 ARG 109 2HD ARG 109 -6.450 12.968 4.394 827 HE ARG 109 HE ARG 109 -4.726 15.386 4.063 828 HH11 ARG 109 1HH1 ARG 109 -6.932 13.550 6.150 829 HH12 ARG 109 2HH1 ARG 109 -7.147 14.797 7.299 830 HH21 ARG 109 1HH2 ARG 109 -5.170 17.110 5.359 831 HH22 ARG 109 2HH2 ARG 109 -6.092 16.995 6.814 832 H VAL 110 H VAL 110 -3.668 9.605 3.964 833 HA VAL 110 HA VAL 110 -3.535 8.133 1.477 834 HB VAL 110 HB VAL 110 -3.705 7.087 3.600 835 HG11 VAL 110 1HG1 VAL 110 -5.786 7.015 4.870 836 HG12 VAL 110 2HG1 VAL 110 -5.126 8.659 4.813 837 HG13 VAL 110 3HG1 VAL 110 -6.508 8.231 3.789 838 HG21 VAL 110 3HG2 VAL 110 -4.385 5.781 1.762 839 HG22 VAL 110 1HG2 VAL 110 -5.351 5.367 3.188 840 HG23 VAL 110 2HG2 VAL 110 -6.057 6.328 1.881 841 H ARG 111 H ARG 111 -5.565 10.749 2.476 842 HA ARG 111 HA ARG 111 -7.084 11.999 1.400 843 HB2 ARG 111 1HB ARG 111 -5.594 11.123 -0.655 844 HB3 ARG 111 2HB ARG 111 -7.090 10.340 -1.113 845 HG2 ARG 111 1HG ARG 111 -6.850 13.303 -0.487 846 HG3 ARG 111 2HG ARG 111 -6.550 12.645 -2.081 847 HD2 ARG 111 1HD ARG 111 -9.183 12.310 -0.611 848 HD3 ARG 111 2HD ARG 111 -8.854 13.665 -1.656 849 HE ARG 111 HE ARG 111 -8.322 11.559 -3.311 850 HH11 ARG 111 1HH1 ARG 111 -11.154 12.433 -1.326 851 HH12 ARG 111 2HH1 ARG 111 -12.263 11.552 -2.316 852 HH21 ARG 111 1HH2 ARG 111 -9.775 10.251 -4.447 853 HH22 ARG 111 2HH2 ARG 111 -11.475 10.277 -4.115 854 H THR 112 H THR 112 -7.597 8.498 0.976 855 HA THR 112 HA THR 112 -10.503 8.811 1.433 856 HB THR 112 HB THR 112 -10.685 6.894 -0.244 857 HG1 THR 112 1HG THR 112 -7.979 7.641 -0.774 858 HG21 THR 112 3HG2 THR 112 -9.468 9.424 -1.400 859 HG22 THR 112 1HG2 THR 112 -11.118 9.347 -0.744 860 HG23 THR 112 2HG2 THR 112 -10.686 8.366 -2.144 861 HA PRO 113 HA PRO 113 -9.650 5.583 4.384 862 HB2 PRO 113 1HB PRO 113 -11.915 4.077 4.455 863 HB3 PRO 113 2HB PRO 113 -11.892 5.784 4.993 864 HG2 PRO 113 1HG PRO 113 -12.714 4.723 2.267 865 HG3 PRO 113 2HG PRO 113 -13.632 5.838 3.336 866 HD2 PRO 113 1HD PRO 113 -12.096 6.746 1.310 867 HD3 PRO 113 2HD PRO 113 -12.194 7.631 2.862 868 H ILE 114 H ILE 114 -9.845 3.049 4.531 869 HA ILE 114 HA ILE 114 -8.430 1.672 2.457 870 HB ILE 114 HB ILE 114 -10.326 0.712 4.649 871 HG12 ILE 114 1HG1 ILE 114 -8.413 1.781 5.653 872 HG13 ILE 114 2HG1 ILE 114 -8.286 0.048 5.861 873 HG21 ILE 114 1HG2 ILE 114 -8.474 -0.979 2.923 874 HG22 ILE 114 2HG2 ILE 114 -9.220 -1.521 4.435 875 HG23 ILE 114 3HG2 ILE 114 -10.234 -1.088 3.057 876 HD11 ILE 114 3HD1 ILE 114 -6.702 1.812 3.970 877 HD12 ILE 114 1HD1 ILE 114 -6.121 0.826 5.318 878 HD13 ILE 114 2HD1 ILE 114 -6.679 0.036 3.838 879 H SER 115 H SER 115 -9.183 0.390 0.706 880 HA SER 115 HA SER 115 -12.120 0.358 0.245 881 HB2 SER 115 1HB SER 115 -10.112 1.251 -1.519 882 HB3 SER 115 2HB SER 115 -10.434 -0.420 -2.010 883 HG SER 115 HG SER 115 -12.371 1.620 -1.549 884 H ASN 116 H ASN 116 -12.994 -1.666 -0.594 885 HA ASN 116 HA ASN 116 -11.757 -4.153 0.121 886 HB2 ASN 116 1HB ASN 116 -12.481 -3.496 2.295 887 HB3 ASN 116 2HB ASN 116 -13.703 -2.382 1.676 888 HD21 ASN 116 1HD2 ASN 116 -12.976 -5.875 1.636 889 HD22 ASN 116 2HD2 ASN 116 -14.622 -6.359 1.976 890 H GLY 117 H GLY 117 -13.031 -5.748 -1.018 891 HA2 GLY 117 2HA GLY 117 -15.659 -5.007 -2.132 892 HA3 GLY 117 1HA GLY 117 -14.362 -5.361 -3.295 893 H GLN 118 H GLN 118 -16.431 -6.933 -3.584 894 HA GLN 118 HA GLN 118 -16.320 -9.358 -2.062 895 HB2 GLN 118 1HB GLN 118 -17.675 -8.324 -4.495 896 HB3 GLN 118 2HB GLN 118 -17.201 -9.994 -4.633 897 HG2 GLN 118 1HG GLN 118 -19.247 -10.323 -3.739 898 HG3 GLN 118 2HG GLN 118 -18.353 -10.235 -2.234 899 HE21 GLN 118 1HE2 GLN 118 -18.234 -7.819 -1.306 900 HE22 GLN 118 2HE2 GLN 118 -19.708 -6.888 -1.441 901 HA PRO 119 HA PRO 119 -12.578 -10.937 -3.812 902 HB2 PRO 119 1HB PRO 119 -12.929 -13.688 -3.450 903 HB3 PRO 119 2HB PRO 119 -12.450 -12.520 -2.201 904 HG2 PRO 119 1HG PRO 119 -15.152 -13.730 -2.693 905 HG3 PRO 119 2HG PRO 119 -14.392 -13.279 -1.148 906 HD2 PRO 119 1HD PRO 119 -16.311 -11.785 -2.512 907 HD3 PRO 119 2HD PRO 119 -15.166 -11.095 -1.329 908 H THR 120 H THR 120 -11.761 -12.693 -5.332 909 HA THR 120 HA THR 120 -13.379 -12.923 -7.804 910 HB THR 120 HB THR 120 -11.558 -11.151 -7.577 911 HG1 THR 120 1HG THR 120 -12.190 -11.856 -9.627 912 HG21 THR 120 3HG2 THR 120 -9.566 -13.372 -8.000 913 HG22 THR 120 1HG2 THR 120 -10.038 -12.924 -6.373 914 HG23 THR 120 2HG2 THR 120 -9.307 -11.698 -7.451 915 H THR 121 H THR 121 -13.067 -14.879 -5.551 916 HA THR 121 HA THR 121 -10.846 -16.447 -5.716 917 HB THR 121 HB THR 121 -12.473 -16.383 -3.876 918 HG1 THR 121 1HG THR 121 -11.767 -19.034 -4.585 919 HG21 THR 121 3HG2 THR 121 -14.429 -17.144 -5.258 920 HG22 THR 121 1HG2 THR 121 -14.119 -18.000 -3.713 921 HG23 THR 121 2HG2 THR 121 -13.665 -18.744 -5.287 922 H GLY 122 H GLY 122 -10.198 -18.345 -6.392 923 HA2 GLY 122 2HA GLY 122 -11.487 -19.496 -8.787 924 HA3 GLY 122 1HA GLY 122 -9.757 -19.447 -8.468 925 H ASP 123 H ASP 123 -9.745 -21.556 -8.699 926 HA ASP 123 HA ASP 123 -11.321 -23.668 -8.053 927 HB2 ASP 123 1HB ASP 123 -9.092 -23.420 -9.420 928 HB3 ASP 123 2HB ASP 123 -8.302 -23.856 -7.939 929 H ALA 124 H ALA 124 -8.518 -22.552 -6.176 930 HA ALA 124 HA ALA 124 -9.770 -23.052 -3.596 931 HB1 ALA 124 1HB ALA 124 -8.885 -25.326 -4.203 932 HB2 ALA 124 2HB ALA 124 -7.276 -24.576 -4.413 933 HB3 ALA 124 3HB ALA 124 -8.042 -24.625 -2.812 934 H ASP 125 H ASP 125 -8.769 -20.687 -5.193 935 HA ASP 125 HA ASP 125 -7.497 -19.769 -2.852 936 HB2 ASP 125 1HB ASP 125 -5.999 -18.372 -4.590 937 HB3 ASP 125 2HB ASP 125 -5.541 -19.548 -3.326 938 H HIS 126 H HIS 126 -8.273 -17.986 -2.158 939 HA HIS 126 HA HIS 126 -9.998 -16.383 -3.937 940 HB2 HIS 126 1HB HIS 126 -9.733 -15.799 -1.046 941 HB3 HIS 126 2HB HIS 126 -11.059 -15.482 -2.088 942 HD1 HIS 126 1HD HIS 126 -13.086 -17.234 -1.899 943 HD2 HIS 126 2HD HIS 126 -9.612 -18.273 0.305 944 HE1 HIS 126 1HE HIS 126 -13.785 -18.880 -0.146 945 H THR 127 H THR 127 -9.622 -14.152 -4.199 946 HA THR 127 HA THR 127 -7.335 -12.955 -2.804 947 HB THR 127 HB THR 127 -7.705 -12.596 -5.805 948 HG1 THR 127 1HG THR 127 -7.091 -14.673 -5.610 949 HG21 THR 127 3HG2 THR 127 -6.473 -10.835 -4.510 950 HG22 THR 127 1HG2 THR 127 -5.454 -11.689 -5.691 951 HG23 THR 127 2HG2 THR 127 -5.337 -12.089 -3.956 952 H VAL 128 H VAL 128 -8.462 -11.598 -1.561 953 HA VAL 128 HA VAL 128 -10.862 -10.249 -2.522 954 HB VAL 128 HB VAL 128 -10.300 -8.992 -0.224 955 HG11 VAL 128 1HG1 VAL 128 -11.627 -10.600 0.939 956 HG12 VAL 128 2HG1 VAL 128 -12.270 -10.314 -0.683 957 HG13 VAL 128 3HG1 VAL 128 -11.344 -11.813 -0.339 958 HG21 VAL 128 3HG2 VAL 128 -8.808 -11.515 0.330 959 HG22 VAL 128 1HG2 VAL 128 -8.073 -9.921 0.003 960 HG23 VAL 128 2HG2 VAL 128 -9.140 -10.118 1.387 961 HA PRO 129 HA PRO 129 -8.599 -6.799 -4.156 962 HB2 PRO 129 1HB PRO 129 -10.667 -5.165 -4.849 963 HB3 PRO 129 2HB PRO 129 -10.400 -6.742 -5.650 964 HG2 PRO 129 1HG PRO 129 -12.281 -6.139 -3.365 965 HG3 PRO 129 2HG PRO 129 -12.644 -7.018 -4.876 966 HD2 PRO 129 1HD PRO 129 -12.032 -8.279 -2.549 967 HD3 PRO 129 2HD PRO 129 -11.529 -8.915 -4.145 968 H ILE 130 H ILE 130 -7.398 -5.423 -2.844 969 HA ILE 130 HA ILE 130 -8.858 -3.637 -0.997 970 HB ILE 130 HB ILE 130 -6.421 -5.258 -0.174 971 HG12 ILE 130 1HG1 ILE 130 -9.383 -5.535 0.597 972 HG13 ILE 130 2HG1 ILE 130 -8.419 -6.724 -0.281 973 HG21 ILE 130 1HG2 ILE 130 -6.758 -4.264 2.046 974 HG22 ILE 130 2HG2 ILE 130 -6.621 -2.970 0.860 975 HG23 ILE 130 3HG2 ILE 130 -8.211 -3.432 1.499 976 HD11 ILE 130 3HD1 ILE 130 -8.730 -7.486 1.936 977 HD12 ILE 130 1HD1 ILE 130 -7.013 -7.070 1.727 978 HD13 ILE 130 2HD1 ILE 130 -8.104 -5.989 2.640 979 H SER 131 H SER 131 -8.146 -1.599 -1.221 980 HA SER 131 HA SER 131 -5.504 -0.947 -2.148 981 HB2 SER 131 1HB SER 131 -6.530 0.287 -4.213 982 HB3 SER 131 2HB SER 131 -6.330 -1.460 -4.333 983 HG SER 131 HG SER 131 -8.444 -0.348 -4.944 984 H LEU 132 H LEU 132 -5.373 1.503 -2.540 985 HA LEU 132 HA LEU 132 -7.451 3.150 -1.415 986 HB2 LEU 132 1HB LEU 132 -5.944 4.193 0.342 987 HB3 LEU 132 2HB LEU 132 -6.672 2.646 0.679 988 HG LEU 132 HG LEU 132 -4.385 1.585 -0.029 989 HD11 LEU 132 1HD1 LEU 132 -3.197 3.457 -0.972 990 HD12 LEU 132 2HD1 LEU 132 -2.431 3.042 0.565 991 HD13 LEU 132 3HD1 LEU 132 -3.489 4.457 0.443 992 HD21 LEU 132 3HD2 LEU 132 -5.326 1.526 2.172 993 HD22 LEU 132 1HD2 LEU 132 -4.749 3.167 2.531 994 HD23 LEU 132 2HD2 LEU 132 -3.584 1.845 2.279 995 H GLY 133 H GLY 133 -7.175 5.363 -1.926 996 HA2 GLY 133 2HA GLY 133 -5.217 5.782 -4.143 997 HA3 GLY 133 1HA GLY 133 -6.876 6.353 -4.129 998 H TYR 134 H TYR 134 -3.685 7.122 -3.363 999 HA TYR 134 HA TYR 134 -4.337 9.034 -1.191 1000 HB2 TYR 134 1HB TYR 134 -2.056 8.681 -0.440 1001 HB3 TYR 134 2HB TYR 134 -2.905 7.161 -0.543 1002 HD1 TYR 134 1HD TYR 134 -2.266 5.472 -2.241 1003 HD2 TYR 134 2HD TYR 134 -0.173 9.232 -1.874 1004 HE1 TYR 134 1HE TYR 134 -0.355 4.526 -3.494 1005 HE2 TYR 134 2HE TYR 134 1.744 8.289 -3.140 1006 HH TYR 134 HH TYR 134 2.096 4.930 -3.686 1007 H ASP 135 H ASP 135 -2.761 10.941 -0.995 1008 HA ASP 135 HA ASP 135 -1.832 11.893 -3.613 1009 HB2 ASP 135 1HB ASP 135 -2.913 13.923 -3.539 1010 HB3 ASP 135 2HB ASP 135 -4.140 12.676 -3.390 1011 H VAL 136 H VAL 136 -0.211 13.336 -3.516 1012 HA VAL 136 HA VAL 136 1.180 13.807 -0.943 1013 HB VAL 136 HB VAL 136 1.976 13.820 -3.861 1014 HG11 VAL 136 1HG1 VAL 136 3.124 15.804 -2.898 1015 HG12 VAL 136 2HG1 VAL 136 3.840 14.755 -1.654 1016 HG13 VAL 136 3HG1 VAL 136 4.230 14.516 -3.360 1017 HG21 VAL 136 3HG2 VAL 136 2.021 11.653 -2.660 1018 HG22 VAL 136 1HG2 VAL 136 3.654 12.175 -3.109 1019 HG23 VAL 136 2HG2 VAL 136 3.094 12.359 -1.434 1020 H GLN 137 H GLN 137 1.671 15.827 -0.305 1021 HA GLN 137 HA GLN 137 1.022 18.185 -1.852 1022 HB2 GLN 137 1HB GLN 137 0.079 19.355 0.110 1023 HB3 GLN 137 2HB GLN 137 -0.991 18.123 -0.527 1024 HG2 GLN 137 1HG GLN 137 0.834 17.470 1.829 1025 HG3 GLN 137 2HG GLN 137 -0.636 18.401 2.066 1026 HE21 GLN 137 1HE2 GLN 137 0.555 15.203 1.913 1027 HE22 GLN 137 2HE2 GLN 137 -0.963 14.399 1.445 1028 H PHE 138 H PHE 138 2.458 20.022 -1.062 1029 HA PHE 138 HA PHE 138 4.857 19.148 0.339 1030 HB2 PHE 138 1HB PHE 138 3.794 21.911 -0.306 1031 HB3 PHE 138 2HB PHE 138 5.377 21.577 0.375 1032 HD1 PHE 138 2HD PHE 138 4.701 19.028 -2.146 1033 HD2 PHE 138 1HD PHE 138 5.946 23.137 -1.587 1034 HE1 PHE 138 2HE PHE 138 5.598 19.068 -4.423 1035 HE2 PHE 138 1HE PHE 138 6.889 23.132 -3.867 1036 HZ PHE 138 HZ PHE 138 6.635 21.135 -5.326 1037 H TYR 139 H TYR 139 1.735 19.892 1.385 1038 HA TYR 139 HA TYR 139 0.685 20.316 3.270 1039 HB2 TYR 139 1HB TYR 139 2.116 18.264 3.809 1040 HB3 TYR 139 2HB TYR 139 3.177 19.366 4.670 1041 HD1 TYR 139 2HD TYR 139 -0.527 18.846 4.448 1042 HD2 TYR 139 1HD TYR 139 2.959 19.175 6.967 1043 HE1 TYR 139 2HE TYR 139 -1.945 18.493 6.464 1044 HE2 TYR 139 1HE TYR 139 1.570 18.777 8.966 1045 HH TYR 139 HH TYR 139 -1.953 18.772 8.832 1046 HA PRO 140 HA PRO 140 3.155 24.258 3.598 1047 HB2 PRO 140 1HB PRO 140 1.293 26.055 2.726 1048 HB3 PRO 140 2HB PRO 140 2.391 25.158 1.635 1049 HG2 PRO 140 1HG PRO 140 -0.476 24.503 2.352 1050 HG3 PRO 140 2HG PRO 140 0.295 24.524 0.733 1051 HD2 PRO 140 1HD PRO 140 -0.040 22.208 2.152 1052 HD3 PRO 140 2HD PRO 140 1.412 22.480 1.140 1053 H GLU 141 H GLU 141 3.188 25.492 5.285 1054 HA GLU 141 HA GLU 141 1.356 25.158 7.496 1055 HB2 GLU 141 1HB GLU 141 3.053 26.761 8.571 1056 HB3 GLU 141 2HB GLU 141 3.609 25.168 8.121 1057 HG2 GLU 141 1HG GLU 141 4.041 27.425 6.150 1058 HG3 GLU 141 2HG GLU 141 5.024 27.363 7.609 Start of MODEL 4 1 H1 GLY 1 H GLY 1 18.669 12.328 -4.453 2 HA2 GLY 1 2HA GLY 1 16.169 11.595 -3.037 3 HA3 GLY 1 1HA GLY 1 17.241 12.928 -2.561 4 H MET 2 H MET 2 14.677 11.930 -4.604 5 HA MET 2 HA MET 2 14.236 14.676 -5.647 6 HB2 MET 2 1HB MET 2 14.657 12.137 -7.275 7 HB3 MET 2 2HB MET 2 13.851 13.572 -7.919 8 HG2 MET 2 1HG MET 2 15.915 14.885 -7.263 9 HG3 MET 2 2HG MET 2 16.738 13.336 -7.084 10 HE1 MET 2 3HE MET 2 17.734 12.019 -8.885 11 HE2 MET 2 1HE MET 2 16.113 11.427 -9.333 12 HE3 MET 2 2HE MET 2 17.238 12.022 -10.583 13 H SER 3 H SER 3 12.581 14.157 -3.796 14 HA SER 3 HA SER 3 10.511 13.768 -3.093 15 HB2 SER 3 1HB SER 3 10.367 15.121 -5.499 16 HB3 SER 3 2HB SER 3 9.165 13.849 -5.701 17 HG SER 3 HG SER 3 9.310 15.927 -3.788 18 H GLN 4 H GLN 4 10.086 11.973 -6.155 19 HA GLN 4 HA GLN 4 8.494 9.918 -5.292 20 HB2 GLN 4 1HB GLN 4 9.574 10.758 -7.649 21 HB3 GLN 4 2HB GLN 4 10.629 9.404 -7.390 22 HG2 GLN 4 1HG GLN 4 7.678 8.858 -7.133 23 HG3 GLN 4 2HG GLN 4 8.257 9.338 -8.718 24 HE21 GLN 4 1HE2 GLN 4 9.383 7.087 -6.081 25 HE22 GLN 4 2HE2 GLN 4 9.853 5.835 -7.204 26 H ASP 5 H ASP 5 12.056 10.051 -5.187 27 HA ASP 5 HA ASP 5 12.708 7.429 -4.484 28 HB2 ASP 5 1HB ASP 5 13.916 9.952 -3.251 29 HB3 ASP 5 2HB ASP 5 14.636 8.345 -3.237 30 H LEU 6 H LEU 6 11.788 10.129 -2.420 31 HA LEU 6 HA LEU 6 12.279 8.795 0.114 32 HB2 LEU 6 1HB LEU 6 10.843 11.422 -0.456 33 HB3 LEU 6 2HB LEU 6 11.599 10.893 1.031 34 HG LEU 6 HG LEU 6 13.527 11.081 -1.207 35 HD11 LEU 6 1HD1 LEU 6 13.492 13.504 -1.376 36 HD12 LEU 6 2HD1 LEU 6 12.174 13.608 -0.197 37 HD13 LEU 6 3HD1 LEU 6 11.862 12.890 -1.756 38 HD21 LEU 6 3HD2 LEU 6 13.388 12.272 1.596 39 HD22 LEU 6 1HD2 LEU 6 14.819 12.251 0.537 40 HD23 LEU 6 2HD2 LEU 6 14.143 10.730 1.162 41 H ILE 7 H ILE 7 9.519 10.184 -1.603 42 HA ILE 7 HA ILE 7 7.313 9.275 -0.242 43 HB ILE 7 HB ILE 7 7.871 9.397 -3.218 44 HG12 ILE 7 1HG1 ILE 7 6.294 11.303 -1.434 45 HG13 ILE 7 2HG1 ILE 7 8.014 11.493 -1.682 46 HG21 ILE 7 1HG2 ILE 7 5.929 7.932 -2.936 47 HG22 ILE 7 2HG2 ILE 7 5.152 9.117 -1.868 48 HG23 ILE 7 3HG2 ILE 7 5.427 9.485 -3.591 49 HD11 ILE 7 3HD1 ILE 7 7.365 11.473 -4.236 50 HD12 ILE 7 1HD1 ILE 7 5.782 11.982 -3.587 51 HD13 ILE 7 2HD1 ILE 7 7.274 12.920 -3.256 52 H ARG 8 H ARG 8 9.095 7.097 -2.702 53 HA ARG 8 HA ARG 8 7.510 4.835 -2.073 54 HB2 ARG 8 1HB ARG 8 10.348 5.146 -3.142 55 HB3 ARG 8 2HB ARG 8 9.690 3.588 -2.687 56 HG2 ARG 8 1HG ARG 8 7.686 4.260 -4.283 57 HG3 ARG 8 2HG ARG 8 8.906 5.324 -4.976 58 HD2 ARG 8 1HD ARG 8 10.370 3.407 -5.454 59 HD3 ARG 8 2HD ARG 8 9.266 2.333 -4.579 60 HE ARG 8 HE ARG 8 8.058 3.740 -6.844 61 HH11 ARG 8 1HH1 ARG 8 9.676 0.667 -5.871 62 HH12 ARG 8 2HH1 ARG 8 9.203 -0.112 -7.347 63 HH21 ARG 8 1HH2 ARG 8 7.176 2.522 -8.500 64 HH22 ARG 8 2HH2 ARG 8 7.716 0.929 -8.839 65 H ALA 9 H ALA 9 10.457 6.083 -0.456 66 HA ALA 9 HA ALA 9 10.977 3.827 1.116 67 HB1 ALA 9 1HB ALA 9 11.396 6.725 1.972 68 HB2 ALA 9 2HB ALA 9 12.277 5.299 2.529 69 HB3 ALA 9 3HB ALA 9 12.461 5.839 0.848 70 H ALA 10 H ALA 10 8.683 6.546 1.876 71 HA ALA 10 HA ALA 10 8.229 5.496 4.532 72 HB1 ALA 10 1HB ALA 10 6.578 7.471 2.930 73 HB2 ALA 10 2HB ALA 10 6.350 7.063 4.651 74 HB3 ALA 10 3HB ALA 10 7.863 7.807 4.145 75 H PHE 11 H PHE 11 6.877 4.577 1.429 76 HA PHE 11 HA PHE 11 4.509 3.246 2.501 77 HB2 PHE 11 1HB PHE 11 6.067 2.967 -0.103 78 HB3 PHE 11 2HB PHE 11 4.821 1.838 0.352 79 HD1 PHE 11 2HD PHE 11 5.080 5.643 0.379 80 HD2 PHE 11 1HD PHE 11 2.845 2.121 -0.772 81 HE1 PHE 11 2HE PHE 11 3.395 7.067 -0.690 82 HE2 PHE 11 1HE PHE 11 1.119 3.570 -1.777 83 HZ PHE 11 HZ PHE 11 1.397 6.042 -1.776 84 H GLU 12 H GLU 12 7.944 2.400 1.937 85 HA GLU 12 HA GLU 12 7.706 -0.354 2.573 86 HB2 GLU 12 1HB GLU 12 9.727 1.002 1.618 87 HB3 GLU 12 2HB GLU 12 10.176 1.272 3.301 88 HG2 GLU 12 1HG GLU 12 9.524 -1.457 2.188 89 HG3 GLU 12 2HG GLU 12 11.140 -0.789 1.996 90 H LYS 13 H LYS 13 8.175 2.519 4.563 91 HA LYS 13 HA LYS 13 8.525 1.178 7.055 92 HB2 LYS 13 1HB LYS 13 8.883 3.752 6.392 93 HB3 LYS 13 2HB LYS 13 7.247 3.882 7.052 94 HG2 LYS 13 1HG LYS 13 8.526 2.206 8.901 95 HG3 LYS 13 2HG LYS 13 9.847 3.262 8.373 96 HD2 LYS 13 1HD LYS 13 8.617 5.217 9.140 97 HD3 LYS 13 2HD LYS 13 7.179 4.190 9.380 98 HE2 LYS 13 1HE LYS 13 8.306 4.689 11.547 99 HE3 LYS 13 2HE LYS 13 8.249 2.960 11.175 100 HZ1 LYS 13 3HZ LYS 13 10.640 4.682 10.897 101 HZ2 LYS 13 1HZ LYS 13 10.553 3.073 10.491 102 HZ3 LYS 13 2HZ LYS 13 10.350 3.536 12.036 103 H ARG 14 H ARG 14 5.516 2.748 5.617 104 HA ARG 14 HA ARG 14 4.300 1.709 7.910 105 HB2 ARG 14 1HB ARG 14 3.453 3.735 6.607 106 HB3 ARG 14 2HB ARG 14 2.649 2.591 5.532 107 HG2 ARG 14 1HG ARG 14 1.031 3.342 7.097 108 HG3 ARG 14 2HG ARG 14 1.361 1.693 7.545 109 HD2 ARG 14 1HD ARG 14 2.693 4.084 8.894 110 HD3 ARG 14 2HD ARG 14 1.131 3.443 9.416 111 HE ARG 14 HE ARG 14 2.551 1.209 9.572 112 HH11 ARG 14 1HH1 ARG 14 3.291 4.463 10.924 113 HH12 ARG 14 2HH1 ARG 14 4.347 3.813 12.121 114 HH21 ARG 14 1HH2 ARG 14 3.762 0.446 11.403 115 HH22 ARG 14 2HH2 ARG 14 4.466 1.579 12.492 116 H LEU 15 H LEU 15 4.678 0.104 4.802 117 HA LEU 15 HA LEU 15 2.737 -1.970 5.580 118 HB2 LEU 15 1HB LEU 15 2.969 -1.299 3.236 119 HB3 LEU 15 2HB LEU 15 4.657 -1.809 3.232 120 HG LEU 15 HG LEU 15 3.996 -4.160 3.582 121 HD11 LEU 15 1HD1 LEU 15 1.592 -4.826 3.431 122 HD12 LEU 15 2HD1 LEU 15 1.119 -3.117 3.528 123 HD13 LEU 15 3HD1 LEU 15 1.923 -3.914 4.898 124 HD21 LEU 15 3HD2 LEU 15 4.171 -3.355 1.290 125 HD22 LEU 15 1HD2 LEU 15 2.520 -2.722 1.348 126 HD23 LEU 15 2HD2 LEU 15 2.801 -4.474 1.392 127 H SER 16 H SER 16 6.342 -1.861 5.155 128 HA SER 16 HA SER 16 6.685 -4.644 5.559 129 HB2 SER 16 1HB SER 16 8.149 -2.888 4.365 130 HB3 SER 16 2HB SER 16 8.769 -2.475 5.974 131 HG SER 16 HG SER 16 10.062 -3.859 4.889 132 H ASP 17 H ASP 17 7.086 -1.840 7.742 133 HA ASP 17 HA ASP 17 8.121 -3.274 9.951 134 HB2 ASP 17 1HB ASP 17 7.117 -0.585 9.451 135 HB3 ASP 17 2HB ASP 17 6.602 -1.080 11.015 136 H TRP 18 H TRP 18 4.914 -3.254 8.732 137 HA TRP 18 HA TRP 18 3.679 -4.413 11.162 138 HB2 TRP 18 1HB TRP 18 2.325 -2.815 9.989 139 HB3 TRP 18 2HB TRP 18 2.586 -3.588 8.455 140 HD1 TRP 18 HD TRP 18 0.537 -3.916 11.649 141 HE1 TRP 18 1HE TRP 18 -1.405 -5.491 11.255 142 HE3 TRP 18 3HE TRP 18 1.870 -5.627 7.018 143 HZ2 TRP 18 2HZ TRP 18 -2.230 -7.415 9.172 144 HZ3 TRP 18 3HZ TRP 18 0.466 -7.275 5.832 145 HH2 TRP 18 HH TRP 18 -1.642 -8.123 6.929 146 H ALA 19 H ALA 19 4.381 -5.280 7.724 147 HA ALA 19 HA ALA 19 3.387 -7.910 7.887 148 HB1 ALA 19 1HB ALA 19 4.009 -6.813 5.748 149 HB2 ALA 19 2HB ALA 19 5.733 -6.906 6.213 150 HB3 ALA 19 3HB ALA 19 4.812 -8.391 5.945 151 H LYS 20 H LYS 20 6.739 -6.746 8.500 152 HA LYS 20 HA LYS 20 7.785 -9.326 9.105 153 HB2 LYS 20 1HB LYS 20 9.757 -8.218 9.570 154 HB3 LYS 20 2HB LYS 20 8.993 -7.141 8.428 155 HG2 LYS 20 1HG LYS 20 8.258 -5.699 10.363 156 HG3 LYS 20 2HG LYS 20 9.104 -6.803 11.471 157 HD2 LYS 20 1HD LYS 20 11.251 -6.330 10.337 158 HD3 LYS 20 2HD LYS 20 10.403 -5.238 9.226 159 HE2 LYS 20 1HE LYS 20 11.398 -3.868 10.893 160 HE3 LYS 20 2HE LYS 20 9.663 -3.877 11.172 161 HZ1 LYS 20 3HZ LYS 20 11.644 -5.423 12.724 162 HZ2 LYS 20 1HZ LYS 20 10.011 -5.423 12.989 163 HZ3 LYS 20 2HZ LYS 20 10.850 -4.043 13.194 164 H ALA 21 H ALA 21 6.157 -6.913 11.072 165 HA ALA 21 HA ALA 21 6.927 -7.962 13.668 166 HB1 ALA 21 1HB ALA 21 5.065 -6.412 14.407 167 HB2 ALA 21 2HB ALA 21 6.305 -5.609 13.421 168 HB3 ALA 21 3HB ALA 21 4.732 -6.058 12.716 169 H ARG 22 H ARG 22 4.406 -8.635 11.315 170 HA ARG 22 HA ARG 22 2.472 -9.566 13.114 171 HB2 ARG 22 1HB ARG 22 2.606 -9.231 10.334 172 HB3 ARG 22 2HB ARG 22 2.507 -10.991 10.527 173 HG2 ARG 22 1HG ARG 22 0.544 -10.539 12.129 174 HG3 ARG 22 2HG ARG 22 0.556 -8.868 11.533 175 HD2 ARG 22 1HD ARG 22 0.095 -9.655 9.249 176 HD3 ARG 22 2HD ARG 22 0.414 -11.316 9.762 177 HE ARG 22 HE ARG 22 -1.748 -10.059 11.276 178 HH11 ARG 22 1HH1 ARG 22 -0.946 -12.172 8.535 179 HH12 ARG 22 2HH1 ARG 22 -2.512 -12.895 8.475 180 HH21 ARG 22 1HH2 ARG 22 -3.774 -10.998 11.210 181 HH22 ARG 22 2HH2 ARG 22 -4.101 -12.308 10.149 182 H THR 23 H THR 23 1.752 -11.766 13.550 183 HA THR 23 HA THR 23 3.828 -13.454 14.391 184 HB THR 23 HB THR 23 0.877 -14.084 13.990 185 HG1 THR 23 1HG THR 23 1.458 -13.648 16.503 186 HG21 THR 23 3HG2 THR 23 2.230 -16.043 14.165 187 HG22 THR 23 1HG2 THR 23 1.372 -15.820 15.705 188 HG23 THR 23 2HG2 THR 23 3.107 -15.403 15.548 189 HA PRO 24 HA PRO 24 3.116 -16.370 10.661 190 HB2 PRO 24 1HB PRO 24 1.888 -15.329 8.405 191 HB3 PRO 24 2HB PRO 24 1.124 -16.380 9.636 192 HG2 PRO 24 1HG PRO 24 1.054 -13.372 9.386 193 HG3 PRO 24 2HG PRO 24 -0.312 -14.469 9.750 194 HD2 PRO 24 1HD PRO 24 0.927 -13.102 11.712 195 HD3 PRO 24 2HD PRO 24 0.431 -14.802 11.967 196 H ALA 25 H ALA 25 3.791 -13.159 10.692 197 HA ALA 25 HA ALA 25 5.104 -11.618 9.586 198 HB1 ALA 25 1HB ALA 25 6.969 -13.984 9.631 199 HB2 ALA 25 2HB ALA 25 7.422 -12.259 9.462 200 HB3 ALA 25 3HB ALA 25 6.654 -12.844 10.966 201 H LEU 26 H LEU 26 4.436 -10.948 7.581 202 HA LEU 26 HA LEU 26 4.271 -13.048 5.499 203 HB2 LEU 26 1HB LEU 26 3.173 -10.205 5.507 204 HB3 LEU 26 2HB LEU 26 3.056 -11.301 4.148 205 HG LEU 26 HG LEU 26 1.003 -11.416 5.173 206 HD11 LEU 26 1HD1 LEU 26 2.419 -13.880 6.283 207 HD12 LEU 26 2HD1 LEU 26 1.896 -13.668 4.594 208 HD13 LEU 26 3HD1 LEU 26 0.703 -13.722 5.900 209 HD21 LEU 26 3HD2 LEU 26 1.633 -10.379 7.332 210 HD22 LEU 26 1HD2 LEU 26 2.184 -11.974 7.890 211 HD23 LEU 26 2HD2 LEU 26 0.475 -11.719 7.439 212 HA PRO 27 HA PRO 27 7.597 -11.216 3.076 213 HB2 PRO 27 1HB PRO 27 7.286 -12.572 0.735 214 HB3 PRO 27 2HB PRO 27 7.909 -13.363 2.215 215 HG2 PRO 27 1HG PRO 27 5.072 -13.375 1.147 216 HG3 PRO 27 2HG PRO 27 6.046 -14.779 1.693 217 HD2 PRO 27 1HD PRO 27 4.227 -13.499 3.326 218 HD3 PRO 27 2HD PRO 27 5.736 -14.221 3.958 219 H VAL 28 H VAL 28 7.693 -9.613 1.347 220 HA VAL 28 HA VAL 28 5.063 -8.457 0.601 221 HB VAL 28 HB VAL 28 7.483 -7.040 1.810 222 HG11 VAL 28 1HG1 VAL 28 6.131 -5.634 0.234 223 HG12 VAL 28 2HG1 VAL 28 4.710 -5.934 1.265 224 HG13 VAL 28 3HG1 VAL 28 6.112 -5.054 1.900 225 HG21 VAL 28 3HG2 VAL 28 4.803 -7.718 3.088 226 HG22 VAL 28 1HG2 VAL 28 6.412 -8.275 3.595 227 HG23 VAL 28 2HG2 VAL 28 5.996 -6.577 3.759 228 H ALA 29 H ALA 29 5.099 -8.559 -1.607 229 HA ALA 29 HA ALA 29 7.653 -8.176 -3.025 230 HB1 ALA 29 1HB ALA 29 4.840 -8.321 -4.203 231 HB2 ALA 29 2HB ALA 29 6.375 -8.465 -5.077 232 HB3 ALA 29 3HB ALA 29 5.882 -9.739 -3.956 233 H TRP 30 H TRP 30 7.839 -6.317 -4.561 234 HA TRP 30 HA TRP 30 6.246 -3.902 -3.873 235 HB2 TRP 30 1HB TRP 30 9.230 -4.383 -3.796 236 HB3 TRP 30 2HB TRP 30 8.601 -2.757 -3.939 237 HD1 TRP 30 HD TRP 30 9.549 -5.056 -1.316 238 HE1 TRP 30 1HE TRP 30 8.775 -4.111 0.966 239 HE3 TRP 30 3HE TRP 30 6.142 -1.706 -3.027 240 HZ2 TRP 30 2HZ TRP 30 6.727 -2.235 1.901 241 HZ3 TRP 30 3HZ TRP 30 4.773 -0.334 -1.451 242 HH2 TRP 30 HH TRP 30 5.051 -0.609 1.006 243 H GLN 31 H GLN 31 6.148 -5.585 -6.288 244 HA GLN 31 HA GLN 31 6.225 -5.630 -8.476 245 HB2 GLN 31 1HB GLN 31 6.854 -2.701 -8.406 246 HB3 GLN 31 2HB GLN 31 6.066 -3.615 -9.686 247 HG2 GLN 31 1HG GLN 31 4.019 -3.491 -8.654 248 HG3 GLN 31 2HG GLN 31 4.639 -3.849 -7.054 249 HE21 GLN 31 1HE2 GLN 31 5.021 -1.375 -9.414 250 HE22 GLN 31 2HE2 GLN 31 4.842 0.076 -8.421 251 H ASN 32 H ASN 32 7.735 -6.549 -9.630 252 HA ASN 32 HA ASN 32 9.525 -6.955 -10.783 253 HB2 ASN 32 1HB ASN 32 10.780 -4.308 -10.147 254 HB3 ASN 32 2HB ASN 32 11.162 -5.413 -11.459 255 HD21 ASN 32 1HD2 ASN 32 9.025 -2.958 -10.354 256 HD22 ASN 32 2HD2 ASN 32 7.895 -2.939 -11.712 257 H THR 33 H THR 33 10.106 -5.828 -7.557 258 HA THR 33 HA THR 33 12.682 -6.465 -6.982 259 HB THR 33 HB THR 33 10.198 -6.664 -5.223 260 HG1 THR 33 1HG THR 33 11.982 -4.507 -5.569 261 HG21 THR 33 3HG2 THR 33 11.926 -7.545 -3.857 262 HG22 THR 33 1HG2 THR 33 11.673 -5.859 -3.385 263 HG23 THR 33 2HG2 THR 33 13.088 -6.299 -4.376 264 H LYS 34 H LYS 34 13.772 -8.123 -5.922 265 HA LYS 34 HA LYS 34 13.363 -10.796 -6.749 266 HB2 LYS 34 1HB LYS 34 15.506 -9.535 -5.861 267 HB3 LYS 34 2HB LYS 34 14.968 -10.058 -4.277 268 HG2 LYS 34 1HG LYS 34 15.745 -11.761 -6.673 269 HG3 LYS 34 2HG LYS 34 16.647 -11.559 -5.184 270 HD2 LYS 34 1HD LYS 34 14.085 -13.119 -5.560 271 HD3 LYS 34 2HD LYS 34 15.700 -13.744 -5.270 272 HE2 LYS 34 1HE LYS 34 15.681 -12.670 -2.997 273 HE3 LYS 34 2HE LYS 34 14.000 -12.185 -3.282 274 HZ1 LYS 34 3HZ LYS 34 15.042 -14.760 -2.566 275 HZ2 LYS 34 1HZ LYS 34 13.942 -14.843 -3.795 276 HZ3 LYS 34 2HZ LYS 34 13.552 -14.166 -2.365 277 H PHE 35 H PHE 35 11.977 -12.356 -5.881 278 HA PHE 35 HA PHE 35 10.850 -11.986 -3.177 279 HB2 PHE 35 1HB PHE 35 9.589 -10.496 -4.731 280 HB3 PHE 35 2HB PHE 35 9.310 -11.855 -5.812 281 HD1 PHE 35 2HD PHE 35 8.768 -10.860 -2.207 282 HD2 PHE 35 1HD PHE 35 7.227 -12.903 -5.689 283 HE1 PHE 35 2HE PHE 35 6.591 -11.189 -1.067 284 HE2 PHE 35 1HE PHE 35 5.047 -13.213 -4.535 285 HZ PHE 35 HZ PHE 35 4.733 -12.281 -2.250 286 H THR 36 H THR 36 9.343 -13.844 -2.735 287 HA THR 36 HA THR 36 8.670 -15.933 -2.725 288 HB THR 36 HB THR 36 9.001 -15.481 -5.495 289 HG1 THR 36 1HG THR 36 7.169 -16.059 -4.366 290 HG21 THR 36 3HG2 THR 36 9.562 -17.525 -6.542 291 HG22 THR 36 1HG2 THR 36 9.848 -18.352 -5.005 292 HG23 THR 36 2HG2 THR 36 10.934 -17.059 -5.543 293 HA PRO 37 HA PRO 37 8.811 -18.628 -3.150 294 HB2 PRO 37 1HB PRO 37 8.968 -20.474 -1.134 295 HB3 PRO 37 2HB PRO 37 9.938 -20.559 -2.635 296 HG2 PRO 37 1HG PRO 37 10.769 -19.459 0.063 297 HG3 PRO 37 2HG PRO 37 11.656 -20.611 -0.993 298 HD2 PRO 37 1HD PRO 37 12.193 -17.931 -0.977 299 HD3 PRO 37 2HD PRO 37 12.287 -18.897 -2.478 300 HA PRO 38 HA PRO 38 6.026 -16.702 -0.302 301 HB2 PRO 38 1HB PRO 38 3.936 -18.461 -0.083 302 HB3 PRO 38 2HB PRO 38 4.269 -17.507 -1.566 303 HG2 PRO 38 1HG PRO 38 5.061 -20.373 -0.970 304 HG3 PRO 38 2HG PRO 38 4.298 -19.724 -2.459 305 HD2 PRO 38 1HD PRO 38 6.974 -20.133 -2.304 306 HD3 PRO 38 2HD PRO 38 6.319 -18.710 -3.155 307 H ALA 39 H ALA 39 4.531 -17.300 1.698 308 HA ALA 39 HA ALA 39 6.046 -18.841 3.678 309 HB1 ALA 39 1HB ALA 39 3.960 -16.632 4.015 310 HB2 ALA 39 2HB ALA 39 4.630 -17.614 5.333 311 HB3 ALA 39 3HB ALA 39 5.696 -16.530 4.417 312 H ALA 40 H ALA 40 5.340 -20.607 2.535 313 HA ALA 40 HA ALA 40 4.143 -22.581 2.472 314 HB1 ALA 40 1HB ALA 40 3.602 -21.870 4.901 315 HB2 ALA 40 2HB ALA 40 2.009 -21.414 4.279 316 HB3 ALA 40 3HB ALA 40 2.551 -23.087 4.128 317 H GLY 41 H GLY 41 3.482 -20.225 0.726 318 HA2 GLY 41 2HA GLY 41 2.214 -20.248 -1.277 319 HA3 GLY 41 1HA GLY 41 0.962 -21.233 -0.517 320 H VAL 42 H VAL 42 1.574 -19.139 1.812 321 HA VAL 42 HA VAL 42 -0.386 -17.099 0.939 322 HB VAL 42 HB VAL 42 1.074 -17.406 3.620 323 HG11 VAL 42 1HG1 VAL 42 -1.379 -15.780 2.906 324 HG12 VAL 42 2HG1 VAL 42 -0.680 -15.975 4.533 325 HG13 VAL 42 3HG1 VAL 42 0.235 -15.140 3.280 326 HG21 VAL 42 3HG2 VAL 42 -1.747 -18.302 2.950 327 HG22 VAL 42 1HG2 VAL 42 -0.369 -19.400 3.216 328 HG23 VAL 42 2HG2 VAL 42 -0.948 -18.392 4.537 329 H TYR 43 H TYR 43 0.286 -15.005 0.388 330 HA TYR 43 HA TYR 43 2.762 -13.899 1.318 331 HB2 TYR 43 1HB TYR 43 3.742 -13.517 -0.906 332 HB3 TYR 43 2HB TYR 43 3.743 -15.202 -0.491 333 HD1 TYR 43 1HD TYR 43 1.961 -16.764 -1.520 334 HD2 TYR 43 2HD TYR 43 2.619 -12.733 -2.923 335 HE1 TYR 43 1HE TYR 43 0.996 -17.383 -3.689 336 HE2 TYR 43 2HE TYR 43 1.636 -13.341 -5.089 337 HH TYR 43 HH TYR 43 0.431 -16.639 -5.860 338 H LEU 44 H LEU 44 2.974 -11.555 0.373 339 HA LEU 44 HA LEU 44 0.286 -10.524 -0.407 340 HB2 LEU 44 1HB LEU 44 2.546 -9.156 1.096 341 HB3 LEU 44 2HB LEU 44 1.118 -8.334 0.478 342 HG LEU 44 HG LEU 44 1.055 -10.562 2.542 343 HD11 LEU 44 1HD1 LEU 44 0.709 -7.563 2.922 344 HD12 LEU 44 2HD1 LEU 44 2.135 -8.519 3.397 345 HD13 LEU 44 3HD1 LEU 44 0.576 -8.823 4.174 346 HD21 LEU 44 3HD2 LEU 44 -1.297 -9.821 2.924 347 HD22 LEU 44 1HD2 LEU 44 -1.045 -10.507 1.326 348 HD23 LEU 44 2HD2 LEU 44 -1.167 -8.748 1.519 349 H ARG 45 H ARG 45 0.272 -8.892 -1.954 350 HA ARG 45 HA ARG 45 2.756 -8.415 -3.491 351 HB2 ARG 45 1HB ARG 45 0.402 -9.946 -4.450 352 HB3 ARG 45 2HB ARG 45 0.780 -8.569 -5.478 353 HG2 ARG 45 1HG ARG 45 3.156 -9.331 -5.620 354 HG3 ARG 45 2HG ARG 45 2.720 -10.759 -4.658 355 HD2 ARG 45 1HD ARG 45 1.025 -11.335 -6.421 356 HD3 ARG 45 2HD ARG 45 1.609 -9.982 -7.397 357 HE ARG 45 HE ARG 45 3.901 -11.123 -7.170 358 HH11 ARG 45 1HH1 ARG 45 0.878 -13.017 -7.439 359 HH12 ARG 45 2HH1 ARG 45 1.689 -14.428 -7.996 360 HH21 ARG 45 1HH2 ARG 45 4.917 -12.900 -7.773 361 HH22 ARG 45 2HH2 ARG 45 4.109 -14.446 -8.009 362 H ALA 46 H ALA 46 2.970 -6.294 -2.994 363 HA ALA 46 HA ALA 46 0.729 -4.434 -2.997 364 HB1 ALA 46 1HB ALA 46 2.723 -4.011 -1.572 365 HB2 ALA 46 2HB ALA 46 3.763 -4.024 -3.015 366 HB3 ALA 46 3HB ALA 46 2.562 -2.752 -2.815 367 H TYR 47 H TYR 47 0.244 -2.969 -4.763 368 HA TYR 47 HA TYR 47 2.221 -2.793 -6.869 369 HB2 TYR 47 1HB TYR 47 0.246 -4.395 -7.558 370 HB3 TYR 47 2HB TYR 47 -0.657 -2.901 -7.756 371 HD1 TYR 47 1HD TYR 47 0.662 -1.008 -8.969 372 HD2 TYR 47 2HD TYR 47 1.653 -5.139 -9.332 373 HE1 TYR 47 1HE TYR 47 1.977 -0.465 -11.022 374 HE2 TYR 47 2HE TYR 47 2.969 -4.658 -11.413 375 HH TYR 47 HH TYR 47 2.946 -1.624 -13.064 376 H VAL 48 H VAL 48 2.851 -0.796 -6.562 377 HA VAL 48 HA VAL 48 1.161 1.421 -5.756 378 HB VAL 48 HB VAL 48 4.064 1.035 -6.597 379 HG11 VAL 48 1HG1 VAL 48 4.683 3.200 -5.828 380 HG12 VAL 48 2HG1 VAL 48 3.481 3.379 -7.093 381 HG13 VAL 48 3HG1 VAL 48 3.022 3.612 -5.400 382 HG21 VAL 48 3HG2 VAL 48 3.437 0.018 -4.396 383 HG22 VAL 48 1HG2 VAL 48 4.588 1.329 -4.237 384 HG23 VAL 48 2HG2 VAL 48 2.896 1.615 -3.840 385 H MET 49 H MET 49 -0.186 2.320 -7.265 386 HA MET 49 HA MET 49 0.661 2.444 -10.135 387 HB2 MET 49 1HB MET 49 -2.082 2.463 -8.879 388 HB3 MET 49 2HB MET 49 -1.764 2.804 -10.580 389 HG2 MET 49 1HG MET 49 -0.934 0.590 -10.964 390 HG3 MET 49 2HG MET 49 -0.920 0.236 -9.231 391 HE1 MET 49 3HE MET 49 -2.569 -1.263 -8.187 392 HE2 MET 49 1HE MET 49 -3.086 0.364 -7.702 393 HE3 MET 49 2HE MET 49 -4.299 -0.835 -8.222 394 HA PRO 50 HA PRO 50 0.915 6.652 -8.279 395 HB2 PRO 50 1HB PRO 50 3.064 7.605 -9.633 396 HB3 PRO 50 2HB PRO 50 3.238 6.429 -8.301 397 HG2 PRO 50 1HG PRO 50 3.142 5.845 -11.286 398 HG3 PRO 50 2HG PRO 50 4.373 5.304 -10.093 399 HD2 PRO 50 1HD PRO 50 2.273 3.725 -10.765 400 HD3 PRO 50 2HD PRO 50 2.881 3.787 -9.095 401 H ALA 51 H ALA 51 0.858 8.850 -9.278 402 HA ALA 51 HA ALA 51 -0.827 9.073 -11.661 403 HB1 ALA 51 1HB ALA 51 -1.247 10.525 -9.718 404 HB2 ALA 51 2HB ALA 51 0.439 11.113 -9.761 405 HB3 ALA 51 3HB ALA 51 -0.691 11.518 -11.060 406 H ALA 52 H ALA 52 0.068 11.169 -13.008 407 HA ALA 52 HA ALA 52 1.176 11.577 -14.871 408 HB1 ALA 52 1HB ALA 52 3.664 11.150 -13.199 409 HB2 ALA 52 2HB ALA 52 3.552 12.038 -14.730 410 HB3 ALA 52 3HB ALA 52 2.719 12.660 -13.291 411 H THR 53 H THR 53 0.088 9.397 -15.357 412 HA THR 53 HA THR 53 1.873 7.189 -16.044 413 HB THR 53 HB THR 53 -0.348 6.471 -17.217 414 HG1 THR 53 1HG THR 53 -1.911 7.887 -17.114 415 HG21 THR 53 3HG2 THR 53 -1.318 5.719 -15.091 416 HG22 THR 53 1HG2 THR 53 -0.347 6.902 -14.190 417 HG23 THR 53 2HG2 THR 53 0.446 5.560 -15.037 418 H ILE 54 H ILE 54 1.472 6.510 -18.546 419 HA ILE 54 HA ILE 54 2.802 8.361 -20.196 420 HB ILE 54 HB ILE 54 0.795 6.264 -21.066 421 HG12 ILE 54 1HG1 ILE 54 3.780 5.768 -21.005 422 HG13 ILE 54 2HG1 ILE 54 2.777 5.373 -19.618 423 HG21 ILE 54 1HG2 ILE 54 2.104 6.232 -23.212 424 HG22 ILE 54 2HG2 ILE 54 1.402 7.802 -22.890 425 HG23 ILE 54 3HG2 ILE 54 3.127 7.531 -22.579 426 HD11 ILE 54 3HD1 ILE 54 2.399 4.233 -22.421 427 HD12 ILE 54 1HD1 ILE 54 3.133 3.414 -21.051 428 HD13 ILE 54 2HD1 ILE 54 1.414 3.851 -20.989 429 H SER 55 H SER 55 2.104 9.950 -21.583 430 HA SER 55 HA SER 55 -0.655 10.317 -22.307 431 HB2 SER 55 1HB SER 55 -0.444 11.607 -20.115 432 HB3 SER 55 2HB SER 55 0.776 12.623 -20.910 433 HG SER 55 HG SER 55 -1.984 12.510 -21.221 434 H ARG 56 H ARG 56 -0.590 12.447 -23.784 435 HA ARG 56 HA ARG 56 1.715 12.255 -25.633 436 HB2 ARG 56 1HB ARG 56 -0.662 12.249 -26.408 437 HB3 ARG 56 2HB ARG 56 -0.777 13.934 -25.904 438 HG2 ARG 56 1HG ARG 56 1.522 13.195 -27.672 439 HG3 ARG 56 2HG ARG 56 -0.086 12.992 -28.392 440 HD2 ARG 56 1HD ARG 56 -0.456 15.466 -27.500 441 HD3 ARG 56 2HD ARG 56 1.300 15.525 -27.559 442 HE ARG 56 HE ARG 56 -0.415 14.821 -29.862 443 HH11 ARG 56 1HH1 ARG 56 2.417 16.703 -28.617 444 HH12 ARG 56 2HH1 ARG 56 2.580 17.574 -30.108 445 HH21 ARG 56 1HH2 ARG 56 -0.098 15.979 -31.760 446 HH22 ARG 56 2HH2 ARG 56 1.216 17.059 -31.971 447 H ASP 57 H ASP 57 1.672 13.429 -22.810 448 HA ASP 57 HA ASP 57 3.388 15.672 -23.450 449 HB2 ASP 57 1HB ASP 57 1.032 16.519 -22.610 450 HB3 ASP 57 2HB ASP 57 1.590 15.960 -21.028 451 H ALA 58 H ALA 58 4.839 15.972 -21.465 452 HA ALA 58 HA ALA 58 5.128 13.599 -19.795 453 HB1 ALA 58 1HB ALA 58 7.209 14.383 -21.888 454 HB2 ALA 58 2HB ALA 58 7.404 13.134 -20.644 455 HB3 ALA 58 3HB ALA 58 6.203 12.912 -21.929 456 H ALA 59 H ALA 59 4.912 16.637 -19.749 457 HA ALA 59 HA ALA 59 7.285 17.685 -18.618 458 HB1 ALA 59 1HB ALA 59 5.447 19.097 -19.498 459 HB2 ALA 59 2HB ALA 59 4.410 18.595 -18.144 460 HB3 ALA 59 3HB ALA 59 5.868 19.562 -17.836 461 H GLY 60 H GLY 60 5.064 15.605 -17.218 462 HA2 GLY 60 2HA GLY 60 5.120 14.422 -15.200 463 HA3 GLY 60 1HA GLY 60 6.522 15.376 -14.703 464 H ASP 61 H ASP 61 5.508 17.921 -14.837 465 HA ASP 61 HA ASP 61 4.605 19.591 -13.779 466 HB2 ASP 61 1HB ASP 61 2.638 19.196 -14.867 467 HB3 ASP 61 2HB ASP 61 2.363 17.718 -13.972 468 H HIS 62 H HIS 62 5.682 20.058 -12.055 469 HA HIS 62 HA HIS 62 5.978 18.177 -9.908 470 HB2 HIS 62 1HB HIS 62 7.281 20.094 -8.822 471 HB3 HIS 62 2HB HIS 62 7.887 19.435 -10.335 472 HD1 HIS 62 1HD HIS 62 8.568 21.227 -12.035 473 HD2 HIS 62 2HD HIS 62 5.624 22.475 -9.283 474 HE1 HIS 62 1HE HIS 62 8.090 23.687 -12.551 475 H ARG 63 H ARG 63 5.595 18.753 -7.630 476 HA ARG 63 HA ARG 63 4.177 18.990 -5.943 477 HB2 ARG 63 1HB ARG 63 4.576 21.514 -6.932 478 HB3 ARG 63 2HB ARG 63 2.820 21.433 -6.970 479 HG2 ARG 63 1HG ARG 63 3.094 22.271 -4.855 480 HG3 ARG 63 2HG ARG 63 3.043 20.546 -4.497 481 HD2 ARG 63 1HD ARG 63 4.904 21.134 -3.296 482 HD3 ARG 63 2HD ARG 63 5.685 20.738 -4.844 483 HE ARG 63 HE ARG 63 4.909 23.491 -4.780 484 HH11 ARG 63 1HH1 ARG 63 7.255 21.317 -3.216 485 HH12 ARG 63 2HH1 ARG 63 8.187 22.630 -2.533 486 HH21 ARG 63 1HH2 ARG 63 6.347 25.162 -4.224 487 HH22 ARG 63 2HH2 ARG 63 7.556 24.871 -3.009 488 H GLN 64 H GLN 64 3.110 17.936 -8.555 489 HA GLN 64 HA GLN 64 0.432 17.282 -7.365 490 HB2 GLN 64 1HB GLN 64 1.012 17.728 -10.285 491 HB3 GLN 64 2HB GLN 64 -0.407 16.890 -9.674 492 HG2 GLN 64 1HG GLN 64 -0.649 19.155 -8.209 493 HG3 GLN 64 2HG GLN 64 0.177 19.820 -9.629 494 HE21 GLN 64 1HE2 GLN 64 -0.848 19.308 -11.798 495 HE22 GLN 64 2HE2 GLN 64 -2.589 19.000 -11.841 496 H TYR 65 H TYR 65 1.039 15.527 -6.493 497 HA TYR 65 HA TYR 65 1.614 13.149 -8.225 498 HB2 TYR 65 1HB TYR 65 2.267 13.643 -5.298 499 HB3 TYR 65 2HB TYR 65 2.009 12.026 -5.908 500 HD1 TYR 65 1HD TYR 65 3.894 14.793 -7.750 501 HD2 TYR 65 2HD TYR 65 4.101 11.012 -5.624 502 HE1 TYR 65 1HE TYR 65 6.204 14.555 -8.417 503 HE2 TYR 65 2HE TYR 65 6.431 10.772 -6.342 504 HH TYR 65 HH TYR 65 7.946 12.984 -8.674 505 H ARG 66 H ARG 66 0.268 11.188 -7.352 506 HA ARG 66 HA ARG 66 -1.636 11.245 -5.498 507 HB2 ARG 66 1HB ARG 66 -2.804 12.710 -7.169 508 HB3 ARG 66 2HB ARG 66 -2.741 11.423 -8.377 509 HG2 ARG 66 1HG ARG 66 -3.953 11.289 -5.654 510 HG3 ARG 66 2HG ARG 66 -4.817 12.008 -7.043 511 HD2 ARG 66 1HD ARG 66 -3.964 9.513 -7.973 512 HD3 ARG 66 2HD ARG 66 -4.566 9.202 -6.330 513 HE ARG 66 HE ARG 66 -6.654 10.169 -6.888 514 HH11 ARG 66 1HH1 ARG 66 -4.680 9.235 -9.725 515 HH12 ARG 66 2HH1 ARG 66 -6.042 8.879 -10.705 516 HH21 ARG 66 1HH2 ARG 66 -8.398 10.014 -8.301 517 HH22 ARG 66 2HH2 ARG 66 -8.195 9.452 -9.942 518 H GLY 67 H GLY 67 -2.744 8.846 -5.738 519 HA2 GLY 67 2HA GLY 67 -2.092 7.352 -8.036 520 HA3 GLY 67 1HA GLY 67 -0.989 6.867 -6.738 521 H VAL 68 H VAL 68 -2.362 4.810 -7.315 522 HA VAL 68 HA VAL 68 -4.175 4.620 -5.019 523 HB VAL 68 HB VAL 68 -5.744 4.505 -6.776 524 HG11 VAL 68 1HG1 VAL 68 -5.689 2.933 -8.628 525 HG12 VAL 68 2HG1 VAL 68 -4.285 4.010 -8.721 526 HG13 VAL 68 3HG1 VAL 68 -4.110 2.336 -8.125 527 HG21 VAL 68 3HG2 VAL 68 -5.130 1.640 -5.924 528 HG22 VAL 68 1HG2 VAL 68 -6.065 2.831 -4.994 529 HG23 VAL 68 2HG2 VAL 68 -6.672 2.248 -6.542 530 H PHE 69 H PHE 69 -3.588 3.036 -3.684 531 HA PHE 69 HA PHE 69 -1.205 1.387 -4.405 532 HB2 PHE 69 1HB PHE 69 -1.017 2.734 -2.308 533 HB3 PHE 69 2HB PHE 69 -2.497 1.982 -1.723 534 HD1 PHE 69 1HD PHE 69 0.956 1.137 -2.882 535 HD2 PHE 69 2HD PHE 69 -2.428 -0.021 -0.469 536 HE1 PHE 69 1HE PHE 69 2.273 -0.740 -1.927 537 HE2 PHE 69 2HE PHE 69 -1.137 -1.929 0.431 538 HZ PHE 69 HZ PHE 69 1.189 -2.315 -0.325 539 H GLN 70 H GLN 70 -1.502 -0.832 -4.359 540 HA GLN 70 HA GLN 70 -4.206 -1.940 -3.762 541 HB2 GLN 70 1HB GLN 70 -4.007 -1.706 -6.099 542 HB3 GLN 70 2HB GLN 70 -2.378 -2.406 -6.157 543 HG2 GLN 70 1HG GLN 70 -3.163 -4.564 -5.878 544 HG3 GLN 70 2HG GLN 70 -4.584 -4.073 -4.945 545 HE21 GLN 70 1HE2 GLN 70 -6.509 -3.965 -5.948 546 HE22 GLN 70 2HE2 GLN 70 -6.694 -3.572 -7.631 547 H VAL 71 H VAL 71 -4.072 -3.856 -2.554 548 HA VAL 71 HA VAL 71 -1.647 -5.386 -2.803 549 HB VAL 71 HB VAL 71 -1.148 -4.156 -0.805 550 HG11 VAL 71 1HG1 VAL 71 -2.463 -4.284 1.259 551 HG12 VAL 71 2HG1 VAL 71 -3.381 -3.520 -0.033 552 HG13 VAL 71 3HG1 VAL 71 -3.724 -5.197 0.401 553 HG21 VAL 71 3HG2 VAL 71 -0.409 -6.516 -0.894 554 HG22 VAL 71 1HG2 VAL 71 -0.637 -5.921 0.750 555 HG23 VAL 71 2HG2 VAL 71 -1.848 -6.988 0.035 556 H ASN 72 H ASN 72 -2.059 -7.645 -2.163 557 HA ASN 72 HA ASN 72 -4.892 -8.513 -2.242 558 HB2 ASN 72 1HB ASN 72 -2.493 -9.392 -3.908 559 HB3 ASN 72 2HB ASN 72 -3.685 -10.570 -3.483 560 HD21 ASN 72 1HD2 ASN 72 -6.128 -8.621 -3.874 561 HD22 ASN 72 2HD2 ASN 72 -6.107 -8.492 -5.632 562 H VAL 73 H VAL 73 -5.254 -10.053 -0.732 563 HA VAL 73 HA VAL 73 -2.981 -11.430 0.562 564 HB VAL 73 HB VAL 73 -4.041 -10.060 2.157 565 HG11 VAL 73 1HG1 VAL 73 -6.725 -11.344 1.616 566 HG12 VAL 73 2HG1 VAL 73 -6.353 -10.119 2.838 567 HG13 VAL 73 3HG1 VAL 73 -6.263 -9.687 1.137 568 HG21 VAL 73 3HG2 VAL 73 -4.847 -12.974 2.511 569 HG22 VAL 73 1HG2 VAL 73 -3.391 -12.137 3.100 570 HG23 VAL 73 2HG2 VAL 73 -4.966 -11.767 3.784 571 H VAL 74 H VAL 74 -2.827 -12.750 -1.215 572 HA VAL 74 HA VAL 74 -4.895 -14.697 -1.945 573 HB VAL 74 HB VAL 74 -3.254 -13.947 -3.564 574 HG11 VAL 74 1HG1 VAL 74 -0.874 -14.426 -3.438 575 HG12 VAL 74 2HG1 VAL 74 -1.354 -13.287 -2.184 576 HG13 VAL 74 3HG1 VAL 74 -1.041 -15.001 -1.771 577 HG21 VAL 74 3HG2 VAL 74 -2.329 -16.079 -4.346 578 HG22 VAL 74 1HG2 VAL 74 -2.678 -16.820 -2.774 579 HG23 VAL 74 2HG2 VAL 74 -4.006 -16.217 -3.816 580 H MET 75 H MET 75 -5.170 -16.763 -0.863 581 HA MET 75 HA MET 75 -3.075 -17.784 0.798 582 HB2 MET 75 1HB MET 75 -4.646 -17.813 2.923 583 HB3 MET 75 2HB MET 75 -3.500 -16.547 2.609 584 HG2 MET 75 1HG MET 75 -5.227 -15.395 3.399 585 HG3 MET 75 2HG MET 75 -5.374 -15.143 1.672 586 HE1 MET 75 3HE MET 75 -7.274 -16.223 0.210 587 HE2 MET 75 1HE MET 75 -8.889 -15.956 0.905 588 HE3 MET 75 2HE MET 75 -7.641 -14.678 0.957 589 HA PRO 76 HA PRO 76 -5.161 -21.137 -0.830 590 HB2 PRO 76 1HB PRO 76 -4.720 -23.262 0.888 591 HB3 PRO 76 2HB PRO 76 -3.495 -22.539 -0.186 592 HG2 PRO 76 1HG PRO 76 -3.956 -21.962 2.742 593 HG3 PRO 76 2HG PRO 76 -2.409 -22.270 1.904 594 HD2 PRO 76 1HD PRO 76 -3.257 -19.761 2.461 595 HD3 PRO 76 2HD PRO 76 -2.401 -20.099 0.917 596 H ILE 77 H ILE 77 -7.111 -22.362 -0.871 597 HA ILE 77 HA ILE 77 -9.150 -21.404 1.025 598 HB ILE 77 HB ILE 77 -9.411 -23.025 -1.509 599 HG12 ILE 77 1HG1 ILE 77 -10.058 -20.118 -0.834 600 HG13 ILE 77 2HG1 ILE 77 -8.576 -20.572 -1.625 601 HG21 ILE 77 1HG2 ILE 77 -11.484 -21.707 0.336 602 HG22 ILE 77 2HG2 ILE 77 -11.835 -22.321 -1.305 603 HG23 ILE 77 3HG2 ILE 77 -11.378 -23.430 -0.041 604 HD11 ILE 77 3HD1 ILE 77 -9.953 -21.568 -3.499 605 HD12 ILE 77 1HD1 ILE 77 -11.371 -20.779 -2.762 606 HD13 ILE 77 2HD1 ILE 77 -10.007 -19.808 -3.319 607 H GLY 78 H GLY 78 -7.502 -22.725 2.567 608 HA2 GLY 78 2HA GLY 78 -8.607 -25.481 3.001 609 HA3 GLY 78 1HA GLY 78 -6.881 -25.225 2.739 610 H ASP 79 H ASP 79 -5.644 -24.250 4.370 611 HA ASP 79 HA ASP 79 -6.523 -25.027 6.971 612 HB2 ASP 79 1HB ASP 79 -3.951 -23.881 5.824 613 HB3 ASP 79 2HB ASP 79 -4.138 -24.346 7.517 614 H GLY 80 H GLY 80 -8.266 -23.231 6.765 615 HA2 GLY 80 2HA GLY 80 -9.027 -21.511 8.221 616 HA3 GLY 80 1HA GLY 80 -7.392 -20.874 8.345 617 H SER 81 H SER 81 -9.644 -21.571 5.541 618 HA SER 81 HA SER 81 -8.481 -19.640 3.925 619 HB2 SER 81 1HB SER 81 -10.305 -20.000 2.428 620 HB3 SER 81 2HB SER 81 -9.896 -21.550 3.184 621 HG SER 81 HG SER 81 -11.774 -21.466 4.353 622 H ARG 82 H ARG 82 -10.452 -18.838 6.610 623 HA ARG 82 HA ARG 82 -11.670 -16.491 5.301 624 HB2 ARG 82 1HB ARG 82 -12.018 -17.484 8.129 625 HB3 ARG 82 2HB ARG 82 -12.754 -16.065 7.399 626 HG2 ARG 82 1HG ARG 82 -14.425 -17.630 7.275 627 HG3 ARG 82 2HG ARG 82 -13.781 -17.487 5.640 628 HD2 ARG 82 1HD ARG 82 -12.587 -19.625 5.887 629 HD3 ARG 82 2HD ARG 82 -13.118 -19.718 7.576 630 HE ARG 82 HE ARG 82 -14.709 -20.067 5.098 631 HH11 ARG 82 1HH1 ARG 82 -14.664 -20.331 8.671 632 HH12 ARG 82 2HH1 ARG 82 -16.288 -20.915 8.750 633 HH21 ARG 82 1HH2 ARG 82 -16.719 -20.958 5.224 634 HH22 ARG 82 2HH2 ARG 82 -17.507 -21.328 6.733 635 H SER 83 H SER 83 -8.656 -17.101 6.097 636 HA SER 83 HA SER 83 -7.749 -15.241 7.904 637 HB2 SER 83 1HB SER 83 -6.605 -17.163 6.366 638 HB3 SER 83 2HB SER 83 -6.079 -15.745 5.458 639 HG SER 83 HG SER 83 -5.617 -16.529 8.117 640 H ALA 84 H ALA 84 -8.636 -14.604 4.503 641 HA ALA 84 HA ALA 84 -7.291 -12.193 4.067 642 HB1 ALA 84 1HB ALA 84 -8.464 -13.170 2.243 643 HB2 ALA 84 2HB ALA 84 -10.014 -13.189 3.129 644 HB3 ALA 84 3HB ALA 84 -9.329 -11.657 2.567 645 H GLU 85 H GLU 85 -10.290 -12.738 5.941 646 HA GLU 85 HA GLU 85 -11.009 -9.957 6.193 647 HB2 GLU 85 1HB GLU 85 -11.626 -12.414 7.888 648 HB3 GLU 85 2HB GLU 85 -12.406 -10.842 8.056 649 HG2 GLU 85 1HG GLU 85 -13.035 -11.035 5.596 650 HG3 GLU 85 2HG GLU 85 -12.556 -12.738 5.692 651 H GLN 86 H GLN 86 -9.320 -12.316 8.360 652 HA GLN 86 HA GLN 86 -8.707 -10.684 10.470 653 HB2 GLN 86 1HB GLN 86 -8.211 -13.273 9.568 654 HB3 GLN 86 2HB GLN 86 -6.600 -12.603 9.512 655 HG2 GLN 86 1HG GLN 86 -8.138 -12.048 12.034 656 HG3 GLN 86 2HG GLN 86 -7.870 -13.736 11.630 657 HE21 GLN 86 1HE2 GLN 86 -5.648 -14.538 11.637 658 HE22 GLN 86 2HE2 GLN 86 -4.303 -13.569 12.230 659 H VAL 87 H VAL 87 -6.811 -11.176 7.458 660 HA VAL 87 HA VAL 87 -4.775 -9.253 8.079 661 HB VAL 87 HB VAL 87 -5.814 -10.528 5.515 662 HG11 VAL 87 1HG1 VAL 87 -3.670 -9.705 4.427 663 HG12 VAL 87 2HG1 VAL 87 -4.909 -8.484 4.690 664 HG13 VAL 87 3HG1 VAL 87 -3.517 -8.561 5.789 665 HG21 VAL 87 3HG2 VAL 87 -3.657 -11.772 5.684 666 HG22 VAL 87 1HG2 VAL 87 -3.271 -10.856 7.159 667 HG23 VAL 87 2HG2 VAL 87 -4.654 -11.967 7.124 668 H ALA 88 H ALA 88 -7.824 -8.860 6.208 669 HA ALA 88 HA ALA 88 -7.300 -6.170 5.542 670 HB1 ALA 88 1HB ALA 88 -9.957 -7.588 6.020 671 HB2 ALA 88 2HB ALA 88 -9.712 -6.075 5.135 672 HB3 ALA 88 3HB ALA 88 -9.043 -7.579 4.492 673 H ALA 89 H ALA 89 -8.569 -7.644 8.483 674 HA ALA 89 HA ALA 89 -9.562 -5.191 9.672 675 HB1 ALA 89 1HB ALA 89 -9.795 -6.604 11.713 676 HB2 ALA 89 2HB ALA 89 -10.527 -7.366 10.290 677 HB3 ALA 89 3HB ALA 89 -8.948 -7.923 10.895 678 H GLU 90 H GLU 90 -6.724 -7.292 10.196 679 HA GLU 90 HA GLU 90 -5.386 -5.810 12.154 680 HB2 GLU 90 1HB GLU 90 -4.437 -7.596 9.873 681 HB3 GLU 90 2HB GLU 90 -3.320 -6.895 11.034 682 HG2 GLU 90 1HG GLU 90 -5.497 -8.163 12.492 683 HG3 GLU 90 2HG GLU 90 -4.855 -9.269 11.279 684 H LEU 91 H LEU 91 -5.410 -5.420 8.649 685 HA LEU 91 HA LEU 91 -3.348 -3.371 8.596 686 HB2 LEU 91 1HB LEU 91 -5.296 -4.524 6.588 687 HB3 LEU 91 2HB LEU 91 -4.346 -3.094 6.200 688 HG LEU 91 HG LEU 91 -3.003 -5.591 7.257 689 HD11 LEU 91 1HD1 LEU 91 -3.594 -4.962 4.354 690 HD12 LEU 91 2HD1 LEU 91 -4.313 -6.271 5.332 691 HD13 LEU 91 3HD1 LEU 91 -2.571 -6.301 4.975 692 HD21 LEU 91 3HD2 LEU 91 -1.055 -4.655 5.981 693 HD22 LEU 91 1HD2 LEU 91 -1.618 -3.555 7.238 694 HD23 LEU 91 2HD2 LEU 91 -2.046 -3.254 5.539 695 H ASP 92 H ASP 92 -6.981 -3.392 8.552 696 HA ASP 92 HA ASP 92 -7.223 -0.608 7.972 697 HB2 ASP 92 1HB ASP 92 -9.089 -2.165 7.740 698 HB3 ASP 92 2HB ASP 92 -9.080 -2.470 9.483 699 H ALA 93 H ALA 93 -6.708 -2.344 11.040 700 HA ALA 93 HA ALA 93 -6.982 -0.065 12.758 701 HB1 ALA 93 1HB ALA 93 -5.623 -1.383 14.334 702 HB2 ALA 93 2HB ALA 93 -6.879 -2.390 13.591 703 HB3 ALA 93 3HB ALA 93 -5.188 -2.522 13.042 704 H LEU 94 H LEU 94 -4.373 -1.132 10.605 705 HA LEU 94 HA LEU 94 -2.415 0.714 11.741 706 HB2 LEU 94 1HB LEU 94 -1.858 -1.571 10.727 707 HB3 LEU 94 2HB LEU 94 -2.259 -0.890 9.156 708 HG LEU 94 HG LEU 94 -0.453 0.907 9.590 709 HD11 LEU 94 1HD1 LEU 94 -0.306 0.601 12.050 710 HD12 LEU 94 2HD1 LEU 94 1.245 0.321 11.263 711 HD13 LEU 94 3HD1 LEU 94 0.266 -1.069 11.785 712 HD21 LEU 94 3HD2 LEU 94 0.129 -0.740 8.039 713 HD22 LEU 94 1HD2 LEU 94 0.160 -2.031 9.258 714 HD23 LEU 94 2HD2 LEU 94 1.430 -0.790 9.217 715 H PHE 95 H PHE 95 -4.706 0.653 9.053 716 HA PHE 95 HA PHE 95 -3.564 3.161 7.952 717 HB2 PHE 95 1HB PHE 95 -4.999 0.862 6.639 718 HB3 PHE 95 2HB PHE 95 -4.846 2.432 5.884 719 HD1 PHE 95 1HD PHE 95 -2.892 -0.552 7.002 720 HD2 PHE 95 2HD PHE 95 -2.763 3.254 4.982 721 HE1 PHE 95 1HE PHE 95 -0.729 -1.167 5.986 722 HE2 PHE 95 2HE PHE 95 -0.536 2.663 4.047 723 HZ PHE 95 HZ PHE 95 0.475 0.452 4.533 724 HA PRO 96 HA PRO 96 -7.647 4.836 9.275 725 HB2 PRO 96 1HB PRO 96 -6.698 7.197 10.243 726 HB3 PRO 96 2HB PRO 96 -6.671 5.700 11.227 727 HG2 PRO 96 1HG PRO 96 -4.416 6.840 9.524 728 HG3 PRO 96 2HG PRO 96 -4.359 6.409 11.259 729 HD2 PRO 96 1HD PRO 96 -3.555 4.674 9.366 730 HD3 PRO 96 2HD PRO 96 -4.465 4.088 10.785 731 H VAL 97 H VAL 97 -8.294 7.189 8.487 732 HA VAL 97 HA VAL 97 -7.642 7.339 5.637 733 HB VAL 97 HB VAL 97 -9.941 7.303 6.809 734 HG11 VAL 97 1HG1 VAL 97 -9.396 10.280 7.255 735 HG12 VAL 97 2HG1 VAL 97 -10.886 9.371 7.570 736 HG13 VAL 97 3HG1 VAL 97 -9.433 9.065 8.542 737 HG21 VAL 97 3HG2 VAL 97 -9.693 9.670 4.940 738 HG22 VAL 97 1HG2 VAL 97 -9.500 7.996 4.434 739 HG23 VAL 97 2HG2 VAL 97 -11.038 8.516 5.143 740 H ASN 98 H ASN 98 -6.100 8.748 8.119 741 HA ASN 98 HA ASN 98 -5.537 11.233 6.539 742 HB2 ASN 98 1HB ASN 98 -4.876 10.564 9.439 743 HB3 ASN 98 2HB ASN 98 -4.446 12.066 8.621 744 HD21 ASN 98 1HD2 ASN 98 -6.388 13.365 7.712 745 HD22 ASN 98 2HD2 ASN 98 -7.848 13.337 8.663 746 H LEU 99 H LEU 99 -4.003 8.601 8.187 747 HA LEU 99 HA LEU 99 -1.894 7.807 8.311 748 HB2 LEU 99 1HB LEU 99 -3.155 7.111 6.105 749 HB3 LEU 99 2HB LEU 99 -1.851 7.971 5.326 750 HG LEU 99 HG LEU 99 -1.058 5.781 5.348 751 HD11 LEU 99 1HD1 LEU 99 0.859 5.628 6.698 752 HD12 LEU 99 2HD1 LEU 99 0.224 6.807 7.868 753 HD13 LEU 99 3HD1 LEU 99 0.610 7.306 6.203 754 HD21 LEU 99 3HD2 LEU 99 -1.246 4.203 7.182 755 HD22 LEU 99 1HD2 LEU 99 -2.834 4.939 6.919 756 HD23 LEU 99 2HD2 LEU 99 -1.819 5.469 8.282 757 H VAL 100 H VAL 100 -1.287 9.940 9.229 758 HA VAL 100 HA VAL 100 0.274 11.791 7.668 759 HB VAL 100 HB VAL 100 -0.772 12.657 9.549 760 HG11 VAL 100 1HG1 VAL 100 -1.295 10.696 10.906 761 HG12 VAL 100 2HG1 VAL 100 0.403 10.493 11.346 762 HG13 VAL 100 3HG1 VAL 100 -0.494 11.920 11.888 763 HG21 VAL 100 3HG2 VAL 100 2.018 12.307 10.678 764 HG22 VAL 100 1HG2 VAL 100 1.699 13.221 9.205 765 HG23 VAL 100 2HG2 VAL 100 0.946 13.720 10.734 766 H MET 101 H MET 101 1.771 10.394 6.444 767 HA MET 101 HA MET 101 3.831 9.031 7.997 768 HB2 MET 101 1HB MET 101 4.121 10.024 5.146 769 HB3 MET 101 2HB MET 101 5.004 8.725 5.958 770 HG2 MET 101 1HG MET 101 2.636 7.607 6.224 771 HG3 MET 101 2HG MET 101 2.171 8.787 4.984 772 HE1 MET 101 3HE MET 101 1.565 7.812 3.143 773 HE2 MET 101 1HE MET 101 2.081 6.237 2.445 774 HE3 MET 101 2HE MET 101 1.312 6.317 4.060 775 H GLN 102 H GLN 102 6.204 9.724 7.584 776 HA GLN 102 HA GLN 102 6.644 12.546 7.059 777 HB2 GLN 102 1HB GLN 102 8.720 12.231 8.562 778 HB3 GLN 102 2HB GLN 102 7.163 12.580 9.327 779 HG2 GLN 102 1HG GLN 102 6.874 10.323 10.051 780 HG3 GLN 102 2HG GLN 102 8.252 9.763 9.113 781 HE21 GLN 102 1HE2 GLN 102 9.889 12.283 10.167 782 HE22 GLN 102 2HE2 GLN 102 10.448 11.527 11.629 783 H SER 103 H SER 103 7.796 12.569 5.166 784 HA SER 103 HA SER 103 9.407 10.180 4.439 785 HB2 SER 103 1HB SER 103 8.163 10.919 2.040 786 HB3 SER 103 2HB SER 103 7.902 9.521 2.990 787 HG SER 103 HG SER 103 6.528 11.994 3.061 788 H GLY 104 H GLY 104 10.388 12.691 5.435 789 HA2 GLY 104 2HA GLY 104 12.169 13.986 5.022 790 HA3 GLY 104 1HA GLY 104 12.459 13.047 3.561 791 H GLY 105 H GLY 105 11.085 13.575 1.734 792 HA2 GLY 105 2HA GLY 105 11.259 16.126 0.598 793 HA3 GLY 105 1HA GLY 105 10.189 14.763 0.105 794 H LEU 106 H LEU 106 8.331 14.439 1.823 795 HA LEU 106 HA LEU 106 7.049 16.739 2.917 796 HB2 LEU 106 1HB LEU 106 5.034 16.167 1.189 797 HB3 LEU 106 2HB LEU 106 6.101 17.534 1.053 798 HG LEU 106 HG LEU 106 7.402 16.485 -0.686 799 HD11 LEU 106 1HD1 LEU 106 6.605 14.337 -1.738 800 HD12 LEU 106 2HD1 LEU 106 5.718 13.989 -0.239 801 HD13 LEU 106 3HD1 LEU 106 7.502 14.118 -0.253 802 HD21 LEU 106 3HD2 LEU 106 5.341 17.687 -1.251 803 HD22 LEU 106 1HD2 LEU 106 4.407 16.199 -1.111 804 HD23 LEU 106 2HD2 LEU 106 5.621 16.361 -2.385 805 H ALA 107 H ALA 107 4.799 16.025 3.620 806 HA ALA 107 HA ALA 107 4.848 13.206 4.547 807 HB1 ALA 107 1HB ALA 107 4.545 14.906 6.262 808 HB2 ALA 107 2HB ALA 107 3.190 15.633 5.374 809 HB3 ALA 107 3HB ALA 107 3.036 13.993 6.047 810 H VAL 108 H VAL 108 3.900 11.862 3.010 811 HA VAL 108 HA VAL 108 1.754 12.723 1.318 812 HB VAL 108 HB VAL 108 3.187 11.070 0.464 813 HG11 VAL 108 1HG1 VAL 108 4.374 10.209 2.274 814 HG12 VAL 108 2HG1 VAL 108 2.905 9.596 3.044 815 HG13 VAL 108 3HG1 VAL 108 3.570 8.818 1.583 816 HG21 VAL 108 3HG2 VAL 108 0.836 10.458 -0.091 817 HG22 VAL 108 1HG2 VAL 108 1.935 9.097 -0.047 818 HG23 VAL 108 2HG2 VAL 108 0.823 9.385 1.319 819 H ARG 109 H ARG 109 -0.502 11.801 1.381 820 HA ARG 109 HA ARG 109 -1.414 10.903 4.011 821 HB2 ARG 109 1HB ARG 109 -3.538 12.027 3.708 822 HB3 ARG 109 2HB ARG 109 -2.228 13.200 4.040 823 HG2 ARG 109 1HG ARG 109 -2.439 13.558 1.475 824 HG3 ARG 109 2HG ARG 109 -3.918 12.607 1.571 825 HD2 ARG 109 1HD ARG 109 -4.598 14.116 3.545 826 HD3 ARG 109 2HD ARG 109 -3.366 15.244 3.008 827 HE ARG 109 HE ARG 109 -4.646 15.206 0.758 828 HH11 ARG 109 1HH1 ARG 109 -6.136 15.089 3.987 829 HH12 ARG 109 2HH1 ARG 109 -7.692 15.549 3.441 830 HH21 ARG 109 1HH2 ARG 109 -6.783 15.787 0.030 831 HH22 ARG 109 2HH2 ARG 109 -8.049 16.109 1.162 832 H VAL 110 H VAL 110 -3.406 9.700 3.851 833 HA VAL 110 HA VAL 110 -3.220 7.991 1.494 834 HB VAL 110 HB VAL 110 -3.254 7.270 3.851 835 HG11 VAL 110 1HG1 VAL 110 -6.216 7.906 3.767 836 HG12 VAL 110 2HG1 VAL 110 -5.290 7.181 5.082 837 HG13 VAL 110 3HG1 VAL 110 -4.989 8.854 4.642 838 HG21 VAL 110 3HG2 VAL 110 -4.587 5.326 3.638 839 HG22 VAL 110 1HG2 VAL 110 -5.432 5.997 2.218 840 HG23 VAL 110 2HG2 VAL 110 -3.678 5.671 2.166 841 H ARG 111 H ARG 111 -5.373 10.499 2.541 842 HA ARG 111 HA ARG 111 -7.069 11.559 1.593 843 HB2 ARG 111 1HB ARG 111 -5.605 11.016 -0.516 844 HB3 ARG 111 2HB ARG 111 -6.934 9.941 -0.922 845 HG2 ARG 111 1HG ARG 111 -8.006 12.535 -0.097 846 HG3 ARG 111 2HG ARG 111 -6.672 12.788 -1.205 847 HD2 ARG 111 1HD ARG 111 -8.105 10.799 -2.512 848 HD3 ARG 111 2HD ARG 111 -9.386 11.692 -1.690 849 HE ARG 111 HE ARG 111 -7.388 12.637 -3.676 850 HH11 ARG 111 1HH1 ARG 111 -10.308 13.525 -1.808 851 HH12 ARG 111 2HH1 ARG 111 -10.302 15.157 -2.404 852 HH21 ARG 111 1HH2 ARG 111 -7.358 14.792 -4.261 853 HH22 ARG 111 2HH2 ARG 111 -8.650 15.884 -3.827 854 H THR 112 H THR 112 -7.428 8.027 0.828 855 HA THR 112 HA THR 112 -10.297 8.318 1.547 856 HB THR 112 HB THR 112 -10.731 6.514 -0.011 857 HG1 THR 112 1HG THR 112 -9.259 5.297 -0.615 858 HG21 THR 112 3HG2 THR 112 -10.726 8.836 -0.879 859 HG22 THR 112 1HG2 THR 112 -10.292 7.621 -2.101 860 HG23 THR 112 2HG2 THR 112 -9.032 8.631 -1.394 861 HA PRO 113 HA PRO 113 -9.448 5.274 4.664 862 HB2 PRO 113 1HB PRO 113 -11.815 4.009 5.012 863 HB3 PRO 113 2HB PRO 113 -11.604 5.733 5.433 864 HG2 PRO 113 1HG PRO 113 -12.764 4.581 2.874 865 HG3 PRO 113 2HG PRO 113 -13.459 5.863 3.924 866 HD2 PRO 113 1HD PRO 113 -12.006 6.428 1.685 867 HD3 PRO 113 2HD PRO 113 -11.923 7.461 3.138 868 H ILE 114 H ILE 114 -9.527 2.854 4.956 869 HA ILE 114 HA ILE 114 -8.564 1.366 2.727 870 HB ILE 114 HB ILE 114 -9.767 0.675 5.399 871 HG12 ILE 114 1HG1 ILE 114 -7.418 1.665 5.114 872 HG13 ILE 114 2HG1 ILE 114 -7.555 0.207 6.074 873 HG21 ILE 114 1HG2 ILE 114 -10.458 -1.246 4.153 874 HG22 ILE 114 2HG2 ILE 114 -8.860 -1.423 3.403 875 HG23 ILE 114 3HG2 ILE 114 -9.084 -1.684 5.153 876 HD11 ILE 114 3HD1 ILE 114 -5.604 0.289 4.427 877 HD12 ILE 114 1HD1 ILE 114 -6.618 -1.160 4.379 878 HD13 ILE 114 2HD1 ILE 114 -6.799 0.079 3.131 879 H SER 115 H SER 115 -9.601 0.723 0.902 880 HA SER 115 HA SER 115 -12.506 0.190 0.913 881 HB2 SER 115 1HB SER 115 -10.427 1.028 -1.054 882 HB3 SER 115 2HB SER 115 -11.238 -0.478 -1.465 883 HG SER 115 HG SER 115 -13.279 0.744 -1.170 884 H ASN 116 H ASN 116 -13.070 -2.028 0.646 885 HA ASN 116 HA ASN 116 -11.115 -4.152 0.607 886 HB2 ASN 116 1HB ASN 116 -12.254 -2.975 2.999 887 HB3 ASN 116 2HB ASN 116 -13.078 -4.522 2.724 888 HD21 ASN 116 1HD2 ASN 116 -11.639 -6.349 2.041 889 HD22 ASN 116 2HD2 ASN 116 -9.964 -6.271 2.573 890 H GLY 117 H GLY 117 -12.017 -5.279 -1.097 891 HA2 GLY 117 2HA GLY 117 -14.957 -5.029 -1.587 892 HA3 GLY 117 1HA GLY 117 -13.726 -5.329 -2.812 893 H GLN 118 H GLN 118 -15.853 -6.931 -2.757 894 HA GLN 118 HA GLN 118 -15.291 -9.501 -1.530 895 HB2 GLN 118 1HB GLN 118 -17.230 -8.295 -3.494 896 HB3 GLN 118 2HB GLN 118 -16.808 -9.963 -3.760 897 HG2 GLN 118 1HG GLN 118 -17.449 -10.520 -1.410 898 HG3 GLN 118 2HG GLN 118 -17.863 -8.825 -1.138 899 HE21 GLN 118 1HE2 GLN 118 -18.602 -11.242 -3.800 900 HE22 GLN 118 2HE2 GLN 118 -20.305 -10.918 -3.783 901 HA PRO 119 HA PRO 119 -12.030 -10.520 -4.154 902 HB2 PRO 119 1HB PRO 119 -12.118 -13.265 -4.391 903 HB3 PRO 119 2HB PRO 119 -11.829 -12.447 -2.836 904 HG2 PRO 119 1HG PRO 119 -14.461 -13.456 -3.938 905 HG3 PRO 119 2HG PRO 119 -13.742 -13.794 -2.330 906 HD2 PRO 119 1HD PRO 119 -15.592 -11.832 -2.678 907 HD3 PRO 119 2HD PRO 119 -14.203 -11.590 -1.573 908 H THR 120 H THR 120 -11.227 -11.539 -6.152 909 HA THR 120 HA THR 120 -13.319 -11.896 -8.236 910 HB THR 120 HB THR 120 -11.797 -9.902 -8.358 911 HG1 THR 120 1HG THR 120 -12.823 -10.549 -10.169 912 HG21 THR 120 3HG2 THR 120 -9.712 -11.996 -9.092 913 HG22 THR 120 1HG2 THR 120 -9.702 -10.995 -7.622 914 HG23 THR 120 2HG2 THR 120 -9.523 -10.234 -9.211 915 H THR 121 H THR 121 -11.675 -13.589 -6.248 916 HA THR 121 HA THR 121 -11.011 -15.694 -5.944 917 HB THR 121 HB THR 121 -12.554 -16.269 -8.497 918 HG1 THR 121 1HG THR 121 -14.242 -16.452 -7.084 919 HG21 THR 121 3HG2 THR 121 -11.357 -18.294 -7.793 920 HG22 THR 121 1HG2 THR 121 -13.027 -18.454 -7.312 921 HG23 THR 121 2HG2 THR 121 -11.815 -18.010 -6.092 922 H GLY 122 H GLY 122 -9.713 -17.611 -6.769 923 HA2 GLY 122 2HA GLY 122 -7.358 -16.610 -8.270 924 HA3 GLY 122 1HA GLY 122 -7.217 -17.351 -6.669 925 H ASP 123 H ASP 123 -5.897 -18.910 -7.721 926 HA ASP 123 HA ASP 123 -7.093 -20.870 -9.474 927 HB2 ASP 123 1HB ASP 123 -4.538 -20.196 -8.845 928 HB3 ASP 123 2HB ASP 123 -4.731 -21.586 -7.792 929 H ALA 124 H ALA 124 -6.065 -20.990 -6.013 930 HA ALA 124 HA ALA 124 -8.580 -22.219 -5.134 931 HB1 ALA 124 1HB ALA 124 -5.917 -23.653 -4.771 932 HB2 ALA 124 2HB ALA 124 -7.513 -24.187 -4.205 933 HB3 ALA 124 3HB ALA 124 -7.132 -24.148 -5.941 934 H ASP 125 H ASP 125 -7.460 -19.733 -4.832 935 HA ASP 125 HA ASP 125 -6.303 -19.644 -2.061 936 HB2 ASP 125 1HB ASP 125 -5.257 -18.303 -4.562 937 HB3 ASP 125 2HB ASP 125 -4.666 -18.112 -2.925 938 H HIS 126 H HIS 126 -8.136 -18.318 -4.241 939 HA HIS 126 HA HIS 126 -9.547 -16.603 -4.733 940 HB2 HIS 126 1HB HIS 126 -9.524 -16.383 -1.740 941 HB3 HIS 126 2HB HIS 126 -10.175 -15.080 -2.683 942 HD1 HIS 126 1HD HIS 126 -12.402 -15.703 -4.355 943 HD2 HIS 126 2HD HIS 126 -11.157 -18.427 -1.347 944 HE1 HIS 126 1HE HIS 126 -14.311 -17.246 -3.982 945 H THR 127 H THR 127 -9.636 -13.975 -4.412 946 HA THR 127 HA THR 127 -7.291 -12.885 -3.339 947 HB THR 127 HB THR 127 -7.479 -11.410 -5.805 948 HG1 THR 127 1HG THR 127 -7.199 -12.748 -7.344 949 HG21 THR 127 3HG2 THR 127 -5.076 -11.853 -5.902 950 HG22 THR 127 1HG2 THR 127 -5.243 -13.173 -4.722 951 HG23 THR 127 2HG2 THR 127 -5.589 -11.517 -4.236 952 H VAL 128 H VAL 128 -8.429 -11.782 -1.924 953 HA VAL 128 HA VAL 128 -10.678 -10.070 -2.734 954 HB VAL 128 HB VAL 128 -10.110 -9.118 -0.350 955 HG11 VAL 128 1HG1 VAL 128 -11.208 -11.918 -0.706 956 HG12 VAL 128 2HG1 VAL 128 -11.481 -10.829 0.666 957 HG13 VAL 128 3HG1 VAL 128 -12.121 -10.409 -0.914 958 HG21 VAL 128 3HG2 VAL 128 -8.919 -10.260 1.112 959 HG22 VAL 128 1HG2 VAL 128 -8.882 -11.777 0.160 960 HG23 VAL 128 2HG2 VAL 128 -7.891 -10.370 -0.317 961 HA PRO 129 HA PRO 129 -7.831 -6.663 -3.693 962 HB2 PRO 129 1HB PRO 129 -9.673 -4.818 -4.424 963 HB3 PRO 129 2HB PRO 129 -9.342 -6.275 -5.408 964 HG2 PRO 129 1HG PRO 129 -11.603 -5.824 -3.438 965 HG3 PRO 129 2HG PRO 129 -11.693 -6.507 -5.097 966 HD2 PRO 129 1HD PRO 129 -11.566 -8.027 -2.800 967 HD3 PRO 129 2HD PRO 129 -10.958 -8.560 -4.396 968 H ILE 130 H ILE 130 -6.927 -5.193 -2.306 969 HA ILE 130 HA ILE 130 -8.679 -3.641 -0.520 970 HB ILE 130 HB ILE 130 -5.971 -4.727 0.352 971 HG12 ILE 130 1HG1 ILE 130 -8.781 -5.622 1.084 972 HG13 ILE 130 2HG1 ILE 130 -7.539 -6.574 0.300 973 HG21 ILE 130 1HG2 ILE 130 -6.487 -3.744 2.510 974 HG22 ILE 130 2HG2 ILE 130 -6.680 -2.483 1.298 975 HG23 ILE 130 3HG2 ILE 130 -8.115 -3.286 1.979 976 HD11 ILE 130 3HD1 ILE 130 -7.622 -7.356 2.528 977 HD12 ILE 130 1HD1 ILE 130 -6.158 -6.351 2.454 978 HD13 ILE 130 2HD1 ILE 130 -7.638 -5.718 3.198 979 H SER 131 H SER 131 -8.185 -1.475 -0.744 980 HA SER 131 HA SER 131 -5.683 -0.558 -1.834 981 HB2 SER 131 1HB SER 131 -6.814 0.480 -3.931 982 HB3 SER 131 2HB SER 131 -6.333 -1.200 -3.968 983 HG SER 131 HG SER 131 -8.816 -0.058 -4.068 984 H LEU 132 H LEU 132 -5.877 1.847 -2.475 985 HA LEU 132 HA LEU 132 -7.890 3.478 -1.309 986 HB2 LEU 132 1HB LEU 132 -6.324 4.483 0.469 987 HB3 LEU 132 2HB LEU 132 -7.143 2.978 0.809 988 HG LEU 132 HG LEU 132 -4.950 1.758 0.120 989 HD11 LEU 132 1HD1 LEU 132 -2.894 3.133 0.539 990 HD12 LEU 132 2HD1 LEU 132 -3.912 4.595 0.402 991 HD13 LEU 132 3HD1 LEU 132 -3.741 3.525 -0.956 992 HD21 LEU 132 3HD2 LEU 132 -5.816 1.908 2.391 993 HD22 LEU 132 1HD2 LEU 132 -4.954 3.408 2.647 994 HD23 LEU 132 2HD2 LEU 132 -4.051 1.906 2.327 995 H GLY 133 H GLY 133 -7.400 5.770 -1.731 996 HA2 GLY 133 2HA GLY 133 -5.733 5.949 -4.204 997 HA3 GLY 133 1HA GLY 133 -7.318 6.647 -3.964 998 H TYR 134 H TYR 134 -4.220 6.650 -2.597 999 HA TYR 134 HA TYR 134 -4.290 9.027 -1.013 1000 HB2 TYR 134 1HB TYR 134 -1.920 8.668 -0.708 1001 HB3 TYR 134 2HB TYR 134 -2.727 7.123 -0.645 1002 HD1 TYR 134 2HD TYR 134 -2.639 5.637 -2.816 1003 HD2 TYR 134 1HD TYR 134 -0.174 9.137 -2.215 1004 HE1 TYR 134 2HE TYR 134 -1.066 4.829 -4.511 1005 HE2 TYR 134 1HE TYR 134 1.412 8.323 -3.928 1006 HH TYR 134 HH TYR 134 1.573 6.768 -5.746 1007 H ASP 135 H ASP 135 -3.279 11.087 -1.186 1008 HA ASP 135 HA ASP 135 -2.877 11.805 -4.108 1009 HB2 ASP 135 1HB ASP 135 -3.982 13.366 -1.918 1010 HB3 ASP 135 2HB ASP 135 -3.264 14.188 -3.265 1011 H VAL 136 H VAL 136 -1.209 11.541 -1.179 1012 HA VAL 136 HA VAL 136 0.655 12.499 -0.319 1013 HB VAL 136 HB VAL 136 1.280 13.832 -2.952 1014 HG11 VAL 136 1HG1 VAL 136 2.996 13.276 -0.502 1015 HG12 VAL 136 2HG1 VAL 136 3.663 13.700 -2.091 1016 HG13 VAL 136 3HG1 VAL 136 2.624 14.836 -1.264 1017 HG21 VAL 136 3HG2 VAL 136 2.871 11.960 -3.383 1018 HG22 VAL 136 1HG2 VAL 136 2.259 11.110 -1.956 1019 HG23 VAL 136 2HG2 VAL 136 1.206 11.394 -3.363 1020 H GLN 137 H GLN 137 1.478 14.943 0.182 1021 HA GLN 137 HA GLN 137 -0.576 16.895 0.245 1022 HB2 GLN 137 1HB GLN 137 -1.529 15.699 1.895 1023 HB3 GLN 137 2HB GLN 137 -0.088 14.794 2.340 1024 HG2 GLN 137 1HG GLN 137 0.774 16.877 3.394 1025 HG3 GLN 137 2HG GLN 137 -0.811 17.642 3.109 1026 HE21 GLN 137 1HE2 GLN 137 0.858 14.863 4.601 1027 HE22 GLN 137 2HE2 GLN 137 -0.196 14.743 6.009 1028 H PHE 138 H PHE 138 0.334 18.738 1.484 1029 HA PHE 138 HA PHE 138 3.203 19.045 1.565 1030 HB2 PHE 138 1HB PHE 138 2.732 20.898 -0.335 1031 HB3 PHE 138 2HB PHE 138 3.364 19.297 -0.625 1032 HD1 PHE 138 2HD PHE 138 -0.242 20.400 -0.039 1033 HD2 PHE 138 1HD PHE 138 2.632 18.509 -2.619 1034 HE1 PHE 138 2HE PHE 138 -2.062 19.816 -1.621 1035 HE2 PHE 138 1HE PHE 138 0.812 17.913 -4.196 1036 HZ PHE 138 HZ PHE 138 -1.533 18.548 -3.704 1037 H TYR 139 H TYR 139 3.036 19.914 3.525 1038 HA TYR 139 HA TYR 139 1.173 22.057 4.254 1039 HB2 TYR 139 1HB TYR 139 3.706 20.940 5.530 1040 HB3 TYR 139 2HB TYR 139 2.793 22.263 6.226 1041 HD1 TYR 139 2HD TYR 139 0.373 21.919 6.920 1042 HD2 TYR 139 1HD TYR 139 2.955 18.643 5.817 1043 HE1 TYR 139 2HE TYR 139 -1.185 20.330 8.004 1044 HE2 TYR 139 1HE TYR 139 1.404 17.055 6.864 1045 HH TYR 139 HH TYR 139 -1.394 18.168 8.790 1046 HA PRO 140 HA PRO 140 3.626 25.276 2.440 1047 HB2 PRO 140 1HB PRO 140 3.385 27.404 4.157 1048 HB3 PRO 140 2HB PRO 140 2.046 26.810 3.131 1049 HG2 PRO 140 1HG PRO 140 2.584 26.163 6.046 1050 HG3 PRO 140 2HG PRO 140 1.037 26.674 5.296 1051 HD2 PRO 140 1HD PRO 140 1.610 24.057 5.776 1052 HD3 PRO 140 2HD PRO 140 0.715 24.549 4.313 1053 H GLU 141 H GLU 141 5.639 26.297 2.577 1054 HA GLU 141 HA GLU 141 7.398 25.689 4.884 1055 HB2 GLU 141 1HB GLU 141 8.102 25.410 1.928 1056 HB3 GLU 141 2HB GLU 141 9.209 25.212 3.296 1057 HG2 GLU 141 1HG GLU 141 7.774 23.321 4.134 1058 HG3 GLU 141 2HG GLU 141 6.798 23.454 2.668 Start of MODEL 5 1 H1 GLY 1 H GLY 1 18.371 12.727 -3.412 2 HA2 GLY 1 2HA GLY 1 15.777 11.912 -2.245 3 HA3 GLY 1 1HA GLY 1 16.827 13.185 -1.588 4 H MET 2 H MET 2 14.584 12.350 -4.250 5 HA MET 2 HA MET 2 13.975 15.206 -4.304 6 HB2 MET 2 1HB MET 2 13.916 15.556 -6.596 7 HB3 MET 2 2HB MET 2 15.509 14.958 -6.190 8 HG2 MET 2 1HG MET 2 13.303 13.503 -7.644 9 HG3 MET 2 2HG MET 2 14.821 14.052 -8.292 10 HE1 MET 2 3HE MET 2 14.236 11.555 -9.274 11 HE2 MET 2 1HE MET 2 14.750 10.072 -8.431 12 HE3 MET 2 2HE MET 2 13.211 10.842 -8.010 13 H SER 3 H SER 3 12.380 14.639 -2.948 14 HA SER 3 HA SER 3 10.365 14.165 -2.255 15 HB2 SER 3 1HB SER 3 9.713 15.234 -4.993 16 HB3 SER 3 2HB SER 3 8.675 15.289 -3.546 17 HG SER 3 HG SER 3 9.995 16.769 -2.624 18 H GLN 4 H GLN 4 9.591 12.967 -5.597 19 HA GLN 4 HA GLN 4 7.887 10.922 -4.689 20 HB2 GLN 4 1HB GLN 4 8.322 11.929 -7.055 21 HB3 GLN 4 2HB GLN 4 9.542 10.668 -7.208 22 HG2 GLN 4 1HG GLN 4 6.635 10.106 -6.506 23 HG3 GLN 4 2HG GLN 4 7.218 10.214 -8.160 24 HE21 GLN 4 1HE2 GLN 4 6.504 7.953 -5.786 25 HE22 GLN 4 2HE2 GLN 4 7.510 6.671 -6.382 26 H ASP 5 H ASP 5 11.321 10.900 -5.337 27 HA ASP 5 HA ASP 5 12.217 8.321 -4.978 28 HB2 ASP 5 1HB ASP 5 13.462 10.275 -5.664 29 HB3 ASP 5 2HB ASP 5 13.267 11.026 -4.085 30 H LEU 6 H LEU 6 11.384 10.676 -2.306 31 HA LEU 6 HA LEU 6 12.033 8.737 -0.240 32 HB2 LEU 6 1HB LEU 6 10.615 11.428 -0.073 33 HB3 LEU 6 2HB LEU 6 11.342 10.519 1.232 34 HG LEU 6 HG LEU 6 12.857 12.092 0.920 35 HD11 LEU 6 1HD1 LEU 6 14.062 10.201 -1.095 36 HD12 LEU 6 2HD1 LEU 6 14.089 9.988 0.667 37 HD13 LEU 6 3HD1 LEU 6 14.905 11.374 -0.069 38 HD21 LEU 6 3HD2 LEU 6 11.638 13.131 -0.934 39 HD22 LEU 6 1HD2 LEU 6 12.616 12.173 -2.056 40 HD23 LEU 6 2HD2 LEU 6 13.406 13.352 -0.960 41 H ILE 7 H ILE 7 9.145 10.082 -1.866 42 HA ILE 7 HA ILE 7 7.183 9.163 -0.029 43 HB ILE 7 HB ILE 7 7.038 9.647 -3.035 44 HG12 ILE 7 1HG1 ILE 7 5.588 11.360 -1.065 45 HG13 ILE 7 2HG1 ILE 7 7.345 11.538 -1.035 46 HG21 ILE 7 1HG2 ILE 7 4.553 9.758 -2.691 47 HG22 ILE 7 2HG2 ILE 7 5.216 8.133 -2.474 48 HG23 ILE 7 3HG2 ILE 7 4.777 9.104 -1.058 49 HD11 ILE 7 3HD1 ILE 7 5.721 13.004 -2.589 50 HD12 ILE 7 1HD1 ILE 7 7.381 12.629 -3.006 51 HD13 ILE 7 2HD1 ILE 7 6.034 11.692 -3.728 52 H ARG 8 H ARG 8 8.693 7.550 -2.832 53 HA ARG 8 HA ARG 8 7.380 5.090 -2.712 54 HB2 ARG 8 1HB ARG 8 8.874 4.455 -4.310 55 HB3 ARG 8 2HB ARG 8 9.213 6.171 -4.312 56 HG2 ARG 8 1HG ARG 8 11.351 5.469 -4.188 57 HG3 ARG 8 2HG ARG 8 10.999 5.509 -2.476 58 HD2 ARG 8 1HD ARG 8 10.146 2.962 -3.160 59 HD3 ARG 8 2HD ARG 8 11.448 3.200 -4.315 60 HE ARG 8 HE ARG 8 11.902 2.120 -2.037 61 HH11 ARG 8 1HH1 ARG 8 13.032 5.448 -2.865 62 HH12 ARG 8 2HH1 ARG 8 14.600 5.111 -2.253 63 HH21 ARG 8 1HH2 ARG 8 13.826 1.895 -0.961 64 HH22 ARG 8 2HH2 ARG 8 14.972 3.182 -0.957 65 H ALA 9 H ALA 9 9.808 6.334 -0.548 66 HA ALA 9 HA ALA 9 10.589 3.701 0.487 67 HB1 ALA 9 1HB ALA 9 12.416 4.919 1.455 68 HB2 ALA 9 2HB ALA 9 12.183 5.591 -0.170 69 HB3 ALA 9 3HB ALA 9 11.596 6.483 1.250 70 H ALA 10 H ALA 10 8.851 6.655 1.466 71 HA ALA 10 HA ALA 10 8.445 6.186 4.210 72 HB1 ALA 10 1HB ALA 10 7.748 8.194 2.754 73 HB2 ALA 10 2HB ALA 10 6.336 7.263 2.283 74 HB3 ALA 10 3HB ALA 10 6.573 7.676 3.987 75 H PHE 11 H PHE 11 6.610 5.071 1.395 76 HA PHE 11 HA PHE 11 4.570 3.676 2.679 77 HB2 PHE 11 1HB PHE 11 5.821 3.618 -0.052 78 HB3 PHE 11 2HB PHE 11 4.857 2.214 0.404 79 HD1 PHE 11 1HD PHE 11 4.589 6.013 0.641 80 HD2 PHE 11 2HD PHE 11 2.610 2.241 -0.152 81 HE1 PHE 11 1HE PHE 11 2.458 7.195 0.309 82 HE2 PHE 11 2HE PHE 11 0.447 3.450 -0.364 83 HZ PHE 11 HZ PHE 11 0.369 5.924 -0.101 84 H GLU 12 H GLU 12 7.819 2.452 1.729 85 HA GLU 12 HA GLU 12 7.268 -0.194 2.683 86 HB2 GLU 12 1HB GLU 12 8.903 0.279 0.882 87 HB3 GLU 12 2HB GLU 12 9.877 1.240 2.021 88 HG2 GLU 12 1HG GLU 12 10.257 -0.756 3.399 89 HG3 GLU 12 2HG GLU 12 9.215 -1.723 2.362 90 H LYS 13 H LYS 13 8.601 2.763 4.174 91 HA LYS 13 HA LYS 13 9.845 1.338 6.317 92 HB2 LYS 13 1HB LYS 13 10.317 3.745 5.579 93 HB3 LYS 13 2HB LYS 13 8.871 4.234 6.476 94 HG2 LYS 13 1HG LYS 13 9.818 3.502 8.556 95 HG3 LYS 13 2HG LYS 13 10.992 2.474 7.755 96 HD2 LYS 13 1HD LYS 13 12.035 4.655 6.815 97 HD3 LYS 13 2HD LYS 13 11.068 5.477 8.050 98 HE2 LYS 13 1HE LYS 13 13.141 5.061 9.142 99 HE3 LYS 13 2HE LYS 13 12.078 3.762 9.714 100 HZ1 LYS 13 3HZ LYS 13 14.304 3.609 7.809 101 HZ2 LYS 13 1HZ LYS 13 13.106 2.520 7.680 102 HZ3 LYS 13 2HZ LYS 13 13.945 2.625 9.097 103 H ARG 14 H ARG 14 6.605 2.670 5.730 104 HA ARG 14 HA ARG 14 5.670 1.988 8.368 105 HB2 ARG 14 1HB ARG 14 4.506 3.591 6.631 106 HB3 ARG 14 2HB ARG 14 3.916 2.111 5.883 107 HG2 ARG 14 1HG ARG 14 2.143 2.654 7.289 108 HG3 ARG 14 2HG ARG 14 3.032 1.519 8.305 109 HD2 ARG 14 1HD ARG 14 4.128 3.414 9.446 110 HD3 ARG 14 2HD ARG 14 3.265 4.572 8.400 111 HE ARG 14 HE ARG 14 1.310 2.979 9.636 112 HH11 ARG 14 1HH1 ARG 14 3.684 5.519 10.567 113 HH12 ARG 14 2HH1 ARG 14 2.885 5.825 12.069 114 HH21 ARG 14 1HH2 ARG 14 0.275 3.506 11.677 115 HH22 ARG 14 2HH2 ARG 14 1.008 4.671 12.706 116 H LEU 15 H LEU 15 5.420 0.353 5.175 117 HA LEU 15 HA LEU 15 3.724 -1.616 6.215 118 HB2 LEU 15 1HB LEU 15 3.741 -0.921 3.871 119 HB3 LEU 15 2HB LEU 15 5.353 -1.617 3.654 120 HG LEU 15 HG LEU 15 4.477 -3.885 4.036 121 HD11 LEU 15 1HD1 LEU 15 2.567 -3.293 5.593 122 HD12 LEU 15 2HD1 LEU 15 2.130 -4.376 4.302 123 HD13 LEU 15 3HD1 LEU 15 1.686 -2.639 4.206 124 HD21 LEU 15 3HD2 LEU 15 2.912 -2.231 1.999 125 HD22 LEU 15 1HD2 LEU 15 3.055 -4.007 1.980 126 HD23 LEU 15 2HD2 LEU 15 4.473 -3.015 1.757 127 H SER 16 H SER 16 7.322 -1.942 5.491 128 HA SER 16 HA SER 16 7.276 -4.721 6.123 129 HB2 SER 16 1HB SER 16 9.401 -2.586 5.785 130 HB3 SER 16 2HB SER 16 9.806 -4.178 6.433 131 HG SER 16 HG SER 16 8.907 -5.152 4.677 132 H ASP 17 H ASP 17 7.839 -1.820 8.148 133 HA ASP 17 HA ASP 17 8.594 -3.336 10.479 134 HB2 ASP 17 1HB ASP 17 8.026 -0.508 9.841 135 HB3 ASP 17 2HB ASP 17 7.537 -0.951 11.458 136 H TRP 18 H TRP 18 5.569 -3.081 8.954 137 HA TRP 18 HA TRP 18 4.060 -3.912 11.396 138 HB2 TRP 18 1HB TRP 18 2.760 -2.498 10.033 139 HB3 TRP 18 2HB TRP 18 3.262 -3.257 8.545 140 HD1 TRP 18 HD TRP 18 0.806 -3.723 11.420 141 HE1 TRP 18 1HE TRP 18 -0.942 -5.456 10.827 142 HE3 TRP 18 3HE TRP 18 2.671 -5.218 6.894 143 HZ2 TRP 18 2HZ TRP 18 -1.478 -7.298 8.643 144 HZ3 TRP 18 3HZ TRP 18 1.456 -6.900 5.534 145 HH2 TRP 18 HH TRP 18 -0.664 -7.941 6.439 146 H ALA 19 H ALA 19 4.973 -5.089 8.115 147 HA ALA 19 HA ALA 19 3.733 -7.577 8.426 148 HB1 ALA 19 1HB ALA 19 4.789 -8.164 6.357 149 HB2 ALA 19 2HB ALA 19 4.477 -6.432 6.260 150 HB3 ALA 19 3HB ALA 19 6.122 -7.005 6.617 151 H LYS 20 H LYS 20 7.211 -6.786 8.924 152 HA LYS 20 HA LYS 20 7.828 -9.514 9.724 153 HB2 LYS 20 1HB LYS 20 9.976 -8.666 10.384 154 HB3 LYS 20 2HB LYS 20 9.529 -8.045 8.801 155 HG2 LYS 20 1HG LYS 20 10.087 -6.013 9.506 156 HG3 LYS 20 2HG LYS 20 8.670 -6.017 10.569 157 HD2 LYS 20 1HD LYS 20 9.949 -6.772 12.443 158 HD3 LYS 20 2HD LYS 20 11.344 -7.156 11.429 159 HE2 LYS 20 1HE LYS 20 11.630 -4.783 10.829 160 HE3 LYS 20 2HE LYS 20 10.188 -4.359 11.790 161 HZ1 LYS 20 3HZ LYS 20 11.329 -5.164 13.738 162 HZ2 LYS 20 1HZ LYS 20 12.147 -3.939 13.031 163 HZ3 LYS 20 2HZ LYS 20 12.706 -5.473 12.870 164 H ALA 21 H ALA 21 6.362 -6.841 11.385 165 HA ALA 21 HA ALA 21 7.188 -7.763 14.053 166 HB1 ALA 21 1HB ALA 21 7.072 -5.374 13.566 167 HB2 ALA 21 2HB ALA 21 5.330 -5.503 13.187 168 HB3 ALA 21 3HB ALA 21 5.914 -5.824 14.831 169 H ARG 22 H ARG 22 4.514 -8.414 11.870 170 HA ARG 22 HA ARG 22 2.490 -8.879 13.771 171 HB2 ARG 22 1HB ARG 22 2.710 -9.093 11.043 172 HB3 ARG 22 2HB ARG 22 2.793 -10.802 11.489 173 HG2 ARG 22 1HG ARG 22 0.644 -10.305 12.896 174 HG3 ARG 22 2HG ARG 22 0.550 -8.840 11.908 175 HD2 ARG 22 1HD ARG 22 -0.293 -9.999 10.174 176 HD3 ARG 22 2HD ARG 22 1.048 -11.086 10.141 177 HE ARG 22 HE ARG 22 -0.401 -12.090 12.224 178 HH11 ARG 22 1HH1 ARG 22 -2.022 -10.742 9.512 179 HH12 ARG 22 2HH1 ARG 22 -3.030 -12.132 9.232 180 HH21 ARG 22 1HH2 ARG 22 -2.010 -13.734 12.105 181 HH22 ARG 22 2HH2 ARG 22 -3.105 -13.689 10.771 182 H THR 23 H THR 23 1.733 -11.070 14.509 183 HA THR 23 HA THR 23 3.746 -12.427 15.894 184 HB THR 23 HB THR 23 0.914 -13.330 15.287 185 HG1 THR 23 1HG THR 23 2.029 -11.642 17.260 186 HG21 THR 23 3HG2 THR 23 2.874 -14.129 17.456 187 HG22 THR 23 1HG2 THR 23 2.405 -15.104 16.047 188 HG23 THR 23 2HG2 THR 23 1.183 -14.696 17.269 189 HA PRO 24 HA PRO 24 3.927 -16.061 12.797 190 HB2 PRO 24 1HB PRO 24 2.546 -15.875 10.409 191 HB3 PRO 24 2HB PRO 24 1.921 -16.731 11.846 192 HG2 PRO 24 1HG PRO 24 1.346 -13.925 10.863 193 HG3 PRO 24 2HG PRO 24 0.182 -15.137 11.495 194 HD2 PRO 24 1HD PRO 24 1.100 -13.121 13.045 195 HD3 PRO 24 2HD PRO 24 0.853 -14.772 13.713 196 H ALA 25 H ALA 25 3.888 -12.902 12.133 197 HA ALA 25 HA ALA 25 4.646 -11.309 10.625 198 HB1 ALA 25 1HB ALA 25 6.777 -11.608 9.512 199 HB2 ALA 25 2HB ALA 25 6.861 -12.171 11.191 200 HB3 ALA 25 3HB ALA 25 6.756 -13.344 9.856 201 H LEU 26 H LEU 26 4.784 -10.763 8.224 202 HA LEU 26 HA LEU 26 3.880 -12.876 6.371 203 HB2 LEU 26 1HB LEU 26 2.703 -10.120 6.819 204 HB3 LEU 26 2HB LEU 26 2.534 -10.903 5.261 205 HG LEU 26 HG LEU 26 1.543 -12.139 7.871 206 HD11 LEU 26 1HD1 LEU 26 0.422 -10.077 7.391 207 HD12 LEU 26 2HD1 LEU 26 -0.679 -11.418 7.104 208 HD13 LEU 26 3HD1 LEU 26 0.095 -10.548 5.721 209 HD21 LEU 26 3HD2 LEU 26 1.094 -12.877 4.941 210 HD22 LEU 26 1HD2 LEU 26 0.231 -13.598 6.324 211 HD23 LEU 26 2HD2 LEU 26 1.962 -13.841 6.142 212 HA PRO 27 HA PRO 27 6.946 -10.860 3.820 213 HB2 PRO 27 1HB PRO 27 6.474 -11.869 1.363 214 HB3 PRO 27 2HB PRO 27 6.920 -12.934 2.731 215 HG2 PRO 27 1HG PRO 27 4.140 -12.310 1.684 216 HG3 PRO 27 2HG PRO 27 4.861 -13.927 2.002 217 HD2 PRO 27 1HD PRO 27 3.262 -12.612 3.789 218 HD3 PRO 27 2HD PRO 27 4.602 -13.672 4.325 219 H VAL 28 H VAL 28 7.244 -9.445 1.764 220 HA VAL 28 HA VAL 28 4.944 -7.708 1.261 221 HB VAL 28 HB VAL 28 7.654 -6.701 2.255 222 HG11 VAL 28 1HG1 VAL 28 6.502 -4.490 2.221 223 HG12 VAL 28 2HG1 VAL 28 6.598 -5.198 0.612 224 HG13 VAL 28 3HG1 VAL 28 5.071 -5.285 1.502 225 HG21 VAL 28 3HG2 VAL 28 6.383 -7.576 4.163 226 HG22 VAL 28 1HG2 VAL 28 6.396 -5.815 4.202 227 HG23 VAL 28 2HG2 VAL 28 4.942 -6.667 3.659 228 H ALA 29 H ALA 29 4.883 -7.386 -0.903 229 HA ALA 29 HA ALA 29 7.360 -7.696 -2.488 230 HB1 ALA 29 1HB ALA 29 4.653 -8.908 -3.191 231 HB2 ALA 29 2HB ALA 29 6.043 -8.781 -4.288 232 HB3 ALA 29 3HB ALA 29 6.146 -9.789 -2.832 233 H TRP 30 H TRP 30 7.621 -5.557 -2.988 234 HA TRP 30 HA TRP 30 5.499 -3.807 -3.884 235 HB2 TRP 30 1HB TRP 30 8.511 -3.541 -4.290 236 HB3 TRP 30 2HB TRP 30 7.315 -2.265 -4.386 237 HD1 TRP 30 HD TRP 30 9.460 -4.129 -1.868 238 HE1 TRP 30 1HE TRP 30 8.908 -3.423 0.496 239 HE3 TRP 30 3HE TRP 30 5.470 -1.218 -2.939 240 HZ2 TRP 30 2HZ TRP 30 6.758 -1.948 1.804 241 HZ3 TRP 30 3HZ TRP 30 4.196 -0.037 -1.113 242 HH2 TRP 30 HH TRP 30 4.803 -0.452 1.253 243 H GLN 31 H GLN 31 5.955 -2.721 -6.093 244 HA GLN 31 HA GLN 31 4.658 -4.192 -7.873 245 HB2 GLN 31 1HB GLN 31 6.582 -1.905 -8.321 246 HB3 GLN 31 2HB GLN 31 5.630 -2.605 -9.649 247 HG2 GLN 31 1HG GLN 31 3.595 -2.172 -8.088 248 HG3 GLN 31 2HG GLN 31 4.675 -1.073 -7.219 249 HE21 GLN 31 1HE2 GLN 31 2.313 -1.086 -9.557 250 HE22 GLN 31 2HE2 GLN 31 2.890 0.222 -10.543 251 H ASN 32 H ASN 32 8.250 -3.735 -8.446 252 HA ASN 32 HA ASN 32 8.211 -6.436 -9.703 253 HB2 ASN 32 1HB ASN 32 9.632 -4.043 -10.801 254 HB3 ASN 32 2HB ASN 32 9.909 -5.706 -11.303 255 HD21 ASN 32 1HD2 ASN 32 8.121 -3.033 -11.912 256 HD22 ASN 32 2HD2 ASN 32 6.809 -3.703 -12.884 257 H THR 33 H THR 33 8.774 -5.902 -6.934 258 HA THR 33 HA THR 33 11.659 -5.497 -6.703 259 HB THR 33 HB THR 33 9.898 -4.704 -5.082 260 HG1 THR 33 1HG THR 33 11.503 -5.190 -3.340 261 HG21 THR 33 3HG2 THR 33 10.214 -7.482 -3.862 262 HG22 THR 33 1HG2 THR 33 8.741 -6.878 -4.645 263 HG23 THR 33 2HG2 THR 33 9.366 -6.108 -3.166 264 H LYS 34 H LYS 34 12.596 -7.169 -4.878 265 HA LYS 34 HA LYS 34 12.987 -9.660 -6.441 266 HB2 LYS 34 1HB LYS 34 14.411 -8.466 -4.017 267 HB3 LYS 34 2HB LYS 34 14.792 -9.997 -4.779 268 HG2 LYS 34 1HG LYS 34 16.389 -8.397 -5.484 269 HG3 LYS 34 2HG LYS 34 15.419 -8.842 -6.875 270 HD2 LYS 34 1HD LYS 34 14.564 -6.390 -5.339 271 HD3 LYS 34 2HD LYS 34 16.089 -6.268 -6.179 272 HE2 LYS 34 1HE LYS 34 13.615 -7.284 -7.625 273 HE3 LYS 34 2HE LYS 34 13.952 -5.550 -7.453 274 HZ1 LYS 34 3HZ LYS 34 15.975 -5.818 -8.596 275 HZ2 LYS 34 1HZ LYS 34 14.829 -6.549 -9.535 276 HZ3 LYS 34 2HZ LYS 34 15.884 -7.437 -8.632 277 H PHE 35 H PHE 35 10.660 -10.056 -5.825 278 HA PHE 35 HA PHE 35 10.260 -11.047 -3.052 279 HB2 PHE 35 1HB PHE 35 7.947 -11.181 -3.516 280 HB3 PHE 35 2HB PHE 35 8.512 -9.609 -4.052 281 HD1 PHE 35 2HD PHE 35 7.284 -12.940 -5.127 282 HD2 PHE 35 1HD PHE 35 8.387 -8.978 -6.431 283 HE1 PHE 35 2HE PHE 35 6.492 -13.474 -7.401 284 HE2 PHE 35 1HE PHE 35 7.509 -9.483 -8.683 285 HZ PHE 35 HZ PHE 35 6.622 -11.767 -9.202 286 H THR 36 H THR 36 9.106 -13.104 -2.865 287 HA THR 36 HA THR 36 8.617 -15.155 -3.162 288 HB THR 36 HB THR 36 8.773 -14.498 -5.801 289 HG1 THR 36 1HG THR 36 7.239 -15.703 -4.600 290 HG21 THR 36 3HG2 THR 36 11.011 -15.518 -6.066 291 HG22 THR 36 1HG2 THR 36 9.758 -16.300 -7.032 292 HG23 THR 36 2HG2 THR 36 10.330 -17.081 -5.541 293 HA PRO 37 HA PRO 37 8.951 -17.813 -3.147 294 HB2 PRO 37 1HB PRO 37 9.050 -19.104 -0.705 295 HB3 PRO 37 2HB PRO 37 10.104 -19.496 -2.087 296 HG2 PRO 37 1HG PRO 37 10.736 -17.677 0.249 297 HG3 PRO 37 2HG PRO 37 11.713 -19.044 -0.386 298 HD2 PRO 37 1HD PRO 37 12.248 -16.508 -1.141 299 HD3 PRO 37 2HD PRO 37 12.286 -17.826 -2.349 300 HA PRO 38 HA PRO 38 5.830 -15.696 -0.625 301 HB2 PRO 38 1HB PRO 38 3.890 -17.629 -0.365 302 HB3 PRO 38 2HB PRO 38 4.198 -16.754 -1.907 303 HG2 PRO 38 1HG PRO 38 5.179 -19.479 -1.040 304 HG3 PRO 38 2HG PRO 38 4.459 -19.008 -2.619 305 HD2 PRO 38 1HD PRO 38 7.162 -19.205 -2.230 306 HD3 PRO 38 2HD PRO 38 6.455 -17.989 -3.331 307 H ALA 39 H ALA 39 4.301 -16.636 1.418 308 HA ALA 39 HA ALA 39 6.079 -17.938 3.355 309 HB1 ALA 39 1HB ALA 39 5.411 -15.783 4.236 310 HB2 ALA 39 2HB ALA 39 3.701 -16.090 3.801 311 HB3 ALA 39 3HB ALA 39 4.498 -17.066 5.050 312 H ALA 40 H ALA 40 5.688 -19.766 2.181 313 HA ALA 40 HA ALA 40 4.744 -21.820 1.822 314 HB1 ALA 40 1HB ALA 40 3.698 -22.778 3.819 315 HB2 ALA 40 2HB ALA 40 5.062 -21.765 4.255 316 HB3 ALA 40 3HB ALA 40 3.404 -21.156 4.471 317 H GLY 41 H GLY 41 3.344 -19.754 0.443 318 HA2 GLY 41 2HA GLY 41 1.698 -20.153 -1.179 319 HA3 GLY 41 1HA GLY 41 0.738 -21.107 -0.045 320 H VAL 42 H VAL 42 1.606 -18.611 1.785 321 HA VAL 42 HA VAL 42 -0.619 -16.801 0.981 322 HB VAL 42 HB VAL 42 0.973 -17.092 3.586 323 HG11 VAL 42 1HG1 VAL 42 0.415 -14.759 3.352 324 HG12 VAL 42 2HG1 VAL 42 -1.258 -15.154 2.895 325 HG13 VAL 42 3HG1 VAL 42 -0.656 -15.475 4.542 326 HG21 VAL 42 3HG2 VAL 42 -1.105 -17.848 4.600 327 HG22 VAL 42 1HG2 VAL 42 -1.970 -17.674 3.057 328 HG23 VAL 42 2HG2 VAL 42 -0.695 -18.904 3.255 329 H TYR 43 H TYR 43 -0.173 -14.659 0.416 330 HA TYR 43 HA TYR 43 2.232 -13.405 1.177 331 HB2 TYR 43 1HB TYR 43 3.134 -12.940 -1.058 332 HB3 TYR 43 2HB TYR 43 3.337 -14.599 -0.580 333 HD1 TYR 43 2HD TYR 43 1.565 -16.348 -1.607 334 HD2 TYR 43 1HD TYR 43 2.211 -12.329 -3.110 335 HE1 TYR 43 2HE TYR 43 0.684 -17.019 -3.810 336 HE2 TYR 43 1HE TYR 43 1.297 -13.014 -5.301 337 HH TYR 43 HH TYR 43 0.048 -16.279 -5.958 338 H LEU 44 H LEU 44 2.388 -11.203 0.104 339 HA LEU 44 HA LEU 44 -0.263 -10.031 -0.569 340 HB2 LEU 44 1HB LEU 44 1.756 -9.184 1.547 341 HB3 LEU 44 2HB LEU 44 0.879 -7.978 0.667 342 HG LEU 44 HG LEU 44 -1.242 -8.614 1.455 343 HD11 LEU 44 1HD1 LEU 44 0.031 -11.022 2.773 344 HD12 LEU 44 2HD1 LEU 44 -1.240 -10.967 1.523 345 HD13 LEU 44 3HD1 LEU 44 -1.627 -10.373 3.116 346 HD21 LEU 44 3HD2 LEU 44 -0.967 -8.332 3.910 347 HD22 LEU 44 1HD2 LEU 44 0.061 -7.235 3.003 348 HD23 LEU 44 2HD2 LEU 44 0.766 -8.684 3.758 349 H ARG 45 H ARG 45 0.130 -9.723 -2.710 350 HA ARG 45 HA ARG 45 2.507 -8.369 -3.797 351 HB2 ARG 45 1HB ARG 45 -0.336 -9.008 -4.711 352 HB3 ARG 45 2HB ARG 45 0.673 -7.873 -5.625 353 HG2 ARG 45 1HG ARG 45 2.353 -9.584 -6.047 354 HG3 ARG 45 2HG ARG 45 1.593 -10.682 -4.909 355 HD2 ARG 45 1HD ARG 45 0.975 -11.478 -7.006 356 HD3 ARG 45 2HD ARG 45 -0.475 -10.678 -6.392 357 HE ARG 45 HE ARG 45 0.597 -8.668 -7.849 358 HH11 ARG 45 1HH1 ARG 45 -0.026 -12.072 -8.658 359 HH12 ARG 45 2HH1 ARG 45 -0.051 -11.823 -10.351 360 HH21 ARG 45 1HH2 ARG 45 0.582 -8.314 -10.071 361 HH22 ARG 45 2HH2 ARG 45 0.582 -9.657 -11.190 362 H ALA 46 H ALA 46 2.687 -6.107 -3.891 363 HA ALA 46 HA ALA 46 0.457 -4.428 -2.861 364 HB1 ALA 46 1HB ALA 46 1.870 -4.487 -0.961 365 HB2 ALA 46 2HB ALA 46 3.369 -4.415 -1.961 366 HB3 ALA 46 3HB ALA 46 2.321 -3.017 -1.823 367 H TYR 47 H TYR 47 -0.072 -3.933 -4.996 368 HA TYR 47 HA TYR 47 1.997 -2.820 -6.761 369 HB2 TYR 47 1HB TYR 47 -0.134 -4.250 -7.402 370 HB3 TYR 47 2HB TYR 47 -0.932 -2.708 -7.383 371 HD1 TYR 47 1HD TYR 47 1.917 -4.609 -8.910 372 HD2 TYR 47 2HD TYR 47 -0.709 -1.215 -9.245 373 HE1 TYR 47 1HE TYR 47 2.715 -4.227 -11.208 374 HE2 TYR 47 2HE TYR 47 0.085 -0.808 -11.553 375 HH TYR 47 HH TYR 47 1.115 -1.895 -13.363 376 H VAL 48 H VAL 48 2.707 -1.033 -5.788 377 HA VAL 48 HA VAL 48 0.848 1.166 -5.096 378 HB VAL 48 HB VAL 48 2.419 1.136 -3.403 379 HG11 VAL 48 1HG1 VAL 48 4.759 1.098 -3.551 380 HG12 VAL 48 2HG1 VAL 48 4.073 -0.337 -4.320 381 HG13 VAL 48 3HG1 VAL 48 4.721 0.983 -5.335 382 HG21 VAL 48 3HG2 VAL 48 1.976 3.378 -4.257 383 HG22 VAL 48 1HG2 VAL 48 3.633 3.258 -3.625 384 HG23 VAL 48 2HG2 VAL 48 3.347 3.256 -5.369 385 H MET 49 H MET 49 0.017 1.354 -7.052 386 HA MET 49 HA MET 49 1.773 1.834 -9.353 387 HB2 MET 49 1HB MET 49 -0.279 2.427 -10.631 388 HB3 MET 49 2HB MET 49 -0.133 0.799 -10.037 389 HG2 MET 49 1HG MET 49 -1.614 1.659 -8.050 390 HG3 MET 49 2HG MET 49 -2.067 2.879 -9.270 391 HE1 MET 49 3HE MET 49 -2.262 -0.619 -7.878 392 HE2 MET 49 1HE MET 49 -3.798 0.198 -7.660 393 HE3 MET 49 2HE MET 49 -3.720 -1.256 -8.668 394 HA PRO 50 HA PRO 50 2.280 6.193 -8.572 395 HB2 PRO 50 1HB PRO 50 2.592 7.107 -11.125 396 HB3 PRO 50 2HB PRO 50 3.852 6.222 -10.215 397 HG2 PRO 50 1HG PRO 50 1.885 5.123 -12.236 398 HG3 PRO 50 2HG PRO 50 3.660 4.864 -12.165 399 HD2 PRO 50 1HD PRO 50 1.970 3.013 -11.098 400 HD3 PRO 50 2HD PRO 50 3.469 3.468 -10.254 401 H ALA 51 H ALA 51 1.305 8.308 -9.479 402 HA ALA 51 HA ALA 51 -1.548 8.432 -9.604 403 HB1 ALA 51 1HB ALA 51 -1.095 10.666 -10.599 404 HB2 ALA 51 2HB ALA 51 -0.047 10.394 -9.198 405 HB3 ALA 51 3HB ALA 51 0.609 10.223 -10.827 406 H ALA 52 H ALA 52 -2.888 8.516 -11.450 407 HA ALA 52 HA ALA 52 -1.831 7.111 -13.860 408 HB1 ALA 52 1HB ALA 52 -3.074 5.694 -12.228 409 HB2 ALA 52 2HB ALA 52 -4.491 6.723 -12.470 410 HB3 ALA 52 3HB ALA 52 -3.845 5.780 -13.829 411 H THR 53 H THR 53 -1.980 9.934 -13.880 412 HA THR 53 HA THR 53 -4.532 10.616 -15.195 413 HB THR 53 HB THR 53 -4.603 10.590 -12.657 414 HG1 THR 53 1HG THR 53 -6.077 11.731 -13.817 415 HG21 THR 53 3HG2 THR 53 -3.683 12.358 -11.337 416 HG22 THR 53 1HG2 THR 53 -2.968 13.144 -12.751 417 HG23 THR 53 2HG2 THR 53 -2.351 11.578 -12.220 418 H ILE 54 H ILE 54 -2.104 10.429 -16.446 419 HA ILE 54 HA ILE 54 -0.661 12.880 -16.660 420 HB ILE 54 HB ILE 54 -0.964 10.823 -18.853 421 HG12 ILE 54 1HG1 ILE 54 0.741 10.923 -16.341 422 HG13 ILE 54 2HG1 ILE 54 -0.246 9.604 -16.982 423 HG21 ILE 54 1HG2 ILE 54 1.259 12.830 -18.284 424 HG22 ILE 54 2HG2 ILE 54 1.204 11.657 -19.619 425 HG23 ILE 54 3HG2 ILE 54 0.043 12.952 -19.587 426 HD11 ILE 54 3HD1 ILE 54 2.028 8.960 -17.182 427 HD12 ILE 54 1HD1 ILE 54 1.457 9.343 -18.822 428 HD13 ILE 54 2HD1 ILE 54 2.488 10.494 -17.944 429 H SER 55 H SER 55 -0.880 14.641 -17.855 430 HA SER 55 HA SER 55 -3.509 15.411 -18.868 431 HB2 SER 55 1HB SER 55 -1.717 16.782 -17.402 432 HB3 SER 55 2HB SER 55 -1.100 17.195 -19.008 433 HG SER 55 HG SER 55 -2.630 18.679 -18.852 434 H ARG 56 H ARG 56 -2.247 17.186 -20.918 435 HA ARG 56 HA ARG 56 -1.930 15.097 -23.030 436 HB2 ARG 56 1HB ARG 56 -3.277 17.819 -22.975 437 HB3 ARG 56 2HB ARG 56 -2.928 16.983 -24.493 438 HG2 ARG 56 1HG ARG 56 -4.348 15.182 -24.036 439 HG3 ARG 56 2HG ARG 56 -4.441 15.517 -22.309 440 HD2 ARG 56 1HD ARG 56 -5.487 17.528 -24.316 441 HD3 ARG 56 2HD ARG 56 -6.456 16.119 -23.860 442 HE ARG 56 HE ARG 56 -5.900 16.976 -21.432 443 HH11 ARG 56 1HH1 ARG 56 -7.020 18.823 -24.218 444 HH12 ARG 56 2HH1 ARG 56 -8.060 19.871 -23.311 445 HH21 ARG 56 1HH2 ARG 56 -7.128 18.475 -20.174 446 HH22 ARG 56 2HH2 ARG 56 -8.154 19.622 -20.950 447 H ASP 57 H ASP 57 0.194 16.627 -21.409 448 HA ASP 57 HA ASP 57 1.725 17.989 -23.541 449 HB2 ASP 57 1HB ASP 57 1.756 18.504 -20.918 450 HB3 ASP 57 2HB ASP 57 2.959 17.211 -20.894 451 H ALA 58 H ALA 58 4.220 17.041 -23.422 452 HA ALA 58 HA ALA 58 3.959 14.242 -24.329 453 HB1 ALA 58 1HB ALA 58 6.126 16.340 -24.831 454 HB2 ALA 58 2HB ALA 58 6.080 14.715 -25.549 455 HB3 ALA 58 3HB ALA 58 4.823 15.887 -25.959 456 H ALA 59 H ALA 59 4.341 15.319 -21.511 457 HA ALA 59 HA ALA 59 6.700 13.707 -20.692 458 HB1 ALA 59 1HB ALA 59 7.137 15.399 -18.928 459 HB2 ALA 59 2HB ALA 59 7.214 16.115 -20.544 460 HB3 ALA 59 3HB ALA 59 5.773 16.366 -19.541 461 H GLY 60 H GLY 60 6.535 13.303 -18.172 462 HA2 GLY 60 2HA GLY 60 3.785 12.305 -17.577 463 HA3 GLY 60 1HA GLY 60 5.280 11.405 -17.284 464 H ASP 61 H ASP 61 4.761 14.887 -16.640 465 HA ASP 61 HA ASP 61 4.462 14.600 -13.738 466 HB2 ASP 61 1HB ASP 61 6.986 15.288 -15.060 467 HB3 ASP 61 2HB ASP 61 6.361 16.457 -13.910 468 H HIS 62 H HIS 62 2.981 16.088 -13.251 469 HA HIS 62 HA HIS 62 2.764 18.655 -14.754 470 HB2 HIS 62 1HB HIS 62 0.221 18.279 -14.768 471 HB3 HIS 62 2HB HIS 62 1.197 17.375 -15.899 472 HD1 HIS 62 1HD HIS 62 0.476 14.978 -16.096 473 HD2 HIS 62 2HD HIS 62 0.019 16.511 -12.213 474 HE1 HIS 62 1HE HIS 62 -0.515 13.089 -14.613 475 H ARG 63 H ARG 63 0.954 20.046 -13.653 476 HA ARG 63 HA ARG 63 1.326 20.625 -10.957 477 HB2 ARG 63 1HB ARG 63 0.005 22.049 -12.449 478 HB3 ARG 63 2HB ARG 63 -1.226 20.773 -12.602 479 HG2 ARG 63 1HG ARG 63 -1.829 20.960 -10.252 480 HG3 ARG 63 2HG ARG 63 -0.448 22.011 -9.966 481 HD2 ARG 63 1HD ARG 63 -1.695 23.599 -11.688 482 HD3 ARG 63 2HD ARG 63 -3.108 22.636 -11.223 483 HE ARG 63 HE ARG 63 -1.633 23.394 -8.903 484 HH11 ARG 63 1HH1 ARG 63 -3.831 24.909 -11.261 485 HH12 ARG 63 2HH1 ARG 63 -3.867 26.418 -10.389 486 HH21 ARG 63 1HH2 ARG 63 -1.832 25.365 -7.725 487 HH22 ARG 63 2HH2 ARG 63 -2.734 26.670 -8.415 488 H GLN 64 H GLN 64 0.877 19.602 -9.178 489 HA GLN 64 HA GLN 64 0.136 18.467 -7.525 490 HB2 GLN 64 1HB GLN 64 -1.985 18.011 -7.153 491 HB3 GLN 64 2HB GLN 64 -2.111 19.268 -8.368 492 HG2 GLN 64 1HG GLN 64 -2.413 17.152 -10.021 493 HG3 GLN 64 2HG GLN 64 -2.779 16.324 -8.556 494 HE21 GLN 64 1HE2 GLN 64 -4.769 16.692 -7.607 495 HE22 GLN 64 2HE2 GLN 64 -6.001 17.837 -8.226 496 H TYR 65 H TYR 65 -0.183 16.315 -6.613 497 HA TYR 65 HA TYR 65 0.931 14.188 -8.362 498 HB2 TYR 65 1HB TYR 65 1.972 15.387 -5.843 499 HB3 TYR 65 2HB TYR 65 1.807 13.639 -5.783 500 HD1 TYR 65 1HD TYR 65 2.853 15.907 -8.603 501 HD2 TYR 65 2HD TYR 65 3.980 12.699 -5.911 502 HE1 TYR 65 1HE TYR 65 4.835 15.498 -9.946 503 HE2 TYR 65 2HE TYR 65 6.019 12.335 -7.239 504 HH TYR 65 HH TYR 65 6.584 13.995 -10.369 505 H ARG 66 H ARG 66 0.593 11.956 -7.442 506 HA ARG 66 HA ARG 66 -1.684 11.539 -5.668 507 HB2 ARG 66 1HB ARG 66 -2.068 11.930 -8.497 508 HB3 ARG 66 2HB ARG 66 -2.432 10.264 -8.130 509 HG2 ARG 66 1HG ARG 66 -4.236 10.793 -6.733 510 HG3 ARG 66 2HG ARG 66 -3.659 12.452 -6.398 511 HD2 ARG 66 1HD ARG 66 -4.087 13.124 -8.717 512 HD3 ARG 66 2HD ARG 66 -4.356 11.457 -9.225 513 HE ARG 66 HE ARG 66 -6.217 13.246 -7.800 514 HH11 ARG 66 1HH1 ARG 66 -5.716 9.962 -9.151 515 HH12 ARG 66 2HH1 ARG 66 -7.425 9.692 -9.334 516 HH21 ARG 66 1HH2 ARG 66 -8.324 12.910 -8.204 517 HH22 ARG 66 2HH2 ARG 66 -8.992 11.420 -8.804 518 H GLY 67 H GLY 67 -2.200 9.017 -5.718 519 HA2 GLY 67 2HA GLY 67 -0.507 7.287 -7.164 520 HA3 GLY 67 1HA GLY 67 0.097 7.444 -5.508 521 H VAL 68 H VAL 68 -0.751 4.923 -6.171 522 HA VAL 68 HA VAL 68 -3.296 4.678 -4.677 523 HB VAL 68 HB VAL 68 -2.465 3.383 -7.244 524 HG11 VAL 68 1HG1 VAL 68 -5.103 2.875 -5.845 525 HG12 VAL 68 2HG1 VAL 68 -4.553 2.203 -7.375 526 HG13 VAL 68 3HG1 VAL 68 -3.764 1.713 -5.891 527 HG21 VAL 68 3HG2 VAL 68 -4.520 4.379 -8.254 528 HG22 VAL 68 1HG2 VAL 68 -4.691 5.357 -6.773 529 HG23 VAL 68 2HG2 VAL 68 -3.265 5.530 -7.834 530 H PHE 69 H PHE 69 -3.437 2.567 -3.690 531 HA PHE 69 HA PHE 69 -0.995 0.900 -3.742 532 HB2 PHE 69 1HB PHE 69 -0.956 2.393 -1.715 533 HB3 PHE 69 2HB PHE 69 -2.511 1.721 -1.234 534 HD1 PHE 69 2HD PHE 69 0.937 0.547 -2.196 535 HD2 PHE 69 1HD PHE 69 -2.529 -0.010 0.326 536 HE1 PHE 69 2HE PHE 69 2.158 -1.155 -0.867 537 HE2 PHE 69 1HE PHE 69 -1.360 -1.841 1.519 538 HZ PHE 69 HZ PHE 69 0.968 -2.436 0.919 539 H GLN 70 H GLN 70 -1.683 -1.074 -4.371 540 HA GLN 70 HA GLN 70 -4.393 -1.979 -3.619 541 HB2 GLN 70 1HB GLN 70 -4.386 -1.502 -5.990 542 HB3 GLN 70 2HB GLN 70 -2.903 -2.421 -6.236 543 HG2 GLN 70 1HG GLN 70 -3.962 -4.500 -5.949 544 HG3 GLN 70 2HG GLN 70 -5.315 -3.820 -5.050 545 HE21 GLN 70 1HE2 GLN 70 -6.998 -2.612 -6.227 546 HE22 GLN 70 2HE2 GLN 70 -7.296 -3.041 -7.901 547 H VAL 71 H VAL 71 -3.830 -3.306 -1.853 548 HA VAL 71 HA VAL 71 -1.677 -5.301 -2.296 549 HB VAL 71 HB VAL 71 -1.509 -4.127 -0.215 550 HG11 VAL 71 1HG1 VAL 71 -4.318 -5.070 0.396 551 HG12 VAL 71 2HG1 VAL 71 -3.170 -4.489 1.636 552 HG13 VAL 71 3HG1 VAL 71 -3.693 -3.426 0.356 553 HG21 VAL 71 3HG2 VAL 71 -0.707 -6.395 -0.210 554 HG22 VAL 71 1HG2 VAL 71 -1.420 -6.018 1.350 555 HG23 VAL 71 2HG2 VAL 71 -2.320 -7.015 0.218 556 H ASN 72 H ASN 72 -2.177 -7.588 -2.112 557 HA ASN 72 HA ASN 72 -5.053 -8.326 -2.301 558 HB2 ASN 72 1HB ASN 72 -3.042 -8.600 -4.493 559 HB3 ASN 72 2HB ASN 72 -3.912 -10.045 -4.109 560 HD21 ASN 72 1HD2 ASN 72 -5.264 -6.643 -4.002 561 HD22 ASN 72 2HD2 ASN 72 -6.407 -6.979 -5.257 562 H VAL 73 H VAL 73 -5.105 -9.329 -0.373 563 HA VAL 73 HA VAL 73 -3.132 -11.312 0.377 564 HB VAL 73 HB VAL 73 -4.109 -10.056 2.104 565 HG11 VAL 73 1HG1 VAL 73 -6.374 -9.547 1.196 566 HG12 VAL 73 2HG1 VAL 73 -6.856 -11.214 1.561 567 HG13 VAL 73 3HG1 VAL 73 -6.394 -10.107 2.864 568 HG21 VAL 73 3HG2 VAL 73 -5.156 -12.906 2.200 569 HG22 VAL 73 1HG2 VAL 73 -3.491 -12.378 2.577 570 HG23 VAL 73 2HG2 VAL 73 -4.859 -11.873 3.599 571 H VAL 74 H VAL 74 -2.947 -12.829 -1.027 572 HA VAL 74 HA VAL 74 -5.179 -14.600 -1.747 573 HB VAL 74 HB VAL 74 -3.695 -14.305 -3.523 574 HG11 VAL 74 1HG1 VAL 74 -1.813 -13.223 -2.427 575 HG12 VAL 74 2HG1 VAL 74 -1.301 -14.774 -1.730 576 HG13 VAL 74 3HG1 VAL 74 -1.303 -14.514 -3.497 577 HG21 VAL 74 3HG2 VAL 74 -2.716 -16.890 -2.274 578 HG22 VAL 74 1HG2 VAL 74 -4.269 -16.687 -3.120 579 HG23 VAL 74 2HG2 VAL 74 -2.739 -16.458 -3.992 580 H MET 75 H MET 75 -5.178 -16.783 -0.940 581 HA MET 75 HA MET 75 -3.348 -17.518 1.161 582 HB2 MET 75 1HB MET 75 -5.061 -18.383 2.660 583 HB3 MET 75 2HB MET 75 -5.226 -16.644 2.499 584 HG2 MET 75 1HG MET 75 -6.914 -17.875 0.528 585 HG3 MET 75 2HG MET 75 -7.145 -18.670 2.078 586 HE1 MET 75 3HE MET 75 -8.113 -14.270 1.067 587 HE2 MET 75 1HE MET 75 -6.441 -14.828 1.165 588 HE3 MET 75 2HE MET 75 -7.556 -15.534 -0.059 589 HA PRO 76 HA PRO 76 -4.081 -21.131 -1.388 590 HB2 PRO 76 1HB PRO 76 -2.764 -23.103 -0.049 591 HB3 PRO 76 2HB PRO 76 -1.847 -21.700 -0.711 592 HG2 PRO 76 1HG PRO 76 -2.824 -22.115 2.122 593 HG3 PRO 76 2HG PRO 76 -1.198 -21.586 1.579 594 HD2 PRO 76 1HD PRO 76 -3.204 -19.847 2.374 595 HD3 PRO 76 2HD PRO 76 -1.946 -19.403 1.180 596 H ILE 77 H ILE 77 -5.675 -22.638 -1.585 597 HA ILE 77 HA ILE 77 -7.594 -22.738 0.463 598 HB ILE 77 HB ILE 77 -7.514 -23.851 -2.338 599 HG12 ILE 77 1HG1 ILE 77 -8.657 -21.960 -2.997 600 HG13 ILE 77 2HG1 ILE 77 -9.285 -21.658 -1.432 601 HG21 ILE 77 1HG2 ILE 77 -9.806 -23.639 -0.274 602 HG22 ILE 77 2HG2 ILE 77 -10.014 -24.060 -1.991 603 HG23 ILE 77 3HG2 ILE 77 -9.139 -25.153 -0.905 604 HD11 ILE 77 3HD1 ILE 77 -8.058 -19.894 -1.973 605 HD12 ILE 77 1HD1 ILE 77 -7.470 -20.656 -0.508 606 HD13 ILE 77 2HD1 ILE 77 -6.589 -20.906 -2.058 607 H GLY 78 H GLY 78 -6.062 -23.737 1.949 608 HA2 GLY 78 2HA GLY 78 -5.922 -26.725 1.808 609 HA3 GLY 78 1HA GLY 78 -4.807 -25.681 2.698 610 H ASP 79 H ASP 79 -5.491 -24.743 4.685 611 HA ASP 79 HA ASP 79 -7.610 -26.283 6.038 612 HB2 ASP 79 1HB ASP 79 -5.185 -26.170 6.760 613 HB3 ASP 79 2HB ASP 79 -5.469 -24.519 7.265 614 H GLY 80 H GLY 80 -9.228 -24.937 4.848 615 HA2 GLY 80 2HA GLY 80 -11.004 -23.509 4.982 616 HA3 GLY 80 1HA GLY 80 -10.528 -23.183 6.647 617 H SER 81 H SER 81 -10.120 -22.183 3.283 618 HA SER 81 HA SER 81 -8.277 -20.092 3.691 619 HB2 SER 81 1HB SER 81 -8.904 -19.718 1.267 620 HB3 SER 81 2HB SER 81 -8.285 -21.298 1.700 621 HG SER 81 HG SER 81 -10.412 -21.006 0.378 622 H ARG 82 H ARG 82 -9.871 -19.032 5.504 623 HA ARG 82 HA ARG 82 -11.591 -17.021 4.124 624 HB2 ARG 82 1HB ARG 82 -12.049 -18.431 6.758 625 HB3 ARG 82 2HB ARG 82 -12.898 -16.986 6.249 626 HG2 ARG 82 1HG ARG 82 -14.277 -18.867 5.819 627 HG3 ARG 82 2HG ARG 82 -13.795 -18.198 4.262 628 HD2 ARG 82 1HD ARG 82 -12.374 -20.041 3.781 629 HD3 ARG 82 2HD ARG 82 -12.308 -20.521 5.493 630 HE ARG 82 HE ARG 82 -14.934 -20.880 4.913 631 HH11 ARG 82 1HH1 ARG 82 -12.288 -21.725 2.765 632 HH12 ARG 82 2HH1 ARG 82 -12.646 -23.406 2.709 633 HH21 ARG 82 1HH2 ARG 82 -15.549 -23.099 4.718 634 HH22 ARG 82 2HH2 ARG 82 -14.497 -24.237 3.907 635 H SER 83 H SER 83 -8.583 -17.200 5.534 636 HA SER 83 HA SER 83 -8.556 -15.200 7.457 637 HB2 SER 83 1HB SER 83 -6.437 -16.255 5.539 638 HB3 SER 83 2HB SER 83 -6.075 -15.059 6.749 639 HG SER 83 HG SER 83 -5.771 -17.050 7.722 640 H ALA 84 H ALA 84 -9.396 -14.427 4.283 641 HA ALA 84 HA ALA 84 -7.947 -12.071 3.744 642 HB1 ALA 84 1HB ALA 84 -10.016 -11.381 2.493 643 HB2 ALA 84 2HB ALA 84 -9.540 -13.048 2.115 644 HB3 ALA 84 3HB ALA 84 -10.898 -12.718 3.215 645 H GLU 85 H GLU 85 -10.752 -12.534 5.971 646 HA GLU 85 HA GLU 85 -11.248 -9.745 6.373 647 HB2 GLU 85 1HB GLU 85 -11.880 -12.241 8.006 648 HB3 GLU 85 2HB GLU 85 -12.287 -10.604 8.510 649 HG2 GLU 85 1HG GLU 85 -13.191 -10.735 5.847 650 HG3 GLU 85 2HG GLU 85 -13.599 -12.306 6.530 651 H GLN 86 H GLN 86 -9.446 -12.163 8.498 652 HA GLN 86 HA GLN 86 -8.641 -10.678 10.477 653 HB2 GLN 86 1HB GLN 86 -8.568 -13.138 9.767 654 HB3 GLN 86 2HB GLN 86 -7.122 -12.785 8.842 655 HG2 GLN 86 1HG GLN 86 -7.401 -12.139 11.755 656 HG3 GLN 86 2HG GLN 86 -7.015 -13.759 11.149 657 HE21 GLN 86 1HE2 GLN 86 -5.641 -10.749 12.048 658 HE22 GLN 86 2HE2 GLN 86 -4.030 -10.961 11.441 659 H VAL 87 H VAL 87 -6.858 -11.126 7.395 660 HA VAL 87 HA VAL 87 -4.758 -9.314 7.991 661 HB VAL 87 HB VAL 87 -5.856 -10.627 5.476 662 HG11 VAL 87 1HG1 VAL 87 -3.684 -10.004 4.369 663 HG12 VAL 87 2HG1 VAL 87 -4.794 -8.649 4.608 664 HG13 VAL 87 3HG1 VAL 87 -3.382 -8.886 5.700 665 HG21 VAL 87 3HG2 VAL 87 -4.697 -11.997 7.278 666 HG22 VAL 87 1HG2 VAL 87 -3.943 -12.053 5.692 667 HG23 VAL 87 2HG2 VAL 87 -3.227 -11.013 6.960 668 H ALA 88 H ALA 88 -7.877 -8.805 6.116 669 HA ALA 88 HA ALA 88 -7.191 -6.169 5.327 670 HB1 ALA 88 1HB ALA 88 -9.935 -7.339 5.937 671 HB2 ALA 88 2HB ALA 88 -9.607 -5.850 5.039 672 HB3 ALA 88 3HB ALA 88 -9.090 -7.408 4.368 673 H ALA 89 H ALA 89 -8.378 -7.419 8.467 674 HA ALA 89 HA ALA 89 -9.173 -4.832 9.478 675 HB1 ALA 89 1HB ALA 89 -8.550 -7.485 10.863 676 HB2 ALA 89 2HB ALA 89 -9.332 -6.095 11.608 677 HB3 ALA 89 3HB ALA 89 -10.149 -6.957 10.291 678 H GLU 90 H GLU 90 -6.218 -6.736 9.368 679 HA GLU 90 HA GLU 90 -4.723 -5.159 11.299 680 HB2 GLU 90 1HB GLU 90 -3.883 -7.135 9.110 681 HB3 GLU 90 2HB GLU 90 -2.775 -6.321 10.238 682 HG2 GLU 90 1HG GLU 90 -4.196 -7.264 12.088 683 HG3 GLU 90 2HG GLU 90 -4.991 -8.268 10.923 684 H LEU 91 H LEU 91 -4.552 -5.431 7.674 685 HA LEU 91 HA LEU 91 -2.951 -3.210 7.297 686 HB2 LEU 91 1HB LEU 91 -5.070 -4.476 5.534 687 HB3 LEU 91 2HB LEU 91 -4.176 -3.061 5.012 688 HG LEU 91 HG LEU 91 -3.221 -4.931 4.092 689 HD11 LEU 91 1HD1 LEU 91 -1.632 -3.129 4.821 690 HD12 LEU 91 2HD1 LEU 91 -0.878 -4.726 4.642 691 HD13 LEU 91 3HD1 LEU 91 -1.250 -4.124 6.257 692 HD21 LEU 91 3HD2 LEU 91 -3.890 -6.661 5.491 693 HD22 LEU 91 1HD2 LEU 91 -2.761 -6.168 6.769 694 HD23 LEU 91 2HD2 LEU 91 -2.146 -6.762 5.210 695 H ASP 92 H ASP 92 -6.541 -3.214 7.735 696 HA ASP 92 HA ASP 92 -6.919 -0.508 6.927 697 HB2 ASP 92 1HB ASP 92 -8.758 -2.126 7.156 698 HB3 ASP 92 2HB ASP 92 -8.488 -2.217 8.887 699 H ALA 93 H ALA 93 -6.374 -1.960 10.181 700 HA ALA 93 HA ALA 93 -6.247 0.542 11.533 701 HB1 ALA 93 1HB ALA 93 -6.593 -1.653 12.644 702 HB2 ALA 93 2HB ALA 93 -4.913 -2.097 12.255 703 HB3 ALA 93 3HB ALA 93 -5.270 -0.734 13.354 704 H LEU 94 H LEU 94 -3.829 -1.289 9.718 705 HA LEU 94 HA LEU 94 -1.576 0.301 10.535 706 HB2 LEU 94 1HB LEU 94 -1.321 -1.936 9.516 707 HB3 LEU 94 2HB LEU 94 -1.967 -1.314 8.004 708 HG LEU 94 HG LEU 94 -0.005 0.303 7.865 709 HD11 LEU 94 1HD1 LEU 94 0.633 0.542 10.176 710 HD12 LEU 94 2HD1 LEU 94 1.972 -0.246 9.315 711 HD13 LEU 94 3HD1 LEU 94 0.879 -1.207 10.346 712 HD21 LEU 94 3HD2 LEU 94 0.623 -2.644 8.076 713 HD22 LEU 94 1HD2 LEU 94 1.626 -1.432 7.244 714 HD23 LEU 94 2HD2 LEU 94 -0.008 -1.826 6.674 715 H PHE 95 H PHE 95 -4.052 0.644 7.981 716 HA PHE 95 HA PHE 95 -2.829 3.195 7.104 717 HB2 PHE 95 1HB PHE 95 -4.311 1.090 5.542 718 HB3 PHE 95 2HB PHE 95 -4.115 2.723 4.958 719 HD1 PHE 95 2HD PHE 95 -2.108 -0.289 5.994 720 HD2 PHE 95 1HD PHE 95 -2.257 3.314 3.612 721 HE1 PHE 95 2HE PHE 95 -0.134 -1.043 4.674 722 HE2 PHE 95 1HE PHE 95 -0.317 2.531 2.313 723 HZ PHE 95 HZ PHE 95 0.753 0.350 2.836 724 HA PRO 96 HA PRO 96 -6.979 4.218 9.027 725 HB2 PRO 96 1HB PRO 96 -6.076 6.400 10.425 726 HB3 PRO 96 2HB PRO 96 -6.015 4.732 11.072 727 HG2 PRO 96 1HG PRO 96 -3.836 6.307 9.672 728 HG3 PRO 96 2HG PRO 96 -3.710 5.387 11.211 729 HD2 PRO 96 1HD PRO 96 -2.909 4.354 8.875 730 HD3 PRO 96 2HD PRO 96 -3.713 3.332 10.107 731 H VAL 97 H VAL 97 -8.072 6.381 8.564 732 HA VAL 97 HA VAL 97 -7.644 7.303 5.909 733 HB VAL 97 HB VAL 97 -9.761 7.127 7.340 734 HG11 VAL 97 1HG1 VAL 97 -8.927 8.748 9.129 735 HG12 VAL 97 2HG1 VAL 97 -9.188 10.048 7.959 736 HG13 VAL 97 3HG1 VAL 97 -10.555 9.053 8.496 737 HG21 VAL 97 3HG2 VAL 97 -9.741 7.888 5.014 738 HG22 VAL 97 1HG2 VAL 97 -10.960 8.718 5.983 739 HG23 VAL 97 2HG2 VAL 97 -9.455 9.550 5.549 740 H ASN 98 H ASN 98 -5.489 7.809 7.918 741 HA ASN 98 HA ASN 98 -5.063 10.738 7.626 742 HB2 ASN 98 1HB ASN 98 -4.057 8.742 9.733 743 HB3 ASN 98 2HB ASN 98 -3.389 10.358 9.544 744 HD21 ASN 98 1HD2 ASN 98 -6.814 9.042 9.719 745 HD22 ASN 98 2HD2 ASN 98 -7.292 10.193 10.919 746 H LEU 99 H LEU 99 -3.259 7.535 7.599 747 HA LEU 99 HA LEU 99 -1.155 7.084 6.944 748 HB2 LEU 99 1HB LEU 99 -2.764 8.041 4.684 749 HB3 LEU 99 2HB LEU 99 -1.070 8.196 4.366 750 HG LEU 99 HG LEU 99 -0.741 5.802 5.064 751 HD11 LEU 99 1HD1 LEU 99 -3.704 5.392 4.812 752 HD12 LEU 99 2HD1 LEU 99 -2.913 5.700 6.362 753 HD13 LEU 99 3HD1 LEU 99 -2.409 4.342 5.427 754 HD21 LEU 99 3HD2 LEU 99 -1.105 6.714 2.615 755 HD22 LEU 99 1HD2 LEU 99 -2.525 5.652 2.698 756 HD23 LEU 99 2HD2 LEU 99 -0.912 5.007 2.984 757 H VAL 100 H VAL 100 -1.052 9.240 8.627 758 HA VAL 100 HA VAL 100 0.558 11.365 7.408 759 HB VAL 100 HB VAL 100 -0.547 10.904 10.191 760 HG11 VAL 100 1HG1 VAL 100 1.458 12.035 10.724 761 HG12 VAL 100 2HG1 VAL 100 1.446 12.944 9.199 762 HG13 VAL 100 3HG1 VAL 100 0.314 13.357 10.516 763 HG21 VAL 100 3HG2 VAL 100 -0.985 13.129 8.139 764 HG22 VAL 100 1HG2 VAL 100 -2.062 11.744 8.322 765 HG23 VAL 100 2HG2 VAL 100 -1.869 12.888 9.657 766 H MET 101 H MET 101 2.106 10.015 6.582 767 HA MET 101 HA MET 101 4.068 8.616 8.303 768 HB2 MET 101 1HB MET 101 4.325 9.281 5.347 769 HB3 MET 101 2HB MET 101 5.213 8.038 6.252 770 HG2 MET 101 1HG MET 101 3.077 6.760 6.528 771 HG3 MET 101 2HG MET 101 2.231 8.045 5.676 772 HE1 MET 101 3HE MET 101 1.156 7.440 3.925 773 HE2 MET 101 1HE MET 101 1.591 6.306 2.643 774 HE3 MET 101 2HE MET 101 1.274 5.712 4.292 775 H GLN 102 H GLN 102 6.535 9.279 7.841 776 HA GLN 102 HA GLN 102 6.879 11.962 6.880 777 HB2 GLN 102 1HB GLN 102 7.615 11.139 9.701 778 HB3 GLN 102 2HB GLN 102 8.775 12.069 8.767 779 HG2 GLN 102 1HG GLN 102 6.828 13.699 8.241 780 HG3 GLN 102 2HG GLN 102 5.979 12.912 9.563 781 HE21 GLN 102 1HE2 GLN 102 7.903 12.622 11.637 782 HE22 GLN 102 2HE2 GLN 102 8.640 14.178 11.910 783 H SER 103 H SER 103 8.788 12.185 5.825 784 HA SER 103 HA SER 103 10.707 9.996 5.523 785 HB2 SER 103 1HB SER 103 9.833 10.568 2.915 786 HB3 SER 103 2HB SER 103 9.486 9.103 3.840 787 HG SER 103 HG SER 103 7.649 10.513 2.896 788 H GLY 104 H GLY 104 12.210 10.811 3.597 789 HA2 GLY 104 2HA GLY 104 13.338 13.249 4.515 790 HA3 GLY 104 1HA GLY 104 13.844 12.322 3.085 791 H GLY 105 H GLY 105 10.571 13.303 2.833 792 HA2 GLY 105 2HA GLY 105 11.401 15.458 0.916 793 HA3 GLY 105 1HA GLY 105 10.194 14.223 0.527 794 H LEU 106 H LEU 106 8.567 14.038 2.696 795 HA LEU 106 HA LEU 106 7.449 16.294 3.799 796 HB2 LEU 106 1HB LEU 106 5.477 16.372 2.080 797 HB3 LEU 106 2HB LEU 106 6.885 17.396 1.878 798 HG LEU 106 HG LEU 106 7.701 16.179 0.033 799 HD11 LEU 106 1HD1 LEU 106 7.615 13.865 0.523 800 HD12 LEU 106 2HD1 LEU 106 6.571 14.105 -0.854 801 HD13 LEU 106 3HD1 LEU 106 5.866 13.919 0.782 802 HD21 LEU 106 3HD2 LEU 106 4.691 16.205 -0.173 803 HD22 LEU 106 1HD2 LEU 106 5.850 16.257 -1.538 804 HD23 LEU 106 2HD2 LEU 106 5.753 17.594 -0.389 805 H ALA 107 H ALA 107 5.126 15.743 4.390 806 HA ALA 107 HA ALA 107 4.705 12.910 4.962 807 HB1 ALA 107 1HB ALA 107 2.873 15.336 5.271 808 HB2 ALA 107 2HB ALA 107 2.570 13.717 5.936 809 HB3 ALA 107 3HB ALA 107 3.944 14.667 6.524 810 H VAL 108 H VAL 108 2.387 11.952 4.295 811 HA VAL 108 HA VAL 108 1.481 12.832 1.648 812 HB VAL 108 HB VAL 108 3.135 10.918 1.482 813 HG11 VAL 108 1HG1 VAL 108 2.607 9.762 3.571 814 HG12 VAL 108 2HG1 VAL 108 1.033 9.298 2.903 815 HG13 VAL 108 3HG1 VAL 108 2.538 8.707 2.152 816 HG21 VAL 108 3HG2 VAL 108 1.374 11.296 -0.242 817 HG22 VAL 108 1HG2 VAL 108 1.893 9.621 -0.096 818 HG23 VAL 108 2HG2 VAL 108 0.331 10.116 0.593 819 H ARG 109 H ARG 109 -0.884 11.660 1.367 820 HA ARG 109 HA ARG 109 -2.074 10.945 3.953 821 HB2 ARG 109 1HB ARG 109 -2.474 13.618 2.740 822 HB3 ARG 109 2HB ARG 109 -3.984 12.743 2.984 823 HG2 ARG 109 1HG ARG 109 -3.552 12.419 5.289 824 HG3 ARG 109 2HG ARG 109 -1.947 13.145 5.202 825 HD2 ARG 109 1HD ARG 109 -4.471 14.611 4.408 826 HD3 ARG 109 2HD ARG 109 -3.957 14.447 6.097 827 HE ARG 109 HE ARG 109 -1.756 15.503 4.700 828 HH11 ARG 109 1HH1 ARG 109 -4.957 16.385 5.845 829 HH12 ARG 109 2HH1 ARG 109 -4.966 17.993 5.206 830 HH21 ARG 109 1HH2 ARG 109 -1.423 17.944 4.720 831 HH22 ARG 109 2HH2 ARG 109 -2.830 18.917 4.751 832 H VAL 110 H VAL 110 -3.682 9.485 3.696 833 HA VAL 110 HA VAL 110 -3.845 8.084 1.252 834 HB VAL 110 HB VAL 110 -3.979 7.051 3.377 835 HG11 VAL 110 1HG1 VAL 110 -5.192 8.677 4.668 836 HG12 VAL 110 2HG1 VAL 110 -6.684 8.286 3.766 837 HG13 VAL 110 3HG1 VAL 110 -5.900 7.056 4.786 838 HG21 VAL 110 3HG2 VAL 110 -6.460 6.424 1.810 839 HG22 VAL 110 1HG2 VAL 110 -4.836 5.751 1.600 840 HG23 VAL 110 2HG2 VAL 110 -5.746 5.426 3.082 841 H ARG 111 H ARG 111 -5.954 10.603 2.484 842 HA ARG 111 HA ARG 111 -7.515 11.858 1.459 843 HB2 ARG 111 1HB ARG 111 -6.211 10.642 -0.925 844 HB3 ARG 111 2HB ARG 111 -7.898 11.038 -1.186 845 HG2 ARG 111 1HG ARG 111 -6.434 12.900 -1.800 846 HG3 ARG 111 2HG ARG 111 -7.513 13.327 -0.449 847 HD2 ARG 111 1HD ARG 111 -5.646 12.837 1.143 848 HD3 ARG 111 2HD ARG 111 -4.603 12.509 -0.246 849 HE ARG 111 HE ARG 111 -5.961 15.124 -0.092 850 HH11 ARG 111 1HH1 ARG 111 -2.921 13.306 0.419 851 HH12 ARG 111 2HH1 ARG 111 -1.911 14.681 0.345 852 HH21 ARG 111 1HH2 ARG 111 -4.559 16.900 -0.562 853 HH22 ARG 111 2HH2 ARG 111 -2.838 16.599 -0.683 854 H THR 112 H THR 112 -7.933 8.341 0.993 855 HA THR 112 HA THR 112 -10.803 8.816 1.575 856 HB THR 112 HB THR 112 -11.212 6.864 0.078 857 HG1 THR 112 1HG THR 112 -9.663 5.832 -0.735 858 HG21 THR 112 3HG2 THR 112 -9.769 9.153 -1.315 859 HG22 THR 112 1HG2 THR 112 -11.448 9.233 -0.718 860 HG23 THR 112 2HG2 THR 112 -11.025 8.084 -2.009 861 HA PRO 113 HA PRO 113 -10.124 5.625 4.654 862 HB2 PRO 113 1HB PRO 113 -12.497 4.270 4.727 863 HB3 PRO 113 2HB PRO 113 -12.322 5.935 5.342 864 HG2 PRO 113 1HG PRO 113 -13.395 5.030 2.667 865 HG3 PRO 113 2HG PRO 113 -14.065 6.263 3.776 866 HD2 PRO 113 1HD PRO 113 -12.546 6.892 1.605 867 HD3 PRO 113 2HD PRO 113 -12.522 7.866 3.099 868 H ILE 114 H ILE 114 -10.375 3.123 4.831 869 HA ILE 114 HA ILE 114 -9.075 1.845 2.602 870 HB ILE 114 HB ILE 114 -10.370 0.963 5.215 871 HG12 ILE 114 1HG1 ILE 114 -8.277 2.380 5.232 872 HG13 ILE 114 2HG1 ILE 114 -8.170 0.866 6.078 873 HG21 ILE 114 1HG2 ILE 114 -9.239 -1.225 5.019 874 HG22 ILE 114 2HG2 ILE 114 -10.552 -1.013 3.865 875 HG23 ILE 114 3HG2 ILE 114 -8.875 -0.866 3.309 876 HD11 ILE 114 3HD1 ILE 114 -7.195 1.051 3.217 877 HD12 ILE 114 1HD1 ILE 114 -6.225 1.701 4.517 878 HD13 ILE 114 2HD1 ILE 114 -6.643 -0.023 4.514 879 H SER 115 H SER 115 -9.927 0.171 1.238 880 HA SER 115 HA SER 115 -12.899 0.148 0.981 881 HB2 SER 115 1HB SER 115 -11.416 -0.188 -1.472 882 HB3 SER 115 2HB SER 115 -12.826 0.850 -1.169 883 HG SER 115 HG SER 115 -10.073 1.372 -1.107 884 H ASN 116 H ASN 116 -13.689 -1.803 0.056 885 HA ASN 116 HA ASN 116 -11.896 -4.015 -0.464 886 HB2 ASN 116 1HB ASN 116 -13.526 -3.687 2.026 887 HB3 ASN 116 2HB ASN 116 -13.699 -5.254 1.248 888 HD21 ASN 116 1HD2 ASN 116 -11.097 -5.751 0.188 889 HD22 ASN 116 2HD2 ASN 116 -10.042 -5.746 1.581 890 H GLY 117 H GLY 117 -13.439 -6.036 -0.988 891 HA2 GLY 117 2HA GLY 117 -16.121 -5.454 -1.817 892 HA3 GLY 117 1HA GLY 117 -15.004 -5.733 -3.175 893 H GLN 118 H GLN 118 -16.783 -7.695 -3.174 894 HA GLN 118 HA GLN 118 -16.215 -9.817 -1.294 895 HB2 GLN 118 1HB GLN 118 -17.925 -9.303 -3.697 896 HB3 GLN 118 2HB GLN 118 -17.462 -10.949 -3.431 897 HG2 GLN 118 1HG GLN 118 -18.417 -10.960 -1.185 898 HG3 GLN 118 2HG GLN 118 -18.774 -9.228 -1.304 899 HE21 GLN 118 1HE2 GLN 118 -20.989 -10.386 -0.650 900 HE22 GLN 118 2HE2 GLN 118 -22.010 -10.758 -2.029 901 HA PRO 119 HA PRO 119 -12.627 -11.164 -3.325 902 HB2 PRO 119 1HB PRO 119 -12.575 -13.888 -2.802 903 HB3 PRO 119 2HB PRO 119 -12.275 -12.641 -1.575 904 HG2 PRO 119 1HG PRO 119 -14.844 -14.117 -2.162 905 HG3 PRO 119 2HG PRO 119 -14.105 -13.777 -0.556 906 HD2 PRO 119 1HD PRO 119 -16.139 -12.273 -1.605 907 HD3 PRO 119 2HD PRO 119 -14.858 -11.525 -0.607 908 H THR 120 H THR 120 -11.768 -12.108 -5.139 909 HA THR 120 HA THR 120 -13.552 -13.502 -7.043 910 HB THR 120 HB THR 120 -10.544 -12.960 -7.148 911 HG1 THR 120 1HG THR 120 -11.403 -11.005 -7.210 912 HG21 THR 120 3HG2 THR 120 -11.001 -13.188 -9.634 913 HG22 THR 120 1HG2 THR 120 -12.627 -13.769 -9.239 914 HG23 THR 120 2HG2 THR 120 -11.195 -14.697 -8.736 915 H THR 121 H THR 121 -13.192 -15.775 -7.406 916 HA THR 121 HA THR 121 -11.325 -17.174 -5.627 917 HB THR 121 HB THR 121 -13.972 -18.325 -6.602 918 HG1 THR 121 1HG THR 121 -14.475 -18.252 -4.287 919 HG21 THR 121 3HG2 THR 121 -11.768 -19.416 -4.813 920 HG22 THR 121 1HG2 THR 121 -12.376 -20.083 -6.332 921 HG23 THR 121 2HG2 THR 121 -13.400 -20.105 -4.893 922 H GLY 122 H GLY 122 -10.028 -18.472 -6.830 923 HA2 GLY 122 2HA GLY 122 -10.188 -18.419 -9.787 924 HA3 GLY 122 1HA GLY 122 -8.703 -18.493 -8.829 925 H ASP 123 H ASP 123 -8.052 -20.427 -9.753 926 HA ASP 123 HA ASP 123 -9.572 -22.791 -10.166 927 HB2 ASP 123 1HB ASP 123 -7.393 -22.303 -11.202 928 HB3 ASP 123 2HB ASP 123 -6.614 -22.390 -9.618 929 H ALA 124 H ALA 124 -7.583 -21.699 -7.528 930 HA ALA 124 HA ALA 124 -8.848 -22.987 -5.282 931 HB1 ALA 124 1HB ALA 124 -7.746 -25.043 -6.279 932 HB2 ALA 124 2HB ALA 124 -6.208 -24.156 -6.295 933 HB3 ALA 124 3HB ALA 124 -6.999 -24.551 -4.743 934 H ASP 125 H ASP 125 -8.296 -20.347 -5.991 935 HA ASP 125 HA ASP 125 -6.956 -19.829 -3.610 936 HB2 ASP 125 1HB ASP 125 -6.067 -17.764 -4.637 937 HB3 ASP 125 2HB ASP 125 -5.189 -19.294 -4.433 938 H HIS 126 H HIS 126 -7.563 -17.725 -2.798 939 HA HIS 126 HA HIS 126 -9.869 -16.489 -4.182 940 HB2 HIS 126 1HB HIS 126 -9.573 -16.435 -1.180 941 HB3 HIS 126 2HB HIS 126 -10.921 -15.845 -2.132 942 HD1 HIS 126 1HD HIS 126 -12.667 -17.809 -3.035 943 HD2 HIS 126 2HD HIS 126 -9.475 -19.003 -0.537 944 HE1 HIS 126 1HE HIS 126 -13.210 -20.149 -2.237 945 H THR 127 H THR 127 -9.817 -14.193 -4.048 946 HA THR 127 HA THR 127 -7.642 -12.880 -2.569 947 HB THR 127 HB THR 127 -7.739 -11.656 -5.192 948 HG1 THR 127 1HG THR 127 -7.922 -13.364 -6.408 949 HG21 THR 127 3HG2 THR 127 -5.912 -11.477 -3.543 950 HG22 THR 127 1HG2 THR 127 -5.299 -12.082 -5.101 951 HG23 THR 127 2HG2 THR 127 -5.561 -13.204 -3.745 952 H VAL 128 H VAL 128 -8.626 -11.404 -1.434 953 HA VAL 128 HA VAL 128 -11.183 -10.272 -2.323 954 HB VAL 128 HB VAL 128 -10.619 -8.724 -0.324 955 HG11 VAL 128 1HG1 VAL 128 -12.437 -10.366 -0.380 956 HG12 VAL 128 2HG1 VAL 128 -11.301 -11.629 0.182 957 HG13 VAL 128 3HG1 VAL 128 -11.691 -10.234 1.208 958 HG21 VAL 128 3HG2 VAL 128 -8.842 -11.034 0.472 959 HG22 VAL 128 1HG2 VAL 128 -8.264 -9.441 -0.083 960 HG23 VAL 128 2HG2 VAL 128 -9.222 -9.556 1.399 961 HA PRO 129 HA PRO 129 -8.989 -6.841 -4.290 962 HB2 PRO 129 1HB PRO 129 -11.154 -5.212 -4.710 963 HB3 PRO 129 2HB PRO 129 -10.836 -6.687 -5.688 964 HG2 PRO 129 1HG PRO 129 -12.730 -6.331 -3.376 965 HG3 PRO 129 2HG PRO 129 -13.022 -7.186 -4.925 966 HD2 PRO 129 1HD PRO 129 -12.329 -8.410 -2.556 967 HD3 PRO 129 2HD PRO 129 -11.929 -9.082 -4.160 968 H ILE 130 H ILE 130 -7.827 -5.346 -3.078 969 HA ILE 130 HA ILE 130 -9.305 -3.640 -1.224 970 HB ILE 130 HB ILE 130 -6.522 -4.365 -0.395 971 HG12 ILE 130 1HG1 ILE 130 -8.825 -6.277 -0.006 972 HG13 ILE 130 2HG1 ILE 130 -7.165 -6.530 -0.484 973 HG21 ILE 130 1HG2 ILE 130 -8.971 -3.741 1.293 974 HG22 ILE 130 2HG2 ILE 130 -7.258 -3.669 1.755 975 HG23 ILE 130 3HG2 ILE 130 -7.910 -2.512 0.598 976 HD11 ILE 130 3HD1 ILE 130 -6.512 -5.970 1.958 977 HD12 ILE 130 1HD1 ILE 130 -8.257 -5.899 2.306 978 HD13 ILE 130 2HD1 ILE 130 -7.524 -7.416 1.788 979 H SER 131 H SER 131 -8.588 -1.572 -1.491 980 HA SER 131 HA SER 131 -6.096 -0.831 -2.465 981 HB2 SER 131 1HB SER 131 -7.093 0.319 -4.711 982 HB3 SER 131 2HB SER 131 -6.161 -1.160 -4.634 983 HG SER 131 HG SER 131 -8.877 -0.773 -5.069 984 H LEU 132 H LEU 132 -5.896 1.585 -2.963 985 HA LEU 132 HA LEU 132 -8.011 3.331 -2.057 986 HB2 LEU 132 1HB LEU 132 -6.649 4.323 -0.214 987 HB3 LEU 132 2HB LEU 132 -7.302 2.728 0.096 988 HG LEU 132 HG LEU 132 -4.919 1.838 -0.601 989 HD11 LEU 132 1HD1 LEU 132 -4.343 4.791 -0.220 990 HD12 LEU 132 2HD1 LEU 132 -3.756 3.695 -1.462 991 HD13 LEU 132 3HD1 LEU 132 -3.137 3.543 0.184 992 HD21 LEU 132 3HD2 LEU 132 -5.920 1.661 1.575 993 HD22 LEU 132 1HD2 LEU 132 -5.415 3.305 2.001 994 HD23 LEU 132 2HD2 LEU 132 -4.196 2.036 1.717 995 H GLY 133 H GLY 133 -7.228 5.682 -2.310 996 HA2 GLY 133 2HA GLY 133 -5.051 5.879 -4.349 997 HA3 GLY 133 1HA GLY 133 -6.646 6.576 -4.594 998 H TYR 134 H TYR 134 -3.591 7.036 -3.249 999 HA TYR 134 HA TYR 134 -4.390 9.059 -1.250 1000 HB2 TYR 134 1HB TYR 134 -2.108 8.875 -0.404 1001 HB3 TYR 134 2HB TYR 134 -2.807 7.297 -0.577 1002 HD1 TYR 134 1HD TYR 134 -1.925 5.659 -2.169 1003 HD2 TYR 134 2HD TYR 134 -0.256 9.625 -1.852 1004 HE1 TYR 134 1HE TYR 134 0.212 4.854 -3.159 1005 HE2 TYR 134 2HE TYR 134 1.869 8.830 -2.826 1006 HH TYR 134 HH TYR 134 3.117 6.900 -3.459 1007 H ASP 135 H ASP 135 -3.098 11.073 -1.204 1008 HA ASP 135 HA ASP 135 -1.995 11.885 -3.795 1009 HB2 ASP 135 1HB ASP 135 -3.731 13.789 -2.245 1010 HB3 ASP 135 2HB ASP 135 -2.747 14.174 -3.627 1011 H VAL 136 H VAL 136 -0.760 14.020 -3.373 1012 HA VAL 136 HA VAL 136 0.835 13.753 -0.896 1013 HB VAL 136 HB VAL 136 1.390 14.965 -3.630 1014 HG11 VAL 136 1HG1 VAL 136 2.707 16.321 -2.244 1015 HG12 VAL 136 2HG1 VAL 136 3.064 14.990 -1.127 1016 HG13 VAL 136 3HG1 VAL 136 3.814 15.043 -2.735 1017 HG21 VAL 136 3HG2 VAL 136 2.442 12.459 -2.250 1018 HG22 VAL 136 1HG2 VAL 136 1.459 12.525 -3.716 1019 HG23 VAL 136 2HG2 VAL 136 3.115 13.121 -3.745 1020 H GLN 137 H GLN 137 1.652 16.123 -0.209 1021 HA GLN 137 HA GLN 137 -0.213 18.255 -0.645 1022 HB2 GLN 137 1HB GLN 137 -0.642 18.628 1.726 1023 HB3 GLN 137 2HB GLN 137 -1.367 17.110 1.234 1024 HG2 GLN 137 1HG GLN 137 1.418 17.034 2.449 1025 HG3 GLN 137 2HG GLN 137 0.064 17.429 3.477 1026 HE21 GLN 137 1HE2 GLN 137 0.378 15.533 4.742 1027 HE22 GLN 137 2HE2 GLN 137 -0.019 13.946 4.121 1028 H PHE 138 H PHE 138 0.717 20.102 1.012 1029 HA PHE 138 HA PHE 138 3.533 19.818 1.630 1030 HB2 PHE 138 1HB PHE 138 2.401 21.937 -0.234 1031 HB3 PHE 138 2HB PHE 138 3.928 22.112 0.618 1032 HD1 PHE 138 2HD PHE 138 5.904 20.761 0.059 1033 HD2 PHE 138 1HD PHE 138 2.236 20.421 -2.187 1034 HE1 PHE 138 2HE PHE 138 7.152 19.765 -1.821 1035 HE2 PHE 138 1HE PHE 138 3.491 19.411 -4.077 1036 HZ PHE 138 HZ PHE 138 5.987 19.123 -3.905 1037 H TYR 139 H TYR 139 4.112 21.702 3.016 1038 HA TYR 139 HA TYR 139 1.889 23.042 4.444 1039 HB2 TYR 139 1HB TYR 139 3.282 22.410 6.548 1040 HB3 TYR 139 2HB TYR 139 2.173 21.246 5.862 1041 HD1 TYR 139 1HD TYR 139 5.829 22.243 5.778 1042 HD2 TYR 139 2HD TYR 139 2.922 19.058 5.403 1043 HE1 TYR 139 1HE TYR 139 7.638 20.609 5.746 1044 HE2 TYR 139 2HE TYR 139 4.751 17.395 5.431 1045 HH TYR 139 HH TYR 139 8.131 18.376 5.990 1046 HA PRO 140 HA PRO 140 5.030 26.324 4.510 1047 HB2 PRO 140 1HB PRO 140 4.701 27.490 6.970 1048 HB3 PRO 140 2HB PRO 140 3.583 27.749 5.606 1049 HG2 PRO 140 1HG PRO 140 3.272 25.844 7.928 1050 HG3 PRO 140 2HG PRO 140 2.045 26.943 7.212 1051 HD2 PRO 140 1HD PRO 140 2.163 24.287 6.606 1052 HD3 PRO 140 2HD PRO 140 1.674 25.517 5.398 1053 H GLU 141 H GLU 141 7.105 26.417 5.119 1054 HA GLU 141 HA GLU 141 9.047 25.481 5.358 1055 HB2 GLU 141 1HB GLU 141 9.958 25.034 7.552 1056 HB3 GLU 141 2HB GLU 141 9.217 26.602 7.352 1057 HG2 GLU 141 1HG GLU 141 7.323 26.003 8.725 1058 HG3 GLU 141 2HG GLU 141 7.834 24.307 8.807 Start of MODEL 6 1 H1 GLY 1 H GLY 1 16.173 9.832 -9.393 2 HA2 GLY 1 2HA GLY 1 15.906 11.870 -8.082 3 HA3 GLY 1 1HA GLY 1 14.333 11.131 -8.429 4 H MET 2 H MET 2 14.920 12.917 -6.271 5 HA MET 2 HA MET 2 14.467 11.177 -3.905 6 HB2 MET 2 1HB MET 2 15.855 12.755 -2.591 7 HB3 MET 2 2HB MET 2 16.740 11.792 -3.764 8 HG2 MET 2 1HG MET 2 16.773 13.724 -5.327 9 HG3 MET 2 2HG MET 2 15.984 14.718 -4.101 10 HE1 MET 2 3HE MET 2 17.339 14.242 -1.394 11 HE2 MET 2 1HE MET 2 18.763 15.300 -1.468 12 HE3 MET 2 2HE MET 2 17.208 15.857 -2.121 13 H SER 3 H SER 3 12.263 11.790 -5.041 14 HA SER 3 HA SER 3 11.117 13.515 -3.008 15 HB2 SER 3 1HB SER 3 9.782 14.824 -4.792 16 HB3 SER 3 2HB SER 3 11.498 15.239 -4.638 17 HG SER 3 HG SER 3 11.094 15.017 -6.790 18 H GLN 4 H GLN 4 9.625 12.387 -6.104 19 HA GLN 4 HA GLN 4 7.359 11.351 -4.776 20 HB2 GLN 4 1HB GLN 4 7.632 11.892 -7.228 21 HB3 GLN 4 2HB GLN 4 8.517 10.381 -7.444 22 HG2 GLN 4 1HG GLN 4 5.684 10.487 -6.302 23 HG3 GLN 4 2HG GLN 4 5.990 10.506 -8.030 24 HE21 GLN 4 1HE2 GLN 4 4.681 8.419 -6.163 25 HE22 GLN 4 2HE2 GLN 4 5.407 6.939 -6.788 26 H ASP 5 H ASP 5 10.448 9.836 -5.397 27 HA ASP 5 HA ASP 5 9.807 7.110 -4.806 28 HB2 ASP 5 1HB ASP 5 12.335 8.774 -4.787 29 HB3 ASP 5 2HB ASP 5 12.340 7.089 -4.303 30 H LEU 6 H LEU 6 11.457 9.637 -2.904 31 HA LEU 6 HA LEU 6 11.689 8.131 -0.456 32 HB2 LEU 6 1HB LEU 6 12.729 9.991 0.394 33 HB3 LEU 6 2HB LEU 6 13.034 10.149 -1.327 34 HG LEU 6 HG LEU 6 10.905 11.647 -1.279 35 HD11 LEU 6 1HD1 LEU 6 10.007 12.182 0.759 36 HD12 LEU 6 2HD1 LEU 6 11.615 11.964 1.548 37 HD13 LEU 6 3HD1 LEU 6 10.713 10.586 1.205 38 HD21 LEU 6 3HD2 LEU 6 12.084 13.630 -0.725 39 HD22 LEU 6 1HD2 LEU 6 13.256 12.529 -1.462 40 HD23 LEU 6 2HD2 LEU 6 13.260 12.739 0.274 41 H ILE 7 H ILE 7 9.213 10.496 -1.545 42 HA ILE 7 HA ILE 7 7.375 10.260 0.443 43 HB ILE 7 HB ILE 7 7.093 10.514 -2.505 44 HG12 ILE 7 1HG1 ILE 7 6.210 12.467 -0.418 45 HG13 ILE 7 2HG1 ILE 7 7.937 12.310 -0.686 46 HG21 ILE 7 1HG2 ILE 7 4.772 10.543 -0.556 47 HG22 ILE 7 2HG2 ILE 7 4.705 11.067 -2.273 48 HG23 ILE 7 3HG2 ILE 7 4.999 9.377 -1.872 49 HD11 ILE 7 3HD1 ILE 7 6.245 13.977 -2.076 50 HD12 ILE 7 1HD1 ILE 7 7.841 13.462 -2.615 51 HD13 ILE 7 2HD1 ILE 7 6.386 12.607 -3.187 52 H ARG 8 H ARG 8 7.411 7.732 -2.311 53 HA ARG 8 HA ARG 8 5.435 6.212 -0.970 54 HB2 ARG 8 1HB ARG 8 6.311 4.337 -2.349 55 HB3 ARG 8 2HB ARG 8 5.541 5.695 -3.190 56 HG2 ARG 8 1HG ARG 8 7.819 6.482 -3.725 57 HG3 ARG 8 2HG ARG 8 8.494 4.991 -3.006 58 HD2 ARG 8 1HD ARG 8 7.154 3.654 -4.627 59 HD3 ARG 8 2HD ARG 8 6.592 5.158 -5.390 60 HE ARG 8 HE ARG 8 9.424 5.193 -5.300 61 HH11 ARG 8 1HH1 ARG 8 6.983 3.143 -6.832 62 HH12 ARG 8 2HH1 ARG 8 7.934 2.787 -8.226 63 HH21 ARG 8 1HH2 ARG 8 10.665 4.870 -7.160 64 HH22 ARG 8 2HH2 ARG 8 10.162 3.662 -8.310 65 H ALA 9 H ALA 9 8.950 6.323 -0.577 66 HA ALA 9 HA ALA 9 9.259 3.809 0.631 67 HB1 ALA 9 1HB ALA 9 10.993 5.343 -0.281 68 HB2 ALA 9 2HB ALA 9 10.854 6.328 1.198 69 HB3 ALA 9 3HB ALA 9 11.392 4.653 1.301 70 H ALA 10 H ALA 10 7.787 6.713 2.026 71 HA ALA 10 HA ALA 10 8.021 5.734 4.783 72 HB1 ALA 10 1HB ALA 10 6.208 7.860 3.594 73 HB2 ALA 10 2HB ALA 10 6.372 7.496 5.325 74 HB3 ALA 10 3HB ALA 10 7.770 8.097 4.436 75 H PHE 11 H PHE 11 5.897 4.949 2.099 76 HA PHE 11 HA PHE 11 3.690 3.924 3.745 77 HB2 PHE 11 1HB PHE 11 4.529 3.342 0.887 78 HB3 PHE 11 2HB PHE 11 3.138 2.665 1.690 79 HD1 PHE 11 2HD PHE 11 4.358 6.289 1.338 80 HD2 PHE 11 1HD PHE 11 1.316 3.335 0.488 81 HE1 PHE 11 2HE PHE 11 3.015 7.983 0.267 82 HE2 PHE 11 1HE PHE 11 -0.050 5.083 -0.617 83 HZ PHE 11 HZ PHE 11 0.776 7.441 -0.699 84 H GLU 12 H GLU 12 6.622 2.676 1.987 85 HA GLU 12 HA GLU 12 6.421 0.016 2.815 86 HB2 GLU 12 1HB GLU 12 7.932 0.745 1.036 87 HB3 GLU 12 2HB GLU 12 8.877 1.708 2.186 88 HG2 GLU 12 1HG GLU 12 9.415 -0.322 3.490 89 HG3 GLU 12 2HG GLU 12 8.576 -1.336 2.281 90 H LYS 13 H LYS 13 7.668 2.877 4.596 91 HA LYS 13 HA LYS 13 9.059 1.495 6.646 92 HB2 LYS 13 1HB LYS 13 9.100 3.953 6.069 93 HB3 LYS 13 2HB LYS 13 7.514 4.137 6.793 94 HG2 LYS 13 1HG LYS 13 9.961 3.147 8.280 95 HG3 LYS 13 2HG LYS 13 9.491 4.839 8.164 96 HD2 LYS 13 1HD LYS 13 7.184 3.951 9.158 97 HD3 LYS 13 2HD LYS 13 8.206 2.647 9.787 98 HE2 LYS 13 1HE LYS 13 8.793 5.613 10.114 99 HE3 LYS 13 2HE LYS 13 7.877 4.690 11.308 100 HZ1 LYS 13 3HZ LYS 13 10.372 4.999 11.636 101 HZ2 LYS 13 1HZ LYS 13 10.561 3.795 10.523 102 HZ3 LYS 13 2HZ LYS 13 9.752 3.486 11.896 103 H ARG 14 H ARG 14 5.664 2.351 6.141 104 HA ARG 14 HA ARG 14 4.910 1.445 8.741 105 HB2 ARG 14 1HB ARG 14 3.677 3.196 7.533 106 HB3 ARG 14 2HB ARG 14 3.186 2.045 6.293 107 HG2 ARG 14 1HG ARG 14 1.287 2.171 7.543 108 HG3 ARG 14 2HG ARG 14 2.032 0.771 8.303 109 HD2 ARG 14 1HD ARG 14 2.310 3.649 9.291 110 HD3 ARG 14 2HD ARG 14 1.032 2.558 9.829 111 HE ARG 14 HE ARG 14 3.110 1.051 10.474 112 HH11 ARG 14 1HH1 ARG 14 2.711 4.587 11.032 113 HH12 ARG 14 2HH1 ARG 14 3.276 4.468 12.661 114 HH21 ARG 14 1HH2 ARG 14 3.924 1.025 12.644 115 HH22 ARG 14 2HH2 ARG 14 4.112 2.533 13.491 116 H LEU 15 H LEU 15 4.389 0.147 5.425 117 HA LEU 15 HA LEU 15 2.994 -2.151 6.359 118 HB2 LEU 15 1HB LEU 15 2.706 -1.243 4.091 119 HB3 LEU 15 2HB LEU 15 4.378 -1.652 3.697 120 HG LEU 15 HG LEU 15 3.868 -4.059 3.911 121 HD11 LEU 15 1HD1 LEU 15 1.002 -3.174 4.464 122 HD12 LEU 15 2HD1 LEU 15 2.069 -4.012 5.605 123 HD13 LEU 15 3HD1 LEU 15 1.525 -4.840 4.155 124 HD21 LEU 15 3HD2 LEU 15 2.352 -4.303 1.966 125 HD22 LEU 15 1HD2 LEU 15 3.549 -3.042 1.684 126 HD23 LEU 15 2HD2 LEU 15 1.884 -2.598 2.120 127 H SER 16 H SER 16 6.458 -1.644 5.617 128 HA SER 16 HA SER 16 7.233 -4.377 5.707 129 HB2 SER 16 1HB SER 16 8.458 -2.362 4.701 130 HB3 SER 16 2HB SER 16 8.971 -1.966 6.353 131 HG SER 16 HG SER 16 10.516 -3.160 5.323 132 H ASP 17 H ASP 17 7.509 -1.755 8.138 133 HA ASP 17 HA ASP 17 8.458 -3.327 10.269 134 HB2 ASP 17 1HB ASP 17 6.984 -0.696 10.165 135 HB3 ASP 17 2HB ASP 17 7.008 -1.534 11.685 136 H TRP 18 H TRP 18 5.070 -2.805 9.207 137 HA TRP 18 HA TRP 18 3.937 -4.318 11.406 138 HB2 TRP 18 1HB TRP 18 2.526 -2.835 10.114 139 HB3 TRP 18 2HB TRP 18 2.949 -3.629 8.604 140 HD1 TRP 18 HD TRP 18 0.712 -4.043 11.667 141 HE1 TRP 18 1HE TRP 18 -1.091 -5.780 11.222 142 HE3 TRP 18 3HE TRP 18 2.366 -5.740 7.133 143 HZ2 TRP 18 2HZ TRP 18 -1.743 -7.658 9.165 144 HZ3 TRP 18 3HZ TRP 18 1.098 -7.502 5.927 145 HH2 TRP 18 HH TRP 18 -1.012 -8.420 6.943 146 H ALA 19 H ALA 19 4.790 -5.201 7.997 147 HA ALA 19 HA ALA 19 3.665 -7.733 8.154 148 HB1 ALA 19 1HB ALA 19 6.014 -6.879 6.412 149 HB2 ALA 19 2HB ALA 19 4.937 -8.258 6.144 150 HB3 ALA 19 3HB ALA 19 4.286 -6.629 6.028 151 H LYS 20 H LYS 20 7.054 -6.811 8.673 152 HA LYS 20 HA LYS 20 8.028 -9.407 9.354 153 HB2 LYS 20 1HB LYS 20 10.043 -8.199 10.015 154 HB3 LYS 20 2HB LYS 20 9.395 -7.548 8.520 155 HG2 LYS 20 1HG LYS 20 9.538 -5.507 9.449 156 HG3 LYS 20 2HG LYS 20 8.144 -5.939 10.400 157 HD2 LYS 20 1HD LYS 20 9.506 -5.190 12.049 158 HD3 LYS 20 2HD LYS 20 9.947 -6.911 12.109 159 HE2 LYS 20 1HE LYS 20 11.908 -6.462 10.661 160 HE3 LYS 20 2HE LYS 20 11.351 -4.804 10.405 161 HZ1 LYS 20 3HZ LYS 20 12.995 -4.638 11.955 162 HZ2 LYS 20 1HZ LYS 20 12.500 -5.924 12.858 163 HZ3 LYS 20 2HZ LYS 20 11.648 -4.483 12.848 164 H ALA 21 H ALA 21 6.126 -7.201 11.237 165 HA ALA 21 HA ALA 21 7.114 -8.306 13.817 166 HB1 ALA 21 1HB ALA 21 7.210 -5.852 13.536 167 HB2 ALA 21 2HB ALA 21 5.450 -5.826 13.216 168 HB3 ALA 21 3HB ALA 21 6.059 -6.325 14.801 169 H ARG 22 H ARG 22 4.360 -8.360 11.656 170 HA ARG 22 HA ARG 22 2.320 -9.080 13.480 171 HB2 ARG 22 1HB ARG 22 2.497 -8.807 10.741 172 HB3 ARG 22 2HB ARG 22 2.573 -10.589 10.933 173 HG2 ARG 22 1HG ARG 22 0.474 -10.316 12.392 174 HG3 ARG 22 2HG ARG 22 0.352 -8.688 11.685 175 HD2 ARG 22 1HD ARG 22 0.015 -9.581 9.485 176 HD3 ARG 22 2HD ARG 22 0.643 -11.164 9.923 177 HE ARG 22 HE ARG 22 -1.722 -10.084 11.324 178 HH11 ARG 22 1HH1 ARG 22 -0.988 -12.244 8.586 179 HH12 ARG 22 2HH1 ARG 22 -2.358 -13.283 8.944 180 HH21 ARG 22 1HH2 ARG 22 -3.368 -11.479 11.762 181 HH22 ARG 22 2HH2 ARG 22 -3.752 -12.814 10.724 182 H THR 23 H THR 23 1.589 -11.224 13.935 183 HA THR 23 HA THR 23 3.673 -12.882 14.909 184 HB THR 23 HB THR 23 0.666 -13.250 14.779 185 HG1 THR 23 1HG THR 23 0.810 -12.500 16.821 186 HG21 THR 23 3HG2 THR 23 1.657 -15.453 14.787 187 HG22 THR 23 1HG2 THR 23 1.132 -15.098 16.452 188 HG23 THR 23 2HG2 THR 23 2.849 -14.982 15.997 189 HA PRO 24 HA PRO 24 2.779 -16.172 11.616 190 HB2 PRO 24 1HB PRO 24 1.495 -15.301 9.260 191 HB3 PRO 24 2HB PRO 24 0.806 -16.322 10.547 192 HG2 PRO 24 1HG PRO 24 0.574 -13.373 10.086 193 HG3 PRO 24 2HG PRO 24 -0.681 -14.503 10.703 194 HD2 PRO 24 1HD PRO 24 0.658 -12.809 12.336 195 HD3 PRO 24 2HD PRO 24 0.231 -14.464 12.864 196 H ALA 25 H ALA 25 3.714 -13.070 11.150 197 HA ALA 25 HA ALA 25 4.855 -11.746 9.639 198 HB1 ALA 25 1HB ALA 25 6.648 -14.159 9.870 199 HB2 ALA 25 2HB ALA 25 7.159 -12.535 9.341 200 HB3 ALA 25 3HB ALA 25 6.535 -12.776 10.992 201 H LEU 26 H LEU 26 4.461 -11.107 7.583 202 HA LEU 26 HA LEU 26 4.092 -13.233 5.522 203 HB2 LEU 26 1HB LEU 26 2.824 -10.498 5.795 204 HB3 LEU 26 2HB LEU 26 2.500 -11.633 4.502 205 HG LEU 26 HG LEU 26 1.946 -12.299 7.451 206 HD11 LEU 26 1HD1 LEU 26 -0.453 -11.795 6.795 207 HD12 LEU 26 2HD1 LEU 26 0.219 -11.021 5.336 208 HD13 LEU 26 3HD1 LEU 26 0.619 -10.388 6.930 209 HD21 LEU 26 3HD2 LEU 26 2.133 -14.277 6.053 210 HD22 LEU 26 1HD2 LEU 26 1.047 -13.579 4.844 211 HD23 LEU 26 2HD2 LEU 26 0.443 -14.010 6.467 212 HA PRO 27 HA PRO 27 7.207 -10.945 3.181 213 HB2 PRO 27 1HB PRO 27 7.028 -12.184 0.750 214 HB3 PRO 27 2HB PRO 27 7.722 -12.987 2.181 215 HG2 PRO 27 1HG PRO 27 4.913 -13.208 1.091 216 HG3 PRO 27 2HG PRO 27 6.003 -14.535 1.605 217 HD2 PRO 27 1HD PRO 27 4.028 -13.512 3.223 218 HD3 PRO 27 2HD PRO 27 5.596 -14.082 3.884 219 H VAL 28 H VAL 28 7.351 -9.419 1.446 220 HA VAL 28 HA VAL 28 4.769 -8.318 0.492 221 HB VAL 28 HB VAL 28 5.230 -7.387 2.650 222 HG11 VAL 28 1HG1 VAL 28 7.951 -6.427 1.722 223 HG12 VAL 28 2HG1 VAL 28 7.138 -6.030 3.250 224 HG13 VAL 28 3HG1 VAL 28 7.623 -7.688 2.929 225 HG21 VAL 28 3HG2 VAL 28 5.204 -5.026 2.176 226 HG22 VAL 28 1HG2 VAL 28 5.826 -5.332 0.544 227 HG23 VAL 28 2HG2 VAL 28 4.213 -5.924 1.015 228 H ALA 29 H ALA 29 5.118 -8.888 -1.635 229 HA ALA 29 HA ALA 29 7.743 -8.526 -2.875 230 HB1 ALA 29 1HB ALA 29 6.653 -9.499 -4.854 231 HB2 ALA 29 2HB ALA 29 6.383 -10.501 -3.414 232 HB3 ALA 29 3HB ALA 29 5.079 -9.458 -4.038 233 H TRP 30 H TRP 30 7.920 -6.202 -2.590 234 HA TRP 30 HA TRP 30 6.137 -4.278 -3.723 235 HB2 TRP 30 1HB TRP 30 9.132 -4.091 -3.292 236 HB3 TRP 30 2HB TRP 30 8.062 -2.745 -3.581 237 HD1 TRP 30 HD TRP 30 9.306 -4.910 -0.791 238 HE1 TRP 30 1HE TRP 30 8.249 -4.208 1.422 239 HE3 TRP 30 3HE TRP 30 5.690 -1.630 -2.571 240 HZ2 TRP 30 2HZ TRP 30 6.266 -2.320 2.336 241 HZ3 TRP 30 3HZ TRP 30 4.288 -0.475 -1.008 242 HH2 TRP 30 HH TRP 30 4.550 -0.714 1.441 243 H GLN 31 H GLN 31 7.028 -2.684 -5.471 244 HA GLN 31 HA GLN 31 7.201 -4.019 -8.004 245 HB2 GLN 31 1HB GLN 31 7.684 -1.164 -7.075 246 HB3 GLN 31 2HB GLN 31 7.702 -1.654 -8.776 247 HG2 GLN 31 1HG GLN 31 5.456 -2.056 -8.877 248 HG3 GLN 31 2HG GLN 31 5.313 -2.464 -7.168 249 HE21 GLN 31 1HE2 GLN 31 5.127 0.231 -9.497 250 HE22 GLN 31 2HE2 GLN 31 4.560 1.350 -8.291 251 H ASN 32 H ASN 32 8.899 -4.132 -9.368 252 HA ASN 32 HA ASN 32 10.916 -4.654 -10.075 253 HB2 ASN 32 1HB ASN 32 11.979 -2.279 -8.593 254 HB3 ASN 32 2HB ASN 32 12.590 -3.025 -10.067 255 HD21 ASN 32 1HD2 ASN 32 10.151 -0.922 -8.711 256 HD22 ASN 32 2HD2 ASN 32 9.424 -0.474 -10.239 257 H THR 33 H THR 33 10.208 -5.639 -7.155 258 HA THR 33 HA THR 33 12.732 -5.719 -5.781 259 HB THR 33 HB THR 33 10.365 -5.576 -4.786 260 HG1 THR 33 1HG THR 33 12.159 -5.966 -3.440 261 HG21 THR 33 3HG2 THR 33 10.512 -8.618 -4.997 262 HG22 THR 33 1HG2 THR 33 9.480 -7.637 -6.049 263 HG23 THR 33 2HG2 THR 33 9.221 -7.645 -4.290 264 H LYS 34 H LYS 34 12.927 -8.092 -4.647 265 HA LYS 34 HA LYS 34 13.270 -10.197 -6.645 266 HB2 LYS 34 1HB LYS 34 15.353 -10.872 -5.575 267 HB3 LYS 34 2HB LYS 34 15.398 -9.341 -6.475 268 HG2 LYS 34 1HG LYS 34 14.690 -8.750 -3.797 269 HG3 LYS 34 2HG LYS 34 16.071 -9.834 -3.704 270 HD2 LYS 34 1HD LYS 34 16.935 -7.621 -3.658 271 HD3 LYS 34 2HD LYS 34 17.282 -8.236 -5.282 272 HE2 LYS 34 1HE LYS 34 15.208 -7.051 -6.096 273 HE3 LYS 34 2HE LYS 34 14.991 -6.381 -4.466 274 HZ1 LYS 34 3HZ LYS 34 17.331 -5.907 -6.228 275 HZ2 LYS 34 1HZ LYS 34 17.158 -5.275 -4.731 276 HZ3 LYS 34 2HZ LYS 34 16.130 -4.841 -5.951 277 H PHE 35 H PHE 35 11.874 -11.897 -6.025 278 HA PHE 35 HA PHE 35 11.425 -12.340 -3.190 279 HB2 PHE 35 1HB PHE 35 9.109 -11.895 -3.314 280 HB3 PHE 35 2HB PHE 35 9.884 -10.473 -3.937 281 HD1 PHE 35 2HD PHE 35 10.031 -10.269 -6.597 282 HD2 PHE 35 1HD PHE 35 7.388 -12.970 -4.510 283 HE1 PHE 35 2HE PHE 35 8.648 -10.502 -8.625 284 HE2 PHE 35 1HE PHE 35 6.024 -13.215 -6.569 285 HZ PHE 35 HZ PHE 35 6.660 -11.992 -8.634 286 H THR 36 H THR 36 9.718 -14.016 -2.907 287 HA THR 36 HA THR 36 8.656 -15.829 -3.157 288 HB THR 36 HB THR 36 8.487 -14.943 -5.724 289 HG1 THR 36 1HG THR 36 6.734 -15.664 -4.675 290 HG21 THR 36 3HG2 THR 36 8.619 -16.797 -7.241 291 HG22 THR 36 1HG2 THR 36 9.255 -17.870 -5.979 292 HG23 THR 36 2HG2 THR 36 10.221 -16.492 -6.560 293 HA PRO 37 HA PRO 37 8.157 -18.481 -3.899 294 HB2 PRO 37 1HB PRO 37 8.074 -20.416 -1.967 295 HB3 PRO 37 2HB PRO 37 8.868 -20.638 -3.554 296 HG2 PRO 37 1HG PRO 37 10.134 -19.879 -0.910 297 HG3 PRO 37 2HG PRO 37 10.668 -21.139 -2.072 298 HD2 PRO 37 1HD PRO 37 11.762 -18.636 -2.023 299 HD3 PRO 37 2HD PRO 37 11.528 -19.515 -3.562 300 HA PRO 38 HA PRO 38 6.135 -16.104 -0.769 301 HB2 PRO 38 1HB PRO 38 3.763 -17.471 -0.332 302 HB3 PRO 38 2HB PRO 38 4.112 -16.459 -1.779 303 HG2 PRO 38 1HG PRO 38 4.275 -19.446 -1.469 304 HG3 PRO 38 2HG PRO 38 3.609 -18.514 -2.842 305 HD2 PRO 38 1HD PRO 38 6.112 -19.603 -2.860 306 HD3 PRO 38 2HD PRO 38 5.759 -18.048 -3.661 307 H ALA 39 H ALA 39 4.659 -16.546 1.369 308 HA ALA 39 HA ALA 39 6.158 -18.263 3.190 309 HB1 ALA 39 1HB ALA 39 4.475 -17.362 4.851 310 HB2 ALA 39 2HB ALA 39 5.601 -16.165 4.197 311 HB3 ALA 39 3HB ALA 39 3.916 -16.241 3.598 312 H ALA 40 H ALA 40 5.619 -19.900 1.716 313 HA ALA 40 HA ALA 40 4.615 -21.925 1.309 314 HB1 ALA 40 1HB ALA 40 5.044 -21.995 3.770 315 HB2 ALA 40 2HB ALA 40 3.340 -21.550 4.034 316 HB3 ALA 40 3HB ALA 40 3.768 -23.067 3.220 317 H GLY 41 H GLY 41 3.349 -19.899 0.008 318 HA2 GLY 41 2HA GLY 41 1.526 -20.103 -1.478 319 HA3 GLY 41 1HA GLY 41 0.543 -20.863 -0.227 320 H VAL 42 H VAL 42 1.995 -18.288 1.273 321 HA VAL 42 HA VAL 42 -0.245 -16.426 0.651 322 HB VAL 42 HB VAL 42 1.237 -16.795 3.294 323 HG11 VAL 42 1HG1 VAL 42 -1.431 -15.465 2.633 324 HG12 VAL 42 2HG1 VAL 42 -0.679 -15.598 4.251 325 HG13 VAL 42 3HG1 VAL 42 0.096 -14.637 2.995 326 HG21 VAL 42 3HG2 VAL 42 -1.458 -17.986 2.525 327 HG22 VAL 42 1HG2 VAL 42 0.029 -18.913 2.830 328 HG23 VAL 42 2HG2 VAL 42 -0.715 -18.026 4.144 329 H TYR 43 H TYR 43 0.349 -14.402 -0.087 330 HA TYR 43 HA TYR 43 2.630 -13.042 1.062 331 HB2 TYR 43 1HB TYR 43 3.858 -12.635 -1.015 332 HB3 TYR 43 2HB TYR 43 3.820 -14.348 -0.701 333 HD1 TYR 43 2HD TYR 43 1.851 -15.721 -1.927 334 HD2 TYR 43 1HD TYR 43 3.291 -11.830 -3.161 335 HE1 TYR 43 2HE TYR 43 1.035 -16.141 -4.221 336 HE2 TYR 43 1HE TYR 43 2.532 -12.287 -5.476 337 HH TYR 43 HH TYR 43 0.563 -14.870 -6.452 338 H LEU 44 H LEU 44 2.855 -10.791 0.264 339 HA LEU 44 HA LEU 44 0.292 -9.730 -0.820 340 HB2 LEU 44 1HB LEU 44 2.503 -8.437 0.824 341 HB3 LEU 44 2HB LEU 44 1.206 -7.530 0.052 342 HG LEU 44 HG LEU 44 0.850 -9.676 2.177 343 HD11 LEU 44 1HD1 LEU 44 0.476 -6.669 2.334 344 HD12 LEU 44 2HD1 LEU 44 1.808 -7.631 3.044 345 HD13 LEU 44 3HD1 LEU 44 0.153 -7.855 3.628 346 HD21 LEU 44 3HD2 LEU 44 -1.584 -8.541 2.098 347 HD22 LEU 44 1HD2 LEU 44 -1.139 -9.878 0.991 348 HD23 LEU 44 2HD2 LEU 44 -1.136 -8.206 0.450 349 H ARG 45 H ARG 45 0.290 -8.338 -2.514 350 HA ARG 45 HA ARG 45 2.789 -8.056 -4.143 351 HB2 ARG 45 1HB ARG 45 0.932 -9.658 -4.912 352 HB3 ARG 45 2HB ARG 45 -0.083 -8.267 -5.164 353 HG2 ARG 45 1HG ARG 45 1.742 -7.383 -6.732 354 HG3 ARG 45 2HG ARG 45 2.547 -8.948 -6.566 355 HD2 ARG 45 1HD ARG 45 0.649 -10.109 -7.540 356 HD3 ARG 45 2HD ARG 45 -0.350 -8.648 -7.475 357 HE ARG 45 HE ARG 45 2.126 -8.658 -9.115 358 HH11 ARG 45 1HH1 ARG 45 -1.382 -9.213 -9.349 359 HH12 ARG 45 2HH1 ARG 45 -1.539 -8.307 -10.813 360 HH21 ARG 45 1HH2 ARG 45 1.866 -7.494 -11.172 361 HH22 ARG 45 2HH2 ARG 45 0.285 -7.484 -11.869 362 H ALA 46 H ALA 46 2.828 -6.098 -2.537 363 HA ALA 46 HA ALA 46 0.816 -4.067 -2.958 364 HB1 ALA 46 1HB ALA 46 2.365 -4.553 -0.845 365 HB2 ALA 46 2HB ALA 46 3.437 -3.382 -1.670 366 HB3 ALA 46 3HB ALA 46 1.773 -2.953 -1.230 367 H TYR 47 H TYR 47 0.767 -2.695 -4.651 368 HA TYR 47 HA TYR 47 3.168 -2.081 -6.243 369 HB2 TYR 47 1HB TYR 47 1.379 -3.950 -7.015 370 HB3 TYR 47 2HB TYR 47 0.504 -2.558 -7.568 371 HD1 TYR 47 2HD TYR 47 1.917 -0.805 -8.959 372 HD2 TYR 47 1HD TYR 47 3.000 -4.919 -8.428 373 HE1 TYR 47 2HE TYR 47 3.241 -0.706 -11.053 374 HE2 TYR 47 1HE TYR 47 4.394 -4.841 -10.478 375 HH TYR 47 HH TYR 47 5.285 -3.430 -12.170 376 H VAL 48 H VAL 48 3.398 0.045 -5.988 377 HA VAL 48 HA VAL 48 1.157 1.919 -5.576 378 HB VAL 48 HB VAL 48 4.181 2.233 -5.688 379 HG11 VAL 48 1HG1 VAL 48 2.020 4.230 -4.813 380 HG12 VAL 48 2HG1 VAL 48 3.774 4.526 -4.797 381 HG13 VAL 48 3HG1 VAL 48 2.911 4.358 -6.333 382 HG21 VAL 48 3HG2 VAL 48 4.064 2.645 -3.303 383 HG22 VAL 48 1HG2 VAL 48 2.318 2.338 -3.304 384 HG23 VAL 48 2HG2 VAL 48 3.479 1.026 -3.690 385 H MET 49 H MET 49 0.081 1.749 -7.495 386 HA MET 49 HA MET 49 1.267 1.930 -10.118 387 HB2 MET 49 1HB MET 49 -1.434 1.720 -8.984 388 HB3 MET 49 2HB MET 49 -1.387 2.942 -10.247 389 HG2 MET 49 1HG MET 49 -1.924 0.950 -11.356 390 HG3 MET 49 2HG MET 49 -0.242 1.256 -11.726 391 HE1 MET 49 3HE MET 49 -1.842 -2.198 -9.166 392 HE2 MET 49 1HE MET 49 -2.134 -0.508 -8.677 393 HE3 MET 49 2HE MET 49 -2.820 -1.137 -10.200 394 HA PRO 50 HA PRO 50 1.988 6.253 -10.233 395 HB2 PRO 50 1HB PRO 50 1.955 6.825 -12.897 396 HB3 PRO 50 2HB PRO 50 3.132 5.669 -12.202 397 HG2 PRO 50 1HG PRO 50 0.487 5.059 -13.536 398 HG3 PRO 50 2HG PRO 50 2.090 4.344 -13.899 399 HD2 PRO 50 1HD PRO 50 0.287 3.160 -12.240 400 HD3 PRO 50 2HD PRO 50 2.044 3.031 -11.917 401 H ALA 51 H ALA 51 1.135 8.347 -11.106 402 HA ALA 51 HA ALA 51 -1.620 8.812 -10.596 403 HB1 ALA 51 1HB ALA 51 0.457 10.610 -11.876 404 HB2 ALA 51 2HB ALA 51 -1.063 11.107 -11.106 405 HB3 ALA 51 3HB ALA 51 0.223 10.395 -10.123 406 H ALA 52 H ALA 52 -1.387 6.975 -12.771 407 HA ALA 52 HA ALA 52 -2.070 6.469 -14.904 408 HB1 ALA 52 1HB ALA 52 -4.149 6.634 -13.669 409 HB2 ALA 52 2HB ALA 52 -4.268 8.374 -14.036 410 HB3 ALA 52 3HB ALA 52 -4.383 7.182 -15.339 411 H THR 53 H THR 53 -0.173 7.513 -15.887 412 HA THR 53 HA THR 53 -0.482 10.133 -17.082 413 HB THR 53 HB THR 53 1.709 9.445 -16.527 414 HG1 THR 53 1HG THR 53 2.673 9.909 -18.534 415 HG21 THR 53 3HG2 THR 53 1.404 7.013 -18.287 416 HG22 THR 53 1HG2 THR 53 1.737 7.074 -16.547 417 HG23 THR 53 2HG2 THR 53 2.952 7.662 -17.691 418 H ILE 54 H ILE 54 -1.778 10.584 -18.727 419 HA ILE 54 HA ILE 54 -1.876 8.786 -21.009 420 HB ILE 54 HB ILE 54 -4.484 10.032 -20.031 421 HG12 ILE 54 1HG1 ILE 54 -3.424 7.253 -19.547 422 HG13 ILE 54 2HG1 ILE 54 -3.920 8.416 -18.318 423 HG21 ILE 54 1HG2 ILE 54 -5.460 8.540 -21.722 424 HG22 ILE 54 2HG2 ILE 54 -4.191 9.493 -22.468 425 HG23 ILE 54 3HG2 ILE 54 -3.871 7.807 -22.027 426 HD11 ILE 54 3HD1 ILE 54 -5.615 6.771 -18.411 427 HD12 ILE 54 1HD1 ILE 54 -6.284 8.226 -19.182 428 HD13 ILE 54 2HD1 ILE 54 -5.729 6.854 -20.172 429 H SER 55 H SER 55 -1.817 9.963 -22.834 430 HA SER 55 HA SER 55 -1.113 12.769 -22.596 431 HB2 SER 55 1HB SER 55 -0.148 10.896 -24.183 432 HB3 SER 55 2HB SER 55 -1.498 11.360 -25.232 433 HG SER 55 HG SER 55 0.780 12.477 -25.206 434 H ARG 56 H ARG 56 -1.970 14.109 -24.468 435 HA ARG 56 HA ARG 56 -3.460 15.592 -25.094 436 HB2 ARG 56 1HB ARG 56 -5.310 13.698 -25.232 437 HB3 ARG 56 2HB ARG 56 -5.862 14.472 -23.737 438 HG2 ARG 56 1HG ARG 56 -5.483 16.704 -25.150 439 HG3 ARG 56 2HG ARG 56 -5.586 15.630 -26.544 440 HD2 ARG 56 1HD ARG 56 -7.665 15.816 -24.334 441 HD3 ARG 56 2HD ARG 56 -7.731 16.794 -25.810 442 HE ARG 56 HE ARG 56 -7.553 14.214 -26.749 443 HH11 ARG 56 1HH1 ARG 56 -9.767 15.914 -24.517 444 HH12 ARG 56 2HH1 ARG 56 -11.075 14.809 -24.732 445 HH21 ARG 56 1HH2 ARG 56 -9.442 13.009 -27.361 446 HH22 ARG 56 2HH2 ARG 56 -10.828 13.018 -26.319 447 H ASP 57 H ASP 57 -2.913 17.286 -24.057 448 HA ASP 57 HA ASP 57 -2.206 17.588 -21.338 449 HB2 ASP 57 1HB ASP 57 -1.635 18.880 -23.613 450 HB3 ASP 57 2HB ASP 57 -2.998 19.881 -23.090 451 H ALA 58 H ALA 58 -3.227 19.937 -20.389 452 HA ALA 58 HA ALA 58 -4.830 20.627 -18.956 453 HB1 ALA 58 1HB ALA 58 -5.847 21.076 -21.228 454 HB2 ALA 58 2HB ALA 58 -6.859 19.642 -20.972 455 HB3 ALA 58 3HB ALA 58 -6.978 21.025 -19.850 456 H ALA 59 H ALA 59 -4.005 17.764 -19.045 457 HA ALA 59 HA ALA 59 -6.007 15.997 -18.183 458 HB1 ALA 59 1HB ALA 59 -4.099 14.568 -17.469 459 HB2 ALA 59 2HB ALA 59 -3.786 15.313 -19.046 460 HB3 ALA 59 3HB ALA 59 -3.012 15.961 -17.578 461 H GLY 60 H GLY 60 -5.873 14.816 -16.017 462 HA2 GLY 60 2HA GLY 60 -6.450 16.685 -13.829 463 HA3 GLY 60 1HA GLY 60 -6.771 14.936 -13.928 464 H ASP 61 H ASP 61 -3.878 16.898 -14.361 465 HA ASP 61 HA ASP 61 -2.389 15.966 -12.085 466 HB2 ASP 61 1HB ASP 61 -1.937 14.030 -13.457 467 HB3 ASP 61 2HB ASP 61 -1.843 15.016 -14.915 468 H HIS 62 H HIS 62 -0.990 17.715 -11.726 469 HA HIS 62 HA HIS 62 -0.045 19.403 -13.818 470 HB2 HIS 62 1HB HIS 62 -1.203 21.547 -12.977 471 HB3 HIS 62 2HB HIS 62 -2.141 20.470 -13.998 472 HD1 HIS 62 1HD HIS 62 -4.414 19.622 -13.014 473 HD2 HIS 62 2HD HIS 62 -1.819 21.377 -10.186 474 HE1 HIS 62 1HE HIS 62 -5.744 19.873 -10.865 475 H ARG 63 H ARG 63 -0.380 18.758 -10.510 476 HA ARG 63 HA ARG 63 2.174 19.710 -9.819 477 HB2 ARG 63 1HB ARG 63 0.245 21.714 -9.678 478 HB3 ARG 63 2HB ARG 63 0.117 21.021 -8.048 479 HG2 ARG 63 1HG ARG 63 2.546 21.411 -7.736 480 HG3 ARG 63 2HG ARG 63 2.675 21.927 -9.430 481 HD2 ARG 63 1HD ARG 63 1.232 23.870 -9.007 482 HD3 ARG 63 2HD ARG 63 0.821 23.263 -7.402 483 HE ARG 63 HE ARG 63 2.819 23.921 -6.527 484 HH11 ARG 63 1HH1 ARG 63 2.847 24.645 -9.998 485 HH12 ARG 63 2HH1 ARG 63 4.011 25.912 -9.877 486 HH21 ARG 63 1HH2 ARG 63 4.414 25.569 -6.349 487 HH22 ARG 63 2HH2 ARG 63 4.931 26.436 -7.755 488 H GLN 64 H GLN 64 2.313 19.246 -7.228 489 HA GLN 64 HA GLN 64 2.636 17.558 -5.978 490 HB2 GLN 64 1HB GLN 64 0.835 16.876 -4.593 491 HB3 GLN 64 2HB GLN 64 0.738 18.580 -4.913 492 HG2 GLN 64 1HG GLN 64 -1.127 18.243 -6.462 493 HG3 GLN 64 2HG GLN 64 -1.016 16.493 -6.261 494 HE21 GLN 64 1HE2 GLN 64 -1.571 15.590 -4.116 495 HE22 GLN 64 2HE2 GLN 64 -2.579 16.484 -3.002 496 H TYR 65 H TYR 65 1.130 15.147 -5.551 497 HA TYR 65 HA TYR 65 1.852 13.610 -7.995 498 HB2 TYR 65 1HB TYR 65 2.461 13.029 -5.081 499 HB3 TYR 65 2HB TYR 65 2.684 11.846 -6.320 500 HD1 TYR 65 1HD TYR 65 3.922 13.536 -8.563 501 HD2 TYR 65 2HD TYR 65 4.587 13.550 -4.311 502 HE1 TYR 65 1HE TYR 65 6.202 14.339 -8.947 503 HE2 TYR 65 2HE TYR 65 6.921 14.396 -4.700 504 HH TYR 65 HH TYR 65 8.124 15.337 -7.870 505 H ARG 66 H ARG 66 0.918 11.194 -7.632 506 HA ARG 66 HA ARG 66 -1.425 10.911 -6.064 507 HB2 ARG 66 1HB ARG 66 -1.762 12.179 -8.710 508 HB3 ARG 66 2HB ARG 66 -2.566 10.636 -8.693 509 HG2 ARG 66 1HG ARG 66 -4.291 11.579 -7.727 510 HG3 ARG 66 2HG ARG 66 -3.354 11.761 -6.251 511 HD2 ARG 66 1HD ARG 66 -2.964 14.052 -6.627 512 HD3 ARG 66 2HD ARG 66 -3.176 13.918 -8.370 513 HE ARG 66 HE ARG 66 -5.127 14.520 -6.376 514 HH11 ARG 66 1HH1 ARG 66 -4.680 13.206 -9.618 515 HH12 ARG 66 2HH1 ARG 66 -6.349 13.270 -10.065 516 HH21 ARG 66 1HH2 ARG 66 -7.400 14.719 -6.994 517 HH22 ARG 66 2HH2 ARG 66 -7.939 14.021 -8.483 518 H GLY 67 H GLY 67 -2.631 8.762 -6.897 519 HA2 GLY 67 2HA GLY 67 -1.912 7.036 -8.784 520 HA3 GLY 67 1HA GLY 67 -0.623 6.763 -7.606 521 H VAL 68 H VAL 68 -1.852 4.565 -7.713 522 HA VAL 68 HA VAL 68 -3.741 4.522 -5.448 523 HB VAL 68 HB VAL 68 -5.147 4.278 -7.342 524 HG11 VAL 68 1HG1 VAL 68 -5.011 2.495 -8.994 525 HG12 VAL 68 2HG1 VAL 68 -3.531 3.439 -9.042 526 HG13 VAL 68 3HG1 VAL 68 -3.539 1.850 -8.240 527 HG21 VAL 68 3HG2 VAL 68 -6.235 2.134 -6.871 528 HG22 VAL 68 1HG2 VAL 68 -4.782 1.542 -6.016 529 HG23 VAL 68 2HG2 VAL 68 -5.725 2.923 -5.398 530 H PHE 69 H PHE 69 -3.135 3.144 -3.931 531 HA PHE 69 HA PHE 69 -0.759 1.456 -4.406 532 HB2 PHE 69 1HB PHE 69 -0.871 2.988 -2.396 533 HB3 PHE 69 2HB PHE 69 -2.248 2.057 -1.837 534 HD1 PHE 69 2HD PHE 69 0.796 0.499 -3.430 535 HD2 PHE 69 1HD PHE 69 -1.299 1.387 0.262 536 HE1 PHE 69 2HE PHE 69 2.360 -0.908 -2.198 537 HE2 PHE 69 1HE PHE 69 0.329 -0.017 1.487 538 HZ PHE 69 HZ PHE 69 2.166 -1.143 0.281 539 H GLN 70 H GLN 70 -1.329 -0.409 -5.303 540 HA GLN 70 HA GLN 70 -3.858 -1.821 -4.694 541 HB2 GLN 70 1HB GLN 70 -3.401 -1.744 -7.018 542 HB3 GLN 70 2HB GLN 70 -1.679 -1.909 -6.793 543 HG2 GLN 70 1HG GLN 70 -2.870 -3.847 -7.875 544 HG3 GLN 70 2HG GLN 70 -1.727 -4.186 -6.583 545 HE21 GLN 70 1HE2 GLN 70 -5.273 -3.180 -6.190 546 HE22 GLN 70 2HE2 GLN 70 -5.529 -4.536 -5.142 547 H VAL 71 H VAL 71 -3.780 -3.676 -3.299 548 HA VAL 71 HA VAL 71 -1.221 -5.088 -3.074 549 HB VAL 71 HB VAL 71 -2.861 -4.503 -0.570 550 HG11 VAL 71 1HG1 VAL 71 0.073 -5.262 -0.918 551 HG12 VAL 71 2HG1 VAL 71 -0.866 -5.237 0.597 552 HG13 VAL 71 3HG1 VAL 71 -1.258 -6.407 -0.671 553 HG21 VAL 71 3HG2 VAL 71 -2.174 -2.253 -1.114 554 HG22 VAL 71 1HG2 VAL 71 -1.214 -2.849 0.233 555 HG23 VAL 71 2HG2 VAL 71 -0.504 -2.778 -1.387 556 H ASN 72 H ASN 72 -1.736 -7.275 -3.308 557 HA ASN 72 HA ASN 72 -4.572 -8.029 -2.790 558 HB2 ASN 72 1HB ASN 72 -2.733 -8.711 -5.048 559 HB3 ASN 72 2HB ASN 72 -3.528 -10.079 -4.316 560 HD21 ASN 72 1HD2 ASN 72 -4.076 -8.468 -7.042 561 HD22 ASN 72 2HD2 ASN 72 -5.815 -8.355 -6.932 562 H VAL 73 H VAL 73 -5.034 -9.725 -1.606 563 HA VAL 73 HA VAL 73 -2.899 -10.752 0.151 564 HB VAL 73 HB VAL 73 -4.179 -9.178 1.274 565 HG11 VAL 73 1HG1 VAL 73 -6.078 -8.794 -0.148 566 HG12 VAL 73 2HG1 VAL 73 -6.680 -10.446 0.132 567 HG13 VAL 73 3HG1 VAL 73 -6.675 -9.250 1.442 568 HG21 VAL 73 3HG2 VAL 73 -3.911 -11.232 2.628 569 HG22 VAL 73 1HG2 VAL 73 -5.299 -10.213 3.070 570 HG23 VAL 73 2HG2 VAL 73 -5.576 -11.691 2.181 571 H VAL 74 H VAL 74 -2.649 -12.328 -1.625 572 HA VAL 74 HA VAL 74 -4.731 -14.322 -2.049 573 HB VAL 74 HB VAL 74 -3.233 -13.685 -3.839 574 HG11 VAL 74 1HG1 VAL 74 -0.932 -14.129 -3.958 575 HG12 VAL 74 2HG1 VAL 74 -1.212 -13.188 -2.495 576 HG13 VAL 74 3HG1 VAL 74 -0.917 -14.929 -2.356 577 HG21 VAL 74 3HG2 VAL 74 -2.645 -15.872 -4.658 578 HG22 VAL 74 1HG2 VAL 74 -2.675 -16.541 -3.007 579 HG23 VAL 74 2HG2 VAL 74 -4.182 -15.967 -3.778 580 H MET 75 H MET 75 -5.094 -16.194 -1.028 581 HA MET 75 HA MET 75 -3.053 -17.317 0.803 582 HB2 MET 75 1HB MET 75 -4.776 -17.935 2.410 583 HB3 MET 75 2HB MET 75 -4.812 -16.201 2.177 584 HG2 MET 75 1HG MET 75 -6.673 -16.987 0.315 585 HG3 MET 75 2HG MET 75 -6.821 -18.279 1.480 586 HE1 MET 75 3HE MET 75 -6.313 -14.636 1.045 587 HE2 MET 75 1HE MET 75 -8.031 -14.599 0.629 588 HE3 MET 75 2HE MET 75 -7.450 -13.787 2.106 589 HA PRO 76 HA PRO 76 -4.409 -21.000 -1.511 590 HB2 PRO 76 1HB PRO 76 -3.464 -23.023 0.004 591 HB3 PRO 76 2HB PRO 76 -2.334 -21.864 -0.771 592 HG2 PRO 76 1HG PRO 76 -3.389 -21.795 2.071 593 HG3 PRO 76 2HG PRO 76 -1.675 -21.721 1.537 594 HD2 PRO 76 1HD PRO 76 -3.206 -19.503 2.087 595 HD3 PRO 76 2HD PRO 76 -1.921 -19.496 0.854 596 H ILE 77 H ILE 77 -5.759 -23.090 -0.886 597 HA ILE 77 HA ILE 77 -7.592 -22.513 1.402 598 HB ILE 77 HB ILE 77 -8.418 -23.776 -1.221 599 HG12 ILE 77 1HG1 ILE 77 -8.847 -20.953 -0.182 600 HG13 ILE 77 2HG1 ILE 77 -7.861 -21.380 -1.550 601 HG21 ILE 77 1HG2 ILE 77 -10.046 -22.759 1.174 602 HG22 ILE 77 2HG2 ILE 77 -10.686 -23.564 -0.272 603 HG23 ILE 77 3HG2 ILE 77 -9.695 -24.468 0.849 604 HD11 ILE 77 3HD1 ILE 77 -9.886 -20.507 -2.406 605 HD12 ILE 77 1HD1 ILE 77 -9.872 -22.255 -2.748 606 HD13 ILE 77 2HD1 ILE 77 -10.857 -21.590 -1.418 607 H GLY 78 H GLY 78 -6.222 -23.732 2.729 608 HA2 GLY 78 2HA GLY 78 -5.835 -26.605 2.211 609 HA3 GLY 78 1HA GLY 78 -5.253 -25.675 3.599 610 H ASP 79 H ASP 79 -8.553 -25.778 2.290 611 HA ASP 79 HA ASP 79 -10.542 -25.748 3.087 612 HB2 ASP 79 1HB ASP 79 -10.240 -28.083 3.594 613 HB3 ASP 79 2HB ASP 79 -9.474 -27.654 5.117 614 H GLY 80 H GLY 80 -11.638 -24.255 4.129 615 HA2 GLY 80 2HA GLY 80 -12.245 -22.640 5.644 616 HA3 GLY 80 1HA GLY 80 -11.480 -23.690 6.841 617 H SER 81 H SER 81 -10.167 -21.705 4.159 618 HA SER 81 HA SER 81 -7.840 -20.993 5.693 619 HB2 SER 81 1HB SER 81 -7.754 -21.128 3.257 620 HB3 SER 81 2HB SER 81 -8.917 -19.795 3.114 621 HG SER 81 HG SER 81 -6.219 -19.779 3.881 622 H ARG 82 H ARG 82 -10.503 -18.957 4.471 623 HA ARG 82 HA ARG 82 -11.593 -17.127 5.186 624 HB2 ARG 82 1HB ARG 82 -11.405 -18.975 7.521 625 HB3 ARG 82 2HB ARG 82 -11.948 -17.343 7.864 626 HG2 ARG 82 1HG ARG 82 -13.858 -18.752 7.445 627 HG3 ARG 82 2HG ARG 82 -13.722 -17.464 6.251 628 HD2 ARG 82 1HD ARG 82 -12.588 -19.182 4.745 629 HD3 ARG 82 2HD ARG 82 -13.162 -20.436 5.850 630 HE ARG 82 HE ARG 82 -15.479 -19.351 5.456 631 HH11 ARG 82 1HH1 ARG 82 -13.160 -19.910 2.857 632 HH12 ARG 82 2HH1 ARG 82 -14.180 -19.135 1.645 633 HH21 ARG 82 1HH2 ARG 82 -16.748 -18.348 3.886 634 HH22 ARG 82 2HH2 ARG 82 -16.360 -18.554 2.198 635 H SER 83 H SER 83 -8.415 -17.092 5.836 636 HA SER 83 HA SER 83 -8.057 -15.086 7.701 637 HB2 SER 83 1HB SER 83 -6.422 -16.744 6.881 638 HB3 SER 83 2HB SER 83 -6.327 -15.894 5.337 639 HG SER 83 HG SER 83 -4.948 -14.655 6.154 640 H ALA 84 H ALA 84 -9.238 -14.577 4.438 641 HA ALA 84 HA ALA 84 -8.072 -12.124 3.763 642 HB1 ALA 84 1HB ALA 84 -9.616 -13.256 2.186 643 HB2 ALA 84 2HB ALA 84 -10.956 -13.088 3.332 644 HB3 ALA 84 3HB ALA 84 -10.280 -11.659 2.560 645 H GLU 85 H GLU 85 -11.031 -12.664 5.746 646 HA GLU 85 HA GLU 85 -11.569 -9.908 5.897 647 HB2 GLU 85 1HB GLU 85 -12.563 -12.209 7.642 648 HB3 GLU 85 2HB GLU 85 -13.265 -10.586 7.569 649 HG2 GLU 85 1HG GLU 85 -13.481 -11.006 5.012 650 HG3 GLU 85 2HG GLU 85 -13.198 -12.702 5.398 651 H GLN 86 H GLN 86 -9.950 -12.127 8.049 652 HA GLN 86 HA GLN 86 -9.564 -10.504 10.352 653 HB2 GLN 86 1HB GLN 86 -8.214 -12.924 9.083 654 HB3 GLN 86 2HB GLN 86 -7.489 -12.185 10.468 655 HG2 GLN 86 1HG GLN 86 -10.260 -13.351 10.395 656 HG3 GLN 86 2HG GLN 86 -8.819 -14.045 11.137 657 HE21 GLN 86 1HE2 GLN 86 -7.676 -11.791 12.453 658 HE22 GLN 86 2HE2 GLN 86 -8.762 -11.240 13.686 659 H VAL 87 H VAL 87 -7.430 -11.137 7.527 660 HA VAL 87 HA VAL 87 -5.370 -9.387 8.382 661 HB VAL 87 HB VAL 87 -6.174 -10.712 5.747 662 HG11 VAL 87 1HG1 VAL 87 -3.915 -10.280 4.914 663 HG12 VAL 87 2HG1 VAL 87 -4.868 -8.799 5.042 664 HG13 VAL 87 3HG1 VAL 87 -3.614 -9.173 6.270 665 HG21 VAL 87 3HG2 VAL 87 -5.365 -12.154 7.648 666 HG22 VAL 87 1HG2 VAL 87 -4.312 -12.202 6.237 667 HG23 VAL 87 2HG2 VAL 87 -3.849 -11.232 7.660 668 H ALA 88 H ALA 88 -8.172 -8.874 6.144 669 HA ALA 88 HA ALA 88 -7.400 -6.313 5.258 670 HB1 ALA 88 1HB ALA 88 -9.168 -7.581 4.172 671 HB2 ALA 88 2HB ALA 88 -10.157 -7.541 5.648 672 HB3 ALA 88 3HB ALA 88 -9.817 -6.050 4.766 673 H ALA 89 H ALA 89 -8.709 -7.252 8.385 674 HA ALA 89 HA ALA 89 -9.357 -4.481 9.141 675 HB1 ALA 89 1HB ALA 89 -10.802 -6.158 9.999 676 HB2 ALA 89 2HB ALA 89 -9.442 -7.183 10.509 677 HB3 ALA 89 3HB ALA 89 -9.757 -5.656 11.349 678 H GLU 90 H GLU 90 -6.643 -6.760 9.465 679 HA GLU 90 HA GLU 90 -5.272 -5.264 11.544 680 HB2 GLU 90 1HB GLU 90 -4.342 -7.392 9.559 681 HB3 GLU 90 2HB GLU 90 -3.272 -6.537 10.705 682 HG2 GLU 90 1HG GLU 90 -5.057 -7.257 12.484 683 HG3 GLU 90 2HG GLU 90 -5.619 -8.371 11.289 684 H LEU 91 H LEU 91 -4.654 -5.588 8.011 685 HA LEU 91 HA LEU 91 -2.887 -3.492 7.755 686 HB2 LEU 91 1HB LEU 91 -4.992 -4.589 5.863 687 HB3 LEU 91 2HB LEU 91 -3.953 -3.283 5.386 688 HG LEU 91 HG LEU 91 -3.065 -5.177 4.524 689 HD11 LEU 91 1HD1 LEU 91 -1.409 -3.532 5.489 690 HD12 LEU 91 2HD1 LEU 91 -0.778 -5.176 5.260 691 HD13 LEU 91 3HD1 LEU 91 -1.225 -4.635 6.874 692 HD21 LEU 91 3HD2 LEU 91 -2.339 -7.145 5.617 693 HD22 LEU 91 1HD2 LEU 91 -4.063 -6.846 5.815 694 HD23 LEU 91 2HD2 LEU 91 -2.961 -6.548 7.169 695 H ASP 92 H ASP 92 -6.389 -3.258 8.201 696 HA ASP 92 HA ASP 92 -6.619 -0.539 7.180 697 HB2 ASP 92 1HB ASP 92 -8.534 -1.972 6.972 698 HB3 ASP 92 2HB ASP 92 -8.525 -2.329 8.711 699 H ALA 93 H ALA 93 -6.668 -2.086 10.441 700 HA ALA 93 HA ALA 93 -6.801 0.362 11.913 701 HB1 ALA 93 1HB ALA 93 -5.432 -2.271 12.623 702 HB2 ALA 93 2HB ALA 93 -5.885 -0.976 13.760 703 HB3 ALA 93 3HB ALA 93 -7.153 -1.882 12.904 704 H LEU 94 H LEU 94 -4.150 -1.350 10.358 705 HA LEU 94 HA LEU 94 -1.990 0.238 11.370 706 HB2 LEU 94 1HB LEU 94 -1.762 -2.022 10.391 707 HB3 LEU 94 2HB LEU 94 -2.314 -1.407 8.842 708 HG LEU 94 HG LEU 94 -0.259 0.106 8.795 709 HD11 LEU 94 1HD1 LEU 94 0.336 0.096 11.182 710 HD12 LEU 94 2HD1 LEU 94 1.649 -0.625 10.235 711 HD13 LEU 94 3HD1 LEU 94 0.537 -1.662 11.147 712 HD21 LEU 94 3HD2 LEU 94 -0.446 -1.939 7.477 713 HD22 LEU 94 1HD2 LEU 94 0.030 -2.903 8.848 714 HD23 LEU 94 2HD2 LEU 94 1.209 -1.789 8.108 715 H PHE 95 H PHE 95 -4.264 0.703 8.625 716 HA PHE 95 HA PHE 95 -2.818 3.181 7.873 717 HB2 PHE 95 1HB PHE 95 -4.099 1.095 6.099 718 HB3 PHE 95 2HB PHE 95 -3.887 2.733 5.562 719 HD1 PHE 95 2HD PHE 95 -1.821 -0.161 6.821 720 HD2 PHE 95 1HD PHE 95 -2.032 3.392 4.389 721 HE1 PHE 95 2HE PHE 95 0.466 -0.612 5.912 722 HE2 PHE 95 1HE PHE 95 0.234 2.932 3.512 723 HZ PHE 95 HZ PHE 95 1.484 0.931 4.282 724 HA PRO 96 HA PRO 96 -7.208 4.338 8.945 725 HB2 PRO 96 1HB PRO 96 -6.696 6.292 10.779 726 HB3 PRO 96 2HB PRO 96 -6.763 4.554 11.219 727 HG2 PRO 96 1HG PRO 96 -4.328 6.274 10.660 728 HG3 PRO 96 2HG PRO 96 -4.602 5.117 12.005 729 HD2 PRO 96 1HD PRO 96 -3.208 4.474 9.719 730 HD3 PRO 96 2HD PRO 96 -4.164 3.274 10.636 731 H VAL 97 H VAL 97 -8.197 6.493 8.558 732 HA VAL 97 HA VAL 97 -7.339 7.205 6.028 733 HB VAL 97 HB VAL 97 -9.679 7.103 7.004 734 HG11 VAL 97 1HG1 VAL 97 -10.677 9.094 7.931 735 HG12 VAL 97 2HG1 VAL 97 -9.266 8.693 8.929 736 HG13 VAL 97 3HG1 VAL 97 -9.180 10.020 7.760 737 HG21 VAL 97 3HG2 VAL 97 -9.152 9.585 5.348 738 HG22 VAL 97 1HG2 VAL 97 -9.155 7.938 4.707 739 HG23 VAL 97 2HG2 VAL 97 -10.634 8.624 5.409 740 H ASN 98 H ASN 98 -6.211 8.592 8.767 741 HA ASN 98 HA ASN 98 -5.673 11.240 7.546 742 HB2 ASN 98 1HB ASN 98 -4.541 10.241 10.179 743 HB3 ASN 98 2HB ASN 98 -4.708 11.906 9.641 744 HD21 ASN 98 1HD2 ASN 98 -7.059 12.747 9.387 745 HD22 ASN 98 2HD2 ASN 98 -8.266 11.980 10.416 746 H LEU 99 H LEU 99 -4.031 8.281 8.375 747 HA LEU 99 HA LEU 99 -1.880 7.622 8.407 748 HB2 LEU 99 1HB LEU 99 -3.152 7.473 6.092 749 HB3 LEU 99 2HB LEU 99 -1.802 8.405 5.513 750 HG LEU 99 HG LEU 99 -0.969 6.293 5.158 751 HD11 LEU 99 1HD1 LEU 99 -0.274 6.239 8.118 752 HD12 LEU 99 2HD1 LEU 99 0.640 7.181 6.911 753 HD13 LEU 99 3HD1 LEU 99 0.536 5.417 6.794 754 HD21 LEU 99 3HD2 LEU 99 -2.587 5.436 7.577 755 HD22 LEU 99 1HD2 LEU 99 -1.565 4.347 6.615 756 HD23 LEU 99 2HD2 LEU 99 -2.981 5.143 5.877 757 H VAL 100 H VAL 100 -1.462 9.825 9.689 758 HA VAL 100 HA VAL 100 -0.043 11.864 8.345 759 HB VAL 100 HB VAL 100 -0.062 11.170 11.315 760 HG11 VAL 100 1HG1 VAL 100 0.452 13.776 9.842 761 HG12 VAL 100 2HG1 VAL 100 0.285 13.615 11.607 762 HG13 VAL 100 3HG1 VAL 100 1.636 12.841 10.762 763 HG21 VAL 100 3HG2 VAL 100 -2.368 11.318 10.674 764 HG22 VAL 100 1HG2 VAL 100 -1.949 12.849 11.431 765 HG23 VAL 100 2HG2 VAL 100 -2.063 12.741 9.666 766 H MET 101 H MET 101 1.756 10.951 7.111 767 HA MET 101 HA MET 101 3.988 9.951 8.769 768 HB2 MET 101 1HB MET 101 4.757 8.688 6.824 769 HB3 MET 101 2HB MET 101 3.253 8.085 7.551 770 HG2 MET 101 1HG MET 101 1.958 9.227 5.834 771 HG3 MET 101 2HG MET 101 3.424 9.893 5.126 772 HE1 MET 101 3HE MET 101 0.766 7.803 4.747 773 HE2 MET 101 1HE MET 101 1.382 8.803 3.441 774 HE3 MET 101 2HE MET 101 1.233 7.037 3.190 775 H GLN 102 H GLN 102 5.986 10.895 8.396 776 HA GLN 102 HA GLN 102 6.210 12.937 6.273 777 HB2 GLN 102 1HB GLN 102 7.976 13.938 7.761 778 HB3 GLN 102 2HB GLN 102 6.302 14.314 8.081 779 HG2 GLN 102 1HG GLN 102 7.850 12.209 9.647 780 HG3 GLN 102 2HG GLN 102 7.818 13.918 10.084 781 HE21 GLN 102 1HE2 GLN 102 6.850 11.697 11.732 782 HE22 GLN 102 2HE2 GLN 102 5.141 12.016 11.998 783 H SER 103 H SER 103 7.255 11.832 4.675 784 HA SER 103 HA SER 103 9.254 9.814 5.215 785 HB2 SER 103 1HB SER 103 9.101 11.131 2.554 786 HB3 SER 103 2HB SER 103 9.192 9.424 2.972 787 HG SER 103 HG SER 103 7.178 9.469 2.411 788 H GLY 104 H GLY 104 11.419 10.329 3.695 789 HA2 GLY 104 2HA GLY 104 13.012 12.157 5.163 790 HA3 GLY 104 1HA GLY 104 13.445 11.256 3.730 791 H GLY 105 H GLY 105 10.752 13.566 3.678 792 HA2 GLY 105 2HA GLY 105 12.172 15.271 1.704 793 HA3 GLY 105 1HA GLY 105 10.782 14.262 1.212 794 H LEU 106 H LEU 106 8.678 14.608 2.390 795 HA LEU 106 HA LEU 106 8.492 17.226 3.739 796 HB2 LEU 106 1HB LEU 106 6.244 17.188 1.984 797 HB3 LEU 106 2HB LEU 106 7.548 18.301 2.090 798 HG LEU 106 HG LEU 106 8.853 17.071 0.410 799 HD11 LEU 106 1HD1 LEU 106 6.302 15.424 0.092 800 HD12 LEU 106 2HD1 LEU 106 7.932 14.800 0.448 801 HD13 LEU 106 3HD1 LEU 106 7.608 15.530 -1.108 802 HD21 LEU 106 3HD2 LEU 106 7.451 19.008 -0.144 803 HD22 LEU 106 1HD2 LEU 106 6.061 17.931 -0.398 804 HD23 LEU 106 2HD2 LEU 106 7.465 17.842 -1.472 805 H ALA 107 H ALA 107 5.841 15.279 2.423 806 HA ALA 107 HA ALA 107 5.495 13.481 4.543 807 HB1 ALA 107 1HB ALA 107 4.723 15.390 5.880 808 HB2 ALA 107 2HB ALA 107 3.693 15.934 4.543 809 HB3 ALA 107 3HB ALA 107 3.309 14.452 5.424 810 H VAL 108 H VAL 108 2.992 12.736 4.279 811 HA VAL 108 HA VAL 108 1.737 13.095 1.763 812 HB VAL 108 HB VAL 108 3.462 11.778 0.846 813 HG11 VAL 108 1HG1 VAL 108 4.162 9.528 1.596 814 HG12 VAL 108 2HG1 VAL 108 4.599 10.836 2.694 815 HG13 VAL 108 3HG1 VAL 108 3.212 9.821 3.060 816 HG21 VAL 108 3HG2 VAL 108 1.374 9.636 1.223 817 HG22 VAL 108 1HG2 VAL 108 1.057 11.061 0.240 818 HG23 VAL 108 2HG2 VAL 108 2.378 9.999 -0.202 819 H ARG 109 H ARG 109 -0.367 11.969 1.740 820 HA ARG 109 HA ARG 109 -0.938 10.389 4.233 821 HB2 ARG 109 1HB ARG 109 -2.642 12.715 3.211 822 HB3 ARG 109 2HB ARG 109 -3.175 11.532 4.415 823 HG2 ARG 109 1HG ARG 109 -1.228 12.107 5.840 824 HG3 ARG 109 2HG ARG 109 -0.763 13.317 4.647 825 HD2 ARG 109 1HD ARG 109 -2.841 14.570 5.037 826 HD3 ARG 109 2HD ARG 109 -3.370 13.310 6.171 827 HE ARG 109 HE ARG 109 -0.751 14.415 6.763 828 HH11 ARG 109 1HH1 ARG 109 -4.240 14.664 7.420 829 HH12 ARG 109 2HH1 ARG 109 -4.024 15.037 9.094 830 HH21 ARG 109 1HH2 ARG 109 -0.475 15.416 8.804 831 HH22 ARG 109 2HH2 ARG 109 -1.844 15.803 9.795 832 H VAL 110 H VAL 110 -3.064 9.338 4.118 833 HA VAL 110 HA VAL 110 -3.116 7.744 1.658 834 HB VAL 110 HB VAL 110 -3.244 6.833 3.958 835 HG11 VAL 110 1HG1 VAL 110 -5.336 6.789 5.153 836 HG12 VAL 110 2HG1 VAL 110 -4.859 8.470 4.874 837 HG13 VAL 110 3HG1 VAL 110 -6.147 7.733 3.886 838 HG21 VAL 110 3HG2 VAL 110 -5.414 5.968 2.053 839 HG22 VAL 110 1HG2 VAL 110 -3.756 5.347 2.248 840 HG23 VAL 110 2HG2 VAL 110 -4.942 5.096 3.524 841 H ARG 111 H ARG 111 -5.125 10.284 2.975 842 HA ARG 111 HA ARG 111 -6.608 11.675 2.001 843 HB2 ARG 111 1HB ARG 111 -5.310 11.440 -0.083 844 HB3 ARG 111 2HB ARG 111 -6.381 10.133 -0.601 845 HG2 ARG 111 1HG ARG 111 -8.324 11.610 -0.587 846 HG3 ARG 111 2HG ARG 111 -7.413 12.833 0.279 847 HD2 ARG 111 1HD ARG 111 -7.290 13.744 -1.762 848 HD3 ARG 111 2HD ARG 111 -5.818 12.812 -1.746 849 HE ARG 111 HE ARG 111 -6.640 11.331 -3.345 850 HH11 ARG 111 1HH1 ARG 111 -9.221 13.592 -2.370 851 HH12 ARG 111 2HH1 ARG 111 -10.265 13.136 -3.669 852 HH21 ARG 111 1HH2 ARG 111 -7.853 10.977 -5.175 853 HH22 ARG 111 2HH2 ARG 111 -9.422 11.721 -5.417 854 H THR 112 H THR 112 -7.296 8.375 0.740 855 HA THR 112 HA THR 112 -10.113 8.743 1.665 856 HB THR 112 HB THR 112 -10.583 7.026 -0.186 857 HG1 THR 112 1HG THR 112 -8.595 6.340 -0.713 858 HG21 THR 112 3HG2 THR 112 -11.109 9.470 -0.369 859 HG22 THR 112 1HG2 THR 112 -10.698 8.709 -1.916 860 HG23 THR 112 2HG2 THR 112 -9.495 9.719 -1.095 861 HA PRO 113 HA PRO 113 -9.531 5.383 4.381 862 HB2 PRO 113 1HB PRO 113 -11.973 4.155 4.540 863 HB3 PRO 113 2HB PRO 113 -11.655 5.796 5.176 864 HG2 PRO 113 1HG PRO 113 -12.895 5.036 2.516 865 HG3 PRO 113 2HG PRO 113 -13.461 6.261 3.696 866 HD2 PRO 113 1HD PRO 113 -11.973 6.922 1.505 867 HD3 PRO 113 2HD PRO 113 -11.798 7.792 3.052 868 H ILE 114 H ILE 114 -9.238 3.070 4.498 869 HA ILE 114 HA ILE 114 -8.245 1.721 2.281 870 HB ILE 114 HB ILE 114 -9.385 0.905 4.954 871 HG12 ILE 114 1HG1 ILE 114 -7.131 2.134 4.594 872 HG13 ILE 114 2HG1 ILE 114 -7.165 0.764 5.671 873 HG21 ILE 114 1HG2 ILE 114 -8.310 -1.083 2.934 874 HG22 ILE 114 2HG2 ILE 114 -8.445 -1.394 4.677 875 HG23 ILE 114 3HG2 ILE 114 -9.885 -1.057 3.727 876 HD11 ILE 114 3HD1 ILE 114 -6.394 0.453 2.762 877 HD12 ILE 114 1HD1 ILE 114 -5.214 0.904 4.013 878 HD13 ILE 114 2HD1 ILE 114 -6.062 -0.654 4.108 879 H SER 115 H SER 115 -9.099 0.674 0.545 880 HA SER 115 HA SER 115 -12.019 0.351 0.416 881 HB2 SER 115 1HB SER 115 -10.081 -0.771 -1.611 882 HB3 SER 115 2HB SER 115 -11.779 -0.289 -1.825 883 HG SER 115 HG SER 115 -10.979 1.902 -1.194 884 H ASN 116 H ASN 116 -12.833 -1.941 -0.531 885 HA ASN 116 HA ASN 116 -11.694 -4.321 0.479 886 HB2 ASN 116 1HB ASN 116 -12.625 -3.682 2.566 887 HB3 ASN 116 2HB ASN 116 -13.905 -2.698 1.836 888 HD21 ASN 116 1HD2 ASN 116 -12.807 -6.067 1.857 889 HD22 ASN 116 2HD2 ASN 116 -14.387 -6.794 1.765 890 H GLY 117 H GLY 117 -12.958 -6.023 -0.730 891 HA2 GLY 117 2HA GLY 117 -15.573 -5.271 -1.677 892 HA3 GLY 117 1HA GLY 117 -14.406 -5.602 -2.994 893 H GLN 118 H GLN 118 -16.415 -7.163 -3.109 894 HA GLN 118 HA GLN 118 -16.260 -9.629 -1.695 895 HB2 GLN 118 1HB GLN 118 -17.606 -8.557 -4.103 896 HB3 GLN 118 2HB GLN 118 -17.057 -10.192 -4.323 897 HG2 GLN 118 1HG GLN 118 -19.225 -10.463 -3.565 898 HG3 GLN 118 2HG GLN 118 -18.267 -10.781 -2.120 899 HE21 GLN 118 1HE2 GLN 118 -18.139 -9.022 -0.482 900 HE22 GLN 118 2HE2 GLN 118 -19.312 -7.734 -0.461 901 HA PRO 119 HA PRO 119 -12.461 -11.026 -3.360 902 HB2 PRO 119 1HB PRO 119 -12.675 -13.786 -3.079 903 HB3 PRO 119 2HB PRO 119 -12.350 -12.648 -1.759 904 HG2 PRO 119 1HG PRO 119 -14.963 -13.922 -2.590 905 HG3 PRO 119 2HG PRO 119 -14.360 -13.608 -0.930 906 HD2 PRO 119 1HD PRO 119 -16.220 -12.015 -2.207 907 HD3 PRO 119 2HD PRO 119 -15.082 -11.385 -0.995 908 H THR 120 H THR 120 -11.484 -12.721 -4.879 909 HA THR 120 HA THR 120 -13.141 -13.201 -7.311 910 HB THR 120 HB THR 120 -11.963 -11.011 -7.261 911 HG1 THR 120 1HG THR 120 -11.233 -12.876 -9.243 912 HG21 THR 120 3HG2 THR 120 -9.383 -12.453 -7.723 913 HG22 THR 120 1HG2 THR 120 -9.913 -12.124 -6.072 914 HG23 THR 120 2HG2 THR 120 -9.694 -10.772 -7.237 915 H THR 121 H THR 121 -12.328 -14.820 -5.196 916 HA THR 121 HA THR 121 -10.336 -16.514 -5.004 917 HB THR 121 HB THR 121 -13.306 -17.181 -5.169 918 HG1 THR 121 1HG THR 121 -11.697 -16.547 -2.941 919 HG21 THR 121 3HG2 THR 121 -11.223 -18.739 -3.597 920 HG22 THR 121 1HG2 THR 121 -12.062 -19.316 -5.044 921 HG23 THR 121 2HG2 THR 121 -12.983 -18.980 -3.579 922 H GLY 122 H GLY 122 -9.333 -18.159 -6.119 923 HA2 GLY 122 2HA GLY 122 -10.327 -18.956 -8.780 924 HA3 GLY 122 1HA GLY 122 -8.623 -18.780 -8.344 925 H ASP 123 H ASP 123 -8.593 -20.901 -9.193 926 HA ASP 123 HA ASP 123 -10.035 -23.042 -8.712 927 HB2 ASP 123 1HB ASP 123 -7.780 -22.607 -10.086 928 HB3 ASP 123 2HB ASP 123 -7.059 -23.476 -8.733 929 H ALA 124 H ALA 124 -7.383 -22.037 -6.522 930 HA ALA 124 HA ALA 124 -8.542 -23.446 -4.298 931 HB1 ALA 124 1HB ALA 124 -5.792 -24.279 -5.329 932 HB2 ALA 124 2HB ALA 124 -6.546 -24.816 -3.809 933 HB3 ALA 124 3HB ALA 124 -7.266 -25.281 -5.360 934 H ASP 125 H ASP 125 -7.899 -20.584 -5.146 935 HA ASP 125 HA ASP 125 -6.478 -19.937 -2.713 936 HB2 ASP 125 1HB ASP 125 -5.707 -17.894 -3.986 937 HB3 ASP 125 2HB ASP 125 -4.708 -19.332 -4.100 938 H HIS 126 H HIS 126 -7.225 -17.990 -1.829 939 HA HIS 126 HA HIS 126 -9.540 -16.748 -3.200 940 HB2 HIS 126 1HB HIS 126 -9.142 -16.410 -0.293 941 HB3 HIS 126 2HB HIS 126 -10.543 -16.001 -1.208 942 HD1 HIS 126 1HD HIS 126 -12.333 -18.124 -1.573 943 HD2 HIS 126 2HD HIS 126 -9.094 -18.550 1.067 944 HE1 HIS 126 1HE HIS 126 -12.894 -20.082 -0.094 945 H THR 127 H THR 127 -9.457 -14.504 -3.278 946 HA THR 127 HA THR 127 -7.497 -12.982 -1.767 947 HB THR 127 HB THR 127 -7.578 -12.803 -4.840 948 HG1 THR 127 1HG THR 127 -6.173 -14.417 -4.894 949 HG21 THR 127 3HG2 THR 127 -5.487 -11.885 -2.836 950 HG22 THR 127 1HG2 THR 127 -6.750 -10.816 -3.472 951 HG23 THR 127 2HG2 THR 127 -5.526 -11.537 -4.560 952 H VAL 128 H VAL 128 -8.470 -11.291 -1.033 953 HA VAL 128 HA VAL 128 -10.950 -10.299 -2.253 954 HB VAL 128 HB VAL 128 -11.001 -8.932 -0.157 955 HG11 VAL 128 1HG1 VAL 128 -11.990 -10.647 1.226 956 HG12 VAL 128 2HG1 VAL 128 -12.506 -10.750 -0.454 957 HG13 VAL 128 3HG1 VAL 128 -11.284 -11.909 0.185 958 HG21 VAL 128 3HG2 VAL 128 -8.904 -10.803 0.911 959 HG22 VAL 128 1HG2 VAL 128 -8.741 -9.051 0.564 960 HG23 VAL 128 2HG2 VAL 128 -9.840 -9.587 1.817 961 HA PRO 129 HA PRO 129 -8.551 -6.927 -3.861 962 HB2 PRO 129 1HB PRO 129 -10.543 -5.190 -4.513 963 HB3 PRO 129 2HB PRO 129 -10.264 -6.724 -5.395 964 HG2 PRO 129 1HG PRO 129 -12.241 -6.210 -3.179 965 HG3 PRO 129 2HG PRO 129 -12.555 -7.015 -4.748 966 HD2 PRO 129 1HD PRO 129 -12.082 -8.383 -2.465 967 HD3 PRO 129 2HD PRO 129 -11.494 -8.959 -4.049 968 H ILE 130 H ILE 130 -7.450 -5.314 -2.809 969 HA ILE 130 HA ILE 130 -8.822 -3.516 -0.959 970 HB ILE 130 HB ILE 130 -6.124 -4.654 -0.152 971 HG12 ILE 130 1HG1 ILE 130 -8.851 -5.689 0.783 972 HG13 ILE 130 2HG1 ILE 130 -7.645 -6.586 -0.136 973 HG21 ILE 130 1HG2 ILE 130 -7.101 -2.433 0.771 974 HG22 ILE 130 2HG2 ILE 130 -8.345 -3.426 1.538 975 HG23 ILE 130 3HG2 ILE 130 -6.648 -3.627 1.988 976 HD11 ILE 130 3HD1 ILE 130 -7.336 -5.655 2.747 977 HD12 ILE 130 1HD1 ILE 130 -7.627 -7.293 2.188 978 HD13 ILE 130 2HD1 ILE 130 -6.091 -6.514 1.800 979 H SER 131 H SER 131 -7.960 -1.454 -1.182 980 HA SER 131 HA SER 131 -5.386 -0.886 -2.159 981 HB2 SER 131 1HB SER 131 -6.272 0.393 -4.301 982 HB3 SER 131 2HB SER 131 -5.820 -1.305 -4.337 983 HG SER 131 HG SER 131 -8.427 -0.219 -4.296 984 H LEU 132 H LEU 132 -5.402 1.688 -2.847 985 HA LEU 132 HA LEU 132 -7.431 3.315 -1.713 986 HB2 LEU 132 1HB LEU 132 -5.934 4.472 -0.023 987 HB3 LEU 132 2HB LEU 132 -6.527 2.884 0.416 988 HG LEU 132 HG LEU 132 -4.133 2.100 -0.591 989 HD11 LEU 132 1HD1 LEU 132 -3.686 5.017 0.138 990 HD12 LEU 132 2HD1 LEU 132 -3.212 4.165 -1.317 991 HD13 LEU 132 3HD1 LEU 132 -2.394 3.788 0.201 992 HD21 LEU 132 3HD2 LEU 132 -3.316 2.084 1.708 993 HD22 LEU 132 1HD2 LEU 132 -5.009 1.599 1.550 994 HD23 LEU 132 2HD2 LEU 132 -4.628 3.191 2.181 995 H GLY 133 H GLY 133 -6.946 5.684 -2.115 996 HA2 GLY 133 2HA GLY 133 -4.879 5.996 -4.256 997 HA3 GLY 133 1HA GLY 133 -6.502 6.636 -4.375 998 H TYR 134 H TYR 134 -3.376 7.124 -3.202 999 HA TYR 134 HA TYR 134 -3.847 9.206 -1.196 1000 HB2 TYR 134 1HB TYR 134 -1.394 9.256 -1.111 1001 HB3 TYR 134 2HB TYR 134 -2.011 7.626 -0.948 1002 HD1 TYR 134 1HD TYR 134 -0.147 9.989 -3.098 1003 HD2 TYR 134 2HD TYR 134 -1.633 5.944 -2.740 1004 HE1 TYR 134 1HE TYR 134 1.291 9.309 -4.978 1005 HE2 TYR 134 2HE TYR 134 -0.186 5.262 -4.648 1006 HH TYR 134 HH TYR 134 1.705 7.610 -6.527 1007 H ASP 135 H ASP 135 -2.382 11.266 -1.498 1008 HA ASP 135 HA ASP 135 -2.287 12.211 -4.291 1009 HB2 ASP 135 1HB ASP 135 -3.353 14.167 -3.963 1010 HB3 ASP 135 2HB ASP 135 -4.506 12.935 -3.459 1011 H VAL 136 H VAL 136 -1.288 12.729 -1.121 1012 HA VAL 136 HA VAL 136 0.922 13.086 -0.181 1013 HB VAL 136 HB VAL 136 1.717 12.953 -2.806 1014 HG11 VAL 136 1HG1 VAL 136 0.913 15.471 -2.935 1015 HG12 VAL 136 2HG1 VAL 136 2.438 15.766 -2.197 1016 HG13 VAL 136 3HG1 VAL 136 2.408 14.922 -3.765 1017 HG21 VAL 136 3HG2 VAL 136 3.224 12.419 -1.109 1018 HG22 VAL 136 1HG2 VAL 136 3.981 13.610 -2.155 1019 HG23 VAL 136 2HG2 VAL 136 3.401 14.111 -0.572 1020 H GLN 137 H GLN 137 2.109 14.982 0.371 1021 HA GLN 137 HA GLN 137 0.404 17.359 0.617 1022 HB2 GLN 137 1HB GLN 137 0.322 16.402 2.795 1023 HB3 GLN 137 2HB GLN 137 1.964 15.739 2.593 1024 HG2 GLN 137 1HG GLN 137 3.052 17.585 3.101 1025 HG3 GLN 137 2HG GLN 137 1.766 18.659 2.516 1026 HE21 GLN 137 1HE2 GLN 137 3.230 17.631 5.519 1027 HE22 GLN 137 2HE2 GLN 137 1.886 18.198 6.472 1028 H PHE 138 H PHE 138 1.418 18.864 -0.293 1029 HA PHE 138 HA PHE 138 4.365 19.220 -0.150 1030 HB2 PHE 138 1HB PHE 138 2.504 19.987 -2.423 1031 HB3 PHE 138 2HB PHE 138 3.912 20.951 -2.033 1032 HD1 PHE 138 1HD PHE 138 3.988 17.188 -1.863 1033 HD2 PHE 138 2HD PHE 138 5.090 20.725 -4.073 1034 HE1 PHE 138 1HE PHE 138 5.316 15.818 -3.398 1035 HE2 PHE 138 2HE PHE 138 6.340 19.318 -5.666 1036 HZ PHE 138 HZ PHE 138 6.497 16.885 -5.333 1037 H TYR 139 H TYR 139 4.627 20.689 1.442 1038 HA TYR 139 HA TYR 139 2.517 22.620 2.145 1039 HB2 TYR 139 1HB TYR 139 4.458 23.467 3.621 1040 HB3 TYR 139 2HB TYR 139 3.658 21.961 4.032 1041 HD1 TYR 139 2HD TYR 139 6.664 23.128 2.028 1042 HD2 TYR 139 1HD TYR 139 4.965 20.158 4.685 1043 HE1 TYR 139 2HE TYR 139 8.804 21.937 2.056 1044 HE2 TYR 139 1HE TYR 139 7.109 18.976 4.729 1045 HH TYR 139 HH TYR 139 9.487 19.234 4.231 1046 HA PRO 140 HA PRO 140 4.532 25.712 -0.550 1047 HB2 PRO 140 1HB PRO 140 4.241 28.008 0.899 1048 HB3 PRO 140 2HB PRO 140 2.881 27.246 0.020 1049 HG2 PRO 140 1HG PRO 140 3.573 26.989 2.962 1050 HG3 PRO 140 2HG PRO 140 1.967 27.322 2.230 1051 HD2 PRO 140 1HD PRO 140 2.738 24.830 3.015 1052 HD3 PRO 140 2HD PRO 140 1.701 25.081 1.573 1053 H GLU 141 H GLU 141 6.592 26.907 -0.436 1054 HA GLU 141 HA GLU 141 8.371 25.936 1.728 1055 HB2 GLU 141 1HB GLU 141 8.739 26.142 -1.288 1056 HB3 GLU 141 2HB GLU 141 10.110 26.060 -0.187 1057 HG2 GLU 141 1HG GLU 141 9.819 23.852 0.275 1058 HG3 GLU 141 2HG GLU 141 8.067 23.947 0.298 Start of MODEL 7 1 H1 GLY 1 H GLY 1 16.281 17.378 -7.020 2 HA2 GLY 1 2HA GLY 1 14.229 16.027 -7.007 3 HA3 GLY 1 1HA GLY 1 15.663 15.051 -6.584 4 H MET 2 H MET 2 15.674 13.999 -4.672 5 HA MET 2 HA MET 2 15.036 13.270 -2.610 6 HB2 MET 2 1HB MET 2 15.094 16.274 -2.125 7 HB3 MET 2 2HB MET 2 15.179 15.029 -0.884 8 HG2 MET 2 1HG MET 2 17.386 15.748 -1.215 9 HG3 MET 2 2HG MET 2 17.257 14.150 -1.945 10 HE1 MET 2 3HE MET 2 19.693 16.083 -2.266 11 HE2 MET 2 1HE MET 2 19.625 14.511 -3.094 12 HE3 MET 2 2HE MET 2 20.060 15.975 -4.001 13 H SER 3 H SER 3 12.867 12.740 -3.864 14 HA SER 3 HA SER 3 10.649 13.818 -2.272 15 HB2 SER 3 1HB SER 3 11.142 15.374 -4.231 16 HB3 SER 3 2HB SER 3 10.700 14.065 -5.315 17 HG SER 3 HG SER 3 9.221 15.652 -3.561 18 H GLN 4 H GLN 4 10.511 12.041 -5.446 19 HA GLN 4 HA GLN 4 8.637 10.335 -4.285 20 HB2 GLN 4 1HB GLN 4 8.239 9.576 -6.343 21 HB3 GLN 4 2HB GLN 4 9.234 10.911 -6.807 22 HG2 GLN 4 1HG GLN 4 10.246 9.391 -8.126 23 HG3 GLN 4 2HG GLN 4 11.239 9.148 -6.718 24 HE21 GLN 4 1HE2 GLN 4 7.847 8.012 -7.348 25 HE22 GLN 4 2HE2 GLN 4 8.166 6.317 -7.143 26 H ASP 5 H ASP 5 12.071 10.028 -4.453 27 HA ASP 5 HA ASP 5 12.610 7.318 -3.798 28 HB2 ASP 5 1HB ASP 5 14.463 8.629 -4.330 29 HB3 ASP 5 2HB ASP 5 13.908 10.011 -3.381 30 H LEU 6 H LEU 6 12.062 10.151 -1.624 31 HA LEU 6 HA LEU 6 12.108 8.595 0.766 32 HB2 LEU 6 1HB LEU 6 10.914 11.340 0.130 33 HB3 LEU 6 2HB LEU 6 11.130 10.657 1.740 34 HG LEU 6 HG LEU 6 12.848 12.064 1.571 35 HD11 LEU 6 1HD1 LEU 6 14.924 10.878 1.530 36 HD12 LEU 6 2HD1 LEU 6 14.183 9.554 0.586 37 HD13 LEU 6 3HD1 LEU 6 13.690 9.828 2.258 38 HD21 LEU 6 3HD2 LEU 6 14.123 12.693 -0.154 39 HD22 LEU 6 1HD2 LEU 6 12.440 12.563 -0.763 40 HD23 LEU 6 2HD2 LEU 6 13.645 11.309 -1.181 41 H ILE 7 H ILE 7 9.475 10.054 -1.148 42 HA ILE 7 HA ILE 7 7.336 9.255 0.458 43 HB ILE 7 HB ILE 7 7.609 9.660 -2.505 44 HG12 ILE 7 1HG1 ILE 7 5.811 11.321 -0.768 45 HG13 ILE 7 2HG1 ILE 7 7.516 11.431 -0.352 46 HG21 ILE 7 1HG2 ILE 7 5.731 8.123 -2.395 47 HG22 ILE 7 2HG2 ILE 7 5.000 9.047 -1.066 48 HG23 ILE 7 3HG2 ILE 7 5.123 9.756 -2.693 49 HD11 ILE 7 3HD1 ILE 7 6.716 11.704 -3.251 50 HD12 ILE 7 1HD1 ILE 7 6.516 13.062 -2.131 51 HD13 ILE 7 2HD1 ILE 7 8.122 12.364 -2.370 52 H ARG 8 H ARG 8 8.842 7.339 -2.231 53 HA ARG 8 HA ARG 8 7.375 4.913 -1.878 54 HB2 ARG 8 1HB ARG 8 8.870 5.524 -3.802 55 HB3 ARG 8 2HB ARG 8 10.270 5.334 -2.740 56 HG2 ARG 8 1HG ARG 8 9.444 2.924 -2.345 57 HG3 ARG 8 2HG ARG 8 8.327 3.180 -3.686 58 HD2 ARG 8 1HD ARG 8 11.358 3.545 -3.813 59 HD3 ARG 8 2HD ARG 8 10.524 2.090 -4.318 60 HE ARG 8 HE ARG 8 10.503 4.748 -5.629 61 HH11 ARG 8 1HH1 ARG 8 9.396 1.314 -5.787 62 HH12 ARG 8 2HH1 ARG 8 9.163 1.378 -7.495 63 HH21 ARG 8 1HH2 ARG 8 9.963 4.820 -7.820 64 HH22 ARG 8 2HH2 ARG 8 9.270 3.443 -8.628 65 H ALA 9 H ALA 9 10.554 5.946 -0.430 66 HA ALA 9 HA ALA 9 10.941 3.697 1.168 67 HB1 ALA 9 1HB ALA 9 12.519 5.060 2.382 68 HB2 ALA 9 2HB ALA 9 12.601 5.518 0.673 69 HB3 ALA 9 3HB ALA 9 11.748 6.558 1.842 70 H ALA 10 H ALA 10 8.684 6.365 1.766 71 HA ALA 10 HA ALA 10 8.318 5.650 4.580 72 HB1 ALA 10 1HB ALA 10 7.989 7.928 3.848 73 HB2 ALA 10 2HB ALA 10 6.621 7.439 2.807 74 HB3 ALA 10 3HB ALA 10 6.527 7.271 4.579 75 H PHE 11 H PHE 11 6.889 4.695 1.479 76 HA PHE 11 HA PHE 11 4.433 3.690 2.546 77 HB2 PHE 11 1HB PHE 11 5.915 3.222 -0.028 78 HB3 PHE 11 2HB PHE 11 4.727 2.049 0.463 79 HD1 PHE 11 1HD PHE 11 4.955 5.803 0.263 80 HD2 PHE 11 2HD PHE 11 2.586 2.282 -0.390 81 HE1 PHE 11 1HE PHE 11 3.210 7.193 -0.803 82 HE2 PHE 11 2HE PHE 11 0.835 3.670 -1.474 83 HZ PHE 11 HZ PHE 11 1.121 6.146 -1.619 84 H GLU 12 H GLU 12 7.654 2.086 1.986 85 HA GLU 12 HA GLU 12 6.697 -0.341 3.164 86 HB2 GLU 12 1HB GLU 12 8.982 -1.077 3.066 87 HB3 GLU 12 2HB GLU 12 8.499 -0.377 1.533 88 HG2 GLU 12 1HG GLU 12 9.750 1.573 1.864 89 HG3 GLU 12 2HG GLU 12 10.063 1.225 3.580 90 H LYS 13 H LYS 13 7.903 2.604 4.616 91 HA LYS 13 HA LYS 13 8.859 1.327 7.029 92 HB2 LYS 13 1HB LYS 13 8.783 4.011 5.889 93 HB3 LYS 13 2HB LYS 13 8.066 4.071 7.494 94 HG2 LYS 13 1HG LYS 13 10.433 4.452 7.658 95 HG3 LYS 13 2HG LYS 13 9.990 2.898 8.409 96 HD2 LYS 13 1HD LYS 13 11.047 1.638 6.713 97 HD3 LYS 13 2HD LYS 13 10.918 2.930 5.530 98 HE2 LYS 13 1HE LYS 13 13.210 2.726 6.052 99 HE3 LYS 13 2HE LYS 13 12.639 4.238 6.774 100 HZ1 LYS 13 3HZ LYS 13 13.102 1.677 8.176 101 HZ2 LYS 13 1HZ LYS 13 12.491 3.015 8.900 102 HZ3 LYS 13 2HZ LYS 13 14.024 3.045 8.296 103 H ARG 14 H ARG 14 5.843 2.354 5.883 104 HA ARG 14 HA ARG 14 4.580 1.498 8.423 105 HB2 ARG 14 1HB ARG 14 3.466 2.787 5.985 106 HB3 ARG 14 2HB ARG 14 2.425 1.560 6.716 107 HG2 ARG 14 1HG ARG 14 3.692 3.726 8.410 108 HG3 ARG 14 2HG ARG 14 2.167 3.995 7.557 109 HD2 ARG 14 1HD ARG 14 0.984 2.444 8.830 110 HD3 ARG 14 2HD ARG 14 2.427 1.544 9.280 111 HE ARG 14 HE ARG 14 3.091 3.291 10.783 112 HH11 ARG 14 1HH1 ARG 14 -0.399 3.223 9.974 113 HH12 ARG 14 2HH1 ARG 14 -0.850 4.030 11.414 114 HH21 ARG 14 1HH2 ARG 14 2.473 4.354 12.620 115 HH22 ARG 14 2HH2 ARG 14 0.895 5.022 12.828 116 H LEU 15 H LEU 15 4.451 0.339 5.008 117 HA LEU 15 HA LEU 15 2.873 -1.833 5.781 118 HB2 LEU 15 1HB LEU 15 3.421 -0.677 3.428 119 HB3 LEU 15 2HB LEU 15 4.478 -2.075 3.245 120 HG LEU 15 HG LEU 15 1.481 -2.117 3.850 121 HD11 LEU 15 1HD1 LEU 15 2.004 -1.296 1.585 122 HD12 LEU 15 2HD1 LEU 15 1.211 -2.867 1.569 123 HD13 LEU 15 3HD1 LEU 15 2.967 -2.766 1.264 124 HD21 LEU 15 3HD2 LEU 15 3.383 -4.423 3.257 125 HD22 LEU 15 1HD2 LEU 15 1.606 -4.540 3.198 126 HD23 LEU 15 2HD2 LEU 15 2.395 -4.159 4.713 127 H SER 16 H SER 16 6.437 -1.854 5.161 128 HA SER 16 HA SER 16 6.733 -4.715 5.349 129 HB2 SER 16 1HB SER 16 8.271 -2.940 4.251 130 HB3 SER 16 2HB SER 16 8.881 -2.625 5.885 131 HG SER 16 HG SER 16 9.633 -4.713 5.984 132 H ASP 17 H ASP 17 7.336 -1.975 7.551 133 HA ASP 17 HA ASP 17 8.125 -3.400 9.786 134 HB2 ASP 17 1HB ASP 17 6.765 -0.716 9.481 135 HB3 ASP 17 2HB ASP 17 7.401 -1.299 11.015 136 H TRP 18 H TRP 18 4.757 -2.573 8.757 137 HA TRP 18 HA TRP 18 3.538 -3.756 11.134 138 HB2 TRP 18 1HB TRP 18 2.106 -2.389 9.922 139 HB3 TRP 18 2HB TRP 18 2.542 -3.078 8.365 140 HD1 TRP 18 HD TRP 18 0.426 -4.012 11.487 141 HE1 TRP 18 1HE TRP 18 -1.321 -5.774 10.832 142 HE3 TRP 18 3HE TRP 18 1.972 -4.919 6.714 143 HZ2 TRP 18 2HZ TRP 18 -1.935 -7.387 8.517 144 HZ3 TRP 18 3HZ TRP 18 0.855 -6.655 5.326 145 HH2 TRP 18 HH TRP 18 -1.113 -7.887 6.222 146 H ALA 19 H ALA 19 4.295 -4.896 7.805 147 HA ALA 19 HA ALA 19 2.982 -7.281 8.033 148 HB1 ALA 19 1HB ALA 19 5.505 -6.839 6.399 149 HB2 ALA 19 2HB ALA 19 4.296 -8.108 6.166 150 HB3 ALA 19 3HB ALA 19 3.853 -6.405 5.891 151 H LYS 20 H LYS 20 6.351 -6.635 8.878 152 HA LYS 20 HA LYS 20 6.962 -9.342 9.738 153 HB2 LYS 20 1HB LYS 20 9.067 -8.394 10.498 154 HB3 LYS 20 2HB LYS 20 8.680 -7.831 8.887 155 HG2 LYS 20 1HG LYS 20 9.344 -5.824 9.742 156 HG3 LYS 20 2HG LYS 20 7.658 -5.742 10.234 157 HD2 LYS 20 1HD LYS 20 8.435 -6.814 12.454 158 HD3 LYS 20 2HD LYS 20 10.067 -6.499 11.898 159 HE2 LYS 20 1HE LYS 20 9.551 -4.069 11.766 160 HE3 LYS 20 2HE LYS 20 7.912 -4.417 12.359 161 HZ1 LYS 20 3HZ LYS 20 10.449 -4.838 13.777 162 HZ2 LYS 20 1HZ LYS 20 9.052 -5.496 14.302 163 HZ3 LYS 20 2HZ LYS 20 9.226 -3.846 14.234 164 H ALA 21 H ALA 21 5.576 -6.511 11.359 165 HA ALA 21 HA ALA 21 6.063 -7.633 14.048 166 HB1 ALA 21 1HB ALA 21 5.084 -5.538 14.840 167 HB2 ALA 21 2HB ALA 21 6.370 -5.198 13.674 168 HB3 ALA 21 3HB ALA 21 4.659 -5.080 13.181 169 H ARG 22 H ARG 22 3.833 -8.258 11.606 170 HA ARG 22 HA ARG 22 1.572 -8.713 13.364 171 HB2 ARG 22 1HB ARG 22 1.933 -8.649 10.608 172 HB3 ARG 22 2HB ARG 22 1.969 -10.398 10.952 173 HG2 ARG 22 1HG ARG 22 -0.169 -10.000 12.310 174 HG3 ARG 22 2HG ARG 22 -0.185 -8.380 11.579 175 HD2 ARG 22 1HD ARG 22 -0.560 -9.263 9.389 176 HD3 ARG 22 2HD ARG 22 0.116 -10.817 9.837 177 HE ARG 22 HE ARG 22 -2.332 -10.085 11.269 178 HH11 ARG 22 1HH1 ARG 22 -1.036 -11.549 8.327 179 HH12 ARG 22 2HH1 ARG 22 -2.300 -12.692 8.082 180 HH21 ARG 22 1HH2 ARG 22 -4.103 -11.606 10.994 181 HH22 ARG 22 2HH2 ARG 22 -4.063 -12.773 9.714 182 H THR 23 H THR 23 0.946 -10.889 13.963 183 HA THR 23 HA THR 23 2.844 -12.633 15.032 184 HB THR 23 HB THR 23 -0.005 -13.053 14.082 185 HG1 THR 23 1HG THR 23 1.128 -12.803 16.661 186 HG21 THR 23 3HG2 THR 23 1.026 -15.240 14.022 187 HG22 THR 23 1HG2 THR 23 0.026 -15.117 15.488 188 HG23 THR 23 2HG2 THR 23 1.798 -14.971 15.591 189 HA PRO 24 HA PRO 24 2.868 -15.608 11.417 190 HB2 PRO 24 1HB PRO 24 1.782 -14.976 8.953 191 HB3 PRO 24 2HB PRO 24 0.962 -15.866 10.270 192 HG2 PRO 24 1HG PRO 24 0.818 -12.935 9.532 193 HG3 PRO 24 2HG PRO 24 -0.543 -14.039 9.944 194 HD2 PRO 24 1HD PRO 24 0.478 -12.348 11.790 195 HD3 PRO 24 2HD PRO 24 -0.005 -14.020 12.217 196 H ALA 25 H ALA 25 3.482 -12.471 11.069 197 HA ALA 25 HA ALA 25 4.886 -11.047 9.954 198 HB1 ALA 25 1HB ALA 25 6.729 -13.332 10.443 199 HB2 ALA 25 2HB ALA 25 7.191 -11.638 10.092 200 HB3 ALA 25 3HB ALA 25 6.286 -12.030 11.578 201 H LEU 26 H LEU 26 4.208 -10.675 7.932 202 HA LEU 26 HA LEU 26 4.578 -12.723 5.804 203 HB2 LEU 26 1HB LEU 26 2.998 -10.126 5.720 204 HB3 LEU 26 2HB LEU 26 2.955 -11.409 4.526 205 HG LEU 26 HG LEU 26 1.893 -11.567 7.370 206 HD11 LEU 26 1HD1 LEU 26 -0.299 -11.677 6.280 207 HD12 LEU 26 2HD1 LEU 26 0.455 -11.647 4.681 208 HD13 LEU 26 3HD1 LEU 26 0.547 -10.222 5.741 209 HD21 LEU 26 3HD2 LEU 26 1.802 -13.716 5.231 210 HD22 LEU 26 1HD2 LEU 26 0.930 -13.713 6.788 211 HD23 LEU 26 2HD2 LEU 26 2.697 -13.777 6.773 212 HA PRO 27 HA PRO 27 7.694 -10.138 3.753 213 HB2 PRO 27 1HB PRO 27 7.698 -11.113 1.231 214 HB3 PRO 27 2HB PRO 27 8.147 -12.144 2.615 215 HG2 PRO 27 1HG PRO 27 5.426 -11.978 1.267 216 HG3 PRO 27 2HG PRO 27 6.394 -13.450 1.588 217 HD2 PRO 27 1HD PRO 27 4.419 -12.564 3.274 218 HD3 PRO 27 2HD PRO 27 5.881 -13.367 3.885 219 H VAL 28 H VAL 28 7.753 -8.686 1.444 220 HA VAL 28 HA VAL 28 5.038 -7.744 0.785 221 HB VAL 28 HB VAL 28 7.183 -5.716 1.536 222 HG11 VAL 28 1HG1 VAL 28 5.248 -4.152 1.399 223 HG12 VAL 28 2HG1 VAL 28 5.529 -4.961 -0.143 224 HG13 VAL 28 3HG1 VAL 28 4.194 -5.492 0.908 225 HG21 VAL 28 3HG2 VAL 28 6.478 -6.739 3.642 226 HG22 VAL 28 1HG2 VAL 28 5.772 -5.129 3.471 227 HG23 VAL 28 2HG2 VAL 28 4.768 -6.556 3.181 228 H ALA 29 H ALA 29 5.239 -8.623 -1.311 229 HA ALA 29 HA ALA 29 7.552 -7.982 -2.944 230 HB1 ALA 29 1HB ALA 29 4.888 -9.302 -3.621 231 HB2 ALA 29 2HB ALA 29 6.222 -9.055 -4.768 232 HB3 ALA 29 3HB ALA 29 6.475 -10.090 -3.358 233 H TRP 30 H TRP 30 7.671 -5.740 -3.100 234 HA TRP 30 HA TRP 30 5.544 -4.010 -3.971 235 HB2 TRP 30 1HB TRP 30 8.566 -3.689 -4.121 236 HB3 TRP 30 2HB TRP 30 7.396 -2.402 -4.367 237 HD1 TRP 30 HD TRP 30 9.178 -4.273 -1.681 238 HE1 TRP 30 1HE TRP 30 8.564 -3.393 0.624 239 HE3 TRP 30 3HE TRP 30 5.215 -1.286 -3.009 240 HZ2 TRP 30 2HZ TRP 30 6.492 -1.777 1.763 241 HZ3 TRP 30 3HZ TRP 30 3.890 -0.141 -1.260 242 HH2 TRP 30 HH TRP 30 4.503 -0.370 1.134 243 H GLN 31 H GLN 31 6.235 -2.576 -6.068 244 HA GLN 31 HA GLN 31 5.747 -4.140 -8.432 245 HB2 GLN 31 1HB GLN 31 6.841 -1.330 -8.008 246 HB3 GLN 31 2HB GLN 31 6.451 -2.020 -9.594 247 HG2 GLN 31 1HG GLN 31 4.119 -2.293 -8.964 248 HG3 GLN 31 2HG GLN 31 4.428 -1.651 -7.343 249 HE21 GLN 31 1HE2 GLN 31 2.584 -0.636 -9.421 250 HE22 GLN 31 2HE2 GLN 31 3.069 1.060 -9.557 251 H ASN 32 H ASN 32 7.162 -4.964 -9.894 252 HA ASN 32 HA ASN 32 9.109 -5.762 -10.786 253 HB2 ASN 32 1HB ASN 32 9.497 -2.770 -10.724 254 HB3 ASN 32 2HB ASN 32 10.721 -3.829 -11.422 255 HD21 ASN 32 1HD2 ASN 32 7.838 -2.203 -12.206 256 HD22 ASN 32 2HD2 ASN 32 7.467 -3.121 -13.652 257 H THR 33 H THR 33 8.984 -6.035 -8.016 258 HA THR 33 HA THR 33 11.714 -5.728 -6.974 259 HB THR 33 HB THR 33 9.408 -5.439 -5.775 260 HG1 THR 33 1HG THR 33 11.758 -6.400 -4.799 261 HG21 THR 33 3HG2 THR 33 8.455 -7.375 -4.750 262 HG22 THR 33 1HG2 THR 33 9.673 -8.457 -5.421 263 HG23 THR 33 2HG2 THR 33 8.487 -7.674 -6.488 264 H LYS 34 H LYS 34 12.339 -8.035 -5.763 265 HA LYS 34 HA LYS 34 11.710 -10.395 -7.451 266 HB2 LYS 34 1HB LYS 34 14.473 -9.550 -6.515 267 HB3 LYS 34 2HB LYS 34 14.080 -11.090 -7.285 268 HG2 LYS 34 1HG LYS 34 13.564 -10.030 -9.380 269 HG3 LYS 34 2HG LYS 34 13.695 -8.403 -8.689 270 HD2 LYS 34 1HD LYS 34 15.996 -10.376 -8.739 271 HD3 LYS 34 2HD LYS 34 15.702 -9.164 -10.007 272 HE2 LYS 34 1HE LYS 34 15.846 -7.345 -8.344 273 HE3 LYS 34 2HE LYS 34 16.061 -8.514 -7.046 274 HZ1 LYS 34 3HZ LYS 34 17.957 -8.128 -9.290 275 HZ2 LYS 34 1HZ LYS 34 18.150 -9.197 -8.067 276 HZ3 LYS 34 2HZ LYS 34 18.153 -7.584 -7.766 277 H PHE 35 H PHE 35 10.426 -11.302 -5.804 278 HA PHE 35 HA PHE 35 11.665 -11.761 -3.134 279 HB2 PHE 35 1HB PHE 35 9.307 -10.041 -3.752 280 HB3 PHE 35 2HB PHE 35 9.012 -11.262 -2.541 281 HD1 PHE 35 2HD PHE 35 11.299 -8.398 -3.334 282 HD2 PHE 35 1HD PHE 35 9.843 -11.162 -0.378 283 HE1 PHE 35 2HE PHE 35 12.181 -6.927 -1.533 284 HE2 PHE 35 1HE PHE 35 10.762 -9.711 1.440 285 HZ PHE 35 HZ PHE 35 11.888 -7.573 0.865 286 H THR 36 H THR 36 11.827 -13.962 -3.243 287 HA THR 36 HA THR 36 9.426 -15.406 -3.193 288 HB THR 36 HB THR 36 10.220 -14.933 -5.785 289 HG1 THR 36 1HG THR 36 8.291 -15.563 -5.667 290 HG21 THR 36 3HG2 THR 36 12.154 -16.491 -5.607 291 HG22 THR 36 1HG2 THR 36 10.960 -16.887 -6.845 292 HG23 THR 36 2HG2 THR 36 11.002 -17.822 -5.337 293 HA PRO 37 HA PRO 37 9.146 -18.050 -3.632 294 HB2 PRO 37 1HB PRO 37 8.574 -19.855 -1.693 295 HB3 PRO 37 2HB PRO 37 9.786 -20.159 -2.970 296 HG2 PRO 37 1HG PRO 37 10.269 -19.144 -0.150 297 HG3 PRO 37 2HG PRO 37 11.076 -20.517 -0.984 298 HD2 PRO 37 1HD PRO 37 12.196 -18.037 -0.917 299 HD3 PRO 37 2HD PRO 37 12.308 -19.052 -2.382 300 HA PRO 38 HA PRO 38 6.332 -15.662 -0.967 301 HB2 PRO 38 1HB PRO 38 4.099 -17.311 -0.825 302 HB3 PRO 38 2HB PRO 38 4.446 -16.185 -2.191 303 HG2 PRO 38 1HG PRO 38 4.861 -19.155 -2.017 304 HG3 PRO 38 2HG PRO 38 4.408 -18.186 -3.446 305 HD2 PRO 38 1HD PRO 38 6.925 -19.129 -3.070 306 HD3 PRO 38 2HD PRO 38 6.582 -17.590 -3.911 307 H ALA 39 H ALA 39 4.733 -16.168 1.014 308 HA ALA 39 HA ALA 39 6.252 -17.778 2.914 309 HB1 ALA 39 1HB ALA 39 5.605 -15.565 3.698 310 HB2 ALA 39 2HB ALA 39 3.895 -15.881 3.297 311 HB3 ALA 39 3HB ALA 39 4.695 -16.789 4.600 312 H ALA 40 H ALA 40 5.692 -19.501 1.427 313 HA ALA 40 HA ALA 40 4.636 -21.447 0.851 314 HB1 ALA 40 1HB ALA 40 5.258 -21.967 3.179 315 HB2 ALA 40 2HB ALA 40 3.673 -21.380 3.729 316 HB3 ALA 40 3HB ALA 40 3.783 -22.798 2.666 317 H GLY 41 H GLY 41 3.327 -20.099 -0.632 318 HA2 GLY 41 2HA GLY 41 1.353 -20.092 -1.737 319 HA3 GLY 41 1HA GLY 41 0.502 -20.742 -0.342 320 H VAL 42 H VAL 42 2.045 -18.247 0.964 321 HA VAL 42 HA VAL 42 -0.235 -16.401 0.477 322 HB VAL 42 HB VAL 42 1.386 -16.771 3.032 323 HG11 VAL 42 1HG1 VAL 42 -0.467 -15.428 4.060 324 HG12 VAL 42 2HG1 VAL 42 0.551 -14.519 2.939 325 HG13 VAL 42 3HG1 VAL 42 -1.049 -15.086 2.406 326 HG21 VAL 42 3HG2 VAL 42 -1.436 -17.711 2.378 327 HG22 VAL 42 1HG2 VAL 42 -0.028 -18.757 2.646 328 HG23 VAL 42 2HG2 VAL 42 -0.674 -17.788 3.972 329 H TYR 43 H TYR 43 0.060 -14.385 -0.159 330 HA TYR 43 HA TYR 43 2.275 -12.867 0.752 331 HB2 TYR 43 1HB TYR 43 3.250 -12.198 -1.393 332 HB3 TYR 43 2HB TYR 43 3.507 -13.897 -1.074 333 HD1 TYR 43 2HD TYR 43 1.744 -15.583 -2.185 334 HD2 TYR 43 1HD TYR 43 2.495 -11.538 -3.526 335 HE1 TYR 43 2HE TYR 43 0.817 -16.130 -4.401 336 HE2 TYR 43 1HE TYR 43 1.571 -12.109 -5.753 337 HH TYR 43 HH TYR 43 0.577 -13.783 -7.087 338 H LEU 44 H LEU 44 2.113 -10.666 0.024 339 HA LEU 44 HA LEU 44 -0.642 -9.683 -0.608 340 HB2 LEU 44 1HB LEU 44 1.405 -8.836 1.457 341 HB3 LEU 44 2HB LEU 44 0.467 -7.602 0.691 342 HG LEU 44 HG LEU 44 -1.634 -8.584 1.429 343 HD11 LEU 44 1HD1 LEU 44 0.097 -10.791 2.557 344 HD12 LEU 44 2HD1 LEU 44 -1.292 -10.913 1.452 345 HD13 LEU 44 3HD1 LEU 44 -1.549 -10.460 3.138 346 HD21 LEU 44 3HD2 LEU 44 -1.425 -8.121 3.788 347 HD22 LEU 44 1HD2 LEU 44 -0.290 -7.048 2.940 348 HD23 LEU 44 2HD2 LEU 44 0.303 -8.504 3.762 349 H ARG 45 H ARG 45 -0.472 -9.210 -2.703 350 HA ARG 45 HA ARG 45 2.104 -8.562 -3.893 351 HB2 ARG 45 1HB ARG 45 0.248 -10.081 -4.739 352 HB3 ARG 45 2HB ARG 45 -0.669 -8.648 -5.149 353 HG2 ARG 45 1HG ARG 45 1.281 -7.962 -6.659 354 HG3 ARG 45 2HG ARG 45 2.018 -9.537 -6.296 355 HD2 ARG 45 1HD ARG 45 -0.030 -10.697 -7.079 356 HD3 ARG 45 2HD ARG 45 -0.796 -9.128 -7.385 357 HE ARG 45 HE ARG 45 1.708 -9.712 -8.847 358 HH11 ARG 45 1HH1 ARG 45 -1.886 -9.926 -8.906 359 HH12 ARG 45 2HH1 ARG 45 -1.955 -9.885 -10.627 360 HH21 ARG 45 1HH2 ARG 45 1.514 -9.905 -11.161 361 HH22 ARG 45 2HH2 ARG 45 -0.058 -10.050 -11.842 362 H ALA 46 H ALA 46 2.528 -6.599 -2.811 363 HA ALA 46 HA ALA 46 0.739 -4.410 -2.717 364 HB1 ALA 46 1HB ALA 46 2.448 -4.876 -0.993 365 HB2 ALA 46 2HB ALA 46 3.756 -4.723 -2.184 366 HB3 ALA 46 3HB ALA 46 2.839 -3.301 -1.699 367 H TYR 47 H TYR 47 0.191 -3.246 -4.576 368 HA TYR 47 HA TYR 47 2.378 -2.503 -6.461 369 HB2 TYR 47 1HB TYR 47 0.642 -4.374 -7.046 370 HB3 TYR 47 2HB TYR 47 -0.420 -3.003 -7.336 371 HD1 TYR 47 2HD TYR 47 0.267 -1.257 -9.014 372 HD2 TYR 47 1HD TYR 47 2.321 -5.010 -8.604 373 HE1 TYR 47 2HE TYR 47 1.150 -1.037 -11.379 374 HE2 TYR 47 1HE TYR 47 3.212 -4.786 -10.927 375 HH TYR 47 HH TYR 47 1.870 -2.486 -13.138 376 H VAL 48 H VAL 48 2.707 -0.549 -5.640 377 HA VAL 48 HA VAL 48 0.709 1.576 -5.312 378 HB VAL 48 HB VAL 48 2.900 2.905 -4.953 379 HG11 VAL 48 1HG1 VAL 48 2.412 0.609 -3.022 380 HG12 VAL 48 2HG1 VAL 48 3.221 2.145 -2.708 381 HG13 VAL 48 3HG1 VAL 48 1.480 2.130 -3.069 382 HG21 VAL 48 3HG2 VAL 48 4.218 1.058 -6.095 383 HG22 VAL 48 1HG2 VAL 48 4.893 1.704 -4.555 384 HG23 VAL 48 2HG2 VAL 48 4.030 0.135 -4.592 385 H MET 49 H MET 49 -0.012 1.312 -7.295 386 HA MET 49 HA MET 49 1.019 1.901 -9.892 387 HB2 MET 49 1HB MET 49 -1.592 1.477 -8.729 388 HB3 MET 49 2HB MET 49 -1.637 2.804 -9.896 389 HG2 MET 49 1HG MET 49 -0.788 1.464 -11.636 390 HG3 MET 49 2HG MET 49 -0.256 0.213 -10.522 391 HE1 MET 49 3HE MET 49 -1.775 -1.861 -9.679 392 HE2 MET 49 1HE MET 49 -2.478 -0.595 -8.636 393 HE3 MET 49 2HE MET 49 -3.523 -1.684 -9.568 394 HA PRO 50 HA PRO 50 1.980 6.125 -8.460 395 HB2 PRO 50 1HB PRO 50 3.844 6.815 -10.318 396 HB3 PRO 50 2HB PRO 50 4.209 5.615 -9.033 397 HG2 PRO 50 1HG PRO 50 3.286 5.093 -11.881 398 HG3 PRO 50 2HG PRO 50 4.717 4.397 -11.043 399 HD2 PRO 50 1HD PRO 50 2.327 3.061 -11.156 400 HD3 PRO 50 2HD PRO 50 3.391 2.997 -9.736 401 H ALA 51 H ALA 51 2.041 8.284 -9.740 402 HA ALA 51 HA ALA 51 -0.323 8.572 -11.412 403 HB1 ALA 51 1HB ALA 51 0.300 10.920 -11.447 404 HB2 ALA 51 2HB ALA 51 0.435 10.289 -9.794 405 HB3 ALA 51 3HB ALA 51 1.899 10.533 -10.756 406 H ALA 52 H ALA 52 0.283 7.034 -12.999 407 HA ALA 52 HA ALA 52 0.760 6.343 -15.041 408 HB1 ALA 52 1HB ALA 52 0.198 8.634 -15.809 409 HB2 ALA 52 2HB ALA 52 1.910 9.091 -15.662 410 HB3 ALA 52 3HB ALA 52 1.418 7.842 -16.823 411 H THR 53 H THR 53 2.288 4.965 -15.721 412 HA THR 53 HA THR 53 5.053 5.298 -14.758 413 HB THR 53 HB THR 53 5.219 2.897 -15.691 414 HG1 THR 53 1HG THR 53 3.125 3.175 -16.907 415 HG21 THR 53 3HG2 THR 53 3.176 3.383 -13.496 416 HG22 THR 53 1HG2 THR 53 4.945 3.485 -13.285 417 HG23 THR 53 2HG2 THR 53 4.202 1.947 -13.719 418 H ILE 54 H ILE 54 4.663 7.280 -16.597 419 HA ILE 54 HA ILE 54 6.075 6.260 -19.012 420 HB ILE 54 HB ILE 54 4.125 8.613 -18.909 421 HG12 ILE 54 1HG1 ILE 54 3.524 5.760 -19.683 422 HG13 ILE 54 2HG1 ILE 54 2.873 6.614 -18.283 423 HG21 ILE 54 1HG2 ILE 54 5.574 8.712 -20.879 424 HG22 ILE 54 2HG2 ILE 54 5.183 7.010 -21.283 425 HG23 ILE 54 3HG2 ILE 54 3.976 8.306 -21.382 426 HD11 ILE 54 3HD1 ILE 54 2.146 7.137 -21.169 427 HD12 ILE 54 1HD1 ILE 54 1.131 6.535 -19.859 428 HD13 ILE 54 2HD1 ILE 54 1.711 8.211 -19.816 429 H SER 55 H SER 55 6.900 7.547 -16.419 430 HA SER 55 HA SER 55 9.163 9.083 -17.308 431 HB2 SER 55 1HB SER 55 7.368 10.741 -17.783 432 HB3 SER 55 2HB SER 55 6.863 10.627 -16.108 433 HG SER 55 HG SER 55 8.902 11.994 -17.297 434 H ARG 56 H ARG 56 10.168 10.168 -15.291 435 HA ARG 56 HA ARG 56 9.436 8.899 -12.741 436 HB2 ARG 56 1HB ARG 56 11.723 8.221 -12.195 437 HB3 ARG 56 2HB ARG 56 10.961 7.304 -13.496 438 HG2 ARG 56 1HG ARG 56 12.168 8.605 -15.167 439 HG3 ARG 56 2HG ARG 56 12.996 9.537 -13.907 440 HD2 ARG 56 1HD ARG 56 13.964 7.449 -12.992 441 HD3 ARG 56 2HD ARG 56 13.131 6.508 -14.247 442 HE ARG 56 HE ARG 56 14.707 8.487 -15.525 443 HH11 ARG 56 1HH1 ARG 56 15.163 5.487 -13.597 444 HH12 ARG 56 2HH1 ARG 56 16.664 5.123 -14.363 445 HH21 ARG 56 1HH2 ARG 56 16.800 7.945 -16.468 446 HH22 ARG 56 2HH2 ARG 56 17.451 6.391 -16.125 447 H ASP 57 H ASP 57 8.980 11.529 -13.676 448 HA ASP 57 HA ASP 57 10.874 13.431 -12.797 449 HB2 ASP 57 1HB ASP 57 9.241 14.931 -13.401 450 HB3 ASP 57 2HB ASP 57 8.700 13.556 -14.321 451 H ALA 58 H ALA 58 10.966 14.635 -10.904 452 HA ALA 58 HA ALA 58 9.385 14.366 -8.556 453 HB1 ALA 58 1HB ALA 58 11.085 13.121 -7.175 454 HB2 ALA 58 2HB ALA 58 10.355 12.100 -8.413 455 HB3 ALA 58 3HB ALA 58 11.991 12.745 -8.653 456 H ALA 59 H ALA 59 9.815 16.772 -9.183 457 HA ALA 59 HA ALA 59 12.586 17.685 -8.640 458 HB1 ALA 59 1HB ALA 59 11.745 18.226 -10.870 459 HB2 ALA 59 2HB ALA 59 10.328 19.042 -10.160 460 HB3 ALA 59 3HB ALA 59 11.961 19.690 -9.917 461 H GLY 60 H GLY 60 9.758 17.419 -6.910 462 HA2 GLY 60 2HA GLY 60 8.850 18.496 -5.092 463 HA3 GLY 60 1HA GLY 60 10.408 19.340 -4.872 464 H ASP 61 H ASP 61 8.319 19.456 -7.807 465 HA ASP 61 HA ASP 61 7.483 22.226 -7.299 466 HB2 ASP 61 1HB ASP 61 9.632 22.867 -7.918 467 HB3 ASP 61 2HB ASP 61 9.838 21.492 -9.010 468 H HIS 62 H HIS 62 8.248 20.492 -10.230 469 HA HIS 62 HA HIS 62 5.798 21.291 -11.399 470 HB2 HIS 62 1HB HIS 62 8.155 20.397 -12.450 471 HB3 HIS 62 2HB HIS 62 7.126 18.969 -12.675 472 HD1 HIS 62 1HD HIS 62 7.428 22.628 -13.832 473 HD2 HIS 62 2HD HIS 62 4.988 19.195 -14.306 474 HE1 HIS 62 1HE HIS 62 5.848 23.134 -15.742 475 H ARG 63 H ARG 63 3.821 20.515 -10.966 476 HA ARG 63 HA ARG 63 2.136 19.146 -10.440 477 HB2 ARG 63 1HB ARG 63 3.715 17.774 -12.506 478 HB3 ARG 63 2HB ARG 63 2.888 16.592 -11.498 479 HG2 ARG 63 1HG ARG 63 1.283 17.058 -13.148 480 HG3 ARG 63 2HG ARG 63 0.763 18.006 -11.763 481 HD2 ARG 63 1HD ARG 63 0.561 19.613 -13.378 482 HD3 ARG 63 2HD ARG 63 2.241 19.918 -12.928 483 HE ARG 63 HE ARG 63 2.355 17.978 -14.905 484 HH11 ARG 63 1HH1 ARG 63 1.271 21.330 -14.667 485 HH12 ARG 63 2HH1 ARG 63 1.375 21.682 -16.358 486 HH21 ARG 63 1HH2 ARG 63 2.270 18.308 -17.199 487 HH22 ARG 63 2HH2 ARG 63 2.144 19.915 -17.819 488 H GLN 64 H GLN 64 1.983 16.360 -9.712 489 HA GLN 64 HA GLN 64 3.313 16.290 -7.129 490 HB2 GLN 64 1HB GLN 64 1.112 16.556 -5.972 491 HB3 GLN 64 2HB GLN 64 1.740 18.003 -6.695 492 HG2 GLN 64 1HG GLN 64 0.177 17.777 -8.624 493 HG3 GLN 64 2HG GLN 64 -0.464 16.280 -7.928 494 HE21 GLN 64 1HE2 GLN 64 0.277 19.623 -6.774 495 HE22 GLN 64 2HE2 GLN 64 -1.218 19.863 -5.914 496 H TYR 65 H TYR 65 2.181 14.440 -5.813 497 HA TYR 65 HA TYR 65 2.249 12.116 -7.644 498 HB2 TYR 65 1HB TYR 65 2.544 12.282 -4.626 499 HB3 TYR 65 2HB TYR 65 2.767 10.847 -5.613 500 HD1 TYR 65 1HD TYR 65 4.527 10.984 -7.500 501 HD2 TYR 65 2HD TYR 65 4.370 13.739 -4.188 502 HE1 TYR 65 1HE TYR 65 6.964 11.527 -7.804 503 HE2 TYR 65 2HE TYR 65 6.719 14.328 -4.521 504 HH TYR 65 HH TYR 65 8.605 13.932 -5.728 505 H ARG 66 H ARG 66 0.419 11.052 -8.093 506 HA ARG 66 HA ARG 66 -1.714 10.867 -6.029 507 HB2 ARG 66 1HB ARG 66 -2.468 11.554 -8.873 508 HB3 ARG 66 2HB ARG 66 -3.504 11.328 -7.449 509 HG2 ARG 66 1HG ARG 66 -2.656 13.353 -6.429 510 HG3 ARG 66 2HG ARG 66 -1.493 13.580 -7.757 511 HD2 ARG 66 1HD ARG 66 -3.462 15.006 -8.040 512 HD3 ARG 66 2HD ARG 66 -3.205 13.830 -9.366 513 HE ARG 66 HE ARG 66 -5.071 13.152 -7.159 514 HH11 ARG 66 1HH1 ARG 66 -4.802 14.373 -10.431 515 HH12 ARG 66 2HH1 ARG 66 -6.056 13.370 -11.113 516 HH21 ARG 66 1HH2 ARG 66 -7.046 12.119 -7.912 517 HH22 ARG 66 2HH2 ARG 66 -7.615 12.366 -9.512 518 H GLY 67 H GLY 67 -1.734 8.682 -5.758 519 HA2 GLY 67 2HA GLY 67 -1.391 6.936 -8.166 520 HA3 GLY 67 1HA GLY 67 -0.398 6.692 -6.759 521 H VAL 68 H VAL 68 -1.825 4.598 -7.414 522 HA VAL 68 HA VAL 68 -3.851 4.435 -5.276 523 HB VAL 68 HB VAL 68 -5.285 4.453 -7.101 524 HG11 VAL 68 1HG1 VAL 68 -3.625 2.430 -8.625 525 HG12 VAL 68 2HG1 VAL 68 -5.131 3.201 -9.153 526 HG13 VAL 68 3HG1 VAL 68 -3.673 4.174 -8.990 527 HG21 VAL 68 3HG2 VAL 68 -4.769 1.465 -6.657 528 HG22 VAL 68 1HG2 VAL 68 -5.642 2.529 -5.527 529 HG23 VAL 68 2HG2 VAL 68 -6.270 2.240 -7.149 530 H PHE 69 H PHE 69 -3.585 2.685 -4.029 531 HA PHE 69 HA PHE 69 -1.159 1.013 -4.515 532 HB2 PHE 69 1HB PHE 69 -1.414 2.171 -2.268 533 HB3 PHE 69 2HB PHE 69 -2.953 1.316 -2.071 534 HD1 PHE 69 2HD PHE 69 0.304 0.042 -3.418 535 HD2 PHE 69 1HD PHE 69 -2.578 -0.100 -0.197 536 HE1 PHE 69 2HE PHE 69 1.471 -1.871 -2.486 537 HE2 PHE 69 1HE PHE 69 -1.487 -2.181 0.619 538 HZ PHE 69 HZ PHE 69 0.526 -3.072 -0.502 539 H GLN 70 H GLN 70 -1.581 -1.333 -4.397 540 HA GLN 70 HA GLN 70 -4.361 -2.204 -4.166 541 HB2 GLN 70 1HB GLN 70 -3.863 -2.143 -6.629 542 HB3 GLN 70 2HB GLN 70 -2.436 -3.119 -6.340 543 HG2 GLN 70 1HG GLN 70 -4.051 -4.592 -7.161 544 HG3 GLN 70 2HG GLN 70 -3.934 -4.962 -5.455 545 HE21 GLN 70 1HE2 GLN 70 -6.102 -4.517 -7.931 546 HE22 GLN 70 2HE2 GLN 70 -7.553 -4.265 -6.952 547 H VAL 71 H VAL 71 -4.363 -4.013 -2.726 548 HA VAL 71 HA VAL 71 -1.883 -5.625 -2.655 549 HB VAL 71 HB VAL 71 -1.562 -4.386 -0.730 550 HG11 VAL 71 1HG1 VAL 71 -3.797 -3.374 -0.339 551 HG12 VAL 71 2HG1 VAL 71 -4.363 -4.940 0.281 552 HG13 VAL 71 3HG1 VAL 71 -3.087 -4.056 1.127 553 HG21 VAL 71 3HG2 VAL 71 -1.261 -6.841 -0.566 554 HG22 VAL 71 1HG2 VAL 71 -1.556 -6.051 0.999 555 HG23 VAL 71 2HG2 VAL 71 -2.849 -6.964 0.213 556 H ASN 72 H ASN 72 -2.647 -7.082 -3.952 557 HA ASN 72 HA ASN 72 -5.260 -8.413 -3.448 558 HB2 ASN 72 1HB ASN 72 -2.981 -8.905 -5.397 559 HB3 ASN 72 2HB ASN 72 -4.082 -10.205 -4.940 560 HD21 ASN 72 1HD2 ASN 72 -3.883 -7.163 -6.737 561 HD22 ASN 72 2HD2 ASN 72 -5.497 -7.386 -7.437 562 H VAL 73 H VAL 73 -5.105 -8.969 -1.294 563 HA VAL 73 HA VAL 73 -2.967 -10.522 -0.097 564 HB VAL 73 HB VAL 73 -5.955 -10.556 0.523 565 HG11 VAL 73 1HG1 VAL 73 -3.597 -11.293 2.288 566 HG12 VAL 73 2HG1 VAL 73 -5.314 -11.355 2.737 567 HG13 VAL 73 3HG1 VAL 73 -4.686 -12.443 1.497 568 HG21 VAL 73 3HG2 VAL 73 -3.906 -8.783 1.876 569 HG22 VAL 73 1HG2 VAL 73 -5.156 -8.234 0.738 570 HG23 VAL 73 2HG2 VAL 73 -5.633 -8.973 2.267 571 H VAL 74 H VAL 74 -2.403 -12.524 -1.023 572 HA VAL 74 HA VAL 74 -4.660 -14.224 -1.902 573 HB VAL 74 HB VAL 74 -3.483 -13.420 -3.824 574 HG11 VAL 74 1HG1 VAL 74 -1.184 -13.951 -4.280 575 HG12 VAL 74 2HG1 VAL 74 -1.327 -12.811 -2.928 576 HG13 VAL 74 3HG1 VAL 74 -0.966 -14.528 -2.615 577 HG21 VAL 74 3HG2 VAL 74 -2.906 -15.521 -4.880 578 HG22 VAL 74 1HG2 VAL 74 -2.786 -16.316 -3.300 579 HG23 VAL 74 2HG2 VAL 74 -4.358 -15.688 -3.880 580 H MET 75 H MET 75 -4.777 -16.178 -1.022 581 HA MET 75 HA MET 75 -2.603 -17.332 0.510 582 HB2 MET 75 1HB MET 75 -5.390 -16.865 1.698 583 HB3 MET 75 2HB MET 75 -4.131 -17.815 2.451 584 HG2 MET 75 1HG MET 75 -3.086 -16.010 3.309 585 HG3 MET 75 2HG MET 75 -3.280 -15.052 1.853 586 HE1 MET 75 3HE MET 75 -6.997 -15.420 2.130 587 HE2 MET 75 1HE MET 75 -6.927 -13.646 2.220 588 HE3 MET 75 2HE MET 75 -5.871 -14.509 1.100 589 HA PRO 76 HA PRO 76 -4.335 -20.606 -1.829 590 HB2 PRO 76 1HB PRO 76 -3.538 -22.876 -0.541 591 HB3 PRO 76 2HB PRO 76 -2.368 -21.726 -1.266 592 HG2 PRO 76 1HG PRO 76 -3.287 -21.865 1.634 593 HG3 PRO 76 2HG PRO 76 -1.605 -21.822 1.018 594 HD2 PRO 76 1HD PRO 76 -2.875 -19.576 1.843 595 HD3 PRO 76 2HD PRO 76 -1.764 -19.551 0.450 596 H ILE 77 H ILE 77 -5.777 -22.659 -1.641 597 HA ILE 77 HA ILE 77 -7.783 -22.365 0.548 598 HB ILE 77 HB ILE 77 -8.341 -23.428 -2.227 599 HG12 ILE 77 1HG1 ILE 77 -8.732 -20.641 -1.077 600 HG13 ILE 77 2HG1 ILE 77 -7.711 -21.067 -2.411 601 HG21 ILE 77 1HG2 ILE 77 -9.809 -24.128 -0.298 602 HG22 ILE 77 2HG2 ILE 77 -10.150 -22.421 0.024 603 HG23 ILE 77 3HG2 ILE 77 -10.677 -23.185 -1.498 604 HD11 ILE 77 3HD1 ILE 77 -9.649 -19.998 -3.287 605 HD12 ILE 77 1HD1 ILE 77 -9.699 -21.710 -3.763 606 HD13 ILE 77 2HD1 ILE 77 -10.734 -21.103 -2.441 607 H GLY 78 H GLY 78 -6.348 -23.681 1.834 608 HA2 GLY 78 2HA GLY 78 -6.939 -26.562 1.472 609 HA3 GLY 78 1HA GLY 78 -5.235 -26.085 1.542 610 H ASP 79 H ASP 79 -4.979 -24.263 3.460 611 HA ASP 79 HA ASP 79 -6.220 -25.234 5.963 612 HB2 ASP 79 1HB ASP 79 -4.466 -26.834 5.440 613 HB3 ASP 79 2HB ASP 79 -3.290 -25.570 5.259 614 H GLY 80 H GLY 80 -6.902 -23.300 6.650 615 HA2 GLY 80 2HA GLY 80 -6.426 -21.340 7.893 616 HA3 GLY 80 1HA GLY 80 -4.956 -21.093 6.984 617 H SER 81 H SER 81 -7.988 -21.763 5.059 618 HA SER 81 HA SER 81 -7.204 -19.658 3.390 619 HB2 SER 81 1HB SER 81 -9.444 -20.221 2.326 620 HB3 SER 81 2HB SER 81 -8.270 -21.528 2.456 621 HG SER 81 HG SER 81 -10.677 -21.658 3.168 622 H ARG 82 H ARG 82 -9.564 -19.763 6.013 623 HA ARG 82 HA ARG 82 -10.689 -17.141 5.369 624 HB2 ARG 82 1HB ARG 82 -10.988 -18.770 7.914 625 HB3 ARG 82 2HB ARG 82 -11.775 -17.239 7.557 626 HG2 ARG 82 1HG ARG 82 -13.441 -18.569 6.906 627 HG3 ARG 82 2HG ARG 82 -12.620 -18.466 5.352 628 HD2 ARG 82 1HD ARG 82 -11.661 -20.675 5.595 629 HD3 ARG 82 2HD ARG 82 -11.967 -20.675 7.325 630 HE ARG 82 HE ARG 82 -13.844 -21.393 5.240 631 HH11 ARG 82 1HH1 ARG 82 -13.576 -20.497 8.651 632 HH12 ARG 82 2HH1 ARG 82 -15.257 -20.678 9.017 633 HH21 ARG 82 1HH2 ARG 82 -16.148 -21.579 5.696 634 HH22 ARG 82 2HH2 ARG 82 -16.735 -21.196 7.286 635 H SER 83 H SER 83 -8.292 -16.480 5.145 636 HA SER 83 HA SER 83 -7.402 -15.126 7.671 637 HB2 SER 83 1HB SER 83 -5.933 -16.228 5.267 638 HB3 SER 83 2HB SER 83 -5.172 -15.091 6.386 639 HG SER 83 HG SER 83 -6.063 -17.746 6.748 640 H ALA 84 H ALA 84 -8.795 -14.573 4.547 641 HA ALA 84 HA ALA 84 -7.634 -12.113 3.801 642 HB1 ALA 84 1HB ALA 84 -9.733 -11.725 2.587 643 HB2 ALA 84 2HB ALA 84 -9.156 -13.376 2.309 644 HB3 ALA 84 3HB ALA 84 -10.516 -13.073 3.421 645 H GLU 85 H GLU 85 -10.498 -12.677 6.014 646 HA GLU 85 HA GLU 85 -11.090 -9.879 6.115 647 HB2 GLU 85 1HB GLU 85 -11.960 -12.066 8.051 648 HB3 GLU 85 2HB GLU 85 -12.728 -10.517 7.739 649 HG2 GLU 85 1HG GLU 85 -13.072 -11.300 5.335 650 HG3 GLU 85 2HG GLU 85 -12.580 -12.904 5.870 651 H GLN 86 H GLN 86 -9.237 -12.128 8.099 652 HA GLN 86 HA GLN 86 -8.591 -10.456 10.302 653 HB2 GLN 86 1HB GLN 86 -7.744 -13.007 9.185 654 HB3 GLN 86 2HB GLN 86 -6.302 -12.075 9.489 655 HG2 GLN 86 1HG GLN 86 -8.178 -11.948 11.760 656 HG3 GLN 86 2HG GLN 86 -7.769 -13.603 11.312 657 HE21 GLN 86 1HE2 GLN 86 -6.246 -10.454 12.273 658 HE22 GLN 86 2HE2 GLN 86 -4.946 -11.273 13.113 659 H VAL 87 H VAL 87 -6.827 -11.008 7.233 660 HA VAL 87 HA VAL 87 -4.887 -8.943 7.652 661 HB VAL 87 HB VAL 87 -5.866 -10.485 5.207 662 HG11 VAL 87 1HG1 VAL 87 -4.810 -8.584 4.308 663 HG12 VAL 87 2HG1 VAL 87 -3.482 -8.620 5.493 664 HG13 VAL 87 3HG1 VAL 87 -3.608 -9.867 4.225 665 HG21 VAL 87 3HG2 VAL 87 -4.722 -11.799 7.083 666 HG22 VAL 87 1HG2 VAL 87 -3.910 -11.848 5.523 667 HG23 VAL 87 2HG2 VAL 87 -3.296 -10.782 6.806 668 H ALA 88 H ALA 88 -8.073 -8.811 6.003 669 HA ALA 88 HA ALA 88 -7.742 -6.151 5.142 670 HB1 ALA 88 1HB ALA 88 -10.184 -6.116 4.958 671 HB2 ALA 88 2HB ALA 88 -9.590 -7.690 4.416 672 HB3 ALA 88 3HB ALA 88 -10.324 -7.525 6.026 673 H ALA 89 H ALA 89 -8.670 -7.402 8.329 674 HA ALA 89 HA ALA 89 -9.536 -4.755 9.277 675 HB1 ALA 89 1HB ALA 89 -9.009 -7.395 10.707 676 HB2 ALA 89 2HB ALA 89 -9.615 -5.923 11.493 677 HB3 ALA 89 3HB ALA 89 -10.579 -6.710 10.231 678 H GLU 90 H GLU 90 -6.550 -6.567 9.192 679 HA GLU 90 HA GLU 90 -5.141 -4.935 11.170 680 HB2 GLU 90 1HB GLU 90 -4.258 -6.980 9.092 681 HB3 GLU 90 2HB GLU 90 -3.145 -6.056 10.085 682 HG2 GLU 90 1HG GLU 90 -5.090 -7.125 11.893 683 HG3 GLU 90 2HG GLU 90 -4.735 -8.414 10.748 684 H LEU 91 H LEU 91 -4.900 -5.366 7.663 685 HA LEU 91 HA LEU 91 -3.282 -3.186 7.015 686 HB2 LEU 91 1HB LEU 91 -5.548 -4.533 5.502 687 HB3 LEU 91 2HB LEU 91 -4.522 -3.332 4.750 688 HG LEU 91 HG LEU 91 -3.351 -5.841 6.010 689 HD11 LEU 91 1HD1 LEU 91 -4.251 -5.376 3.137 690 HD12 LEU 91 2HD1 LEU 91 -4.989 -6.465 4.338 691 HD13 LEU 91 3HD1 LEU 91 -3.351 -6.790 3.746 692 HD21 LEU 91 3HD2 LEU 91 -1.725 -4.026 5.601 693 HD22 LEU 91 1HD2 LEU 91 -2.274 -3.902 3.919 694 HD23 LEU 91 2HD2 LEU 91 -1.461 -5.370 4.489 695 H ASP 92 H ASP 92 -6.862 -3.251 7.365 696 HA ASP 92 HA ASP 92 -7.364 -0.571 6.724 697 HB2 ASP 92 1HB ASP 92 -9.187 -2.072 6.873 698 HB3 ASP 92 2HB ASP 92 -8.754 -2.548 8.527 699 H ALA 93 H ALA 93 -6.893 -2.024 9.995 700 HA ALA 93 HA ALA 93 -7.151 0.414 11.384 701 HB1 ALA 93 1HB ALA 93 -6.025 -0.822 13.258 702 HB2 ALA 93 2HB ALA 93 -7.354 -1.736 12.510 703 HB3 ALA 93 3HB ALA 93 -5.662 -2.136 12.124 704 H LEU 94 H LEU 94 -4.324 -1.212 10.021 705 HA LEU 94 HA LEU 94 -2.394 0.577 11.143 706 HB2 LEU 94 1HB LEU 94 -2.118 -1.848 10.535 707 HB3 LEU 94 2HB LEU 94 -2.113 -1.410 8.842 708 HG LEU 94 HG LEU 94 0.039 -1.866 10.234 709 HD11 LEU 94 1HD1 LEU 94 0.144 -1.368 7.906 710 HD12 LEU 94 2HD1 LEU 94 1.427 -0.484 8.732 711 HD13 LEU 94 3HD1 LEU 94 -0.032 0.378 8.200 712 HD21 LEU 94 3HD2 LEU 94 -0.008 1.095 10.759 713 HD22 LEU 94 1HD2 LEU 94 1.229 -0.086 11.209 714 HD23 LEU 94 2HD2 LEU 94 -0.373 -0.164 11.963 715 H PHE 95 H PHE 95 -4.365 0.750 8.262 716 HA PHE 95 HA PHE 95 -2.822 3.158 7.419 717 HB2 PHE 95 1HB PHE 95 -4.235 1.149 5.643 718 HB3 PHE 95 2HB PHE 95 -3.794 2.761 5.159 719 HD1 PHE 95 1HD PHE 95 -2.297 -0.494 6.261 720 HD2 PHE 95 2HD PHE 95 -1.635 3.411 4.589 721 HE1 PHE 95 1HE PHE 95 -0.008 -1.148 5.619 722 HE2 PHE 95 2HE PHE 95 0.708 2.847 4.161 723 HZ PHE 95 HZ PHE 95 1.535 0.517 4.610 724 HA PRO 96 HA PRO 96 -6.948 4.511 9.005 725 HB2 PRO 96 1HB PRO 96 -6.123 6.474 10.653 726 HB3 PRO 96 2HB PRO 96 -5.974 4.755 11.107 727 HG2 PRO 96 1HG PRO 96 -3.813 6.491 9.870 728 HG3 PRO 96 2HG PRO 96 -3.732 5.545 11.395 729 HD2 PRO 96 1HD PRO 96 -2.853 4.487 9.074 730 HD3 PRO 96 2HD PRO 96 -3.769 3.495 10.246 731 H VAL 97 H VAL 97 -7.987 6.661 8.481 732 HA VAL 97 HA VAL 97 -7.220 7.419 5.906 733 HB VAL 97 HB VAL 97 -9.501 7.176 6.737 734 HG11 VAL 97 1HG1 VAL 97 -10.628 8.942 7.986 735 HG12 VAL 97 2HG1 VAL 97 -9.265 8.335 8.923 736 HG13 VAL 97 3HG1 VAL 97 -9.122 9.884 8.078 737 HG21 VAL 97 3HG2 VAL 97 -10.563 8.810 5.411 738 HG22 VAL 97 1HG2 VAL 97 -9.243 9.976 5.621 739 HG23 VAL 97 2HG2 VAL 97 -9.000 8.512 4.643 740 H ASN 98 H ASN 98 -5.947 8.727 8.625 741 HA ASN 98 HA ASN 98 -5.163 11.292 7.334 742 HB2 ASN 98 1HB ASN 98 -4.437 10.002 10.009 743 HB3 ASN 98 2HB ASN 98 -3.430 11.280 9.343 744 HD21 ASN 98 1HD2 ASN 98 -6.962 10.711 9.825 745 HD22 ASN 98 2HD2 ASN 98 -7.293 12.382 10.259 746 H LEU 99 H LEU 99 -3.814 8.204 8.021 747 HA LEU 99 HA LEU 99 -1.804 7.280 7.851 748 HB2 LEU 99 1HB LEU 99 -3.369 7.150 5.781 749 HB3 LEU 99 2HB LEU 99 -2.154 8.062 4.969 750 HG LEU 99 HG LEU 99 -2.306 5.297 5.252 751 HD11 LEU 99 1HD1 LEU 99 -0.009 7.041 4.406 752 HD12 LEU 99 2HD1 LEU 99 -1.327 6.440 3.391 753 HD13 LEU 99 3HD1 LEU 99 -0.168 5.291 4.033 754 HD21 LEU 99 3HD2 LEU 99 0.035 6.145 7.001 755 HD22 LEU 99 1HD2 LEU 99 -0.189 4.544 6.293 756 HD23 LEU 99 2HD2 LEU 99 -1.358 5.137 7.459 757 H VAL 100 H VAL 100 -0.617 8.862 9.042 758 HA VAL 100 HA VAL 100 0.802 11.051 7.937 759 HB VAL 100 HB VAL 100 1.809 10.955 10.274 760 HG11 VAL 100 1HG1 VAL 100 -1.229 10.650 10.231 761 HG12 VAL 100 2HG1 VAL 100 -0.247 11.390 11.508 762 HG13 VAL 100 3HG1 VAL 100 -0.326 12.145 9.911 763 HG21 VAL 100 3HG2 VAL 100 1.374 9.159 11.734 764 HG22 VAL 100 1HG2 VAL 100 -0.061 8.619 10.832 765 HG23 VAL 100 2HG2 VAL 100 1.545 8.315 10.168 766 H MET 101 H MET 101 1.597 9.041 6.267 767 HA MET 101 HA MET 101 4.213 7.961 6.923 768 HB2 MET 101 1HB MET 101 2.729 8.249 4.306 769 HB3 MET 101 2HB MET 101 4.307 7.466 4.469 770 HG2 MET 101 1HG MET 101 3.231 5.932 6.197 771 HG3 MET 101 2HG MET 101 1.677 6.583 5.677 772 HE1 MET 101 3HE MET 101 1.754 5.458 1.803 773 HE2 MET 101 1HE MET 101 1.374 6.845 2.830 774 HE3 MET 101 2HE MET 101 3.017 6.632 2.207 775 H GLN 102 H GLN 102 4.630 10.303 7.806 776 HA GLN 102 HA GLN 102 6.037 12.160 6.123 777 HB2 GLN 102 1HB GLN 102 6.614 11.170 8.949 778 HB3 GLN 102 2HB GLN 102 7.451 12.495 8.128 779 HG2 GLN 102 1HG GLN 102 5.215 13.646 7.842 780 HG3 GLN 102 2HG GLN 102 4.491 12.388 8.865 781 HE21 GLN 102 1HE2 GLN 102 7.084 14.888 8.761 782 HE22 GLN 102 2HE2 GLN 102 7.090 15.199 10.487 783 H SER 103 H SER 103 7.934 12.014 5.162 784 HA SER 103 HA SER 103 9.468 9.483 5.198 785 HB2 SER 103 1HB SER 103 9.379 11.191 2.761 786 HB3 SER 103 2HB SER 103 9.368 9.444 2.931 787 HG SER 103 HG SER 103 7.037 9.929 3.651 788 H GLY 104 H GLY 104 11.725 10.118 4.039 789 HA2 GLY 104 2HA GLY 104 13.164 12.089 5.413 790 HA3 GLY 104 1HA GLY 104 13.587 11.399 3.817 791 H GLY 105 H GLY 105 10.612 13.179 3.656 792 HA2 GLY 105 2HA GLY 105 12.023 15.286 2.119 793 HA3 GLY 105 1HA GLY 105 11.119 14.037 1.219 794 H LEU 106 H LEU 106 8.820 13.634 2.144 795 HA LEU 106 HA LEU 106 7.495 16.143 2.922 796 HB2 LEU 106 1HB LEU 106 6.151 14.357 0.876 797 HB3 LEU 106 2HB LEU 106 5.865 16.019 1.276 798 HG LEU 106 HG LEU 106 7.998 16.637 0.071 799 HD11 LEU 106 1HD1 LEU 106 8.413 14.603 -1.702 800 HD12 LEU 106 2HD1 LEU 106 8.053 13.657 -0.236 801 HD13 LEU 106 3HD1 LEU 106 9.380 14.837 -0.263 802 HD21 LEU 106 3HD2 LEU 106 5.761 15.175 -1.429 803 HD22 LEU 106 1HD2 LEU 106 6.886 16.348 -2.156 804 HD23 LEU 106 2HD2 LEU 106 5.754 16.873 -0.917 805 H ALA 107 H ALA 107 4.965 15.207 2.949 806 HA ALA 107 HA ALA 107 4.919 12.626 4.447 807 HB1 ALA 107 1HB ALA 107 4.552 14.573 5.997 808 HB2 ALA 107 2HB ALA 107 3.188 15.081 4.999 809 HB3 ALA 107 3HB ALA 107 3.119 13.519 5.854 810 H VAL 108 H VAL 108 3.748 11.146 3.414 811 HA VAL 108 HA VAL 108 1.946 11.891 1.240 812 HB VAL 108 HB VAL 108 1.777 9.256 2.662 813 HG11 VAL 108 1HG1 VAL 108 0.312 9.666 0.696 814 HG12 VAL 108 2HG1 VAL 108 1.762 9.911 -0.308 815 HG13 VAL 108 3HG1 VAL 108 1.428 8.336 0.436 816 HG21 VAL 108 3HG2 VAL 108 4.183 10.090 1.029 817 HG22 VAL 108 1HG2 VAL 108 4.085 9.269 2.613 818 HG23 VAL 108 2HG2 VAL 108 3.679 8.392 1.155 819 H ARG 109 H ARG 109 -0.500 11.348 1.417 820 HA ARG 109 HA ARG 109 -1.531 10.990 4.069 821 HB2 ARG 109 1HB ARG 109 -1.763 13.348 4.084 822 HB3 ARG 109 2HB ARG 109 -2.212 13.438 2.373 823 HG2 ARG 109 1HG ARG 109 -4.376 12.497 2.828 824 HG3 ARG 109 2HG ARG 109 -3.934 12.095 4.501 825 HD2 ARG 109 1HD ARG 109 -3.775 14.455 5.078 826 HD3 ARG 109 2HD ARG 109 -4.045 14.927 3.389 827 HE ARG 109 HE ARG 109 -6.204 13.273 4.284 828 HH11 ARG 109 1HH1 ARG 109 -4.971 16.483 5.203 829 HH12 ARG 109 2HH1 ARG 109 -6.564 17.084 5.511 830 HH21 ARG 109 1HH2 ARG 109 -8.186 14.057 4.787 831 HH22 ARG 109 2HH2 ARG 109 -8.467 15.730 5.138 832 H VAL 110 H VAL 110 -3.000 9.359 3.752 833 HA VAL 110 HA VAL 110 -3.184 8.186 1.214 834 HB VAL 110 HB VAL 110 -3.425 7.058 3.379 835 HG11 VAL 110 1HG1 VAL 110 -5.673 7.100 4.488 836 HG12 VAL 110 2HG1 VAL 110 -4.826 8.640 4.564 837 HG13 VAL 110 3HG1 VAL 110 -6.170 8.382 3.432 838 HG21 VAL 110 3HG2 VAL 110 -4.771 5.343 2.588 839 HG22 VAL 110 1HG2 VAL 110 -5.781 6.438 1.611 840 HG23 VAL 110 2HG2 VAL 110 -4.091 6.119 1.173 841 H ARG 111 H ARG 111 -5.173 10.647 2.604 842 HA ARG 111 HA ARG 111 -6.799 11.978 1.801 843 HB2 ARG 111 1HB ARG 111 -5.670 11.693 -0.494 844 HB3 ARG 111 2HB ARG 111 -6.932 10.539 -0.873 845 HG2 ARG 111 1HG ARG 111 -8.669 12.145 -0.522 846 HG3 ARG 111 2HG ARG 111 -7.580 13.234 0.329 847 HD2 ARG 111 1HD ARG 111 -8.013 14.202 -1.733 848 HD3 ARG 111 2HD ARG 111 -6.334 13.700 -1.738 849 HE ARG 111 HE ARG 111 -7.116 11.637 -3.029 850 HH11 ARG 111 1HH1 ARG 111 -8.236 14.847 -3.841 851 HH12 ARG 111 2HH1 ARG 111 -9.428 14.303 -4.972 852 HH21 ARG 111 1HH2 ARG 111 -8.654 10.867 -4.523 853 HH22 ARG 111 2HH2 ARG 111 -9.582 12.018 -5.441 854 H THR 112 H THR 112 -7.384 8.744 0.404 855 HA THR 112 HA THR 112 -10.207 8.889 1.191 856 HB THR 112 HB THR 112 -10.266 6.764 -0.152 857 HG1 THR 112 1HG THR 112 -7.675 7.467 -1.101 858 HG21 THR 112 3HG2 THR 112 -10.780 8.938 -1.190 859 HG22 THR 112 1HG2 THR 112 -9.942 7.891 -2.333 860 HG23 THR 112 2HG2 THR 112 -9.054 9.220 -1.532 861 HA PRO 113 HA PRO 113 -9.507 5.707 4.370 862 HB2 PRO 113 1HB PRO 113 -11.987 4.685 4.722 863 HB3 PRO 113 2HB PRO 113 -11.596 6.359 5.222 864 HG2 PRO 113 1HG PRO 113 -12.961 5.422 2.699 865 HG3 PRO 113 2HG PRO 113 -13.435 6.774 3.772 866 HD2 PRO 113 1HD PRO 113 -11.947 7.064 1.431 867 HD3 PRO 113 2HD PRO 113 -11.856 8.207 2.795 868 H ILE 114 H ILE 114 -9.814 3.332 4.539 869 HA ILE 114 HA ILE 114 -8.890 2.009 2.179 870 HB ILE 114 HB ILE 114 -9.896 0.924 4.855 871 HG12 ILE 114 1HG1 ILE 114 -7.965 2.616 4.970 872 HG13 ILE 114 2HG1 ILE 114 -7.719 1.100 5.737 873 HG21 ILE 114 1HG2 ILE 114 -8.265 -0.475 2.711 874 HG22 ILE 114 2HG2 ILE 114 -8.398 -1.038 4.392 875 HG23 ILE 114 3HG2 ILE 114 -9.837 -0.944 3.382 876 HD11 ILE 114 3HD1 ILE 114 -5.811 2.002 4.302 877 HD12 ILE 114 1HD1 ILE 114 -6.281 0.306 4.016 878 HD13 ILE 114 2HD1 ILE 114 -6.802 1.602 2.901 879 H SER 115 H SER 115 -10.030 0.492 0.771 880 HA SER 115 HA SER 115 -12.857 -0.007 1.479 881 HB2 SER 115 1HB SER 115 -11.544 1.252 -0.847 882 HB3 SER 115 2HB SER 115 -12.306 -0.272 -1.231 883 HG SER 115 HG SER 115 -13.411 2.081 -0.101 884 H ASN 116 H ASN 116 -13.476 -2.135 1.078 885 HA ASN 116 HA ASN 116 -11.680 -4.183 0.252 886 HB2 ASN 116 1HB ASN 116 -10.948 -4.112 2.554 887 HB3 ASN 116 2HB ASN 116 -12.594 -3.829 3.142 888 HD21 ASN 116 1HD2 ASN 116 -11.096 -6.233 0.846 889 HD22 ASN 116 2HD2 ASN 116 -12.082 -7.529 1.503 890 H GLY 117 H GLY 117 -13.005 -5.902 -0.430 891 HA2 GLY 117 2HA GLY 117 -15.940 -5.765 -0.013 892 HA3 GLY 117 1HA GLY 117 -15.249 -5.954 -1.627 893 H GLN 118 H GLN 118 -16.639 -8.027 -1.419 894 HA GLN 118 HA GLN 118 -15.700 -10.182 0.298 895 HB2 GLN 118 1HB GLN 118 -17.837 -9.744 -1.727 896 HB3 GLN 118 2HB GLN 118 -17.030 -11.289 -1.880 897 HG2 GLN 118 1HG GLN 118 -18.927 -11.644 -0.523 898 HG3 GLN 118 2HG GLN 118 -17.501 -11.823 0.493 899 HE21 GLN 118 1HE2 GLN 118 -18.502 -11.323 2.495 900 HE22 GLN 118 2HE2 GLN 118 -19.299 -9.822 2.849 901 HA PRO 119 HA PRO 119 -12.437 -11.337 -2.550 902 HB2 PRO 119 1HB PRO 119 -12.204 -14.077 -1.932 903 HB3 PRO 119 2HB PRO 119 -11.426 -12.763 -1.044 904 HG2 PRO 119 1HG PRO 119 -13.894 -14.288 -0.349 905 HG3 PRO 119 2HG PRO 119 -12.693 -13.569 0.741 906 HD2 PRO 119 1HD PRO 119 -15.196 -12.478 0.137 907 HD3 PRO 119 2HD PRO 119 -13.813 -11.537 0.749 908 H THR 120 H THR 120 -12.077 -12.416 -4.494 909 HA THR 120 HA THR 120 -14.555 -13.296 -5.821 910 HB THR 120 HB THR 120 -13.230 -11.362 -6.602 911 HG1 THR 120 1HG THR 120 -14.474 -12.853 -8.097 912 HG21 THR 120 3HG2 THR 120 -11.174 -13.385 -7.527 913 HG22 THR 120 1HG2 THR 120 -10.979 -12.346 -6.099 914 HG23 THR 120 2HG2 THR 120 -11.128 -11.611 -7.689 915 H THR 121 H THR 121 -12.565 -14.948 -4.134 916 HA THR 121 HA THR 121 -11.475 -16.954 -4.117 917 HB THR 121 HB THR 121 -13.010 -18.179 -6.363 918 HG1 THR 121 1HG THR 121 -14.628 -16.971 -5.631 919 HG21 THR 121 3HG2 THR 121 -12.555 -18.880 -3.418 920 HG22 THR 121 1HG2 THR 121 -11.629 -19.521 -4.781 921 HG23 THR 121 2HG2 THR 121 -13.343 -19.920 -4.623 922 H GLY 122 H GLY 122 -10.613 -18.807 -6.139 923 HA2 GLY 122 2HA GLY 122 -9.852 -17.798 -8.565 924 HA3 GLY 122 1HA GLY 122 -8.455 -17.675 -7.477 925 H ASP 123 H ASP 123 -7.939 -19.326 -9.268 926 HA ASP 123 HA ASP 123 -8.797 -21.829 -9.641 927 HB2 ASP 123 1HB ASP 123 -6.877 -20.813 -10.733 928 HB3 ASP 123 2HB ASP 123 -5.919 -20.963 -9.271 929 H ALA 124 H ALA 124 -6.431 -21.068 -7.062 930 HA ALA 124 HA ALA 124 -7.573 -23.108 -5.287 931 HB1 ALA 124 1HB ALA 124 -5.957 -24.377 -6.658 932 HB2 ALA 124 2HB ALA 124 -4.675 -23.221 -6.234 933 HB3 ALA 124 3HB ALA 124 -5.411 -24.247 -4.978 934 H ASP 125 H ASP 125 -7.229 -20.080 -5.486 935 HA ASP 125 HA ASP 125 -6.078 -19.657 -2.823 936 HB2 ASP 125 1HB ASP 125 -5.260 -17.917 -5.136 937 HB3 ASP 125 2HB ASP 125 -4.651 -17.886 -3.483 938 H HIS 126 H HIS 126 -6.996 -17.722 -1.974 939 HA HIS 126 HA HIS 126 -9.382 -16.647 -3.480 940 HB2 HIS 126 1HB HIS 126 -8.650 -16.229 -0.558 941 HB3 HIS 126 2HB HIS 126 -10.064 -15.579 -1.358 942 HD1 HIS 126 1HD HIS 126 -12.182 -17.348 -1.660 943 HD2 HIS 126 2HD HIS 126 -8.746 -18.602 0.448 944 HE1 HIS 126 1HE HIS 126 -12.815 -19.462 -0.475 945 H THR 127 H THR 127 -9.434 -14.352 -3.975 946 HA THR 127 HA THR 127 -7.393 -12.659 -2.661 947 HB THR 127 HB THR 127 -7.944 -11.195 -4.814 948 HG1 THR 127 1HG THR 127 -7.868 -13.853 -5.826 949 HG21 THR 127 3HG2 THR 127 -5.679 -11.731 -3.938 950 HG22 THR 127 1HG2 THR 127 -5.734 -11.838 -5.698 951 HG23 THR 127 2HG2 THR 127 -5.752 -13.329 -4.716 952 H VAL 128 H VAL 128 -8.311 -11.373 -1.263 953 HA VAL 128 HA VAL 128 -10.971 -10.228 -1.797 954 HB VAL 128 HB VAL 128 -10.150 -8.713 0.158 955 HG11 VAL 128 1HG1 VAL 128 -10.980 -11.546 0.713 956 HG12 VAL 128 2HG1 VAL 128 -11.182 -10.131 1.771 957 HG13 VAL 128 3HG1 VAL 128 -12.052 -10.198 0.240 958 HG21 VAL 128 3HG2 VAL 128 -8.366 -11.073 0.740 959 HG22 VAL 128 1HG2 VAL 128 -7.849 -9.424 0.284 960 HG23 VAL 128 2HG2 VAL 128 -8.714 -9.699 1.801 961 HA PRO 129 HA PRO 129 -8.987 -6.646 -3.761 962 HB2 PRO 129 1HB PRO 129 -11.184 -5.040 -3.875 963 HB3 PRO 129 2HB PRO 129 -11.005 -6.463 -4.947 964 HG2 PRO 129 1HG PRO 129 -12.687 -6.213 -2.460 965 HG3 PRO 129 2HG PRO 129 -13.065 -7.050 -3.990 966 HD2 PRO 129 1HD PRO 129 -12.075 -8.236 -1.664 967 HD3 PRO 129 2HD PRO 129 -12.007 -8.951 -3.295 968 H ILE 130 H ILE 130 -7.763 -5.208 -2.466 969 HA ILE 130 HA ILE 130 -9.115 -3.731 -0.350 970 HB ILE 130 HB ILE 130 -6.498 -5.175 0.183 971 HG12 ILE 130 1HG1 ILE 130 -9.252 -5.642 1.376 972 HG13 ILE 130 2HG1 ILE 130 -8.353 -6.747 0.313 973 HG21 ILE 130 1HG2 ILE 130 -6.706 -2.869 1.226 974 HG22 ILE 130 2HG2 ILE 130 -8.192 -3.416 2.037 975 HG23 ILE 130 3HG2 ILE 130 -6.622 -4.141 2.424 976 HD11 ILE 130 3HD1 ILE 130 -8.127 -7.563 2.535 977 HD12 ILE 130 1HD1 ILE 130 -6.560 -6.837 2.096 978 HD13 ILE 130 2HD1 ILE 130 -7.695 -5.962 3.134 979 H SER 131 H SER 131 -8.636 -1.629 -0.769 980 HA SER 131 HA SER 131 -5.984 -0.815 -1.466 981 HB2 SER 131 1HB SER 131 -6.752 0.250 -3.728 982 HB3 SER 131 2HB SER 131 -6.257 -1.437 -3.644 983 HG SER 131 HG SER 131 -8.531 -1.927 -3.426 984 H LEU 132 H LEU 132 -5.827 1.519 -2.028 985 HA LEU 132 HA LEU 132 -7.956 3.310 -1.311 986 HB2 LEU 132 1HB LEU 132 -6.423 4.485 0.289 987 HB3 LEU 132 2HB LEU 132 -7.117 2.992 0.859 988 HG LEU 132 HG LEU 132 -4.850 3.259 1.613 989 HD11 LEU 132 1HD1 LEU 132 -5.800 0.953 1.080 990 HD12 LEU 132 2HD1 LEU 132 -4.116 1.169 1.558 991 HD13 LEU 132 3HD1 LEU 132 -4.542 0.921 -0.162 992 HD21 LEU 132 3HD2 LEU 132 -3.982 4.583 -0.326 993 HD22 LEU 132 1HD2 LEU 132 -3.766 3.063 -1.173 994 HD23 LEU 132 2HD2 LEU 132 -2.890 3.348 0.339 995 H GLY 133 H GLY 133 -7.213 5.564 -1.886 996 HA2 GLY 133 2HA GLY 133 -5.213 5.591 -4.108 997 HA3 GLY 133 1HA GLY 133 -6.856 6.212 -4.283 998 H TYR 134 H TYR 134 -3.755 7.181 -3.706 999 HA TYR 134 HA TYR 134 -4.325 9.235 -1.619 1000 HB2 TYR 134 1HB TYR 134 -1.817 9.049 -1.222 1001 HB3 TYR 134 2HB TYR 134 -2.686 7.633 -0.757 1002 HD1 TYR 134 2HD TYR 134 -0.303 9.043 -3.210 1003 HD2 TYR 134 1HD TYR 134 -2.497 5.517 -2.046 1004 HE1 TYR 134 2HE TYR 134 1.153 7.670 -4.658 1005 HE2 TYR 134 1HE TYR 134 -1.026 4.133 -3.488 1006 HH TYR 134 HH TYR 134 1.553 5.508 -5.521 1007 H ASP 135 H ASP 135 -3.136 11.151 -1.715 1008 HA ASP 135 HA ASP 135 -2.576 12.166 -4.470 1009 HB2 ASP 135 1HB ASP 135 -4.807 12.621 -2.753 1010 HB3 ASP 135 2HB ASP 135 -3.845 14.088 -2.799 1011 H VAL 136 H VAL 136 -1.254 11.684 -1.488 1012 HA VAL 136 HA VAL 136 0.432 12.366 -0.326 1013 HB VAL 136 HB VAL 136 1.312 12.529 -2.722 1014 HG11 VAL 136 1HG1 VAL 136 0.929 14.565 -3.670 1015 HG12 VAL 136 2HG1 VAL 136 1.300 15.486 -2.205 1016 HG13 VAL 136 3HG1 VAL 136 2.587 14.734 -3.147 1017 HG21 VAL 136 3HG2 VAL 136 2.723 12.016 -0.818 1018 HG22 VAL 136 1HG2 VAL 136 3.581 13.070 -1.922 1019 HG23 VAL 136 2HG2 VAL 136 2.912 13.742 -0.433 1020 H GLN 137 H GLN 137 1.542 14.780 0.413 1021 HA GLN 137 HA GLN 137 -0.134 16.858 -0.390 1022 HB2 GLN 137 1HB GLN 137 -0.264 18.042 1.643 1023 HB3 GLN 137 2HB GLN 137 -1.171 16.554 1.812 1024 HG2 GLN 137 1HG GLN 137 1.613 16.453 2.870 1025 HG3 GLN 137 2HG GLN 137 0.570 17.669 3.609 1026 HE21 GLN 137 1HE2 GLN 137 1.410 14.431 3.697 1027 HE22 GLN 137 2HE2 GLN 137 0.138 13.851 4.747 1028 H PHE 138 H PHE 138 1.154 18.977 0.094 1029 HA PHE 138 HA PHE 138 4.099 18.464 0.098 1030 HB2 PHE 138 1HB PHE 138 2.331 20.646 -0.993 1031 HB3 PHE 138 2HB PHE 138 3.973 21.021 -0.540 1032 HD1 PHE 138 1HD PHE 138 2.891 17.779 -2.218 1033 HD2 PHE 138 2HD PHE 138 4.961 21.560 -2.593 1034 HE1 PHE 138 1HE PHE 138 3.598 17.175 -4.490 1035 HE2 PHE 138 2HE PHE 138 5.667 20.923 -4.875 1036 HZ PHE 138 HZ PHE 138 4.980 18.749 -5.843 1037 H TYR 139 H TYR 139 1.741 18.869 2.241 1038 HA TYR 139 HA TYR 139 1.261 19.858 4.154 1039 HB2 TYR 139 1HB TYR 139 3.144 18.093 4.468 1040 HB3 TYR 139 2HB TYR 139 4.091 19.454 5.036 1041 HD1 TYR 139 1HD TYR 139 3.048 20.844 7.046 1042 HD2 TYR 139 2HD TYR 139 1.554 17.012 5.747 1043 HE1 TYR 139 1HE TYR 139 1.855 20.579 9.196 1044 HE2 TYR 139 2HE TYR 139 0.380 16.722 7.899 1045 HH TYR 139 HH TYR 139 0.242 17.557 10.114 1046 HA PRO 140 HA PRO 140 2.905 24.100 3.289 1047 HB2 PRO 140 1HB PRO 140 0.477 25.349 2.966 1048 HB3 PRO 140 2HB PRO 140 1.353 24.562 1.628 1049 HG2 PRO 140 1HG PRO 140 -0.888 23.417 3.319 1050 HG3 PRO 140 2HG PRO 140 -0.733 23.386 1.538 1051 HD2 PRO 140 1HD PRO 140 -0.024 21.263 3.069 1052 HD3 PRO 140 2HD PRO 140 0.925 21.709 1.616 1053 H GLU 141 H GLU 141 2.924 25.723 4.850 1054 HA GLU 141 HA GLU 141 1.585 25.329 7.432 1055 HB2 GLU 141 1HB GLU 141 3.157 27.645 6.239 1056 HB3 GLU 141 2HB GLU 141 2.398 27.660 7.836 1057 HG2 GLU 141 1HG GLU 141 3.901 25.427 8.134 1058 HG3 GLU 141 2HG GLU 141 4.890 26.288 6.921 Start of MODEL 8 1 H1 GLY 1 H GLY 1 18.491 13.424 -2.473 2 HA2 GLY 1 2HA GLY 1 15.992 11.959 -1.856 3 HA3 GLY 1 1HA GLY 1 16.411 13.526 -1.119 4 H MET 2 H MET 2 14.362 12.384 -3.335 5 HA MET 2 HA MET 2 14.598 14.741 -5.130 6 HB2 MET 2 1HB MET 2 14.222 11.838 -5.955 7 HB3 MET 2 2HB MET 2 13.990 13.217 -7.032 8 HG2 MET 2 1HG MET 2 16.289 13.818 -6.959 9 HG3 MET 2 2HG MET 2 16.602 12.733 -5.612 10 HE1 MET 2 3HE MET 2 14.512 11.948 -8.867 11 HE2 MET 2 1HE MET 2 15.893 12.857 -9.541 12 HE3 MET 2 2HE MET 2 15.713 11.123 -9.860 13 H SER 3 H SER 3 12.894 14.394 -2.796 14 HA SER 3 HA SER 3 10.797 14.349 -2.063 15 HB2 SER 3 1HB SER 3 10.059 15.232 -4.877 16 HB3 SER 3 2HB SER 3 9.050 15.380 -3.430 17 HG SER 3 HG SER 3 10.399 17.231 -4.177 18 H GLN 4 H GLN 4 10.039 13.003 -5.380 19 HA GLN 4 HA GLN 4 8.004 11.373 -4.235 20 HB2 GLN 4 1HB GLN 4 8.379 12.152 -6.710 21 HB3 GLN 4 2HB GLN 4 9.268 10.642 -6.878 22 HG2 GLN 4 1HG GLN 4 6.473 10.676 -5.660 23 HG3 GLN 4 2HG GLN 4 6.685 10.807 -7.387 24 HE21 GLN 4 1HE2 GLN 4 6.356 8.505 -4.844 25 HE22 GLN 4 2HE2 GLN 4 6.567 7.155 -5.938 26 H ASP 5 H ASP 5 11.344 10.660 -5.125 27 HA ASP 5 HA ASP 5 11.796 8.039 -4.669 28 HB2 ASP 5 1HB ASP 5 13.290 10.526 -3.809 29 HB3 ASP 5 2HB ASP 5 13.826 8.984 -3.167 30 H LEU 6 H LEU 6 11.154 10.464 -2.083 31 HA LEU 6 HA LEU 6 11.494 8.564 0.075 32 HB2 LEU 6 1HB LEU 6 10.645 11.485 0.046 33 HB3 LEU 6 2HB LEU 6 11.179 10.585 1.424 34 HG LEU 6 HG LEU 6 13.022 11.732 0.994 35 HD11 LEU 6 1HD1 LEU 6 13.724 9.449 -0.821 36 HD12 LEU 6 2HD1 LEU 6 13.675 9.391 0.957 37 HD13 LEU 6 3HD1 LEU 6 14.805 10.479 0.137 38 HD21 LEU 6 3HD2 LEU 6 12.699 11.648 -1.974 39 HD22 LEU 6 1HD2 LEU 6 13.776 12.687 -0.987 40 HD23 LEU 6 2HD2 LEU 6 12.016 12.869 -0.896 41 H ILE 7 H ILE 7 8.867 10.089 -1.704 42 HA ILE 7 HA ILE 7 6.806 9.948 0.255 43 HB ILE 7 HB ILE 7 6.611 9.713 -2.779 44 HG12 ILE 7 1HG1 ILE 7 7.654 11.795 -2.131 45 HG13 ILE 7 2HG1 ILE 7 5.999 12.121 -2.670 46 HG21 ILE 7 1HG2 ILE 7 4.260 10.474 -2.535 47 HG22 ILE 7 2HG2 ILE 7 4.524 8.882 -1.823 48 HG23 ILE 7 3HG2 ILE 7 4.392 10.304 -0.777 49 HD11 ILE 7 3HD1 ILE 7 7.422 12.463 -0.148 50 HD12 ILE 7 1HD1 ILE 7 6.048 13.401 -0.800 51 HD13 ILE 7 2HD1 ILE 7 5.735 11.909 0.093 52 H ARG 8 H ARG 8 7.591 7.639 -2.402 53 HA ARG 8 HA ARG 8 5.944 5.521 -1.476 54 HB2 ARG 8 1HB ARG 8 7.492 4.116 -2.818 55 HB3 ARG 8 2HB ARG 8 6.700 5.410 -3.711 56 HG2 ARG 8 1HG ARG 8 8.669 6.560 -4.116 57 HG3 ARG 8 2HG ARG 8 9.368 6.091 -2.569 58 HD2 ARG 8 1HD ARG 8 9.371 3.698 -3.655 59 HD3 ARG 8 2HD ARG 8 9.416 4.615 -5.175 60 HE ARG 8 HE ARG 8 11.371 5.732 -3.543 61 HH11 ARG 8 1HH1 ARG 8 10.582 2.335 -4.320 62 HH12 ARG 8 2HH1 ARG 8 12.182 1.772 -3.961 63 HH21 ARG 8 1HH2 ARG 8 13.566 4.931 -3.263 64 HH22 ARG 8 2HH2 ARG 8 13.847 3.239 -3.394 65 H ALA 9 H ALA 9 9.354 6.328 -0.736 66 HA ALA 9 HA ALA 9 9.894 4.093 0.822 67 HB1 ALA 9 1HB ALA 9 11.516 5.793 -0.035 68 HB2 ALA 9 2HB ALA 9 11.014 6.866 1.310 69 HB3 ALA 9 3HB ALA 9 11.779 5.320 1.649 70 H ALA 10 H ALA 10 7.899 6.872 1.679 71 HA ALA 10 HA ALA 10 7.914 6.470 4.542 72 HB1 ALA 10 1HB ALA 10 5.621 7.689 2.957 73 HB2 ALA 10 2HB ALA 10 6.190 8.078 4.590 74 HB3 ALA 10 3HB ALA 10 7.129 8.566 3.155 75 H PHE 11 H PHE 11 5.902 5.363 1.810 76 HA PHE 11 HA PHE 11 3.880 3.964 3.312 77 HB2 PHE 11 1HB PHE 11 4.851 3.902 0.430 78 HB3 PHE 11 2HB PHE 11 3.822 2.642 1.019 79 HD1 PHE 11 2HD PHE 11 3.933 6.434 1.251 80 HD2 PHE 11 1HD PHE 11 1.597 2.890 0.435 81 HE1 PHE 11 2HE PHE 11 1.938 7.823 0.865 82 HE2 PHE 11 1HE PHE 11 -0.396 4.296 0.056 83 HZ PHE 11 HZ PHE 11 -0.241 6.766 0.353 84 H GLU 12 H GLU 12 6.891 2.991 1.680 85 HA GLU 12 HA GLU 12 6.979 0.297 2.365 86 HB2 GLU 12 1HB GLU 12 9.191 2.332 1.966 87 HB3 GLU 12 2HB GLU 12 9.484 0.606 2.077 88 HG2 GLU 12 1HG GLU 12 8.422 0.137 0.030 89 HG3 GLU 12 2HG GLU 12 7.540 1.660 0.001 90 H LYS 13 H LYS 13 7.935 3.111 4.368 91 HA LYS 13 HA LYS 13 9.308 1.565 6.389 92 HB2 LYS 13 1HB LYS 13 9.142 4.265 5.723 93 HB3 LYS 13 2HB LYS 13 8.117 4.220 7.129 94 HG2 LYS 13 1HG LYS 13 10.290 4.670 7.982 95 HG3 LYS 13 2HG LYS 13 9.974 2.976 8.367 96 HD2 LYS 13 1HD LYS 13 11.156 2.710 5.900 97 HD3 LYS 13 2HD LYS 13 11.946 4.185 6.453 98 HE2 LYS 13 1HE LYS 13 11.814 1.524 7.961 99 HE3 LYS 13 2HE LYS 13 13.146 2.028 6.918 100 HZ1 LYS 13 3HZ LYS 13 13.827 2.533 8.981 101 HZ2 LYS 13 1HZ LYS 13 12.383 3.087 9.525 102 HZ3 LYS 13 2HZ LYS 13 13.318 4.003 8.472 103 H ARG 14 H ARG 14 6.072 2.263 5.736 104 HA ARG 14 HA ARG 14 5.289 1.423 8.477 105 HB2 ARG 14 1HB ARG 14 4.086 3.298 7.538 106 HB3 ARG 14 2HB ARG 14 3.445 2.302 6.227 107 HG2 ARG 14 1HG ARG 14 1.968 1.195 7.624 108 HG3 ARG 14 2HG ARG 14 3.043 1.258 9.016 109 HD2 ARG 14 1HD ARG 14 1.445 3.630 8.002 110 HD3 ARG 14 2HD ARG 14 0.994 2.589 9.355 111 HE ARG 14 HE ARG 14 3.686 3.655 9.594 112 HH11 ARG 14 1HH1 ARG 14 0.299 4.393 10.409 113 HH12 ARG 14 2HH1 ARG 14 0.751 5.489 11.689 114 HH21 ARG 14 1HH2 ARG 14 4.235 4.929 11.185 115 HH22 ARG 14 2HH2 ARG 14 3.091 5.659 12.290 116 H LEU 15 H LEU 15 4.633 0.391 5.085 117 HA LEU 15 HA LEU 15 3.181 -1.899 5.824 118 HB2 LEU 15 1HB LEU 15 3.612 -0.655 3.504 119 HB3 LEU 15 2HB LEU 15 4.830 -1.890 3.289 120 HG LEU 15 HG LEU 15 1.831 -2.244 3.661 121 HD11 LEU 15 1HD1 LEU 15 1.915 -3.120 1.401 122 HD12 LEU 15 2HD1 LEU 15 3.690 -3.032 1.373 123 HD13 LEU 15 3HD1 LEU 15 2.723 -1.550 1.432 124 HD21 LEU 15 3HD2 LEU 15 3.942 -4.433 3.534 125 HD22 LEU 15 1HD2 LEU 15 2.208 -4.695 3.249 126 HD23 LEU 15 2HD2 LEU 15 2.756 -4.141 4.825 127 H SER 16 H SER 16 6.675 -1.658 4.878 128 HA SER 16 HA SER 16 7.065 -4.518 5.196 129 HB2 SER 16 1HB SER 16 8.172 -2.657 3.663 130 HB3 SER 16 2HB SER 16 9.243 -2.485 5.064 131 HG SER 16 HG SER 16 9.484 -4.825 4.942 132 H ASP 17 H ASP 17 7.087 -1.907 7.331 133 HA ASP 17 HA ASP 17 8.811 -3.336 9.299 134 HB2 ASP 17 1HB ASP 17 7.448 -0.605 9.335 135 HB3 ASP 17 2HB ASP 17 8.327 -1.261 10.699 136 H TRP 18 H TRP 18 5.504 -2.750 8.479 137 HA TRP 18 HA TRP 18 4.332 -3.638 11.027 138 HB2 TRP 18 1HB TRP 18 2.977 -2.167 9.711 139 HB3 TRP 18 2HB TRP 18 3.269 -3.070 8.239 140 HD1 TRP 18 HD TRP 18 1.083 -3.094 11.329 141 HE1 TRP 18 1HE TRP 18 -0.904 -4.647 10.966 142 HE3 TRP 18 3HE TRP 18 2.480 -5.099 6.871 143 HZ2 TRP 18 2HZ TRP 18 -1.517 -6.901 9.178 144 HZ3 TRP 18 3HZ TRP 18 1.124 -6.886 5.800 145 HH2 TRP 18 HH TRP 18 -0.915 -7.773 6.995 146 H ALA 19 H ALA 19 4.924 -5.037 7.727 147 HA ALA 19 HA ALA 19 3.391 -7.280 8.282 148 HB1 ALA 19 1HB ALA 19 5.646 -7.090 6.233 149 HB2 ALA 19 2HB ALA 19 4.348 -8.289 6.256 150 HB3 ALA 19 3HB ALA 19 3.985 -6.578 5.984 151 H LYS 20 H LYS 20 6.905 -6.983 8.840 152 HA LYS 20 HA LYS 20 7.116 -9.620 9.994 153 HB2 LYS 20 1HB LYS 20 9.379 -8.916 10.560 154 HB3 LYS 20 2HB LYS 20 8.975 -8.465 8.922 155 HG2 LYS 20 1HG LYS 20 9.820 -6.447 9.441 156 HG3 LYS 20 2HG LYS 20 8.280 -6.126 10.227 157 HD2 LYS 20 1HD LYS 20 9.282 -6.966 12.398 158 HD3 LYS 20 2HD LYS 20 10.794 -7.239 11.524 159 HE2 LYS 20 1HE LYS 20 11.208 -5.219 12.454 160 HE3 LYS 20 2HE LYS 20 10.637 -4.715 10.864 161 HZ1 LYS 20 3HZ LYS 20 8.491 -4.206 11.918 162 HZ2 LYS 20 1HZ LYS 20 9.713 -3.464 12.760 163 HZ3 LYS 20 2HZ LYS 20 9.012 -4.809 13.347 164 H ALA 21 H ALA 21 5.992 -6.577 11.312 165 HA ALA 21 HA ALA 21 6.544 -7.253 14.103 166 HB1 ALA 21 1HB ALA 21 4.515 -5.259 12.984 167 HB2 ALA 21 2HB ALA 21 5.070 -5.397 14.652 168 HB3 ALA 21 3HB ALA 21 6.200 -4.870 13.398 169 H ARG 22 H ARG 22 4.088 -7.876 11.654 170 HA ARG 22 HA ARG 22 1.988 -8.794 13.337 171 HB2 ARG 22 1HB ARG 22 2.351 -8.463 10.587 172 HB3 ARG 22 2HB ARG 22 2.458 -10.225 10.794 173 HG2 ARG 22 1HG ARG 22 0.229 -9.751 12.232 174 HG3 ARG 22 2HG ARG 22 0.126 -8.379 11.124 175 HD2 ARG 22 1HD ARG 22 -0.182 -9.847 9.210 176 HD3 ARG 22 2HD ARG 22 0.740 -11.063 9.965 177 HE ARG 22 HE ARG 22 -1.608 -10.606 11.545 178 HH11 ARG 22 1HH1 ARG 22 -0.862 -11.823 8.342 179 HH12 ARG 22 2HH1 ARG 22 -2.231 -12.837 8.146 180 HH21 ARG 22 1HH2 ARG 22 -3.574 -11.788 11.342 181 HH22 ARG 22 2HH2 ARG 22 -3.844 -12.816 9.979 182 H THR 23 H THR 23 1.411 -11.029 13.736 183 HA THR 23 HA THR 23 3.588 -12.559 14.772 184 HB THR 23 HB THR 23 0.624 -13.135 14.480 185 HG1 THR 23 1HG THR 23 2.154 -12.602 16.774 186 HG21 THR 23 3HG2 THR 23 2.747 -14.745 15.931 187 HG22 THR 23 1HG2 THR 23 1.837 -15.265 14.503 188 HG23 THR 23 2HG2 THR 23 0.992 -14.986 16.041 189 HA PRO 24 HA PRO 24 2.964 -15.830 11.376 190 HB2 PRO 24 1HB PRO 24 1.461 -15.059 9.094 191 HB3 PRO 24 2HB PRO 24 0.935 -16.165 10.394 192 HG2 PRO 24 1HG PRO 24 0.412 -13.247 10.018 193 HG3 PRO 24 2HG PRO 24 -0.702 -14.490 10.666 194 HD2 PRO 24 1HD PRO 24 0.564 -12.718 12.253 195 HD3 PRO 24 2HD PRO 24 0.355 -14.423 12.758 196 H ALA 25 H ALA 25 3.702 -12.776 10.936 197 HA ALA 25 HA ALA 25 4.960 -11.397 9.553 198 HB1 ALA 25 1HB ALA 25 6.390 -12.370 11.155 199 HB2 ALA 25 2HB ALA 25 6.706 -13.773 10.089 200 HB3 ALA 25 3HB ALA 25 7.255 -12.137 9.624 201 H LEU 26 H LEU 26 4.332 -10.908 7.570 202 HA LEU 26 HA LEU 26 4.401 -13.016 5.489 203 HB2 LEU 26 1HB LEU 26 2.759 -10.472 5.805 204 HB3 LEU 26 2HB LEU 26 2.700 -11.481 4.388 205 HG LEU 26 HG LEU 26 0.869 -12.203 5.479 206 HD11 LEU 26 1HD1 LEU 26 2.341 -14.157 4.995 207 HD12 LEU 26 2HD1 LEU 26 1.131 -14.410 6.261 208 HD13 LEU 26 3HD1 LEU 26 2.810 -14.141 6.722 209 HD21 LEU 26 3HD2 LEU 26 0.725 -12.893 7.885 210 HD22 LEU 26 1HD2 LEU 26 0.703 -11.177 7.519 211 HD23 LEU 26 2HD2 LEU 26 2.196 -11.940 8.152 212 HA PRO 27 HA PRO 27 7.276 -10.832 2.946 213 HB2 PRO 27 1HB PRO 27 6.657 -11.714 0.437 214 HB3 PRO 27 2HB PRO 27 7.269 -12.843 1.683 215 HG2 PRO 27 1HG PRO 27 4.398 -12.310 0.938 216 HG3 PRO 27 2HG PRO 27 5.231 -13.898 1.038 217 HD2 PRO 27 1HD PRO 27 3.757 -12.924 3.126 218 HD3 PRO 27 2HD PRO 27 5.290 -13.768 3.443 219 H VAL 28 H VAL 28 7.440 -9.151 1.270 220 HA VAL 28 HA VAL 28 4.925 -7.790 0.507 221 HB VAL 28 HB VAL 28 7.307 -6.358 1.772 222 HG11 VAL 28 1HG1 VAL 28 5.817 -4.409 1.771 223 HG12 VAL 28 2HG1 VAL 28 6.011 -5.019 0.125 224 HG13 VAL 28 3HG1 VAL 28 4.518 -5.367 1.027 225 HG21 VAL 28 3HG2 VAL 28 5.816 -5.868 3.692 226 HG22 VAL 28 1HG2 VAL 28 4.604 -6.991 3.028 227 HG23 VAL 28 2HG2 VAL 28 6.190 -7.580 3.570 228 H ALA 29 H ALA 29 5.103 -8.197 -1.670 229 HA ALA 29 HA ALA 29 7.752 -8.007 -2.998 230 HB1 ALA 29 1HB ALA 29 6.424 -10.038 -3.366 231 HB2 ALA 29 2HB ALA 29 5.043 -9.073 -3.911 232 HB3 ALA 29 3HB ALA 29 6.529 -9.085 -4.871 233 H TRP 30 H TRP 30 8.066 -5.732 -3.165 234 HA TRP 30 HA TRP 30 6.084 -3.924 -4.260 235 HB2 TRP 30 1HB TRP 30 9.088 -3.562 -4.121 236 HB3 TRP 30 2HB TRP 30 7.861 -2.330 -4.242 237 HD1 TRP 30 HD TRP 30 9.770 -4.195 -1.616 238 HE1 TRP 30 1HE TRP 30 9.036 -3.352 0.688 239 HE3 TRP 30 3HE TRP 30 5.791 -1.361 -3.050 240 HZ2 TRP 30 2HZ TRP 30 6.765 -1.918 1.810 241 HZ3 TRP 30 3HZ TRP 30 4.427 -0.162 -1.355 242 HH2 TRP 30 HH TRP 30 4.849 -0.476 1.058 243 H GLN 31 H GLN 31 7.187 -2.468 -6.181 244 HA GLN 31 HA GLN 31 7.087 -3.982 -8.628 245 HB2 GLN 31 1HB GLN 31 7.998 -1.148 -8.088 246 HB3 GLN 31 2HB GLN 31 7.716 -1.870 -9.678 247 HG2 GLN 31 1HG GLN 31 5.603 -1.159 -9.502 248 HG3 GLN 31 2HG GLN 31 5.359 -2.455 -8.320 249 HE21 GLN 31 1HE2 GLN 31 6.478 0.972 -8.566 250 HE22 GLN 31 2HE2 GLN 31 5.741 1.441 -7.053 251 H ASN 32 H ASN 32 8.907 -4.593 -9.925 252 HA ASN 32 HA ASN 32 10.951 -5.174 -10.594 253 HB2 ASN 32 1HB ASN 32 11.697 -2.508 -9.368 254 HB3 ASN 32 2HB ASN 32 12.836 -3.523 -10.238 255 HD21 ASN 32 1HD2 ASN 32 9.711 -3.797 -11.734 256 HD22 ASN 32 2HD2 ASN 32 10.064 -2.638 -12.985 257 H THR 33 H THR 33 10.742 -4.688 -7.174 258 HA THR 33 HA THR 33 13.036 -5.897 -6.201 259 HB THR 33 HB THR 33 10.135 -5.914 -5.276 260 HG1 THR 33 1HG THR 33 12.076 -4.171 -4.251 261 HG21 THR 33 3HG2 THR 33 12.635 -6.327 -3.604 262 HG22 THR 33 1HG2 THR 33 11.312 -7.496 -3.859 263 HG23 THR 33 2HG2 THR 33 11.006 -6.008 -2.962 264 H LYS 34 H LYS 34 13.437 -8.018 -5.531 265 HA LYS 34 HA LYS 34 12.037 -10.140 -7.052 266 HB2 LYS 34 1HB LYS 34 14.831 -9.746 -6.037 267 HB3 LYS 34 2HB LYS 34 14.244 -11.386 -5.999 268 HG2 LYS 34 1HG LYS 34 13.987 -9.644 -8.482 269 HG3 LYS 34 2HG LYS 34 15.398 -10.667 -8.183 270 HD2 LYS 34 1HD LYS 34 14.208 -12.666 -8.398 271 HD3 LYS 34 2HD LYS 34 12.655 -11.933 -8.020 272 HE2 LYS 34 1HE LYS 34 12.680 -10.697 -10.160 273 HE3 LYS 34 2HE LYS 34 14.192 -11.500 -10.601 274 HZ1 LYS 34 3HZ LYS 34 12.994 -13.630 -10.416 275 HZ2 LYS 34 1HZ LYS 34 12.285 -12.642 -11.534 276 HZ3 LYS 34 2HZ LYS 34 11.619 -12.847 -10.047 277 H PHE 35 H PHE 35 11.058 -11.875 -6.074 278 HA PHE 35 HA PHE 35 10.707 -12.092 -3.222 279 HB2 PHE 35 1HB PHE 35 8.357 -11.568 -3.332 280 HB3 PHE 35 2HB PHE 35 9.201 -10.168 -3.964 281 HD1 PHE 35 1HD PHE 35 9.312 -9.878 -6.558 282 HD2 PHE 35 2HD PHE 35 6.716 -12.743 -4.633 283 HE1 PHE 35 1HE PHE 35 8.076 -10.167 -8.665 284 HE2 PHE 35 2HE PHE 35 5.448 -12.994 -6.742 285 HZ PHE 35 HZ PHE 35 6.124 -11.736 -8.772 286 H THR 36 H THR 36 9.028 -13.885 -2.921 287 HA THR 36 HA THR 36 8.169 -15.868 -3.254 288 HB THR 36 HB THR 36 7.916 -14.820 -5.831 289 HG1 THR 36 1HG THR 36 6.346 -15.831 -4.545 290 HG21 THR 36 3HG2 THR 36 8.271 -16.553 -7.430 291 HG22 THR 36 1HG2 THR 36 8.883 -17.677 -6.202 292 HG23 THR 36 2HG2 THR 36 9.818 -16.236 -6.658 293 HA PRO 37 HA PRO 37 8.051 -18.433 -4.087 294 HB2 PRO 37 1HB PRO 37 8.564 -20.545 -2.368 295 HB3 PRO 37 2HB PRO 37 9.017 -20.504 -4.102 296 HG2 PRO 37 1HG PRO 37 10.716 -19.823 -1.685 297 HG3 PRO 37 2HG PRO 37 11.146 -20.873 -3.079 298 HD2 PRO 37 1HD PRO 37 11.950 -18.290 -2.937 299 HD3 PRO 37 2HD PRO 37 11.417 -18.985 -4.495 300 HA PRO 38 HA PRO 38 6.157 -16.869 -0.290 301 HB2 PRO 38 1HB PRO 38 3.928 -18.415 -0.122 302 HB3 PRO 38 2HB PRO 38 4.151 -17.080 -1.327 303 HG2 PRO 38 1HG PRO 38 4.468 -20.067 -1.755 304 HG3 PRO 38 2HG PRO 38 3.645 -18.885 -2.810 305 HD2 PRO 38 1HD PRO 38 6.215 -19.710 -3.249 306 HD3 PRO 38 2HD PRO 38 5.677 -18.053 -3.625 307 H ALA 39 H ALA 39 4.860 -17.899 1.747 308 HA ALA 39 HA ALA 39 6.825 -19.707 2.854 309 HB1 ALA 39 1HB ALA 39 6.213 -17.911 4.280 310 HB2 ALA 39 2HB ALA 39 4.517 -18.011 3.783 311 HB3 ALA 39 3HB ALA 39 5.198 -19.230 4.903 312 H ALA 40 H ALA 40 3.672 -20.025 1.915 313 HA ALA 40 HA ALA 40 3.599 -22.919 1.799 314 HB1 ALA 40 1HB ALA 40 2.018 -23.008 3.880 315 HB2 ALA 40 2HB ALA 40 3.764 -22.853 4.130 316 HB3 ALA 40 3HB ALA 40 2.782 -21.421 4.279 317 H GLY 41 H GLY 41 2.878 -20.395 0.362 318 HA2 GLY 41 2HA GLY 41 1.348 -20.334 -1.408 319 HA3 GLY 41 1HA GLY 41 0.080 -21.040 -0.403 320 H VAL 42 H VAL 42 1.379 -18.736 1.528 321 HA VAL 42 HA VAL 42 -0.626 -16.687 0.677 322 HB VAL 42 HB VAL 42 0.907 -16.941 3.284 323 HG11 VAL 42 1HG1 VAL 42 0.044 -14.688 2.967 324 HG12 VAL 42 2HG1 VAL 42 -1.553 -15.319 2.502 325 HG13 VAL 42 3HG1 VAL 42 -0.962 -15.489 4.169 326 HG21 VAL 42 3HG2 VAL 42 -1.974 -17.833 2.772 327 HG22 VAL 42 1HG2 VAL 42 -0.606 -18.940 2.993 328 HG23 VAL 42 2HG2 VAL 42 -1.098 -17.905 4.321 329 H TYR 43 H TYR 43 0.061 -14.664 -0.015 330 HA TYR 43 HA TYR 43 2.500 -13.489 0.947 331 HB2 TYR 43 1HB TYR 43 3.530 -13.257 -1.384 332 HB3 TYR 43 2HB TYR 43 3.643 -14.843 -0.664 333 HD1 TYR 43 2HD TYR 43 2.075 -16.710 -1.390 334 HD2 TYR 43 1HD TYR 43 2.229 -12.891 -3.404 335 HE1 TYR 43 2HE TYR 43 0.882 -17.685 -3.339 336 HE2 TYR 43 1HE TYR 43 0.996 -13.874 -5.342 337 HH TYR 43 HH TYR 43 0.240 -15.894 -6.368 338 H LEU 44 H LEU 44 2.870 -11.297 -0.142 339 HA LEU 44 HA LEU 44 0.278 -10.105 -0.993 340 HB2 LEU 44 1HB LEU 44 2.392 -8.820 0.773 341 HB3 LEU 44 2HB LEU 44 0.955 -8.058 0.120 342 HG LEU 44 HG LEU 44 1.013 -10.274 2.202 343 HD11 LEU 44 1HD1 LEU 44 -0.131 -8.405 3.553 344 HD12 LEU 44 2HD1 LEU 44 0.330 -7.304 2.268 345 HD13 LEU 44 3HD1 LEU 44 1.598 -8.153 3.175 346 HD21 LEU 44 3HD2 LEU 44 -1.453 -9.894 2.332 347 HD22 LEU 44 1HD2 LEU 44 -0.948 -10.636 0.821 348 HD23 LEU 44 2HD2 LEU 44 -1.343 -8.902 0.855 349 H ARG 45 H ARG 45 0.497 -9.801 -3.066 350 HA ARG 45 HA ARG 45 2.885 -8.699 -4.400 351 HB2 ARG 45 1HB ARG 45 0.096 -9.599 -5.108 352 HB3 ARG 45 2HB ARG 45 0.719 -8.262 -6.034 353 HG2 ARG 45 1HG ARG 45 2.532 -9.471 -6.910 354 HG3 ARG 45 2HG ARG 45 2.408 -10.768 -5.700 355 HD2 ARG 45 1HD ARG 45 0.563 -11.745 -6.690 356 HD3 ARG 45 2HD ARG 45 0.044 -10.262 -7.485 357 HE ARG 45 HE ARG 45 2.253 -12.089 -8.302 358 HH11 ARG 45 1HH1 ARG 45 -0.142 -9.602 -9.185 359 HH12 ARG 45 2HH1 ARG 45 0.354 -9.486 -10.837 360 HH21 ARG 45 1HH2 ARG 45 2.850 -12.006 -10.563 361 HH22 ARG 45 2HH2 ARG 45 1.984 -10.967 -11.648 362 H ALA 46 H ALA 46 3.410 -6.597 -3.946 363 HA ALA 46 HA ALA 46 1.292 -4.774 -2.946 364 HB1 ALA 46 1HB ALA 46 3.296 -5.359 -1.424 365 HB2 ALA 46 2HB ALA 46 4.333 -4.569 -2.619 366 HB3 ALA 46 3HB ALA 46 3.101 -3.631 -1.762 367 H TYR 47 H TYR 47 0.839 -2.998 -4.433 368 HA TYR 47 HA TYR 47 2.945 -2.364 -6.339 369 HB2 TYR 47 1HB TYR 47 1.302 -4.051 -7.282 370 HB3 TYR 47 2HB TYR 47 0.053 -2.830 -7.074 371 HD1 TYR 47 2HD TYR 47 3.219 -1.377 -8.120 372 HD2 TYR 47 1HD TYR 47 -0.266 -3.462 -9.504 373 HE1 TYR 47 2HE TYR 47 3.552 -0.373 -10.335 374 HE2 TYR 47 1HE TYR 47 0.049 -2.498 -11.776 375 HH TYR 47 HH TYR 47 2.634 -0.090 -12.485 376 H VAL 48 H VAL 48 3.392 -0.386 -5.859 377 HA VAL 48 HA VAL 48 1.413 1.697 -5.237 378 HB VAL 48 HB VAL 48 4.389 2.049 -5.856 379 HG11 VAL 48 1HG1 VAL 48 4.119 4.121 -4.555 380 HG12 VAL 48 2HG1 VAL 48 2.988 4.074 -5.909 381 HG13 VAL 48 3HG1 VAL 48 2.404 3.730 -4.265 382 HG21 VAL 48 3HG2 VAL 48 4.806 2.137 -3.415 383 HG22 VAL 48 1HG2 VAL 48 3.165 1.516 -3.131 384 HG23 VAL 48 2HG2 VAL 48 4.370 0.528 -3.986 385 H MET 49 H MET 49 0.108 1.827 -7.014 386 HA MET 49 HA MET 49 1.242 1.871 -9.746 387 HB2 MET 49 1HB MET 49 -1.480 1.763 -8.573 388 HB3 MET 49 2HB MET 49 -1.355 2.745 -10.038 389 HG2 MET 49 1HG MET 49 -0.469 0.919 -11.298 390 HG3 MET 49 2HG MET 49 -0.238 -0.059 -9.845 391 HE1 MET 49 3HE MET 49 -2.348 -0.495 -8.210 392 HE2 MET 49 1HE MET 49 -3.578 -1.552 -8.953 393 HE3 MET 49 2HE MET 49 -1.859 -1.914 -9.143 394 HA PRO 50 HA PRO 50 2.132 6.136 -9.432 395 HB2 PRO 50 1HB PRO 50 2.595 6.826 -12.031 396 HB3 PRO 50 2HB PRO 50 3.565 5.573 -11.202 397 HG2 PRO 50 1HG PRO 50 1.146 5.157 -12.998 398 HG3 PRO 50 2HG PRO 50 2.766 4.393 -13.140 399 HD2 PRO 50 1HD PRO 50 0.692 3.170 -11.855 400 HD3 PRO 50 2HD PRO 50 2.378 3.014 -11.273 401 H ALA 51 H ALA 51 1.586 8.350 -10.375 402 HA ALA 51 HA ALA 51 -1.252 8.922 -10.540 403 HB1 ALA 51 1HB ALA 51 -0.524 11.226 -10.672 404 HB2 ALA 51 2HB ALA 51 0.546 10.440 -9.499 405 HB3 ALA 51 3HB ALA 51 1.113 10.755 -11.142 406 H ALA 52 H ALA 52 -0.308 7.145 -12.565 407 HA ALA 52 HA ALA 52 -0.494 6.696 -14.845 408 HB1 ALA 52 1HB ALA 52 -3.078 7.862 -13.779 409 HB2 ALA 52 2HB ALA 52 -2.933 6.747 -15.155 410 HB3 ALA 52 3HB ALA 52 -2.456 6.220 -13.527 411 H THR 53 H THR 53 0.907 8.066 -16.020 412 HA THR 53 HA THR 53 0.580 10.664 -16.627 413 HB THR 53 HB THR 53 2.618 9.531 -16.931 414 HG1 THR 53 1HG THR 53 1.823 10.618 -19.436 415 HG21 THR 53 3HG2 THR 53 3.236 8.157 -18.834 416 HG22 THR 53 1HG2 THR 53 1.567 8.128 -19.413 417 HG23 THR 53 2HG2 THR 53 1.993 7.366 -17.862 418 H ILE 54 H ILE 54 -1.379 11.439 -17.101 419 HA ILE 54 HA ILE 54 -2.078 11.503 -19.923 420 HB ILE 54 HB ILE 54 -4.173 11.288 -17.690 421 HG12 ILE 54 1HG1 ILE 54 -3.178 9.206 -19.642 422 HG13 ILE 54 2HG1 ILE 54 -3.209 9.099 -17.893 423 HG21 ILE 54 1HG2 ILE 54 -4.931 12.631 -19.638 424 HG22 ILE 54 2HG2 ILE 54 -4.491 11.295 -20.732 425 HG23 ILE 54 3HG2 ILE 54 -5.809 11.135 -19.550 426 HD11 ILE 54 3HD1 ILE 54 -5.702 9.050 -17.943 427 HD12 ILE 54 1HD1 ILE 54 -5.610 8.877 -19.716 428 HD13 ILE 54 2HD1 ILE 54 -4.894 7.646 -18.669 429 H SER 55 H SER 55 -3.020 13.680 -20.333 430 HA SER 55 HA SER 55 -3.528 15.334 -18.001 431 HB2 SER 55 1HB SER 55 -1.319 16.125 -18.662 432 HB3 SER 55 2HB SER 55 -1.846 16.305 -20.343 433 HG SER 55 HG SER 55 -2.448 17.833 -18.057 434 H ARG 56 H ARG 56 -5.264 16.598 -18.365 435 HA ARG 56 HA ARG 56 -6.396 17.049 -20.928 436 HB2 ARG 56 1HB ARG 56 -7.055 14.531 -20.326 437 HB3 ARG 56 2HB ARG 56 -8.197 15.302 -19.244 438 HG2 ARG 56 1HG ARG 56 -9.479 14.964 -21.115 439 HG3 ARG 56 2HG ARG 56 -8.986 16.626 -21.391 440 HD2 ARG 56 1HD ARG 56 -7.731 14.146 -22.637 441 HD3 ARG 56 2HD ARG 56 -8.947 15.200 -23.390 442 HE ARG 56 HE ARG 56 -7.006 16.981 -22.832 443 HH11 ARG 56 1HH1 ARG 56 -7.146 14.013 -24.755 444 HH12 ARG 56 2HH1 ARG 56 -5.950 14.560 -25.898 445 HH21 ARG 56 1HH2 ARG 56 -5.146 17.465 -24.022 446 HH22 ARG 56 2HH2 ARG 56 -4.586 16.452 -25.300 447 H ASP 57 H ASP 57 -5.742 18.379 -18.230 448 HA ASP 57 HA ASP 57 -8.360 19.692 -17.758 449 HB2 ASP 57 1HB ASP 57 -7.547 20.456 -15.632 450 HB3 ASP 57 2HB ASP 57 -7.600 18.730 -15.735 451 H ALA 58 H ALA 58 -8.172 21.857 -17.127 452 HA ALA 58 HA ALA 58 -6.236 23.492 -18.703 453 HB1 ALA 58 1HB ALA 58 -8.278 22.964 -20.018 454 HB2 ALA 58 2HB ALA 58 -9.278 23.655 -18.723 455 HB3 ALA 58 3HB ALA 58 -8.165 24.702 -19.642 456 H ALA 59 H ALA 59 -6.635 22.920 -15.776 457 HA ALA 59 HA ALA 59 -6.703 25.660 -14.754 458 HB1 ALA 59 1HB ALA 59 -8.313 23.368 -13.505 459 HB2 ALA 59 2HB ALA 59 -8.173 25.026 -12.875 460 HB3 ALA 59 3HB ALA 59 -9.017 24.726 -14.398 461 H GLY 60 H GLY 60 -6.229 25.024 -12.118 462 HA2 GLY 60 2HA GLY 60 -4.948 22.625 -11.583 463 HA3 GLY 60 1HA GLY 60 -3.692 23.873 -11.635 464 H ASP 61 H ASP 61 -4.165 22.778 -9.198 465 HA ASP 61 HA ASP 61 -5.706 24.859 -7.696 466 HB2 ASP 61 1HB ASP 61 -7.225 23.051 -7.850 467 HB3 ASP 61 2HB ASP 61 -5.948 21.863 -7.578 468 H HIS 62 H HIS 62 -3.838 21.969 -7.097 469 HA HIS 62 HA HIS 62 -1.570 23.460 -6.043 470 HB2 HIS 62 1HB HIS 62 -3.578 22.213 -4.235 471 HB3 HIS 62 2HB HIS 62 -1.999 21.489 -4.034 472 HD1 HIS 62 1HD HIS 62 -3.595 25.030 -3.812 473 HD2 HIS 62 2HD HIS 62 -0.195 22.775 -2.680 474 HE1 HIS 62 1HE HIS 62 -2.319 26.418 -2.096 475 H ARG 63 H ARG 63 0.219 22.031 -5.760 476 HA ARG 63 HA ARG 63 1.578 20.284 -6.037 477 HB2 ARG 63 1HB ARG 63 0.900 18.305 -4.845 478 HB3 ARG 63 2HB ARG 63 0.326 19.754 -4.040 479 HG2 ARG 63 1HG ARG 63 -1.994 19.280 -4.992 480 HG3 ARG 63 2HG ARG 63 -1.357 17.740 -5.578 481 HD2 ARG 63 1HD ARG 63 -0.652 17.379 -3.088 482 HD3 ARG 63 2HD ARG 63 -1.620 18.807 -2.734 483 HE ARG 63 HE ARG 63 -2.557 16.141 -3.533 484 HH11 ARG 63 1HH1 ARG 63 -3.562 19.490 -3.503 485 HH12 ARG 63 2HH1 ARG 63 -5.198 19.184 -3.039 486 HH21 ARG 63 1HH2 ARG 63 -4.658 15.664 -2.855 487 HH22 ARG 63 2HH2 ARG 63 -5.756 16.927 -2.356 488 H GLN 64 H GLN 64 1.672 17.753 -6.840 489 HA GLN 64 HA GLN 64 0.092 17.402 -9.229 490 HB2 GLN 64 1HB GLN 64 2.542 18.855 -9.535 491 HB3 GLN 64 2HB GLN 64 2.892 17.241 -10.148 492 HG2 GLN 64 1HG GLN 64 0.709 17.403 -11.461 493 HG3 GLN 64 2HG GLN 64 0.634 19.103 -10.981 494 HE21 GLN 64 1HE2 GLN 64 1.261 17.314 -13.571 495 HE22 GLN 64 2HE2 GLN 64 2.579 18.205 -14.321 496 H TYR 65 H TYR 65 0.989 15.938 -6.707 497 HA TYR 65 HA TYR 65 1.993 13.430 -8.027 498 HB2 TYR 65 1HB TYR 65 2.441 14.652 -5.301 499 HB3 TYR 65 2HB TYR 65 2.486 12.930 -5.456 500 HD1 TYR 65 1HD TYR 65 3.734 14.561 -8.508 501 HD2 TYR 65 2HD TYR 65 4.844 13.468 -4.473 502 HE1 TYR 65 1HE TYR 65 6.030 14.998 -9.054 503 HE2 TYR 65 2HE TYR 65 7.228 13.916 -5.043 504 HH TYR 65 HH TYR 65 8.224 14.986 -8.330 505 H ARG 66 H ARG 66 1.034 11.446 -7.539 506 HA ARG 66 HA ARG 66 -1.215 11.181 -5.817 507 HB2 ARG 66 1HB ARG 66 -1.756 12.185 -8.408 508 HB3 ARG 66 2HB ARG 66 -2.021 10.465 -8.593 509 HG2 ARG 66 1HG ARG 66 -3.279 11.291 -6.148 510 HG3 ARG 66 2HG ARG 66 -3.652 12.515 -7.356 511 HD2 ARG 66 1HD ARG 66 -4.255 10.397 -8.856 512 HD3 ARG 66 2HD ARG 66 -4.422 9.590 -7.291 513 HE ARG 66 HE ARG 66 -5.809 12.158 -7.473 514 HH11 ARG 66 1HH1 ARG 66 -6.217 8.790 -8.601 515 HH12 ARG 66 2HH1 ARG 66 -7.946 8.854 -8.436 516 HH21 ARG 66 1HH2 ARG 66 -8.023 12.270 -7.557 517 HH22 ARG 66 2HH2 ARG 66 -8.976 10.936 -8.110 518 H GLY 67 H GLY 67 -2.173 8.859 -6.339 519 HA2 GLY 67 2HA GLY 67 -1.267 7.207 -8.264 520 HA3 GLY 67 1HA GLY 67 -0.226 6.825 -6.877 521 H VAL 68 H VAL 68 -1.610 4.763 -7.291 522 HA VAL 68 HA VAL 68 -3.676 4.807 -5.213 523 HB VAL 68 HB VAL 68 -4.992 4.766 -7.215 524 HG11 VAL 68 1HG1 VAL 68 -4.932 3.046 -8.916 525 HG12 VAL 68 2HG1 VAL 68 -3.360 3.844 -8.856 526 HG13 VAL 68 3HG1 VAL 68 -3.579 2.236 -8.117 527 HG21 VAL 68 3HG2 VAL 68 -5.767 3.401 -5.327 528 HG22 VAL 68 1HG2 VAL 68 -6.252 2.702 -6.878 529 HG23 VAL 68 2HG2 VAL 68 -4.904 1.977 -5.963 530 H PHE 69 H PHE 69 -3.446 3.053 -3.846 531 HA PHE 69 HA PHE 69 -0.965 1.445 -4.311 532 HB2 PHE 69 1HB PHE 69 -0.516 2.936 -2.574 533 HB3 PHE 69 2HB PHE 69 -2.121 2.826 -1.906 534 HD1 PHE 69 1HD PHE 69 -2.830 0.807 -0.600 535 HD2 PHE 69 2HD PHE 69 1.174 1.286 -2.089 536 HE1 PHE 69 1HE PHE 69 -2.037 -0.851 1.067 537 HE2 PHE 69 2HE PHE 69 2.004 -0.267 -0.313 538 HZ PHE 69 HZ PHE 69 0.377 -1.351 1.253 539 H GLN 70 H GLN 70 -1.433 -0.580 -4.748 540 HA GLN 70 HA GLN 70 -4.056 -1.703 -3.896 541 HB2 GLN 70 1HB GLN 70 -2.551 -1.836 -6.522 542 HB3 GLN 70 2HB GLN 70 -3.706 -3.069 -6.093 543 HG2 GLN 70 1HG GLN 70 -5.022 -0.543 -5.642 544 HG3 GLN 70 2HG GLN 70 -4.255 -0.412 -7.178 545 HE21 GLN 70 1HE2 GLN 70 -6.102 -2.783 -5.288 546 HE22 GLN 70 2HE2 GLN 70 -7.152 -3.363 -6.563 547 H VAL 71 H VAL 71 -4.024 -4.005 -3.517 548 HA VAL 71 HA VAL 71 -1.584 -5.516 -3.625 549 HB VAL 71 HB VAL 71 -1.006 -4.441 -1.641 550 HG11 VAL 71 1HG1 VAL 71 -3.058 -3.237 -1.080 551 HG12 VAL 71 2HG1 VAL 71 -3.832 -4.762 -0.597 552 HG13 VAL 71 3HG1 VAL 71 -2.436 -4.099 0.308 553 HG21 VAL 71 3HG2 VAL 71 -2.400 -6.908 -0.576 554 HG22 VAL 71 1HG2 VAL 71 -0.816 -6.898 -1.397 555 HG23 VAL 71 2HG2 VAL 71 -1.028 -6.049 0.127 556 H ASN 72 H ASN 72 -2.058 -7.736 -2.935 557 HA ASN 72 HA ASN 72 -4.918 -8.550 -3.252 558 HB2 ASN 72 1HB ASN 72 -2.606 -9.086 -5.125 559 HB3 ASN 72 2HB ASN 72 -3.585 -10.455 -4.688 560 HD21 ASN 72 1HD2 ASN 72 -4.997 -7.137 -5.038 561 HD22 ASN 72 2HD2 ASN 72 -5.980 -7.619 -6.419 562 H VAL 73 H VAL 73 -5.160 -9.329 -1.180 563 HA VAL 73 HA VAL 73 -3.046 -10.983 0.022 564 HB VAL 73 HB VAL 73 -5.913 -10.637 1.011 565 HG11 VAL 73 1HG1 VAL 73 -4.961 -11.304 3.166 566 HG12 VAL 73 2HG1 VAL 73 -4.662 -12.550 1.951 567 HG13 VAL 73 3HG1 VAL 73 -3.345 -11.458 2.430 568 HG21 VAL 73 3HG2 VAL 73 -4.962 -8.964 2.581 569 HG22 VAL 73 1HG2 VAL 73 -3.479 -8.967 1.618 570 HG23 VAL 73 2HG2 VAL 73 -5.006 -8.406 0.911 571 H VAL 74 H VAL 74 -2.771 -12.830 -1.127 572 HA VAL 74 HA VAL 74 -5.127 -14.382 -1.992 573 HB VAL 74 HB VAL 74 -3.555 -13.970 -3.738 574 HG11 VAL 74 1HG1 VAL 74 -1.263 -14.558 -3.745 575 HG12 VAL 74 2HG1 VAL 74 -1.522 -13.535 -2.338 576 HG13 VAL 74 3HG1 VAL 74 -1.342 -15.285 -2.122 577 HG21 VAL 74 3HG2 VAL 74 -2.937 -16.219 -4.441 578 HG22 VAL 74 1HG2 VAL 74 -3.092 -16.825 -2.790 579 HG23 VAL 74 2HG2 VAL 74 -4.540 -16.242 -3.668 580 H MET 75 H MET 75 -5.466 -16.534 -1.023 581 HA MET 75 HA MET 75 -3.235 -17.561 0.490 582 HB2 MET 75 1HB MET 75 -4.565 -18.074 2.550 583 HB3 MET 75 2HB MET 75 -4.156 -16.390 2.331 584 HG2 MET 75 1HG MET 75 -6.758 -17.074 1.177 585 HG3 MET 75 2HG MET 75 -6.643 -17.440 2.894 586 HE1 MET 75 3HE MET 75 -8.067 -15.018 0.694 587 HE2 MET 75 1HE MET 75 -7.358 -13.415 1.019 588 HE3 MET 75 2HE MET 75 -6.417 -14.649 0.176 589 HA PRO 76 HA PRO 76 -4.964 -21.138 -1.418 590 HB2 PRO 76 1HB PRO 76 -3.921 -23.190 0.056 591 HB3 PRO 76 2HB PRO 76 -2.960 -22.154 -1.045 592 HG2 PRO 76 1HG PRO 76 -3.282 -21.833 1.960 593 HG3 PRO 76 2HG PRO 76 -1.765 -21.857 1.004 594 HD2 PRO 76 1HD PRO 76 -2.987 -19.539 1.741 595 HD3 PRO 76 2HD PRO 76 -2.203 -19.703 0.136 596 H ILE 77 H ILE 77 -6.544 -22.887 -1.068 597 HA ILE 77 HA ILE 77 -8.452 -22.095 1.040 598 HB ILE 77 HB ILE 77 -8.989 -23.625 -1.501 599 HG12 ILE 77 1HG1 ILE 77 -9.318 -20.638 -0.947 600 HG13 ILE 77 2HG1 ILE 77 -8.086 -21.334 -1.978 601 HG21 ILE 77 1HG2 ILE 77 -11.354 -22.908 -1.057 602 HG22 ILE 77 2HG2 ILE 77 -10.725 -23.915 0.186 603 HG23 ILE 77 3HG2 ILE 77 -10.833 -22.127 0.459 604 HD11 ILE 77 3HD1 ILE 77 -9.933 -22.309 -3.415 605 HD12 ILE 77 1HD1 ILE 77 -11.061 -21.274 -2.491 606 HD13 ILE 77 2HD1 ILE 77 -9.765 -20.549 -3.426 607 H GLY 78 H GLY 78 -7.124 -23.301 2.610 608 HA2 GLY 78 2HA GLY 78 -6.827 -26.110 2.602 609 HA3 GLY 78 1HA GLY 78 -6.743 -25.044 4.006 610 H ASP 79 H ASP 79 -8.805 -24.463 5.124 611 HA ASP 79 HA ASP 79 -11.207 -25.935 4.432 612 HB2 ASP 79 1HB ASP 79 -9.992 -27.289 6.132 613 HB3 ASP 79 2HB ASP 79 -9.968 -25.885 7.196 614 H GLY 80 H GLY 80 -12.624 -24.391 4.294 615 HA2 GLY 80 2HA GLY 80 -13.879 -22.488 4.568 616 HA3 GLY 80 1HA GLY 80 -12.994 -22.124 6.055 617 H SER 81 H SER 81 -10.550 -21.729 5.415 618 HA SER 81 HA SER 81 -9.186 -20.051 5.193 619 HB2 SER 81 1HB SER 81 -9.098 -21.428 3.018 620 HB3 SER 81 2HB SER 81 -9.710 -19.947 2.271 621 HG SER 81 HG SER 81 -7.322 -20.198 2.466 622 H ARG 82 H ARG 82 -9.748 -18.415 6.313 623 HA ARG 82 HA ARG 82 -11.415 -16.236 5.120 624 HB2 ARG 82 1HB ARG 82 -11.490 -17.435 7.918 625 HB3 ARG 82 2HB ARG 82 -12.210 -15.890 7.513 626 HG2 ARG 82 1HG ARG 82 -13.916 -17.475 7.586 627 HG3 ARG 82 2HG ARG 82 -13.759 -16.932 5.917 628 HD2 ARG 82 1HD ARG 82 -13.068 -19.033 5.161 629 HD3 ARG 82 2HD ARG 82 -12.282 -19.416 6.701 630 HE ARG 82 HE ARG 82 -14.267 -20.078 7.675 631 HH11 ARG 82 1HH1 ARG 82 -14.823 -19.379 4.226 632 HH12 ARG 82 2HH1 ARG 82 -16.103 -20.540 4.087 633 HH21 ARG 82 1HH2 ARG 82 -15.842 -21.551 7.501 634 HH22 ARG 82 2HH2 ARG 82 -16.726 -21.838 6.040 635 H SER 83 H SER 83 -8.280 -16.791 5.802 636 HA SER 83 HA SER 83 -7.476 -14.890 7.672 637 HB2 SER 83 1HB SER 83 -6.125 -15.919 5.145 638 HB3 SER 83 2HB SER 83 -5.278 -15.050 6.420 639 HG SER 83 HG SER 83 -5.222 -17.363 6.547 640 H ALA 84 H ALA 84 -8.660 -14.272 4.451 641 HA ALA 84 HA ALA 84 -7.684 -11.700 3.869 642 HB1 ALA 84 1HB ALA 84 -10.460 -12.951 3.498 643 HB2 ALA 84 2HB ALA 84 -9.909 -11.463 2.721 644 HB3 ALA 84 3HB ALA 84 -9.118 -13.006 2.338 645 H GLU 85 H GLU 85 -10.351 -12.697 6.127 646 HA GLU 85 HA GLU 85 -11.387 -10.101 6.585 647 HB2 GLU 85 1HB GLU 85 -11.507 -12.727 8.043 648 HB3 GLU 85 2HB GLU 85 -12.206 -11.285 8.763 649 HG2 GLU 85 1HG GLU 85 -12.785 -11.780 5.838 650 HG3 GLU 85 2HG GLU 85 -13.464 -12.884 7.015 651 H GLN 86 H GLN 86 -9.085 -12.051 8.545 652 HA GLN 86 HA GLN 86 -8.552 -10.158 10.523 653 HB2 GLN 86 1HB GLN 86 -6.948 -12.468 9.302 654 HB3 GLN 86 2HB GLN 86 -6.355 -11.514 10.639 655 HG2 GLN 86 1HG GLN 86 -8.925 -13.134 10.620 656 HG3 GLN 86 2HG GLN 86 -7.430 -13.570 11.443 657 HE21 GLN 86 1HE2 GLN 86 -6.582 -11.450 12.908 658 HE22 GLN 86 2HE2 GLN 86 -7.889 -10.816 13.907 659 H VAL 87 H VAL 87 -6.733 -10.800 7.487 660 HA VAL 87 HA VAL 87 -4.773 -8.776 7.959 661 HB VAL 87 HB VAL 87 -5.711 -10.240 5.468 662 HG11 VAL 87 1HG1 VAL 87 -3.197 -8.550 5.844 663 HG12 VAL 87 2HG1 VAL 87 -3.551 -9.586 4.436 664 HG13 VAL 87 3HG1 VAL 87 -4.567 -8.181 4.769 665 HG21 VAL 87 3HG2 VAL 87 -4.642 -11.586 7.367 666 HG22 VAL 87 1HG2 VAL 87 -3.860 -11.689 5.801 667 HG23 VAL 87 2HG2 VAL 87 -3.162 -10.650 7.076 668 H ALA 88 H ALA 88 -7.952 -8.665 6.259 669 HA ALA 88 HA ALA 88 -7.606 -5.983 5.359 670 HB1 ALA 88 1HB ALA 88 -10.050 -6.115 4.913 671 HB2 ALA 88 2HB ALA 88 -9.217 -7.543 4.299 672 HB3 ALA 88 3HB ALA 88 -10.139 -7.628 5.820 673 H ALA 89 H ALA 89 -8.510 -7.244 8.497 674 HA ALA 89 HA ALA 89 -9.599 -4.653 9.378 675 HB1 ALA 89 1HB ALA 89 -9.816 -5.777 11.519 676 HB2 ALA 89 2HB ALA 89 -10.517 -6.784 10.240 677 HB3 ALA 89 3HB ALA 89 -8.926 -7.193 10.929 678 H GLU 90 H GLU 90 -6.626 -6.600 9.777 679 HA GLU 90 HA GLU 90 -5.390 -4.879 11.686 680 HB2 GLU 90 1HB GLU 90 -4.141 -6.765 9.640 681 HB3 GLU 90 2HB GLU 90 -3.254 -5.952 10.940 682 HG2 GLU 90 1HG GLU 90 -5.381 -7.203 12.273 683 HG3 GLU 90 2HG GLU 90 -4.950 -8.358 11.021 684 H LEU 91 H LEU 91 -4.780 -5.191 8.191 685 HA LEU 91 HA LEU 91 -3.019 -2.976 8.006 686 HB2 LEU 91 1HB LEU 91 -4.634 -4.571 6.039 687 HB3 LEU 91 2HB LEU 91 -3.733 -3.167 5.486 688 HG LEU 91 HG LEU 91 -2.438 -5.389 7.103 689 HD11 LEU 91 1HD1 LEU 91 -2.569 -5.064 4.110 690 HD12 LEU 91 2HD1 LEU 91 -3.368 -6.322 5.090 691 HD13 LEU 91 3HD1 LEU 91 -1.597 -6.289 4.991 692 HD21 LEU 91 3HD2 LEU 91 -1.424 -3.001 5.501 693 HD22 LEU 91 1HD2 LEU 91 -0.389 -4.403 5.801 694 HD23 LEU 91 2HD2 LEU 91 -1.037 -3.498 7.163 695 H ASP 92 H ASP 92 -6.527 -3.163 8.109 696 HA ASP 92 HA ASP 92 -7.110 -0.665 6.821 697 HB2 ASP 92 1HB ASP 92 -9.053 -1.898 7.049 698 HB3 ASP 92 2HB ASP 92 -8.591 -2.544 8.624 699 H ALA 93 H ALA 93 -6.809 -1.541 10.317 700 HA ALA 93 HA ALA 93 -6.891 1.203 11.126 701 HB1 ALA 93 1HB ALA 93 -7.363 -0.731 12.620 702 HB2 ALA 93 2HB ALA 93 -5.625 -1.153 12.562 703 HB3 ALA 93 3HB ALA 93 -6.154 0.373 13.300 704 H LEU 94 H LEU 94 -4.362 -0.594 9.658 705 HA LEU 94 HA LEU 94 -2.142 0.981 10.662 706 HB2 LEU 94 1HB LEU 94 -1.953 -1.361 9.685 707 HB3 LEU 94 2HB LEU 94 -2.280 -0.648 8.102 708 HG LEU 94 HG LEU 94 -0.263 0.815 8.353 709 HD11 LEU 94 1HD1 LEU 94 1.419 0.044 10.117 710 HD12 LEU 94 2HD1 LEU 94 0.102 -0.853 10.881 711 HD13 LEU 94 3HD1 LEU 94 0.033 0.920 10.760 712 HD21 LEU 94 3HD2 LEU 94 0.146 -2.176 8.607 713 HD22 LEU 94 1HD2 LEU 94 1.359 -1.042 7.978 714 HD23 LEU 94 2HD2 LEU 94 -0.168 -1.296 7.120 715 H PHE 95 H PHE 95 -4.312 1.118 7.782 716 HA PHE 95 HA PHE 95 -3.138 3.777 7.091 717 HB2 PHE 95 1HB PHE 95 -3.991 1.573 5.197 718 HB3 PHE 95 2HB PHE 95 -3.436 3.163 4.713 719 HD1 PHE 95 2HD PHE 95 -0.910 3.838 5.640 720 HD2 PHE 95 1HD PHE 95 -2.476 -0.159 5.021 721 HE1 PHE 95 2HE PHE 95 1.335 3.003 5.422 722 HE2 PHE 95 1HE PHE 95 -0.151 -0.975 4.715 723 HZ PHE 95 HZ PHE 95 1.765 0.566 4.958 724 HA PRO 96 HA PRO 96 -7.843 4.071 7.203 725 HB2 PRO 96 1HB PRO 96 -8.339 5.415 9.492 726 HB3 PRO 96 2HB PRO 96 -7.992 3.657 9.531 727 HG2 PRO 96 1HG PRO 96 -6.025 5.942 9.982 728 HG3 PRO 96 2HG PRO 96 -6.337 4.535 11.049 729 HD2 PRO 96 1HD PRO 96 -4.308 4.557 9.208 730 HD3 PRO 96 2HD PRO 96 -5.233 3.073 9.595 731 H VAL 97 H VAL 97 -9.046 6.429 7.358 732 HA VAL 97 HA VAL 97 -7.935 8.271 5.742 733 HB VAL 97 HB VAL 97 -10.127 7.995 7.729 734 HG11 VAL 97 1HG1 VAL 97 -11.052 10.219 7.151 735 HG12 VAL 97 2HG1 VAL 97 -9.504 10.394 7.983 736 HG13 VAL 97 3HG1 VAL 97 -9.576 10.601 6.203 737 HG21 VAL 97 3HG2 VAL 97 -10.614 7.079 5.843 738 HG22 VAL 97 1HG2 VAL 97 -11.447 8.554 5.666 739 HG23 VAL 97 2HG2 VAL 97 -9.920 8.384 4.803 740 H ASN 98 H ASN 98 -6.843 7.921 8.814 741 HA ASN 98 HA ASN 98 -5.668 10.689 8.731 742 HB2 ASN 98 1HB ASN 98 -5.878 9.056 11.273 743 HB3 ASN 98 2HB ASN 98 -5.372 10.726 11.130 744 HD21 ASN 98 1HD2 ASN 98 -8.081 8.619 11.506 745 HD22 ASN 98 2HD2 ASN 98 -9.370 9.758 11.210 746 H LEU 99 H LEU 99 -4.745 7.888 7.741 747 HA LEU 99 HA LEU 99 -2.313 7.141 8.701 748 HB2 LEU 99 1HB LEU 99 -3.483 6.172 6.808 749 HB3 LEU 99 2HB LEU 99 -3.243 7.674 5.922 750 HG LEU 99 HG LEU 99 -0.700 7.094 5.911 751 HD11 LEU 99 1HD1 LEU 99 -1.384 4.787 7.606 752 HD12 LEU 99 2HD1 LEU 99 -0.448 6.238 8.027 753 HD13 LEU 99 3HD1 LEU 99 0.172 5.157 6.824 754 HD21 LEU 99 3HD2 LEU 99 -2.514 5.168 4.672 755 HD22 LEU 99 1HD2 LEU 99 -0.781 5.394 4.297 756 HD23 LEU 99 2HD2 LEU 99 -1.894 6.700 4.034 757 H VAL 100 H VAL 100 -0.897 8.720 9.551 758 HA VAL 100 HA VAL 100 0.047 10.817 7.670 759 HB VAL 100 HB VAL 100 -1.269 11.759 9.437 760 HG11 VAL 100 1HG1 VAL 100 -0.613 11.671 11.831 761 HG12 VAL 100 2HG1 VAL 100 -1.204 10.124 11.220 762 HG13 VAL 100 3HG1 VAL 100 0.544 10.383 11.447 763 HG21 VAL 100 3HG2 VAL 100 0.259 13.408 10.258 764 HG22 VAL 100 1HG2 VAL 100 1.648 12.330 10.024 765 HG23 VAL 100 2HG2 VAL 100 0.751 12.950 8.617 766 H MET 101 H MET 101 2.168 10.958 7.260 767 HA MET 101 HA MET 101 4.149 9.624 8.909 768 HB2 MET 101 1HB MET 101 5.056 8.375 6.968 769 HB3 MET 101 2HB MET 101 3.445 7.821 7.417 770 HG2 MET 101 1HG MET 101 2.607 9.490 5.569 771 HG3 MET 101 2HG MET 101 4.275 9.479 5.034 772 HE1 MET 101 3HE MET 101 1.011 6.870 3.624 773 HE2 MET 101 1HE MET 101 0.876 8.117 4.891 774 HE3 MET 101 2HE MET 101 1.471 8.543 3.282 775 H GLN 102 H GLN 102 6.278 10.496 8.378 776 HA GLN 102 HA GLN 102 6.418 12.484 6.212 777 HB2 GLN 102 1HB GLN 102 7.621 12.600 9.004 778 HB3 GLN 102 2HB GLN 102 8.239 13.533 7.644 779 HG2 GLN 102 1HG GLN 102 6.189 14.749 7.391 780 HG3 GLN 102 2HG GLN 102 5.350 13.725 8.568 781 HE21 GLN 102 1HE2 GLN 102 6.813 16.746 8.246 782 HE22 GLN 102 2HE2 GLN 102 7.171 16.993 9.946 783 H SER 103 H SER 103 8.619 12.494 5.292 784 HA SER 103 HA SER 103 10.357 10.223 5.862 785 HB2 SER 103 1HB SER 103 8.672 9.304 4.360 786 HB3 SER 103 2HB SER 103 8.942 10.598 3.179 787 HG SER 103 HG SER 103 10.018 8.732 2.618 788 H GLY 104 H GLY 104 12.027 10.551 3.750 789 HA2 GLY 104 2HA GLY 104 13.518 12.823 4.569 790 HA3 GLY 104 1HA GLY 104 13.858 11.841 3.141 791 H GLY 105 H GLY 105 10.875 12.748 2.072 792 HA2 GLY 105 2HA GLY 105 11.927 15.125 0.766 793 HA3 GLY 105 1HA GLY 105 10.461 14.211 0.434 794 H LEU 106 H LEU 106 9.143 14.076 2.682 795 HA LEU 106 HA LEU 106 8.294 16.416 4.003 796 HB2 LEU 106 1HB LEU 106 6.521 17.148 2.540 797 HB3 LEU 106 2HB LEU 106 8.048 17.379 1.736 798 HG LEU 106 HG LEU 106 6.153 15.035 1.190 799 HD11 LEU 106 1HD1 LEU 106 6.544 17.594 -0.382 800 HD12 LEU 106 2HD1 LEU 106 5.114 17.200 0.595 801 HD13 LEU 106 3HD1 LEU 106 5.515 16.230 -0.837 802 HD21 LEU 106 3HD2 LEU 106 8.701 15.961 -0.167 803 HD22 LEU 106 1HD2 LEU 106 7.506 14.979 -1.006 804 HD23 LEU 106 2HD2 LEU 106 8.265 14.329 0.451 805 H ALA 107 H ALA 107 5.620 16.122 3.996 806 HA ALA 107 HA ALA 107 5.109 13.452 5.068 807 HB1 ALA 107 1HB ALA 107 4.395 15.483 6.274 808 HB2 ALA 107 2HB ALA 107 3.389 15.949 4.893 809 HB3 ALA 107 3HB ALA 107 3.003 14.479 5.825 810 H VAL 108 H VAL 108 3.004 12.370 4.582 811 HA VAL 108 HA VAL 108 1.549 13.115 2.232 812 HB VAL 108 HB VAL 108 3.145 11.963 1.018 813 HG11 VAL 108 1HG1 VAL 108 3.860 9.579 1.486 814 HG12 VAL 108 2HG1 VAL 108 4.499 10.826 2.560 815 HG13 VAL 108 3HG1 VAL 108 3.159 9.812 3.100 816 HG21 VAL 108 3HG2 VAL 108 0.806 11.341 0.453 817 HG22 VAL 108 1HG2 VAL 108 2.004 10.137 -0.019 818 HG23 VAL 108 2HG2 VAL 108 0.995 9.866 1.415 819 H ARG 109 H ARG 109 -0.516 11.773 2.102 820 HA ARG 109 HA ARG 109 -1.296 10.534 4.634 821 HB2 ARG 109 1HB ARG 109 -2.616 12.916 3.275 822 HB3 ARG 109 2HB ARG 109 -3.502 11.909 4.374 823 HG2 ARG 109 1HG ARG 109 -0.969 13.216 5.308 824 HG3 ARG 109 2HG ARG 109 -2.486 14.099 5.122 825 HD2 ARG 109 1HD ARG 109 -3.322 11.900 6.577 826 HD3 ARG 109 2HD ARG 109 -1.701 12.198 7.235 827 HE ARG 109 HE ARG 109 -2.962 14.680 6.999 828 HH11 ARG 109 1HH1 ARG 109 -3.269 11.819 9.192 829 HH12 ARG 109 2HH1 ARG 109 -4.221 12.740 10.308 830 HH21 ARG 109 1HH2 ARG 109 -4.501 15.643 8.383 831 HH22 ARG 109 2HH2 ARG 109 -5.125 14.737 9.724 832 H VAL 110 H VAL 110 -3.937 10.138 3.958 833 HA VAL 110 HA VAL 110 -3.727 8.400 1.555 834 HB VAL 110 HB VAL 110 -3.901 7.347 3.813 835 HG11 VAL 110 1HG1 VAL 110 -6.626 8.641 3.833 836 HG12 VAL 110 2HG1 VAL 110 -6.164 7.256 4.800 837 HG13 VAL 110 3HG1 VAL 110 -5.312 8.798 5.022 838 HG21 VAL 110 3HG2 VAL 110 -5.582 5.686 3.135 839 HG22 VAL 110 1HG2 VAL 110 -6.126 6.768 1.830 840 HG23 VAL 110 2HG2 VAL 110 -4.478 6.119 1.810 841 H ARG 111 H ARG 111 -5.775 10.868 3.109 842 HA ARG 111 HA ARG 111 -7.453 12.136 2.391 843 HB2 ARG 111 1HB ARG 111 -5.992 11.687 -0.032 844 HB3 ARG 111 2HB ARG 111 -7.680 11.531 -0.456 845 HG2 ARG 111 1HG ARG 111 -6.694 13.892 1.175 846 HG3 ARG 111 2HG ARG 111 -6.398 13.811 -0.551 847 HD2 ARG 111 1HD ARG 111 -8.352 15.088 -0.387 848 HD3 ARG 111 2HD ARG 111 -8.890 13.489 -0.905 849 HE ARG 111 HE ARG 111 -8.914 13.918 2.001 850 HH11 ARG 111 1HH1 ARG 111 -10.903 14.145 -0.937 851 HH12 ARG 111 2HH1 ARG 111 -12.372 14.304 -0.041 852 HH21 ARG 111 1HH2 ARG 111 -10.764 13.960 3.074 853 HH22 ARG 111 2HH2 ARG 111 -12.351 14.055 2.253 854 H THR 112 H THR 112 -7.629 8.858 0.936 855 HA THR 112 HA THR 112 -10.560 8.870 1.393 856 HB THR 112 HB THR 112 -10.501 6.816 0.021 857 HG1 THR 112 1HG THR 112 -8.319 6.275 0.340 858 HG21 THR 112 3HG2 THR 112 -9.238 9.254 -1.336 859 HG22 THR 112 1HG2 THR 112 -10.968 9.074 -0.950 860 HG23 THR 112 2HG2 THR 112 -10.207 7.987 -2.110 861 HA PRO 113 HA PRO 113 -9.956 5.751 4.651 862 HB2 PRO 113 1HB PRO 113 -12.262 4.259 4.360 863 HB3 PRO 113 2HB PRO 113 -12.260 5.874 5.104 864 HG2 PRO 113 1HG PRO 113 -12.914 5.133 2.267 865 HG3 PRO 113 2HG PRO 113 -13.842 6.210 3.360 866 HD2 PRO 113 1HD PRO 113 -12.124 7.114 1.446 867 HD3 PRO 113 2HD PRO 113 -12.288 7.967 2.993 868 H ILE 114 H ILE 114 -10.175 3.232 4.635 869 HA ILE 114 HA ILE 114 -8.812 1.908 2.456 870 HB ILE 114 HB ILE 114 -10.508 0.990 4.833 871 HG12 ILE 114 1HG1 ILE 114 -8.497 2.207 5.565 872 HG13 ILE 114 2HG1 ILE 114 -8.507 0.530 6.003 873 HG21 ILE 114 1HG2 ILE 114 -9.332 -1.219 4.604 874 HG22 ILE 114 2HG2 ILE 114 -10.516 -0.870 3.343 875 HG23 ILE 114 3HG2 ILE 114 -8.793 -0.711 2.988 876 HD11 ILE 114 3HD1 ILE 114 -6.874 1.829 3.801 877 HD12 ILE 114 1HD1 ILE 114 -6.278 1.074 5.293 878 HD13 ILE 114 2HD1 ILE 114 -6.961 0.065 4.017 879 H SER 115 H SER 115 -9.796 0.599 0.815 880 HA SER 115 HA SER 115 -12.746 0.303 0.912 881 HB2 SER 115 1HB SER 115 -11.494 -0.083 -1.686 882 HB3 SER 115 2HB SER 115 -12.959 0.822 -1.281 883 HG SER 115 HG SER 115 -11.779 2.631 -0.895 884 H ASN 116 H ASN 116 -13.446 -1.779 -0.009 885 HA ASN 116 HA ASN 116 -11.484 -3.929 -0.298 886 HB2 ASN 116 1HB ASN 116 -13.461 -3.537 1.957 887 HB3 ASN 116 2HB ASN 116 -13.112 -5.176 1.402 888 HD21 ASN 116 1HD2 ASN 116 -10.592 -5.453 1.007 889 HD22 ASN 116 2HD2 ASN 116 -9.628 -5.003 2.409 890 H GLY 117 H GLY 117 -13.166 -6.068 -0.538 891 HA2 GLY 117 2HA GLY 117 -15.701 -5.574 -1.608 892 HA3 GLY 117 1HA GLY 117 -14.561 -5.884 -2.939 893 H GLN 118 H GLN 118 -16.394 -7.850 -2.805 894 HA GLN 118 HA GLN 118 -15.835 -9.949 -0.970 895 HB2 GLN 118 1HB GLN 118 -17.358 -9.480 -3.529 896 HB3 GLN 118 2HB GLN 118 -16.946 -11.123 -3.130 897 HG2 GLN 118 1HG GLN 118 -17.988 -10.875 -0.880 898 HG3 GLN 118 2HG GLN 118 -18.481 -9.231 -1.316 899 HE21 GLN 118 1HE2 GLN 118 -20.475 -11.000 -0.541 900 HE22 GLN 118 2HE2 GLN 118 -21.342 -11.625 -1.929 901 HA PRO 119 HA PRO 119 -12.206 -11.498 -2.926 902 HB2 PRO 119 1HB PRO 119 -12.191 -14.170 -2.275 903 HB3 PRO 119 2HB PRO 119 -11.870 -12.869 -1.119 904 HG2 PRO 119 1HG PRO 119 -14.450 -14.364 -1.548 905 HG3 PRO 119 2HG PRO 119 -13.687 -13.878 -0.006 906 HD2 PRO 119 1HD PRO 119 -15.750 -12.482 -1.225 907 HD3 PRO 119 2HD PRO 119 -14.537 -11.686 -0.186 908 H THR 120 H THR 120 -11.374 -13.054 -4.508 909 HA THR 120 HA THR 120 -13.350 -13.969 -6.533 910 HB THR 120 HB THR 120 -10.568 -12.810 -7.044 911 HG1 THR 120 1HG THR 120 -11.823 -11.197 -6.244 912 HG21 THR 120 3HG2 THR 120 -12.940 -13.335 -8.904 913 HG22 THR 120 1HG2 THR 120 -11.432 -14.271 -8.845 914 HG23 THR 120 2HG2 THR 120 -11.401 -12.584 -9.373 915 H THR 121 H THR 121 -13.342 -16.179 -6.357 916 HA THR 121 HA THR 121 -11.192 -17.558 -5.065 917 HB THR 121 HB THR 121 -13.208 -19.015 -6.740 918 HG1 THR 121 1HG THR 121 -14.824 -18.675 -5.390 919 HG21 THR 121 3HG2 THR 121 -11.736 -20.293 -5.239 920 HG22 THR 121 1HG2 THR 121 -13.385 -20.371 -4.626 921 HG23 THR 121 2HG2 THR 121 -12.215 -19.283 -3.857 922 H GLY 122 H GLY 122 -10.107 -19.440 -6.088 923 HA2 GLY 122 2HA GLY 122 -9.662 -19.455 -8.948 924 HA3 GLY 122 1HA GLY 122 -8.283 -19.175 -7.842 925 H ASP 123 H ASP 123 -7.698 -21.334 -8.962 926 HA ASP 123 HA ASP 123 -9.260 -23.614 -8.822 927 HB2 ASP 123 1HB ASP 123 -7.158 -23.153 -10.191 928 HB3 ASP 123 2HB ASP 123 -6.236 -23.602 -8.767 929 H ALA 124 H ALA 124 -6.641 -22.638 -6.589 930 HA ALA 124 HA ALA 124 -7.933 -24.067 -4.358 931 HB1 ALA 124 1HB ALA 124 -6.352 -25.710 -5.402 932 HB2 ALA 124 2HB ALA 124 -5.039 -24.520 -5.252 933 HB3 ALA 124 3HB ALA 124 -5.800 -25.198 -3.796 934 H ASP 125 H ASP 125 -7.177 -21.175 -5.404 935 HA ASP 125 HA ASP 125 -6.164 -20.246 -2.788 936 HB2 ASP 125 1HB ASP 125 -5.273 -19.115 -5.462 937 HB3 ASP 125 2HB ASP 125 -4.952 -18.430 -3.890 938 H HIS 126 H HIS 126 -6.877 -17.992 -2.440 939 HA HIS 126 HA HIS 126 -8.847 -16.946 -4.354 940 HB2 HIS 126 1HB HIS 126 -10.686 -16.931 -2.974 941 HB3 HIS 126 2HB HIS 126 -9.908 -18.474 -2.585 942 HD1 HIS 126 1HD HIS 126 -11.559 -15.846 -0.808 943 HD2 HIS 126 2HD HIS 126 -8.350 -18.501 -0.277 944 HE1 HIS 126 1HE HIS 126 -11.167 -16.015 1.723 945 H THR 127 H THR 127 -9.256 -14.679 -4.071 946 HA THR 127 HA THR 127 -7.298 -13.277 -2.342 947 HB THR 127 HB THR 127 -7.681 -12.667 -5.299 948 HG1 THR 127 1HG THR 127 -5.680 -13.715 -5.639 949 HG21 THR 127 3HG2 THR 127 -6.628 -10.919 -3.878 950 HG22 THR 127 1HG2 THR 127 -5.508 -11.593 -5.063 951 HG23 THR 127 2HG2 THR 127 -5.382 -12.099 -3.385 952 H VAL 128 H VAL 128 -7.983 -11.507 -1.402 953 HA VAL 128 HA VAL 128 -10.616 -10.412 -2.199 954 HB VAL 128 HB VAL 128 -9.987 -8.869 -0.202 955 HG11 VAL 128 1HG1 VAL 128 -11.268 -10.182 1.288 956 HG12 VAL 128 2HG1 VAL 128 -11.916 -10.440 -0.330 957 HG13 VAL 128 3HG1 VAL 128 -10.871 -11.680 0.420 958 HG21 VAL 128 3HG2 VAL 128 -8.390 -11.301 0.639 959 HG22 VAL 128 1HG2 VAL 128 -7.734 -9.698 0.200 960 HG23 VAL 128 2HG2 VAL 128 -8.777 -9.863 1.608 961 HA PRO 129 HA PRO 129 -8.428 -6.971 -4.125 962 HB2 PRO 129 1HB PRO 129 -10.572 -5.473 -4.833 963 HB3 PRO 129 2HB PRO 129 -10.275 -7.065 -5.591 964 HG2 PRO 129 1HG PRO 129 -12.196 -6.431 -3.336 965 HG3 PRO 129 2HG PRO 129 -12.483 -7.428 -4.793 966 HD2 PRO 129 1HD PRO 129 -11.781 -8.452 -2.346 967 HD3 PRO 129 2HD PRO 129 -11.388 -9.236 -3.906 968 H ILE 130 H ILE 130 -7.380 -5.278 -2.987 969 HA ILE 130 HA ILE 130 -8.971 -3.668 -1.119 970 HB ILE 130 HB ILE 130 -6.261 -4.707 -0.236 971 HG12 ILE 130 1HG1 ILE 130 -8.921 -6.109 0.214 972 HG13 ILE 130 2HG1 ILE 130 -7.458 -6.744 -0.526 973 HG21 ILE 130 1HG2 ILE 130 -7.155 -4.035 2.005 974 HG22 ILE 130 2HG2 ILE 130 -7.138 -2.704 0.878 975 HG23 ILE 130 3HG2 ILE 130 -8.668 -3.515 1.228 976 HD11 ILE 130 3HD1 ILE 130 -7.749 -7.700 1.613 977 HD12 ILE 130 1HD1 ILE 130 -6.323 -6.647 1.658 978 HD13 ILE 130 2HD1 ILE 130 -7.863 -6.138 2.415 979 H SER 131 H SER 131 -8.162 -1.569 -0.897 980 HA SER 131 HA SER 131 -5.615 -0.702 -1.675 981 HB2 SER 131 1HB SER 131 -6.427 0.693 -3.710 982 HB3 SER 131 2HB SER 131 -6.075 -1.018 -3.924 983 HG SER 131 HG SER 131 -8.661 0.103 -3.601 984 H LEU 132 H LEU 132 -5.449 1.723 -1.702 985 HA LEU 132 HA LEU 132 -7.821 3.275 -1.154 986 HB2 LEU 132 1HB LEU 132 -6.291 4.691 0.386 987 HB3 LEU 132 2HB LEU 132 -7.176 3.329 1.051 988 HG LEU 132 HG LEU 132 -4.966 3.620 1.965 989 HD11 LEU 132 1HD1 LEU 132 -4.262 1.437 2.173 990 HD12 LEU 132 2HD1 LEU 132 -4.779 0.977 0.548 991 HD13 LEU 132 3HD1 LEU 132 -5.989 1.302 1.792 992 HD21 LEU 132 3HD2 LEU 132 -3.836 2.931 -0.722 993 HD22 LEU 132 1HD2 LEU 132 -2.903 3.182 0.774 994 HD23 LEU 132 2HD2 LEU 132 -3.783 4.532 0.038 995 H GLY 133 H GLY 133 -7.107 5.664 -1.533 996 HA2 GLY 133 2HA GLY 133 -5.168 5.853 -3.795 997 HA3 GLY 133 1HA GLY 133 -6.418 7.044 -3.386 998 H TYR 134 H TYR 134 -3.868 8.042 -3.566 999 HA TYR 134 HA TYR 134 -3.666 9.207 -0.958 1000 HB2 TYR 134 1HB TYR 134 -1.326 8.721 -0.552 1001 HB3 TYR 134 2HB TYR 134 -2.223 7.225 -0.597 1002 HD1 TYR 134 2HD TYR 134 -1.993 5.680 -2.572 1003 HD2 TYR 134 1HD TYR 134 0.418 9.237 -2.137 1004 HE1 TYR 134 2HE TYR 134 -0.430 4.882 -4.372 1005 HE2 TYR 134 1HE TYR 134 1.922 8.472 -3.927 1006 HH TYR 134 HH TYR 134 2.260 6.839 -5.657 1007 H ASP 135 H ASP 135 -1.694 10.893 -1.135 1008 HA ASP 135 HA ASP 135 -0.688 11.281 -3.792 1009 HB2 ASP 135 1HB ASP 135 -1.246 13.757 -3.860 1010 HB3 ASP 135 2HB ASP 135 -2.424 12.594 -4.422 1011 H VAL 136 H VAL 136 -0.952 13.755 -1.345 1012 HA VAL 136 HA VAL 136 1.579 13.593 -0.039 1013 HB VAL 136 HB VAL 136 1.450 15.268 -2.621 1014 HG11 VAL 136 1HG1 VAL 136 2.024 16.860 -0.708 1015 HG12 VAL 136 2HG1 VAL 136 3.282 15.733 -0.178 1016 HG13 VAL 136 3HG1 VAL 136 3.397 16.574 -1.751 1017 HG21 VAL 136 3HG2 VAL 136 2.746 13.355 -2.991 1018 HG22 VAL 136 1HG2 VAL 136 3.914 14.599 -2.643 1019 HG23 VAL 136 2HG2 VAL 136 3.502 13.420 -1.384 1020 H GLN 137 H GLN 137 1.831 15.134 1.514 1021 HA GLN 137 HA GLN 137 -0.390 16.950 2.019 1022 HB2 GLN 137 1HB GLN 137 -1.057 15.290 3.506 1023 HB3 GLN 137 2HB GLN 137 0.585 14.667 3.774 1024 HG2 GLN 137 1HG GLN 137 1.198 16.543 5.039 1025 HG3 GLN 137 2HG GLN 137 -0.315 17.387 4.671 1026 HE21 GLN 137 1HE2 GLN 137 1.246 15.219 6.895 1027 HE22 GLN 137 2HE2 GLN 137 -0.127 15.084 7.964 1028 H PHE 138 H PHE 138 0.404 18.765 3.217 1029 HA PHE 138 HA PHE 138 3.351 19.113 3.298 1030 HB2 PHE 138 1HB PHE 138 1.194 21.147 2.657 1031 HB3 PHE 138 2HB PHE 138 2.921 21.442 2.707 1032 HD1 PHE 138 2HD PHE 138 0.233 19.487 0.890 1033 HD2 PHE 138 1HD PHE 138 4.167 21.220 0.729 1034 HE1 PHE 138 2HE PHE 138 0.341 19.004 -1.530 1035 HE2 PHE 138 1HE PHE 138 4.263 20.768 -1.721 1036 HZ PHE 138 HZ PHE 138 2.361 19.646 -2.849 1037 H TYR 139 H TYR 139 3.966 19.508 5.393 1038 HA TYR 139 HA TYR 139 1.975 19.544 7.540 1039 HB2 TYR 139 1HB TYR 139 4.933 19.348 7.306 1040 HB3 TYR 139 2HB TYR 139 4.390 20.308 8.654 1041 HD1 TYR 139 1HD TYR 139 2.988 17.140 7.183 1042 HD2 TYR 139 2HD TYR 139 4.656 19.138 10.610 1043 HE1 TYR 139 1HE TYR 139 2.741 15.040 8.544 1044 HE2 TYR 139 2HE TYR 139 4.352 17.128 11.960 1045 HH TYR 139 HH TYR 139 4.107 14.780 11.764 1046 HA PRO 140 HA PRO 140 1.743 24.022 7.962 1047 HB2 PRO 140 1HB PRO 140 1.896 24.466 10.668 1048 HB3 PRO 140 2HB PRO 140 0.441 23.781 9.874 1049 HG2 PRO 140 1HG PRO 140 2.682 22.293 11.280 1050 HG3 PRO 140 2HG PRO 140 0.912 22.061 11.466 1051 HD2 PRO 140 1HD PRO 140 2.370 20.454 9.866 1052 HD3 PRO 140 2HD PRO 140 0.729 20.979 9.395 1053 H GLU 141 H GLU 141 3.165 25.732 8.126 1054 HA GLU 141 HA GLU 141 5.908 25.442 9.154 1055 HB2 GLU 141 1HB GLU 141 4.585 27.440 7.278 1056 HB3 GLU 141 2HB GLU 141 6.089 27.784 8.133 1057 HG2 GLU 141 1HG GLU 141 7.362 26.339 6.876 1058 HG3 GLU 141 2HG GLU 141 6.034 25.238 6.534 Start of MODEL 9 1 H1 GLY 1 H GLY 1 17.640 17.406 -2.247 2 HA2 GLY 1 2HA GLY 1 15.483 16.207 -2.029 3 HA3 GLY 1 1HA GLY 1 15.424 17.569 -3.169 4 H MET 2 H MET 2 15.165 14.138 -2.787 5 HA MET 2 HA MET 2 15.061 13.627 -5.702 6 HB2 MET 2 1HB MET 2 15.305 11.966 -3.190 7 HB3 MET 2 2HB MET 2 14.797 11.223 -4.710 8 HG2 MET 2 1HG MET 2 17.318 12.850 -4.579 9 HG3 MET 2 2HG MET 2 17.290 11.156 -4.105 10 HE1 MET 2 3HE MET 2 16.799 9.132 -7.295 11 HE2 MET 2 1HE MET 2 17.194 9.158 -5.566 12 HE3 MET 2 2HE MET 2 15.533 9.484 -6.108 13 H SER 3 H SER 3 12.782 14.378 -3.243 14 HA SER 3 HA SER 3 10.661 14.004 -2.810 15 HB2 SER 3 1HB SER 3 10.393 14.089 -5.825 16 HB3 SER 3 2HB SER 3 9.102 14.382 -4.642 17 HG SER 3 HG SER 3 10.144 16.244 -3.983 18 H GLN 4 H GLN 4 10.610 11.982 -5.781 19 HA GLN 4 HA GLN 4 8.732 10.151 -4.878 20 HB2 GLN 4 1HB GLN 4 9.639 10.575 -7.236 21 HB3 GLN 4 2HB GLN 4 11.049 9.626 -6.795 22 HG2 GLN 4 1HG GLN 4 9.557 8.228 -8.050 23 HG3 GLN 4 2HG GLN 4 9.576 7.645 -6.387 24 HE21 GLN 4 1HE2 GLN 4 7.492 6.628 -6.529 25 HE22 GLN 4 2HE2 GLN 4 6.022 7.574 -6.737 26 H ASP 5 H ASP 5 12.257 10.041 -4.532 27 HA ASP 5 HA ASP 5 12.695 7.483 -3.443 28 HB2 ASP 5 1HB ASP 5 14.475 9.006 -4.110 29 HB3 ASP 5 2HB ASP 5 13.952 10.179 -2.895 30 H LEU 6 H LEU 6 12.105 10.560 -1.646 31 HA LEU 6 HA LEU 6 12.085 9.382 0.943 32 HB2 LEU 6 1HB LEU 6 10.614 11.903 0.031 33 HB3 LEU 6 2HB LEU 6 11.062 11.471 1.650 34 HG LEU 6 HG LEU 6 12.616 12.995 1.221 35 HD11 LEU 6 1HD1 LEU 6 14.134 10.614 0.182 36 HD12 LEU 6 2HD1 LEU 6 13.855 11.027 1.887 37 HD13 LEU 6 3HD1 LEU 6 14.802 12.105 0.850 38 HD21 LEU 6 3HD2 LEU 6 13.031 12.186 -1.636 39 HD22 LEU 6 1HD2 LEU 6 13.562 13.664 -0.775 40 HD23 LEU 6 2HD2 LEU 6 11.834 13.381 -1.074 41 H ILE 7 H ILE 7 9.554 10.277 -1.351 42 HA ILE 7 HA ILE 7 7.292 9.665 0.119 43 HB ILE 7 HB ILE 7 7.785 9.492 -2.838 44 HG12 ILE 7 1HG1 ILE 7 6.008 11.445 -1.357 45 HG13 ILE 7 2HG1 ILE 7 7.745 11.702 -1.302 46 HG21 ILE 7 1HG2 ILE 7 5.157 9.166 -1.317 47 HG22 ILE 7 2HG2 ILE 7 5.272 9.498 -3.064 48 HG23 ILE 7 3HG2 ILE 7 5.906 7.983 -2.406 49 HD11 ILE 7 3HD1 ILE 7 7.872 12.399 -3.421 50 HD12 ILE 7 1HD1 ILE 7 6.705 11.192 -4.024 51 HD13 ILE 7 2HD1 ILE 7 6.125 12.680 -3.248 52 H ARG 8 H ARG 8 8.917 7.495 -2.223 53 HA ARG 8 HA ARG 8 7.439 5.145 -1.660 54 HB2 ARG 8 1HB ARG 8 8.919 5.737 -3.636 55 HB3 ARG 8 2HB ARG 8 10.332 5.362 -2.658 56 HG2 ARG 8 1HG ARG 8 8.058 3.403 -3.246 57 HG3 ARG 8 2HG ARG 8 9.483 3.604 -4.257 58 HD2 ARG 8 1HD ARG 8 10.891 3.035 -2.164 59 HD3 ARG 8 2HD ARG 8 9.376 2.490 -1.438 60 HE ARG 8 HE ARG 8 9.245 0.708 -2.908 61 HH11 ARG 8 1HH1 ARG 8 12.058 2.749 -3.786 62 HH12 ARG 8 2HH1 ARG 8 12.548 1.694 -5.061 63 HH21 ARG 8 1HH2 ARG 8 10.174 -0.777 -4.397 64 HH22 ARG 8 2HH2 ARG 8 11.350 -0.246 -5.537 65 H ALA 9 H ALA 9 10.578 6.348 -0.291 66 HA ALA 9 HA ALA 9 11.242 4.108 1.154 67 HB1 ALA 9 1HB ALA 9 12.754 6.007 0.887 68 HB2 ALA 9 2HB ALA 9 11.722 7.020 1.932 69 HB3 ALA 9 3HB ALA 9 12.569 5.607 2.607 70 H ALA 10 H ALA 10 9.065 6.786 2.224 71 HA ALA 10 HA ALA 10 8.889 5.886 4.918 72 HB1 ALA 10 1HB ALA 10 6.605 7.297 3.601 73 HB2 ALA 10 2HB ALA 10 7.204 7.456 5.249 74 HB3 ALA 10 3HB ALA 10 8.144 8.153 3.920 75 H PHE 11 H PHE 11 7.429 4.553 2.034 76 HA PHE 11 HA PHE 11 4.994 3.604 3.264 77 HB2 PHE 11 1HB PHE 11 6.385 2.891 0.660 78 HB3 PHE 11 2HB PHE 11 4.958 2.074 1.228 79 HD1 PHE 11 2HD PHE 11 5.404 5.853 1.548 80 HD2 PHE 11 1HD PHE 11 3.537 2.545 -0.538 81 HE1 PHE 11 2HE PHE 11 4.042 7.418 0.288 82 HE2 PHE 11 1HE PHE 11 2.097 4.115 -1.730 83 HZ PHE 11 HZ PHE 11 2.393 6.607 -1.367 84 H GLU 12 H GLU 12 8.257 2.231 2.637 85 HA GLU 12 HA GLU 12 7.602 -0.404 3.576 86 HB2 GLU 12 1HB GLU 12 10.244 1.103 3.445 87 HB3 GLU 12 2HB GLU 12 10.067 -0.590 3.919 88 HG2 GLU 12 1HG GLU 12 8.933 -1.040 1.710 89 HG3 GLU 12 2HG GLU 12 9.338 0.611 1.210 90 H LYS 13 H LYS 13 8.354 2.673 5.184 91 HA LYS 13 HA LYS 13 8.902 1.507 7.771 92 HB2 LYS 13 1HB LYS 13 8.147 4.386 7.107 93 HB3 LYS 13 2HB LYS 13 8.808 3.760 8.607 94 HG2 LYS 13 1HG LYS 13 10.704 2.863 6.902 95 HG3 LYS 13 2HG LYS 13 10.173 4.288 5.997 96 HD2 LYS 13 1HD LYS 13 10.426 5.628 8.147 97 HD3 LYS 13 2HD LYS 13 11.169 4.188 8.883 98 HE2 LYS 13 1HE LYS 13 12.903 4.235 7.038 99 HE3 LYS 13 2HE LYS 13 12.174 5.730 6.452 100 HZ1 LYS 13 3HZ LYS 13 13.473 5.305 9.066 101 HZ2 LYS 13 1HZ LYS 13 12.640 6.683 8.660 102 HZ3 LYS 13 2HZ LYS 13 13.993 6.232 7.833 103 H ARG 14 H ARG 14 6.078 1.623 6.003 104 HA ARG 14 HA ARG 14 4.617 1.398 8.533 105 HB2 ARG 14 1HB ARG 14 3.881 3.178 6.606 106 HB3 ARG 14 2HB ARG 14 3.030 1.748 6.017 107 HG2 ARG 14 1HG ARG 14 1.508 2.817 7.446 108 HG3 ARG 14 2HG ARG 14 2.139 1.479 8.423 109 HD2 ARG 14 1HD ARG 14 3.934 3.323 9.173 110 HD3 ARG 14 2HD ARG 14 2.708 4.444 8.600 111 HE ARG 14 HE ARG 14 2.735 2.769 10.989 112 HH11 ARG 14 1HH1 ARG 14 0.475 4.557 8.898 113 HH12 ARG 14 2HH1 ARG 14 -0.434 5.174 10.249 114 HH21 ARG 14 1HH2 ARG 14 1.455 3.631 12.749 115 HH22 ARG 14 2HH2 ARG 14 0.151 4.694 12.375 116 H LEU 15 H LEU 15 4.628 0.121 5.180 117 HA LEU 15 HA LEU 15 3.052 -2.142 5.916 118 HB2 LEU 15 1HB LEU 15 3.592 -0.971 3.562 119 HB3 LEU 15 2HB LEU 15 4.810 -2.242 3.482 120 HG LEU 15 HG LEU 15 1.793 -2.549 3.747 121 HD11 LEU 15 1HD1 LEU 15 2.787 -1.919 1.515 122 HD12 LEU 15 2HD1 LEU 15 1.921 -3.471 1.516 123 HD13 LEU 15 3HD1 LEU 15 3.699 -3.429 1.540 124 HD21 LEU 15 3HD2 LEU 15 3.907 -4.750 3.736 125 HD22 LEU 15 1HD2 LEU 15 2.174 -5.011 3.418 126 HD23 LEU 15 2HD2 LEU 15 2.683 -4.420 4.987 127 H SER 16 H SER 16 6.620 -1.790 5.338 128 HA SER 16 HA SER 16 7.179 -4.581 5.727 129 HB2 SER 16 1HB SER 16 8.603 -2.652 4.612 130 HB3 SER 16 2HB SER 16 9.199 -2.386 6.261 131 HG SER 16 HG SER 16 10.109 -4.063 4.570 132 H ASP 17 H ASP 17 7.432 -1.669 7.753 133 HA ASP 17 HA ASP 17 8.045 -2.769 10.256 134 HB2 ASP 17 1HB ASP 17 6.764 -0.259 9.207 135 HB3 ASP 17 2HB ASP 17 6.701 -0.542 10.932 136 H TRP 18 H TRP 18 5.247 -3.510 8.614 137 HA TRP 18 HA TRP 18 3.778 -4.171 11.139 138 HB2 TRP 18 1HB TRP 18 2.416 -2.651 9.898 139 HB3 TRP 18 2HB TRP 18 2.719 -3.492 8.387 140 HD1 TRP 18 HD TRP 18 0.448 -3.583 11.433 141 HE1 TRP 18 1HE TRP 18 -1.482 -5.193 10.994 142 HE3 TRP 18 3HE TRP 18 2.146 -5.727 7.103 143 HZ2 TRP 18 2HZ TRP 18 -2.028 -7.405 9.202 144 HZ3 TRP 18 3HZ TRP 18 0.903 -7.597 6.065 145 HH2 TRP 18 HH TRP 18 -1.232 -8.390 7.106 146 H ALA 19 H ALA 19 4.573 -5.195 7.765 147 HA ALA 19 HA ALA 19 3.672 -7.843 8.009 148 HB1 ALA 19 1HB ALA 19 5.120 -8.260 6.055 149 HB2 ALA 19 2HB ALA 19 4.236 -6.733 5.864 150 HB3 ALA 19 3HB ALA 19 5.957 -6.723 6.314 151 H LYS 20 H LYS 20 6.890 -6.445 8.833 152 HA LYS 20 HA LYS 20 8.006 -8.983 9.658 153 HB2 LYS 20 1HB LYS 20 9.853 -7.688 10.491 154 HB3 LYS 20 2HB LYS 20 9.342 -6.994 8.964 155 HG2 LYS 20 1HG LYS 20 9.595 -5.037 10.108 156 HG3 LYS 20 2HG LYS 20 7.930 -5.363 10.541 157 HD2 LYS 20 1HD LYS 20 8.747 -4.758 12.555 158 HD3 LYS 20 2HD LYS 20 8.957 -6.488 12.704 159 HE2 LYS 20 1HE LYS 20 11.101 -4.453 11.946 160 HE3 LYS 20 2HE LYS 20 10.876 -5.188 13.531 161 HZ1 LYS 20 3HZ LYS 20 12.594 -6.332 12.461 162 HZ2 LYS 20 1HZ LYS 20 11.755 -6.557 11.071 163 HZ3 LYS 20 2HZ LYS 20 11.325 -7.366 12.452 164 H ALA 21 H ALA 21 5.887 -6.703 11.203 165 HA ALA 21 HA ALA 21 6.641 -7.497 13.938 166 HB1 ALA 21 1HB ALA 21 4.501 -5.587 12.890 167 HB2 ALA 21 2HB ALA 21 4.955 -5.840 14.575 168 HB3 ALA 21 3HB ALA 21 6.128 -5.123 13.457 169 H ARG 22 H ARG 22 4.191 -8.138 11.472 170 HA ARG 22 HA ARG 22 2.241 -9.269 13.169 171 HB2 ARG 22 1HB ARG 22 2.485 -8.908 10.360 172 HB3 ARG 22 2HB ARG 22 2.516 -10.670 10.613 173 HG2 ARG 22 1HG ARG 22 0.426 -10.347 12.072 174 HG3 ARG 22 2HG ARG 22 0.316 -8.730 11.345 175 HD2 ARG 22 1HD ARG 22 0.069 -9.643 9.139 176 HD3 ARG 22 2HD ARG 22 0.579 -11.245 9.685 177 HE ARG 22 HE ARG 22 -1.849 -10.056 10.878 178 HH11 ARG 22 1HH1 ARG 22 -0.681 -12.411 8.434 179 HH12 ARG 22 2HH1 ARG 22 -2.168 -13.311 8.469 180 HH21 ARG 22 1HH2 ARG 22 -3.644 -11.442 11.025 181 HH22 ARG 22 2HH2 ARG 22 -3.598 -13.027 10.264 182 H THR 23 H THR 23 1.848 -11.338 13.696 183 HA THR 23 HA THR 23 3.966 -12.891 14.566 184 HB THR 23 HB THR 23 1.013 -13.470 14.239 185 HG1 THR 23 1HG THR 23 1.126 -12.883 16.431 186 HG21 THR 23 3HG2 THR 23 1.408 -15.330 15.826 187 HG22 THR 23 1HG2 THR 23 3.174 -15.082 15.657 188 HG23 THR 23 2HG2 THR 23 2.209 -15.586 14.261 189 HA PRO 24 HA PRO 24 3.520 -16.127 11.081 190 HB2 PRO 24 1HB PRO 24 2.172 -15.369 8.785 191 HB3 PRO 24 2HB PRO 24 1.509 -16.390 10.103 192 HG2 PRO 24 1HG PRO 24 1.169 -13.428 9.603 193 HG3 PRO 24 2HG PRO 24 -0.077 -14.600 10.140 194 HD2 PRO 24 1HD PRO 24 1.106 -12.946 11.884 195 HD3 PRO 24 2HD PRO 24 0.747 -14.642 12.325 196 H ALA 25 H ALA 25 4.006 -12.877 10.787 197 HA ALA 25 HA ALA 25 5.172 -11.415 9.533 198 HB1 ALA 25 1HB ALA 25 6.967 -12.280 10.713 199 HB2 ALA 25 2HB ALA 25 7.107 -13.714 9.650 200 HB3 ALA 25 3HB ALA 25 7.532 -12.095 9.042 201 H LEU 26 H LEU 26 4.373 -10.740 7.640 202 HA LEU 26 HA LEU 26 3.896 -12.724 5.530 203 HB2 LEU 26 1HB LEU 26 3.120 -9.823 5.884 204 HB3 LEU 26 2HB LEU 26 3.123 -10.509 4.275 205 HG LEU 26 HG LEU 26 0.912 -10.558 5.221 206 HD11 LEU 26 1HD1 LEU 26 0.261 -12.794 4.683 207 HD12 LEU 26 2HD1 LEU 26 1.880 -13.435 4.989 208 HD13 LEU 26 3HD1 LEU 26 1.588 -12.348 3.609 209 HD21 LEU 26 3HD2 LEU 26 0.233 -11.836 7.065 210 HD22 LEU 26 1HD2 LEU 26 1.557 -10.777 7.595 211 HD23 LEU 26 2HD2 LEU 26 1.864 -12.513 7.321 212 HA PRO 27 HA PRO 27 7.343 -11.232 2.949 213 HB2 PRO 27 1HB PRO 27 6.662 -12.457 0.616 214 HB3 PRO 27 2HB PRO 27 7.357 -13.357 2.003 215 HG2 PRO 27 1HG PRO 27 4.480 -13.142 1.156 216 HG3 PRO 27 2HG PRO 27 5.385 -14.607 1.644 217 HD2 PRO 27 1HD PRO 27 3.760 -13.154 3.314 218 HD3 PRO 27 2HD PRO 27 5.180 -14.064 3.921 219 H VAL 28 H VAL 28 7.418 -9.540 1.376 220 HA VAL 28 HA VAL 28 4.786 -8.383 0.560 221 HB VAL 28 HB VAL 28 7.129 -6.833 1.676 222 HG11 VAL 28 1HG1 VAL 28 5.606 -5.602 0.121 223 HG12 VAL 28 2HG1 VAL 28 4.232 -6.030 1.180 224 HG13 VAL 28 3HG1 VAL 28 5.539 -4.980 1.769 225 HG21 VAL 28 3HG2 VAL 28 6.188 -8.107 3.551 226 HG22 VAL 28 1HG2 VAL 28 5.699 -6.425 3.679 227 HG23 VAL 28 2HG2 VAL 28 4.540 -7.639 3.084 228 H ALA 29 H ALA 29 4.892 -8.967 -1.531 229 HA ALA 29 HA ALA 29 7.354 -8.596 -3.097 230 HB1 ALA 29 1HB ALA 29 4.641 -9.781 -3.803 231 HB2 ALA 29 2HB ALA 29 6.055 -9.717 -4.881 232 HB3 ALA 29 3HB ALA 29 6.128 -10.664 -3.379 233 H TRP 30 H TRP 30 7.386 -6.287 -2.834 234 HA TRP 30 HA TRP 30 5.509 -4.381 -3.735 235 HB2 TRP 30 1HB TRP 30 8.534 -4.299 -3.728 236 HB3 TRP 30 2HB TRP 30 7.487 -2.918 -3.825 237 HD1 TRP 30 HD TRP 30 9.049 -5.236 -1.314 238 HE1 TRP 30 1HE TRP 30 8.439 -4.447 1.082 239 HE3 TRP 30 3HE TRP 30 5.300 -1.966 -2.393 240 HZ2 TRP 30 2HZ TRP 30 6.907 -2.353 2.273 241 HZ3 TRP 30 3HZ TRP 30 4.300 -0.557 -0.684 242 HH2 TRP 30 HH TRP 30 5.150 -0.645 1.683 243 H GLN 31 H GLN 31 6.317 -2.783 -5.612 244 HA GLN 31 HA GLN 31 5.966 -3.697 -8.217 245 HB2 GLN 31 1HB GLN 31 7.682 -1.505 -7.044 246 HB3 GLN 31 2HB GLN 31 7.608 -1.811 -8.783 247 HG2 GLN 31 1HG GLN 31 5.210 -1.397 -8.824 248 HG3 GLN 31 2HG GLN 31 5.163 -1.118 -7.107 249 HE21 GLN 31 1HE2 GLN 31 4.347 1.007 -8.744 250 HE22 GLN 31 2HE2 GLN 31 5.624 2.208 -8.969 251 H ASN 32 H ASN 32 7.133 -4.959 -9.475 252 HA ASN 32 HA ASN 32 8.687 -6.202 -10.435 253 HB2 ASN 32 1HB ASN 32 10.292 -3.694 -9.976 254 HB3 ASN 32 2HB ASN 32 11.014 -5.091 -10.760 255 HD21 ASN 32 1HD2 ASN 32 9.210 -2.322 -11.429 256 HD22 ASN 32 2HD2 ASN 32 8.605 -2.827 -12.994 257 H THR 33 H THR 33 8.475 -6.377 -7.367 258 HA THR 33 HA THR 33 11.095 -7.522 -6.697 259 HB THR 33 HB THR 33 8.525 -7.087 -5.122 260 HG1 THR 33 1HG THR 33 9.672 -5.231 -5.895 261 HG21 THR 33 3HG2 THR 33 9.777 -8.798 -3.961 262 HG22 THR 33 1HG2 THR 33 9.925 -7.263 -3.104 263 HG23 THR 33 2HG2 THR 33 11.276 -7.845 -4.102 264 H LYS 34 H LYS 34 11.198 -9.708 -5.862 265 HA LYS 34 HA LYS 34 9.171 -11.639 -6.881 266 HB2 LYS 34 1HB LYS 34 11.353 -11.804 -8.087 267 HB3 LYS 34 2HB LYS 34 12.199 -11.874 -6.541 268 HG2 LYS 34 1HG LYS 34 10.762 -14.000 -6.053 269 HG3 LYS 34 2HG LYS 34 10.280 -13.890 -7.734 270 HD2 LYS 34 1HD LYS 34 12.004 -15.408 -7.827 271 HD3 LYS 34 2HD LYS 34 12.899 -13.925 -8.183 272 HE2 LYS 34 1HE LYS 34 12.573 -15.092 -5.368 273 HE3 LYS 34 2HE LYS 34 13.848 -15.606 -6.456 274 HZ1 LYS 34 3HZ LYS 34 14.512 -13.887 -4.862 275 HZ2 LYS 34 1HZ LYS 34 13.540 -12.802 -5.563 276 HZ3 LYS 34 2HZ LYS 34 14.797 -13.437 -6.422 277 H PHE 35 H PHE 35 8.362 -12.940 -5.151 278 HA PHE 35 HA PHE 35 10.226 -13.322 -2.916 279 HB2 PHE 35 1HB PHE 35 8.386 -11.577 -2.308 280 HB3 PHE 35 2HB PHE 35 7.329 -12.972 -2.174 281 HD1 PHE 35 1HD PHE 35 8.885 -15.082 -0.880 282 HD2 PHE 35 2HD PHE 35 9.090 -10.813 -0.266 283 HE1 PHE 35 1HE PHE 35 9.860 -15.453 1.351 284 HE2 PHE 35 2HE PHE 35 9.990 -11.214 2.036 285 HZ PHE 35 HZ PHE 35 10.423 -13.528 2.810 286 H THR 36 H THR 36 10.778 -15.285 -3.656 287 HA THR 36 HA THR 36 8.696 -17.322 -3.940 288 HB THR 36 HB THR 36 10.844 -16.856 -6.035 289 HG1 THR 36 1HG THR 36 8.079 -16.352 -6.360 290 HG21 THR 36 3HG2 THR 36 10.075 -19.183 -5.921 291 HG22 THR 36 1HG2 THR 36 9.458 -18.413 -7.387 292 HG23 THR 36 2HG2 THR 36 8.380 -18.663 -5.993 293 HA PRO 37 HA PRO 37 8.551 -19.421 -3.470 294 HB2 PRO 37 1HB PRO 37 8.567 -21.021 -1.264 295 HB3 PRO 37 2HB PRO 37 9.290 -21.492 -2.837 296 HG2 PRO 37 1HG PRO 37 10.660 -20.318 -0.410 297 HG3 PRO 37 2HG PRO 37 11.154 -21.759 -1.359 298 HD2 PRO 37 1HD PRO 37 12.277 -19.311 -1.815 299 HD3 PRO 37 2HD PRO 37 11.910 -20.425 -3.156 300 HA PRO 38 HA PRO 38 6.776 -16.479 -0.700 301 HB2 PRO 38 1HB PRO 38 4.198 -17.324 -0.482 302 HB3 PRO 38 2HB PRO 38 4.895 -16.865 -2.075 303 HG2 PRO 38 1HG PRO 38 4.655 -19.617 -0.820 304 HG3 PRO 38 2HG PRO 38 4.089 -19.127 -2.438 305 HD2 PRO 38 1HD PRO 38 6.497 -20.317 -2.107 306 HD3 PRO 38 2HD PRO 38 6.290 -18.985 -3.283 307 H ALA 39 H ALA 39 4.789 -16.729 1.191 308 HA ALA 39 HA ALA 39 5.863 -18.283 3.403 309 HB1 ALA 39 1HB ALA 39 5.161 -16.177 4.195 310 HB2 ALA 39 2HB ALA 39 3.688 -16.176 3.180 311 HB3 ALA 39 3HB ALA 39 3.811 -17.268 4.553 312 H ALA 40 H ALA 40 5.578 -20.064 1.900 313 HA ALA 40 HA ALA 40 4.577 -22.089 1.469 314 HB1 ALA 40 1HB ALA 40 3.704 -23.047 3.562 315 HB2 ALA 40 2HB ALA 40 5.108 -22.034 3.853 316 HB3 ALA 40 3HB ALA 40 3.483 -21.418 4.226 317 H GLY 41 H GLY 41 3.111 -20.167 0.111 318 HA2 GLY 41 2HA GLY 41 1.289 -20.709 -1.319 319 HA3 GLY 41 1HA GLY 41 0.339 -21.269 0.066 320 H VAL 42 H VAL 42 1.735 -18.622 1.250 321 HA VAL 42 HA VAL 42 -0.480 -16.807 0.414 322 HB VAL 42 HB VAL 42 0.955 -17.222 3.088 323 HG11 VAL 42 1HG1 VAL 42 -0.534 -15.636 4.074 324 HG12 VAL 42 2HG1 VAL 42 0.388 -14.833 2.804 325 HG13 VAL 42 3HG1 VAL 42 -1.303 -15.331 2.507 326 HG21 VAL 42 3HG2 VAL 42 -1.999 -17.634 2.365 327 HG22 VAL 42 1HG2 VAL 42 -0.806 -18.950 2.548 328 HG23 VAL 42 2HG2 VAL 42 -1.233 -17.950 3.931 329 H TYR 43 H TYR 43 0.021 -14.769 -0.305 330 HA TYR 43 HA TYR 43 2.433 -13.505 0.573 331 HB2 TYR 43 1HB TYR 43 3.498 -13.135 -1.584 332 HB3 TYR 43 2HB TYR 43 3.450 -14.812 -1.181 333 HD1 TYR 43 2HD TYR 43 1.522 -16.261 -2.290 334 HD2 TYR 43 1HD TYR 43 2.757 -12.349 -3.675 335 HE1 TYR 43 2HE TYR 43 0.517 -16.711 -4.508 336 HE2 TYR 43 1HE TYR 43 1.774 -12.791 -5.888 337 HH TYR 43 HH TYR 43 0.908 -14.648 -7.338 338 H LEU 44 H LEU 44 2.673 -11.284 -0.709 339 HA LEU 44 HA LEU 44 0.026 -9.975 -0.445 340 HB2 LEU 44 1HB LEU 44 1.716 -10.426 1.670 341 HB3 LEU 44 2HB LEU 44 2.331 -8.882 1.112 342 HG LEU 44 HG LEU 44 -0.069 -8.016 1.254 343 HD11 LEU 44 1HD1 LEU 44 -1.223 -10.173 1.327 344 HD12 LEU 44 2HD1 LEU 44 -1.580 -9.201 2.746 345 HD13 LEU 44 3HD1 LEU 44 -0.448 -10.572 2.875 346 HD21 LEU 44 3HD2 LEU 44 0.115 -7.791 3.767 347 HD22 LEU 44 1HD2 LEU 44 1.630 -7.438 2.931 348 HD23 LEU 44 2HD2 LEU 44 1.423 -8.992 3.740 349 H ARG 45 H ARG 45 0.131 -9.462 -2.545 350 HA ARG 45 HA ARG 45 2.564 -8.637 -3.916 351 HB2 ARG 45 1HB ARG 45 0.607 -10.053 -4.792 352 HB3 ARG 45 2HB ARG 45 -0.320 -8.564 -4.867 353 HG2 ARG 45 1HG ARG 45 1.565 -7.697 -6.439 354 HG3 ARG 45 2HG ARG 45 2.098 -9.388 -6.506 355 HD2 ARG 45 1HD ARG 45 -0.280 -10.012 -7.160 356 HD3 ARG 45 2HD ARG 45 -0.653 -8.283 -7.234 357 HE ARG 45 HE ARG 45 1.611 -9.064 -8.885 358 HH11 ARG 45 1HH1 ARG 45 -1.959 -8.729 -8.832 359 HH12 ARG 45 2HH1 ARG 45 -2.117 -9.079 -10.512 360 HH21 ARG 45 1HH2 ARG 45 1.318 -9.381 -11.197 361 HH22 ARG 45 2HH2 ARG 45 -0.315 -9.467 -11.808 362 H ALA 46 H ALA 46 3.269 -6.695 -2.997 363 HA ALA 46 HA ALA 46 1.385 -4.594 -2.259 364 HB1 ALA 46 1HB ALA 46 3.311 -5.450 -0.836 365 HB2 ALA 46 2HB ALA 46 4.421 -4.680 -1.938 366 HB3 ALA 46 3HB ALA 46 3.265 -3.677 -1.051 367 H TYR 47 H TYR 47 1.106 -4.522 -4.946 368 HA TYR 47 HA TYR 47 3.175 -2.849 -6.178 369 HB2 TYR 47 1HB TYR 47 1.388 -4.419 -7.316 370 HB3 TYR 47 2HB TYR 47 0.416 -2.965 -7.322 371 HD1 TYR 47 1HD TYR 47 1.387 -0.931 -8.524 372 HD2 TYR 47 2HD TYR 47 3.190 -4.818 -8.794 373 HE1 TYR 47 1HE TYR 47 2.645 -0.164 -10.508 374 HE2 TYR 47 2HE TYR 47 4.363 -4.145 -10.843 375 HH TYR 47 HH TYR 47 3.772 -0.980 -12.422 376 H VAL 48 H VAL 48 3.005 -0.587 -6.601 377 HA VAL 48 HA VAL 48 0.834 0.854 -5.285 378 HB VAL 48 HB VAL 48 3.191 0.443 -4.128 379 HG11 VAL 48 1HG1 VAL 48 4.528 1.166 -6.033 380 HG12 VAL 48 2HG1 VAL 48 3.754 2.777 -5.881 381 HG13 VAL 48 3HG1 VAL 48 4.836 2.174 -4.594 382 HG21 VAL 48 3HG2 VAL 48 3.180 2.423 -2.924 383 HG22 VAL 48 1HG2 VAL 48 2.159 3.225 -4.147 384 HG23 VAL 48 2HG2 VAL 48 1.539 1.835 -3.160 385 H MET 49 H MET 49 0.209 2.630 -6.710 386 HA MET 49 HA MET 49 1.604 2.815 -9.339 387 HB2 MET 49 1HB MET 49 -1.301 2.159 -8.910 388 HB3 MET 49 2HB MET 49 -0.814 3.187 -10.248 389 HG2 MET 49 1HG MET 49 0.681 1.591 -11.139 390 HG3 MET 49 2HG MET 49 0.610 0.585 -9.712 391 HE1 MET 49 3HE MET 49 -0.917 -1.399 -9.334 392 HE2 MET 49 1HE MET 49 -2.310 -0.298 -9.106 393 HE3 MET 49 2HE MET 49 -2.448 -1.689 -10.170 394 HA PRO 50 HA PRO 50 1.303 6.959 -7.361 395 HB2 PRO 50 1HB PRO 50 3.548 7.991 -8.580 396 HB3 PRO 50 2HB PRO 50 3.617 6.982 -7.102 397 HG2 PRO 50 1HG PRO 50 3.974 6.088 -9.981 398 HG3 PRO 50 2HG PRO 50 5.041 5.746 -8.581 399 HD2 PRO 50 1HD PRO 50 3.215 3.930 -9.397 400 HD3 PRO 50 2HD PRO 50 3.496 4.210 -7.663 401 H ALA 51 H ALA 51 1.306 9.159 -8.671 402 HA ALA 51 HA ALA 51 -0.645 9.019 -10.639 403 HB1 ALA 51 1HB ALA 51 0.181 11.040 -9.199 404 HB2 ALA 51 2HB ALA 51 1.258 11.352 -10.585 405 HB3 ALA 51 3HB ALA 51 -0.516 11.312 -10.781 406 H ALA 52 H ALA 52 -0.480 8.009 -12.528 407 HA ALA 52 HA ALA 52 1.486 8.606 -14.535 408 HB1 ALA 52 1HB ALA 52 1.568 5.825 -13.242 409 HB2 ALA 52 2HB ALA 52 2.547 6.377 -14.603 410 HB3 ALA 52 3HB ALA 52 2.819 7.064 -13.013 411 H THR 53 H THR 53 -1.465 8.336 -14.038 412 HA THR 53 HA THR 53 -2.649 6.001 -15.022 413 HB THR 53 HB THR 53 -4.608 7.668 -15.569 414 HG1 THR 53 1HG THR 53 -3.238 9.569 -15.630 415 HG21 THR 53 3HG2 THR 53 -5.157 7.883 -13.192 416 HG22 THR 53 1HG2 THR 53 -3.468 7.553 -12.736 417 HG23 THR 53 2HG2 THR 53 -4.447 6.291 -13.500 418 H ILE 54 H ILE 54 -3.708 5.434 -17.022 419 HA ILE 54 HA ILE 54 -2.535 6.763 -19.421 420 HB ILE 54 HB ILE 54 -2.684 3.757 -19.071 421 HG12 ILE 54 1HG1 ILE 54 -0.308 5.631 -18.733 422 HG13 ILE 54 2HG1 ILE 54 -0.978 4.519 -17.539 423 HG21 ILE 54 1HG2 ILE 54 -1.372 5.481 -21.216 424 HG22 ILE 54 2HG2 ILE 54 -1.393 3.697 -21.166 425 HG23 ILE 54 3HG2 ILE 54 -2.895 4.566 -21.390 426 HD11 ILE 54 3HD1 ILE 54 1.032 3.553 -18.318 427 HD12 ILE 54 1HD1 ILE 54 -0.283 2.605 -19.050 428 HD13 ILE 54 2HD1 ILE 54 0.621 3.806 -20.008 429 H SER 55 H SER 55 -3.870 6.950 -21.063 430 HA SER 55 HA SER 55 -6.180 5.367 -21.542 431 HB2 SER 55 1HB SER 55 -6.969 6.977 -19.710 432 HB3 SER 55 2HB SER 55 -6.677 8.297 -20.862 433 HG SER 55 HG SER 55 -8.833 7.225 -20.619 434 H ARG 56 H ARG 56 -7.376 7.388 -23.226 435 HA ARG 56 HA ARG 56 -5.643 7.113 -25.516 436 HB2 ARG 56 1HB ARG 56 -8.384 7.294 -25.146 437 HB3 ARG 56 2HB ARG 56 -8.040 8.930 -25.668 438 HG2 ARG 56 1HG ARG 56 -6.708 7.717 -27.607 439 HG3 ARG 56 2HG ARG 56 -7.629 6.299 -27.086 440 HD2 ARG 56 1HD ARG 56 -8.939 7.150 -28.824 441 HD3 ARG 56 2HD ARG 56 -9.747 7.766 -27.373 442 HE ARG 56 HE ARG 56 -7.728 9.573 -28.363 443 HH11 ARG 56 1HH1 ARG 56 -11.173 8.764 -28.865 444 HH12 ARG 56 2HH1 ARG 56 -11.504 10.243 -29.695 445 HH21 ARG 56 1HH2 ARG 56 -8.203 11.493 -29.273 446 HH22 ARG 56 2HH2 ARG 56 -9.762 11.890 -29.911 447 H ASP 57 H ASP 57 -5.024 9.134 -23.271 448 HA ASP 57 HA ASP 57 -4.833 11.698 -24.831 449 HB2 ASP 57 1HB ASP 57 -4.843 11.248 -21.835 450 HB3 ASP 57 2HB ASP 57 -4.541 12.801 -22.590 451 H ALA 58 H ALA 58 -2.921 13.047 -24.053 452 HA ALA 58 HA ALA 58 -0.602 11.728 -22.998 453 HB1 ALA 58 1HB ALA 58 0.849 12.104 -24.985 454 HB2 ALA 58 2HB ALA 58 -0.423 10.926 -25.327 455 HB3 ALA 58 3HB ALA 58 -0.573 12.592 -25.925 456 H ALA 59 H ALA 59 -1.914 13.729 -21.812 457 HA ALA 59 HA ALA 59 -1.386 16.300 -23.046 458 HB1 ALA 59 1HB ALA 59 -3.591 15.640 -22.066 459 HB2 ALA 59 2HB ALA 59 -2.826 15.699 -20.453 460 HB3 ALA 59 3HB ALA 59 -2.948 17.165 -21.437 461 H GLY 60 H GLY 60 1.010 14.959 -21.938 462 HA2 GLY 60 2HA GLY 60 2.996 15.974 -21.317 463 HA3 GLY 60 1HA GLY 60 2.103 17.411 -20.772 464 H ASP 61 H ASP 61 0.588 16.806 -18.877 465 HA ASP 61 HA ASP 61 0.027 16.417 -16.862 466 HB2 ASP 61 1HB ASP 61 -0.306 14.244 -17.732 467 HB3 ASP 61 2HB ASP 61 1.396 13.901 -17.603 468 H HIS 62 H HIS 62 0.889 17.708 -15.310 469 HA HIS 62 HA HIS 62 3.751 17.832 -15.178 470 HB2 HIS 62 1HB HIS 62 3.412 19.387 -13.204 471 HB3 HIS 62 2HB HIS 62 2.782 19.939 -14.762 472 HD1 HIS 62 1HD HIS 62 0.181 20.442 -14.876 473 HD2 HIS 62 2HD HIS 62 1.537 18.594 -11.338 474 HE1 HIS 62 1HE HIS 62 -1.774 20.462 -13.267 475 H ARG 63 H ARG 63 4.889 17.565 -13.092 476 HA ARG 63 HA ARG 63 4.836 15.057 -11.902 477 HB2 ARG 63 1HB ARG 63 6.630 16.808 -11.810 478 HB3 ARG 63 2HB ARG 63 5.535 17.742 -10.775 479 HG2 ARG 63 1HG ARG 63 5.733 15.862 -9.040 480 HG3 ARG 63 2HG ARG 63 6.939 15.116 -10.105 481 HD2 ARG 63 1HD ARG 63 8.180 16.379 -8.498 482 HD3 ARG 63 2HD ARG 63 8.247 17.318 -9.981 483 HE ARG 63 HE ARG 63 6.129 18.469 -8.891 484 HH11 ARG 63 1HH1 ARG 63 9.039 17.521 -7.089 485 HH12 ARG 63 2HH1 ARG 63 8.962 18.899 -6.032 486 HH21 ARG 63 1HH2 ARG 63 6.007 20.178 -7.481 487 HH22 ARG 63 2HH2 ARG 63 7.314 20.572 -6.411 488 H GLN 64 H GLN 64 3.390 14.133 -10.628 489 HA GLN 64 HA GLN 64 2.148 15.444 -8.377 490 HB2 GLN 64 1HB GLN 64 0.513 14.060 -10.572 491 HB3 GLN 64 2HB GLN 64 -0.064 14.392 -8.944 492 HG2 GLN 64 1HG GLN 64 0.520 16.876 -9.419 493 HG3 GLN 64 2HG GLN 64 0.633 16.388 -11.112 494 HE21 GLN 64 1HE2 GLN 64 -1.478 17.136 -8.481 495 HE22 GLN 64 2HE2 GLN 64 -2.999 16.976 -9.347 496 H TYR 65 H TYR 65 1.199 13.649 -6.955 497 HA TYR 65 HA TYR 65 2.589 11.058 -7.430 498 HB2 TYR 65 1HB TYR 65 2.264 12.539 -4.805 499 HB3 TYR 65 2HB TYR 65 3.171 11.049 -5.080 500 HD1 TYR 65 2HD TYR 65 3.079 14.709 -5.726 501 HD2 TYR 65 1HD TYR 65 5.390 11.095 -6.130 502 HE1 TYR 65 2HE TYR 65 5.135 16.075 -6.119 503 HE2 TYR 65 1HE TYR 65 7.414 12.418 -6.542 504 HH TYR 65 HH TYR 65 8.202 14.528 -7.036 505 H ARG 66 H ARG 66 -0.334 12.564 -6.735 506 HA ARG 66 HA ARG 66 -1.819 10.721 -5.187 507 HB2 ARG 66 1HB ARG 66 -2.691 12.874 -5.705 508 HB3 ARG 66 2HB ARG 66 -2.467 12.629 -7.449 509 HG2 ARG 66 1HG ARG 66 -4.213 10.725 -7.195 510 HG3 ARG 66 2HG ARG 66 -4.583 11.479 -5.633 511 HD2 ARG 66 1HD ARG 66 -4.544 12.872 -8.354 512 HD3 ARG 66 2HD ARG 66 -5.988 12.115 -7.681 513 HE ARG 66 HE ARG 66 -5.002 13.987 -5.772 514 HH11 ARG 66 1HH1 ARG 66 -6.624 13.787 -8.921 515 HH12 ARG 66 2HH1 ARG 66 -7.313 15.376 -8.841 516 HH21 ARG 66 1HH2 ARG 66 -6.050 16.031 -5.558 517 HH22 ARG 66 2HH2 ARG 66 -7.103 16.634 -6.810 518 H GLY 67 H GLY 67 -2.409 8.743 -5.584 519 HA2 GLY 67 2HA GLY 67 -2.423 7.636 -8.346 520 HA3 GLY 67 1HA GLY 67 -1.214 7.063 -7.186 521 H VAL 68 H VAL 68 -2.151 4.896 -7.316 522 HA VAL 68 HA VAL 68 -4.095 4.574 -5.189 523 HB VAL 68 HB VAL 68 -5.498 4.666 -7.197 524 HG11 VAL 68 1HG1 VAL 68 -3.989 2.237 -8.210 525 HG12 VAL 68 2HG1 VAL 68 -5.436 2.994 -8.937 526 HG13 VAL 68 3HG1 VAL 68 -3.905 3.875 -8.907 527 HG21 VAL 68 3HG2 VAL 68 -6.687 2.504 -6.938 528 HG22 VAL 68 1HG2 VAL 68 -5.356 1.911 -5.941 529 HG23 VAL 68 2HG2 VAL 68 -6.331 3.310 -5.419 530 H PHE 69 H PHE 69 -3.687 2.641 -4.014 531 HA PHE 69 HA PHE 69 -1.105 1.205 -4.772 532 HB2 PHE 69 1HB PHE 69 -2.293 1.473 -2.017 533 HB3 PHE 69 2HB PHE 69 -0.738 0.811 -2.499 534 HD1 PHE 69 2HD PHE 69 -0.235 3.024 -4.650 535 HD2 PHE 69 1HD PHE 69 -1.323 3.040 -0.500 536 HE1 PHE 69 2HE PHE 69 0.567 5.402 -4.460 537 HE2 PHE 69 1HE PHE 69 -0.424 5.329 -0.258 538 HZ PHE 69 HZ PHE 69 0.426 6.560 -2.251 539 H GLN 70 H GLN 70 -1.599 -0.644 -5.538 540 HA GLN 70 HA GLN 70 -4.298 -1.939 -5.049 541 HB2 GLN 70 1HB GLN 70 -2.458 -1.826 -7.443 542 HB3 GLN 70 2HB GLN 70 -3.674 -3.034 -7.371 543 HG2 GLN 70 1HG GLN 70 -4.298 -0.065 -7.194 544 HG3 GLN 70 2HG GLN 70 -4.321 -1.006 -8.680 545 HE21 GLN 70 1HE2 GLN 70 -5.604 -3.436 -7.062 546 HE22 GLN 70 2HE2 GLN 70 -7.248 -2.894 -6.870 547 H VAL 71 H VAL 71 -3.981 -3.391 -3.400 548 HA VAL 71 HA VAL 71 -1.557 -5.094 -3.523 549 HB VAL 71 HB VAL 71 -3.372 -4.377 -1.200 550 HG11 VAL 71 1HG1 VAL 71 -0.785 -6.031 -1.225 551 HG12 VAL 71 2HG1 VAL 71 -1.622 -5.436 0.211 552 HG13 VAL 71 3HG1 VAL 71 -2.407 -6.618 -0.790 553 HG21 VAL 71 3HG2 VAL 71 -1.552 -3.032 -0.377 554 HG22 VAL 71 1HG2 VAL 71 -0.488 -3.526 -1.711 555 HG23 VAL 71 2HG2 VAL 71 -1.884 -2.487 -2.003 556 H ASN 72 H ASN 72 -1.808 -7.334 -3.219 557 HA ASN 72 HA ASN 72 -4.558 -8.457 -3.303 558 HB2 ASN 72 1HB ASN 72 -2.431 -8.812 -5.392 559 HB3 ASN 72 2HB ASN 72 -3.237 -10.269 -4.833 560 HD21 ASN 72 1HD2 ASN 72 -5.166 -7.236 -4.856 561 HD22 ASN 72 2HD2 ASN 72 -6.082 -7.744 -6.271 562 H VAL 73 H VAL 73 -4.654 -9.231 -1.361 563 HA VAL 73 HA VAL 73 -2.506 -10.833 -0.171 564 HB VAL 73 HB VAL 73 -3.555 -9.398 1.394 565 HG11 VAL 73 1HG1 VAL 73 -5.546 -8.657 0.252 566 HG12 VAL 73 2HG1 VAL 73 -6.275 -10.270 0.437 567 HG13 VAL 73 3HG1 VAL 73 -5.957 -9.254 1.853 568 HG21 VAL 73 3HG2 VAL 73 -4.529 -12.247 1.655 569 HG22 VAL 73 1HG2 VAL 73 -3.255 -11.385 2.527 570 HG23 VAL 73 2HG2 VAL 73 -4.947 -11.037 2.876 571 H VAL 74 H VAL 74 -2.312 -12.636 -1.358 572 HA VAL 74 HA VAL 74 -4.709 -14.191 -2.208 573 HB VAL 74 HB VAL 74 -3.438 -13.544 -4.079 574 HG11 VAL 74 1HG1 VAL 74 -0.893 -14.399 -2.696 575 HG12 VAL 74 2HG1 VAL 74 -1.078 -13.858 -4.384 576 HG13 VAL 74 3HG1 VAL 74 -1.378 -12.728 -3.087 577 HG21 VAL 74 3HG2 VAL 74 -2.644 -15.628 -5.009 578 HG22 VAL 74 1HG2 VAL 74 -2.459 -16.350 -3.397 579 HG23 VAL 74 2HG2 VAL 74 -4.079 -15.952 -4.021 580 H MET 75 H MET 75 -5.091 -16.172 -1.269 581 HA MET 75 HA MET 75 -2.991 -17.351 0.447 582 HB2 MET 75 1HB MET 75 -5.805 -16.505 1.215 583 HB3 MET 75 2HB MET 75 -4.835 -17.565 2.211 584 HG2 MET 75 1HG MET 75 -3.485 -15.818 2.907 585 HG3 MET 75 2HG MET 75 -3.758 -14.852 1.475 586 HE1 MET 75 3HE MET 75 -5.865 -13.929 0.708 587 HE2 MET 75 1HE MET 75 -7.244 -14.766 1.417 588 HE3 MET 75 2HE MET 75 -6.975 -13.044 1.776 589 HA PRO 76 HA PRO 76 -4.881 -20.868 -1.504 590 HB2 PRO 76 1HB PRO 76 -4.094 -22.969 0.026 591 HB3 PRO 76 2HB PRO 76 -2.923 -21.945 -0.858 592 HG2 PRO 76 1HG PRO 76 -3.756 -21.716 2.051 593 HG3 PRO 76 2HG PRO 76 -2.089 -21.785 1.385 594 HD2 PRO 76 1HD PRO 76 -3.386 -19.440 1.993 595 HD3 PRO 76 2HD PRO 76 -2.219 -19.562 0.647 596 H ILE 77 H ILE 77 -6.348 -22.879 -0.890 597 HA ILE 77 HA ILE 77 -8.175 -22.229 1.372 598 HB ILE 77 HB ILE 77 -9.246 -23.347 -1.223 599 HG12 ILE 77 1HG1 ILE 77 -8.962 -20.413 -0.470 600 HG13 ILE 77 2HG1 ILE 77 -8.249 -21.233 -1.846 601 HG21 ILE 77 1HG2 ILE 77 -11.379 -22.610 -0.211 602 HG22 ILE 77 2HG2 ILE 77 -10.496 -23.618 0.933 603 HG23 ILE 77 3HG2 ILE 77 -10.510 -21.870 1.156 604 HD11 ILE 77 3HD1 ILE 77 -10.064 -20.056 -2.704 605 HD12 ILE 77 1HD1 ILE 77 -10.576 -21.754 -2.679 606 HD13 ILE 77 2HD1 ILE 77 -11.152 -20.617 -1.422 607 H GLY 78 H GLY 78 -6.639 -23.696 2.392 608 HA2 GLY 78 2HA GLY 78 -7.318 -26.587 1.954 609 HA3 GLY 78 1HA GLY 78 -5.780 -26.004 2.573 610 H ASP 79 H ASP 79 -7.285 -23.870 4.251 611 HA ASP 79 HA ASP 79 -8.614 -25.587 6.253 612 HB2 ASP 79 1HB ASP 79 -6.106 -25.471 6.694 613 HB3 ASP 79 2HB ASP 79 -6.323 -23.748 7.019 614 H GLY 80 H GLY 80 -9.436 -23.405 4.362 615 HA2 GLY 80 2HA GLY 80 -11.584 -22.397 4.878 616 HA3 GLY 80 1HA GLY 80 -10.943 -21.824 6.415 617 H SER 81 H SER 81 -11.721 -20.850 3.284 618 HA SER 81 HA SER 81 -9.700 -18.871 2.815 619 HB2 SER 81 1HB SER 81 -11.557 -18.190 1.094 620 HB3 SER 81 2HB SER 81 -10.650 -19.681 0.887 621 HG SER 81 HG SER 81 -12.869 -20.143 0.651 622 H ARG 82 H ARG 82 -10.607 -18.492 5.449 623 HA ARG 82 HA ARG 82 -12.154 -15.918 5.232 624 HB2 ARG 82 1HB ARG 82 -11.784 -17.478 7.789 625 HB3 ARG 82 2HB ARG 82 -12.866 -16.142 7.445 626 HG2 ARG 82 1HG ARG 82 -13.133 -19.022 6.537 627 HG3 ARG 82 2HG ARG 82 -14.218 -18.059 7.547 628 HD2 ARG 82 1HD ARG 82 -14.448 -16.546 5.414 629 HD3 ARG 82 2HD ARG 82 -13.827 -17.982 4.548 630 HE ARG 82 HE ARG 82 -15.782 -19.105 5.945 631 HH11 ARG 82 1HH1 ARG 82 -15.782 -16.226 3.822 632 HH12 ARG 82 2HH1 ARG 82 -17.514 -16.069 3.819 633 HH21 ARG 82 1HH2 ARG 82 -18.095 -19.027 5.637 634 HH22 ARG 82 2HH2 ARG 82 -18.818 -17.678 4.797 635 H SER 83 H SER 83 -9.059 -16.927 5.187 636 HA SER 83 HA SER 83 -7.885 -15.396 7.292 637 HB2 SER 83 1HB SER 83 -6.943 -17.359 5.987 638 HB3 SER 83 2HB SER 83 -6.570 -16.238 4.680 639 HG SER 83 HG SER 83 -5.191 -16.848 6.808 640 H ALA 84 H ALA 84 -8.962 -14.478 4.021 641 HA ALA 84 HA ALA 84 -7.804 -11.924 3.825 642 HB1 ALA 84 1HB ALA 84 -10.642 -12.738 3.032 643 HB2 ALA 84 2HB ALA 84 -9.809 -11.282 2.502 644 HB3 ALA 84 3HB ALA 84 -9.195 -12.863 1.998 645 H GLU 85 H GLU 85 -10.600 -12.971 5.814 646 HA GLU 85 HA GLU 85 -11.571 -10.301 6.282 647 HB2 GLU 85 1HB GLU 85 -12.088 -12.976 7.690 648 HB3 GLU 85 2HB GLU 85 -13.002 -11.510 7.908 649 HG2 GLU 85 1HG GLU 85 -13.197 -11.662 5.272 650 HG3 GLU 85 2HG GLU 85 -12.830 -13.369 5.532 651 H GLN 86 H GLN 86 -9.114 -12.163 7.771 652 HA GLN 86 HA GLN 86 -8.820 -10.840 10.279 653 HB2 GLN 86 1HB GLN 86 -8.437 -13.134 10.289 654 HB3 GLN 86 2HB GLN 86 -7.730 -13.164 8.696 655 HG2 GLN 86 1HG GLN 86 -5.762 -12.889 9.470 656 HG3 GLN 86 2HG GLN 86 -6.208 -11.402 10.203 657 HE21 GLN 86 1HE2 GLN 86 -6.342 -11.255 12.341 658 HE22 GLN 86 2HE2 GLN 86 -6.098 -12.513 13.542 659 H VAL 87 H VAL 87 -6.830 -11.369 7.361 660 HA VAL 87 HA VAL 87 -5.105 -9.275 7.991 661 HB VAL 87 HB VAL 87 -5.751 -10.630 5.332 662 HG11 VAL 87 1HG1 VAL 87 -3.612 -9.789 4.417 663 HG12 VAL 87 2HG1 VAL 87 -4.726 -8.453 4.713 664 HG13 VAL 87 3HG1 VAL 87 -3.390 -8.781 5.842 665 HG21 VAL 87 3HG2 VAL 87 -3.399 -10.811 7.262 666 HG22 VAL 87 1HG2 VAL 87 -4.719 -11.992 7.127 667 HG23 VAL 87 2HG2 VAL 87 -3.594 -11.761 5.786 668 H ALA 88 H ALA 88 -8.019 -8.974 5.847 669 HA ALA 88 HA ALA 88 -7.484 -6.331 5.021 670 HB1 ALA 88 1HB ALA 88 -9.912 -6.192 4.596 671 HB2 ALA 88 2HB ALA 88 -9.252 -7.731 4.021 672 HB3 ALA 88 3HB ALA 88 -10.174 -7.670 5.538 673 H ALA 89 H ALA 89 -8.831 -7.544 8.150 674 HA ALA 89 HA ALA 89 -9.718 -4.885 8.955 675 HB1 ALA 89 1HB ALA 89 -10.875 -6.936 9.716 676 HB2 ALA 89 2HB ALA 89 -9.381 -7.481 10.519 677 HB3 ALA 89 3HB ALA 89 -10.201 -6.017 11.073 678 H GLU 90 H GLU 90 -6.780 -6.828 9.211 679 HA GLU 90 HA GLU 90 -5.593 -5.225 11.352 680 HB2 GLU 90 1HB GLU 90 -4.360 -7.203 9.370 681 HB3 GLU 90 2HB GLU 90 -3.514 -6.397 10.717 682 HG2 GLU 90 1HG GLU 90 -5.288 -7.428 12.238 683 HG3 GLU 90 2HG GLU 90 -5.819 -8.397 10.882 684 H LEU 91 H LEU 91 -5.077 -5.576 7.841 685 HA LEU 91 HA LEU 91 -3.323 -3.492 7.422 686 HB2 LEU 91 1HB LEU 91 -5.382 -4.887 5.727 687 HB3 LEU 91 2HB LEU 91 -4.722 -3.395 5.103 688 HG LEU 91 HG LEU 91 -3.569 -5.424 4.322 689 HD11 LEU 91 1HD1 LEU 91 -1.261 -4.553 4.621 690 HD12 LEU 91 2HD1 LEU 91 -1.820 -3.468 5.891 691 HD13 LEU 91 3HD1 LEU 91 -2.418 -3.260 4.232 692 HD21 LEU 91 3HD2 LEU 91 -2.014 -6.610 5.626 693 HD22 LEU 91 1HD2 LEU 91 -3.568 -6.679 6.473 694 HD23 LEU 91 2HD2 LEU 91 -2.312 -5.576 7.047 695 H ASP 92 H ASP 92 -6.874 -3.332 7.769 696 HA ASP 92 HA ASP 92 -7.238 -0.615 6.961 697 HB2 ASP 92 1HB ASP 92 -9.171 -2.021 7.172 698 HB3 ASP 92 2HB ASP 92 -8.763 -2.462 8.827 699 H ALA 93 H ALA 93 -6.729 -2.067 10.200 700 HA ALA 93 HA ALA 93 -6.542 0.441 11.560 701 HB1 ALA 93 1HB ALA 93 -5.407 -2.285 12.317 702 HB2 ALA 93 2HB ALA 93 -5.628 -0.899 13.412 703 HB3 ALA 93 3HB ALA 93 -7.047 -1.687 12.683 704 H LEU 94 H LEU 94 -4.172 -1.403 9.690 705 HA LEU 94 HA LEU 94 -1.897 0.088 10.647 706 HB2 LEU 94 1HB LEU 94 -1.640 -2.077 9.421 707 HB3 LEU 94 2HB LEU 94 -2.230 -1.290 7.950 708 HG LEU 94 HG LEU 94 -0.306 0.325 8.040 709 HD11 LEU 94 1HD1 LEU 94 0.264 0.421 10.367 710 HD12 LEU 94 2HD1 LEU 94 1.626 -0.361 9.569 711 HD13 LEU 94 3HD1 LEU 94 0.460 -1.344 10.466 712 HD21 LEU 94 3HD2 LEU 94 -0.139 -1.656 6.672 713 HD22 LEU 94 1HD2 LEU 94 0.470 -2.590 8.024 714 HD23 LEU 94 2HD2 LEU 94 1.430 -1.228 7.372 715 H PHE 95 H PHE 95 -4.261 0.579 7.991 716 HA PHE 95 HA PHE 95 -2.877 3.095 7.296 717 HB2 PHE 95 1HB PHE 95 -4.366 1.151 5.523 718 HB3 PHE 95 2HB PHE 95 -3.804 2.727 5.003 719 HD1 PHE 95 2HD PHE 95 -1.192 3.197 5.569 720 HD2 PHE 95 1HD PHE 95 -2.990 -0.661 4.921 721 HE1 PHE 95 2HE PHE 95 1.001 2.299 4.903 722 HE2 PHE 95 1HE PHE 95 -0.794 -1.541 4.172 723 HZ PHE 95 HZ PHE 95 1.209 -0.078 4.177 724 HA PRO 96 HA PRO 96 -7.266 4.153 8.555 725 HB2 PRO 96 1HB PRO 96 -6.860 5.750 10.716 726 HB3 PRO 96 2HB PRO 96 -6.792 3.964 10.836 727 HG2 PRO 96 1HG PRO 96 -4.455 5.868 10.495 728 HG3 PRO 96 2HG PRO 96 -4.657 4.580 11.733 729 HD2 PRO 96 1HD PRO 96 -3.283 4.135 9.437 730 HD3 PRO 96 2HD PRO 96 -4.334 2.873 10.166 731 H VAL 97 H VAL 97 -8.203 6.332 8.682 732 HA VAL 97 HA VAL 97 -7.590 7.624 6.291 733 HB VAL 97 HB VAL 97 -9.751 6.984 7.357 734 HG11 VAL 97 1HG1 VAL 97 -9.279 8.174 9.558 735 HG12 VAL 97 2HG1 VAL 97 -9.644 9.687 8.733 736 HG13 VAL 97 3HG1 VAL 97 -10.887 8.420 8.864 737 HG21 VAL 97 3HG2 VAL 97 -11.078 8.562 6.176 738 HG22 VAL 97 1HG2 VAL 97 -9.821 9.808 6.247 739 HG23 VAL 97 2HG2 VAL 97 -9.574 8.366 5.265 740 H ASN 98 H ASN 98 -5.666 8.175 8.486 741 HA ASN 98 HA ASN 98 -5.399 11.111 7.951 742 HB2 ASN 98 1HB ASN 98 -4.103 9.908 10.420 743 HB3 ASN 98 2HB ASN 98 -4.496 11.585 10.098 744 HD21 ASN 98 1HD2 ASN 98 -6.900 12.232 10.356 745 HD22 ASN 98 2HD2 ASN 98 -7.882 11.189 11.339 746 H LEU 99 H LEU 99 -3.541 8.285 8.777 747 HA LEU 99 HA LEU 99 -1.308 7.891 8.591 748 HB2 LEU 99 1HB LEU 99 -2.909 7.276 6.544 749 HB3 LEU 99 2HB LEU 99 -1.730 8.170 5.630 750 HG LEU 99 HG LEU 99 -0.712 6.092 5.534 751 HD11 LEU 99 1HD1 LEU 99 0.946 7.517 6.578 752 HD12 LEU 99 2HD1 LEU 99 1.166 5.799 6.904 753 HD13 LEU 99 3HD1 LEU 99 0.533 6.868 8.174 754 HD21 LEU 99 3HD2 LEU 99 -1.745 5.608 8.373 755 HD22 LEU 99 1HD2 LEU 99 -0.902 4.402 7.368 756 HD23 LEU 99 2HD2 LEU 99 -2.480 5.055 6.869 757 H VAL 100 H VAL 100 -0.798 10.242 9.474 758 HA VAL 100 HA VAL 100 0.512 11.912 7.463 759 HB VAL 100 HB VAL 100 0.937 12.265 10.430 760 HG11 VAL 100 1HG1 VAL 100 2.137 13.692 8.783 761 HG12 VAL 100 2HG1 VAL 100 0.586 14.188 8.080 762 HG13 VAL 100 3HG1 VAL 100 0.999 14.635 9.758 763 HG21 VAL 100 3HG2 VAL 100 -1.656 12.714 8.958 764 HG22 VAL 100 1HG2 VAL 100 -1.367 12.043 10.569 765 HG23 VAL 100 2HG2 VAL 100 -1.169 13.777 10.300 766 H MET 101 H MET 101 2.240 10.915 6.467 767 HA MET 101 HA MET 101 4.289 9.592 8.174 768 HB2 MET 101 1HB MET 101 4.550 10.091 5.204 769 HB3 MET 101 2HB MET 101 5.352 8.879 6.205 770 HG2 MET 101 1HG MET 101 3.027 7.780 6.496 771 HG3 MET 101 2HG MET 101 2.473 8.962 5.309 772 HE1 MET 101 3HE MET 101 1.736 8.174 3.447 773 HE2 MET 101 1HE MET 101 2.217 6.710 2.579 774 HE3 MET 101 2HE MET 101 1.506 6.596 4.214 775 H GLN 102 H GLN 102 6.515 10.449 7.983 776 HA GLN 102 HA GLN 102 6.738 13.307 7.273 777 HB2 GLN 102 1HB GLN 102 8.366 13.426 9.160 778 HB3 GLN 102 2HB GLN 102 6.673 13.470 9.598 779 HG2 GLN 102 1HG GLN 102 8.195 10.833 9.761 780 HG3 GLN 102 2HG GLN 102 8.405 12.061 11.000 781 HE21 GLN 102 1HE2 GLN 102 6.295 9.494 9.910 782 HE22 GLN 102 2HE2 GLN 102 5.049 9.802 11.103 783 H SER 103 H SER 103 7.691 12.901 5.300 784 HA SER 103 HA SER 103 10.191 11.312 5.310 785 HB2 SER 103 1HB SER 103 9.070 11.480 2.692 786 HB3 SER 103 2HB SER 103 9.272 10.048 3.727 787 HG SER 103 HG SER 103 7.091 10.314 3.080 788 H GLY 104 H GLY 104 11.834 12.142 3.909 789 HA2 GLY 104 2HA GLY 104 12.442 14.729 4.551 790 HA3 GLY 104 1HA GLY 104 13.320 13.695 3.397 791 H GLY 105 H GLY 105 10.203 14.427 2.303 792 HA2 GLY 105 2HA GLY 105 11.358 16.339 0.314 793 HA3 GLY 105 1HA GLY 105 10.291 14.987 -0.148 794 H LEU 106 H LEU 106 8.361 15.028 1.822 795 HA LEU 106 HA LEU 106 6.925 17.391 2.194 796 HB2 LEU 106 1HB LEU 106 5.155 16.467 0.350 797 HB3 LEU 106 2HB LEU 106 6.260 17.784 0.073 798 HG LEU 106 HG LEU 106 7.753 16.350 -1.209 799 HD11 LEU 106 1HD1 LEU 106 7.278 14.088 -1.785 800 HD12 LEU 106 2HD1 LEU 106 5.817 14.051 -0.751 801 HD13 LEU 106 3HD1 LEU 106 7.430 14.155 -0.047 802 HD21 LEU 106 3HD2 LEU 106 6.248 15.911 -3.111 803 HD22 LEU 106 1HD2 LEU 106 5.922 17.474 -2.348 804 HD23 LEU 106 2HD2 LEU 106 4.843 16.116 -2.039 805 H ALA 107 H ALA 107 4.536 16.614 2.603 806 HA ALA 107 HA ALA 107 4.698 14.011 4.039 807 HB1 ALA 107 1HB ALA 107 4.210 15.930 5.456 808 HB2 ALA 107 2HB ALA 107 2.814 16.365 4.429 809 HB3 ALA 107 3HB ALA 107 2.827 14.840 5.361 810 H VAL 108 H VAL 108 3.794 12.362 2.960 811 HA VAL 108 HA VAL 108 1.623 12.641 1.022 812 HB VAL 108 HB VAL 108 3.421 11.046 0.679 813 HG11 VAL 108 1HG1 VAL 108 4.316 10.648 2.811 814 HG12 VAL 108 2HG1 VAL 108 2.778 10.039 3.427 815 HG13 VAL 108 3HG1 VAL 108 3.707 9.101 2.220 816 HG21 VAL 108 3HG2 VAL 108 0.923 9.544 1.442 817 HG22 VAL 108 1HG2 VAL 108 1.287 10.285 -0.139 818 HG23 VAL 108 2HG2 VAL 108 2.262 8.934 0.438 819 H ARG 109 H ARG 109 -0.568 11.608 1.588 820 HA ARG 109 HA ARG 109 -0.955 10.714 4.298 821 HB2 ARG 109 1HB ARG 109 -2.061 13.393 3.490 822 HB3 ARG 109 2HB ARG 109 -3.193 12.285 4.231 823 HG2 ARG 109 1HG ARG 109 -1.472 11.994 6.137 824 HG3 ARG 109 2HG ARG 109 -0.684 13.400 5.522 825 HD2 ARG 109 1HD ARG 109 -3.228 14.366 5.545 826 HD3 ARG 109 2HD ARG 109 -3.418 13.094 6.704 827 HE ARG 109 HE ARG 109 -2.436 14.327 8.250 828 HH11 ARG 109 1HH1 ARG 109 -1.062 15.698 5.223 829 HH12 ARG 109 2HH1 ARG 109 -1.011 17.301 5.886 830 HH21 ARG 109 1HH2 ARG 109 -1.602 16.266 9.233 831 HH22 ARG 109 2HH2 ARG 109 -0.953 17.492 8.230 832 H VAL 110 H VAL 110 -3.255 9.780 4.535 833 HA VAL 110 HA VAL 110 -3.651 8.174 2.276 834 HB VAL 110 HB VAL 110 -3.826 7.538 4.594 835 HG11 VAL 110 1HG1 VAL 110 -5.023 9.696 5.299 836 HG12 VAL 110 2HG1 VAL 110 -6.512 8.902 4.751 837 HG13 VAL 110 3HG1 VAL 110 -5.481 8.154 5.997 838 HG21 VAL 110 3HG2 VAL 110 -4.968 5.760 3.978 839 HG22 VAL 110 1HG2 VAL 110 -6.417 6.570 4.429 840 HG23 VAL 110 2HG2 VAL 110 -5.896 6.661 2.737 841 H ARG 111 H ARG 111 -5.598 10.867 3.492 842 HA ARG 111 HA ARG 111 -7.266 12.076 2.763 843 HB2 ARG 111 1HB ARG 111 -6.107 11.286 0.170 844 HB3 ARG 111 2HB ARG 111 -7.857 11.445 0.082 845 HG2 ARG 111 1HG ARG 111 -6.602 13.499 -0.455 846 HG3 ARG 111 2HG ARG 111 -7.800 13.717 0.837 847 HD2 ARG 111 1HD ARG 111 -6.065 13.800 2.525 848 HD3 ARG 111 2HD ARG 111 -4.893 13.101 1.401 849 HE ARG 111 HE ARG 111 -4.459 15.097 0.503 850 HH11 ARG 111 1HH1 ARG 111 -7.482 15.525 2.373 851 HH12 ARG 111 2HH1 ARG 111 -7.533 17.235 2.147 852 HH21 ARG 111 1HH2 ARG 111 -4.501 17.331 0.264 853 HH22 ARG 111 2HH2 ARG 111 -5.734 18.340 0.883 854 H THR 112 H THR 112 -7.641 8.910 1.143 855 HA THR 112 HA THR 112 -10.520 9.137 1.840 856 HB THR 112 HB THR 112 -10.786 7.230 0.293 857 HG1 THR 112 1HG THR 112 -8.816 6.246 0.422 858 HG21 THR 112 3HG2 THR 112 -10.368 8.531 -1.743 859 HG22 THR 112 1HG2 THR 112 -9.158 9.529 -0.910 860 HG23 THR 112 2HG2 THR 112 -10.877 9.625 -0.459 861 HA PRO 113 HA PRO 113 -10.001 5.754 4.814 862 HB2 PRO 113 1HB PRO 113 -12.410 4.478 4.705 863 HB3 PRO 113 2HB PRO 113 -12.232 6.110 5.419 864 HG2 PRO 113 1HG PRO 113 -13.102 5.392 2.606 865 HG3 PRO 113 2HG PRO 113 -13.908 6.494 3.763 866 HD2 PRO 113 1HD PRO 113 -12.251 7.403 1.817 867 HD3 PRO 113 2HD PRO 113 -12.332 8.188 3.420 868 H ILE 114 H ILE 114 -10.430 3.322 4.715 869 HA ILE 114 HA ILE 114 -9.186 1.949 2.523 870 HB ILE 114 HB ILE 114 -10.779 1.196 5.009 871 HG12 ILE 114 1HG1 ILE 114 -8.635 2.270 5.507 872 HG13 ILE 114 2HG1 ILE 114 -8.644 0.589 5.983 873 HG21 ILE 114 1HG2 ILE 114 -11.085 -0.747 3.675 874 HG22 ILE 114 2HG2 ILE 114 -9.368 -0.794 3.212 875 HG23 ILE 114 3HG2 ILE 114 -9.869 -1.099 4.894 876 HD11 ILE 114 3HD1 ILE 114 -6.519 1.089 5.026 877 HD12 ILE 114 1HD1 ILE 114 -7.362 0.063 3.858 878 HD13 ILE 114 2HD1 ILE 114 -7.233 1.814 3.580 879 H SER 115 H SER 115 -10.263 0.179 1.316 880 HA SER 115 HA SER 115 -13.123 0.005 1.400 881 HB2 SER 115 1HB SER 115 -12.401 1.841 -0.361 882 HB3 SER 115 2HB SER 115 -11.923 0.406 -1.293 883 HG SER 115 HG SER 115 -14.555 0.898 -0.243 884 H ASN 116 H ASN 116 -13.758 -1.901 -0.122 885 HA ASN 116 HA ASN 116 -11.692 -3.946 -0.494 886 HB2 ASN 116 1HB ASN 116 -13.454 -3.619 1.855 887 HB3 ASN 116 2HB ASN 116 -13.710 -5.178 1.107 888 HD21 ASN 116 1HD2 ASN 116 -10.950 -5.682 0.137 889 HD22 ASN 116 2HD2 ASN 116 -10.001 -5.657 1.597 890 H GLY 117 H GLY 117 -13.116 -6.166 -0.998 891 HA2 GLY 117 2HA GLY 117 -15.745 -5.760 -2.035 892 HA3 GLY 117 1HA GLY 117 -14.554 -6.011 -3.323 893 H GLN 118 H GLN 118 -16.124 -7.955 -3.524 894 HA GLN 118 HA GLN 118 -15.903 -10.131 -1.620 895 HB2 GLN 118 1HB GLN 118 -17.348 -9.581 -4.130 896 HB3 GLN 118 2HB GLN 118 -16.571 -11.148 -4.197 897 HG2 GLN 118 1HG GLN 118 -18.600 -11.724 -3.302 898 HG3 GLN 118 2HG GLN 118 -17.636 -11.578 -1.861 899 HE21 GLN 118 1HE2 GLN 118 -20.480 -10.540 -3.467 900 HE22 GLN 118 2HE2 GLN 118 -20.987 -9.481 -2.170 901 HA PRO 119 HA PRO 119 -12.058 -11.604 -3.276 902 HB2 PRO 119 1HB PRO 119 -12.106 -14.298 -2.647 903 HB3 PRO 119 2HB PRO 119 -11.792 -13.004 -1.480 904 HG2 PRO 119 1HG PRO 119 -14.356 -14.511 -1.955 905 HG3 PRO 119 2HG PRO 119 -13.660 -13.913 -0.416 906 HD2 PRO 119 1HD PRO 119 -15.688 -12.684 -1.885 907 HD3 PRO 119 2HD PRO 119 -14.650 -11.826 -0.717 908 H THR 120 H THR 120 -11.114 -12.827 -4.912 909 HA THR 120 HA THR 120 -12.829 -13.691 -7.140 910 HB THR 120 HB THR 120 -11.021 -11.992 -7.333 911 HG1 THR 120 1HG THR 120 -10.688 -14.372 -8.823 912 HG21 THR 120 3HG2 THR 120 -8.773 -13.850 -7.429 913 HG22 THR 120 1HG2 THR 120 -9.532 -13.853 -5.832 914 HG23 THR 120 2HG2 THR 120 -8.983 -12.315 -6.536 915 H THR 121 H THR 121 -12.716 -15.315 -4.787 916 HA THR 121 HA THR 121 -11.076 -17.333 -4.441 917 HB THR 121 HB THR 121 -14.101 -17.662 -4.552 918 HG1 THR 121 1HG THR 121 -13.957 -16.913 -2.402 919 HG21 THR 121 3HG2 THR 121 -12.737 -19.770 -4.094 920 HG22 THR 121 1HG2 THR 121 -13.832 -19.278 -2.791 921 HG23 THR 121 2HG2 THR 121 -12.096 -18.928 -2.659 922 H GLY 122 H GLY 122 -10.155 -18.848 -5.555 923 HA2 GLY 122 2HA GLY 122 -11.124 -19.631 -8.221 924 HA3 GLY 122 1HA GLY 122 -9.453 -19.410 -7.720 925 H ASP 123 H ASP 123 -9.572 -21.525 -8.783 926 HA ASP 123 HA ASP 123 -10.490 -23.928 -7.970 927 HB2 ASP 123 1HB ASP 123 -8.969 -23.437 -9.841 928 HB3 ASP 123 2HB ASP 123 -7.644 -23.246 -8.729 929 H ALA 124 H ALA 124 -7.498 -22.411 -6.558 930 HA ALA 124 HA ALA 124 -8.072 -23.861 -4.022 931 HB1 ALA 124 1HB ALA 124 -5.421 -24.057 -5.523 932 HB2 ALA 124 2HB ALA 124 -5.808 -24.791 -3.950 933 HB3 ALA 124 3HB ALA 124 -6.632 -25.362 -5.411 934 H ASP 125 H ASP 125 -7.797 -20.858 -5.183 935 HA ASP 125 HA ASP 125 -6.424 -19.974 -2.755 936 HB2 ASP 125 1HB ASP 125 -5.471 -18.144 -4.516 937 HB3 ASP 125 2HB ASP 125 -4.495 -19.386 -3.792 938 H HIS 126 H HIS 126 -6.910 -17.775 -2.247 939 HA HIS 126 HA HIS 126 -9.090 -16.550 -3.789 940 HB2 HIS 126 1HB HIS 126 -10.659 -16.636 -2.155 941 HB3 HIS 126 2HB HIS 126 -9.771 -18.105 -1.754 942 HD1 HIS 126 1HD HIS 126 -10.988 -15.054 -0.131 943 HD2 HIS 126 2HD HIS 126 -8.124 -18.085 0.346 944 HE1 HIS 126 1HE HIS 126 -10.325 -15.006 2.311 945 H THR 127 H THR 127 -9.101 -14.398 -3.748 946 HA THR 127 HA THR 127 -7.202 -12.890 -2.088 947 HB THR 127 HB THR 127 -7.353 -12.714 -5.138 948 HG1 THR 127 1HG THR 127 -6.018 -14.316 -5.334 949 HG21 THR 127 3HG2 THR 127 -5.010 -11.902 -3.409 950 HG22 THR 127 1HG2 THR 127 -6.326 -10.780 -3.763 951 HG23 THR 127 2HG2 THR 127 -5.356 -11.482 -5.080 952 H VAL 128 H VAL 128 -8.081 -11.130 -1.391 953 HA VAL 128 HA VAL 128 -10.692 -10.271 -2.484 954 HB VAL 128 HB VAL 128 -10.634 -8.790 -0.459 955 HG11 VAL 128 1HG1 VAL 128 -12.017 -10.770 -0.621 956 HG12 VAL 128 2HG1 VAL 128 -10.668 -11.772 0.011 957 HG13 VAL 128 3HG1 VAL 128 -11.431 -10.526 1.016 958 HG21 VAL 128 3HG2 VAL 128 -8.477 -10.613 0.585 959 HG22 VAL 128 1HG2 VAL 128 -8.211 -8.933 0.038 960 HG23 VAL 128 2HG2 VAL 128 -9.267 -9.258 1.415 961 HA PRO 129 HA PRO 129 -8.615 -6.685 -4.317 962 HB2 PRO 129 1HB PRO 129 -10.823 -5.105 -4.714 963 HB3 PRO 129 2HB PRO 129 -10.486 -6.539 -5.731 964 HG2 PRO 129 1HG PRO 129 -12.335 -6.343 -3.394 965 HG3 PRO 129 2HG PRO 129 -12.644 -7.125 -4.975 966 HD2 PRO 129 1HD PRO 129 -11.922 -8.474 -2.721 967 HD3 PRO 129 2HD PRO 129 -11.423 -9.004 -4.360 968 H ILE 130 H ILE 130 -7.562 -5.092 -3.118 969 HA ILE 130 HA ILE 130 -9.125 -3.499 -1.271 970 HB ILE 130 HB ILE 130 -6.394 -4.173 -0.249 971 HG12 ILE 130 1HG1 ILE 130 -8.656 -6.169 0.007 972 HG13 ILE 130 2HG1 ILE 130 -7.004 -6.377 -0.515 973 HG21 ILE 130 1HG2 ILE 130 -8.022 -2.429 0.662 974 HG22 ILE 130 2HG2 ILE 130 -9.034 -3.738 1.230 975 HG23 ILE 130 3HG2 ILE 130 -7.384 -3.550 1.859 976 HD11 ILE 130 3HD1 ILE 130 -8.021 -5.802 2.298 977 HD12 ILE 130 1HD1 ILE 130 -7.343 -7.323 1.725 978 HD13 ILE 130 2HD1 ILE 130 -6.287 -5.900 1.872 979 H SER 131 H SER 131 -8.536 -1.457 -1.558 980 HA SER 131 HA SER 131 -5.926 -0.595 -2.279 981 HB2 SER 131 1HB SER 131 -6.552 0.454 -4.540 982 HB3 SER 131 2HB SER 131 -6.257 -1.258 -4.473 983 HG SER 131 HG SER 131 -8.717 0.115 -4.688 984 H LEU 132 H LEU 132 -5.742 1.746 -2.444 985 HA LEU 132 HA LEU 132 -8.044 3.438 -1.961 986 HB2 LEU 132 1HB LEU 132 -6.927 4.516 -0.017 987 HB3 LEU 132 2HB LEU 132 -7.540 2.924 0.321 988 HG LEU 132 HG LEU 132 -5.343 3.590 1.266 989 HD11 LEU 132 1HD1 LEU 132 -4.326 1.434 1.273 990 HD12 LEU 132 2HD1 LEU 132 -5.363 0.947 -0.087 991 HD13 LEU 132 3HD1 LEU 132 -6.076 1.377 1.484 992 HD21 LEU 132 3HD2 LEU 132 -3.960 2.803 -1.269 993 HD22 LEU 132 1HD2 LEU 132 -3.277 3.433 0.240 994 HD23 LEU 132 2HD2 LEU 132 -4.185 4.498 -0.805 995 H GLY 133 H GLY 133 -7.112 5.846 -1.854 996 HA2 GLY 133 2HA GLY 133 -4.968 6.048 -3.907 997 HA3 GLY 133 1HA GLY 133 -6.540 6.791 -4.108 998 H TYR 134 H TYR 134 -3.546 6.880 -2.573 999 HA TYR 134 HA TYR 134 -4.015 8.934 -0.552 1000 HB2 TYR 134 1HB TYR 134 -1.709 7.320 -1.611 1001 HB3 TYR 134 2HB TYR 134 -1.367 8.718 -0.668 1002 HD1 TYR 134 1HD TYR 134 -4.213 6.428 0.104 1003 HD2 TYR 134 2HD TYR 134 -0.231 7.744 1.110 1004 HE1 TYR 134 1HE TYR 134 -4.218 5.018 2.102 1005 HE2 TYR 134 2HE TYR 134 -0.321 6.365 3.171 1006 HH TYR 134 HH TYR 134 -3.126 4.326 3.976 1007 H ASP 135 H ASP 135 -2.386 10.865 -0.577 1008 HA ASP 135 HA ASP 135 -1.610 11.860 -3.180 1009 HB2 ASP 135 1HB ASP 135 -2.973 13.645 -3.438 1010 HB3 ASP 135 2HB ASP 135 -4.131 12.526 -2.761 1011 H VAL 136 H VAL 136 -0.927 14.527 -2.554 1012 HA VAL 136 HA VAL 136 0.887 14.112 -0.259 1013 HB VAL 136 HB VAL 136 1.669 13.595 -2.819 1014 HG11 VAL 136 1HG1 VAL 136 2.208 16.535 -2.570 1015 HG12 VAL 136 2HG1 VAL 136 2.911 15.465 -3.763 1016 HG13 VAL 136 3HG1 VAL 136 1.141 15.729 -3.762 1017 HG21 VAL 136 3HG2 VAL 136 3.925 13.872 -2.104 1018 HG22 VAL 136 1HG2 VAL 136 3.370 14.784 -0.658 1019 HG23 VAL 136 2HG2 VAL 136 2.883 13.081 -0.914 1020 H GLN 137 H GLN 137 1.895 16.173 0.402 1021 HA GLN 137 HA GLN 137 1.040 18.702 -0.614 1022 HB2 GLN 137 1HB GLN 137 -0.160 19.315 1.545 1023 HB3 GLN 137 2HB GLN 137 -1.064 18.289 0.465 1024 HG2 GLN 137 1HG GLN 137 0.611 16.770 2.334 1025 HG3 GLN 137 2HG GLN 137 -0.459 17.854 3.198 1026 HE21 GLN 137 1HE2 GLN 137 -0.334 14.840 1.464 1027 HE22 GLN 137 2HE2 GLN 137 -2.052 14.634 1.132 1028 H PHE 138 H PHE 138 1.767 20.382 1.141 1029 HA PHE 138 HA PHE 138 4.137 19.517 2.661 1030 HB2 PHE 138 1HB PHE 138 5.395 21.303 1.245 1031 HB3 PHE 138 2HB PHE 138 5.133 19.665 0.634 1032 HD1 PHE 138 1HD PHE 138 3.742 19.191 -1.266 1033 HD2 PHE 138 2HD PHE 138 4.058 23.218 0.225 1034 HE1 PHE 138 1HE PHE 138 2.546 20.031 -3.282 1035 HE2 PHE 138 2HE PHE 138 2.873 24.055 -1.785 1036 HZ PHE 138 HZ PHE 138 2.082 22.459 -3.522 1037 H TYR 139 H TYR 139 4.583 20.963 4.294 1038 HA TYR 139 HA TYR 139 2.859 23.394 4.493 1039 HB2 TYR 139 1HB TYR 139 3.132 22.902 7.053 1040 HB3 TYR 139 2HB TYR 139 1.863 22.208 6.090 1041 HD1 TYR 139 1HD TYR 139 5.333 21.321 7.340 1042 HD2 TYR 139 2HD TYR 139 1.377 19.954 6.366 1043 HE1 TYR 139 1HE TYR 139 5.964 19.074 8.021 1044 HE2 TYR 139 2HE TYR 139 1.965 17.680 7.105 1045 HH TYR 139 HH TYR 139 3.607 16.478 8.382 1046 HA PRO 140 HA PRO 140 7.136 24.972 4.929 1047 HB2 PRO 140 1HB PRO 140 7.007 26.951 3.071 1048 HB3 PRO 140 2HB PRO 140 7.477 25.285 2.658 1049 HG2 PRO 140 1HG PRO 140 4.788 26.596 2.312 1050 HG3 PRO 140 2HG PRO 140 5.677 25.567 1.148 1051 HD2 PRO 140 1HD PRO 140 3.673 24.625 2.809 1052 HD3 PRO 140 2HD PRO 140 5.041 23.609 2.253 1053 H GLU 141 H GLU 141 7.505 27.227 5.620 1054 HA GLU 141 HA GLU 141 7.232 28.670 7.288 1055 HB2 GLU 141 1HB GLU 141 4.428 29.242 6.226 1056 HB3 GLU 141 2HB GLU 141 5.368 30.190 7.377 1057 HG2 GLU 141 1HG GLU 141 5.808 31.404 5.512 1058 HG3 GLU 141 2HG GLU 141 7.159 30.306 5.443 Start of MODEL 10 1 H1 GLY 1 H GLY 1 18.946 15.878 -4.153 2 HA2 GLY 1 2HA GLY 1 16.692 14.923 -3.540 3 HA3 GLY 1 1HA GLY 1 16.657 16.397 -4.532 4 H MET 2 H MET 2 15.239 13.460 -4.306 5 HA MET 2 HA MET 2 14.697 13.344 -7.237 6 HB2 MET 2 1HB MET 2 16.388 11.625 -6.527 7 HB3 MET 2 2HB MET 2 15.166 10.917 -5.464 8 HG2 MET 2 1HG MET 2 13.733 10.452 -7.429 9 HG3 MET 2 2HG MET 2 14.920 11.223 -8.485 10 HE1 MET 2 3HE MET 2 14.798 7.403 -9.386 11 HE2 MET 2 1HE MET 2 13.463 8.382 -8.751 12 HE3 MET 2 2HE MET 2 14.562 9.062 -9.972 13 H SER 3 H SER 3 13.316 13.731 -4.159 14 HA SER 3 HA SER 3 11.286 13.354 -3.193 15 HB2 SER 3 1HB SER 3 10.185 13.643 -6.001 16 HB3 SER 3 2HB SER 3 9.417 14.017 -4.460 17 HG SER 3 HG SER 3 11.753 15.286 -5.557 18 H GLN 4 H GLN 4 10.575 11.473 -6.229 19 HA GLN 4 HA GLN 4 8.779 9.751 -5.023 20 HB2 GLN 4 1HB GLN 4 10.567 9.556 -7.440 21 HB3 GLN 4 2HB GLN 4 9.745 8.089 -6.934 22 HG2 GLN 4 1HG GLN 4 8.269 10.702 -7.368 23 HG3 GLN 4 2HG GLN 4 8.559 9.539 -8.653 24 HE21 GLN 4 1HE2 GLN 4 8.020 7.711 -5.748 25 HE22 GLN 4 2HE2 GLN 4 6.342 7.381 -6.070 26 H ASP 5 H ASP 5 12.270 9.303 -5.078 27 HA ASP 5 HA ASP 5 12.713 6.754 -4.091 28 HB2 ASP 5 1HB ASP 5 14.321 8.641 -4.776 29 HB3 ASP 5 2HB ASP 5 14.071 9.344 -3.187 30 H LEU 6 H LEU 6 12.165 9.711 -2.284 31 HA LEU 6 HA LEU 6 12.313 8.569 0.385 32 HB2 LEU 6 1HB LEU 6 12.651 10.733 1.029 33 HB3 LEU 6 2HB LEU 6 13.131 10.843 -0.640 34 HG LEU 6 HG LEU 6 10.535 11.535 -0.951 35 HD11 LEU 6 1HD1 LEU 6 10.317 10.739 1.468 36 HD12 LEU 6 2HD1 LEU 6 9.534 12.288 1.033 37 HD13 LEU 6 3HD1 LEU 6 11.135 12.184 1.874 38 HD21 LEU 6 3HD2 LEU 6 12.571 12.991 -1.326 39 HD22 LEU 6 1HD2 LEU 6 12.425 13.489 0.365 40 HD23 LEU 6 2HD2 LEU 6 11.113 13.802 -0.805 41 H ILE 7 H ILE 7 9.682 10.065 -1.548 42 HA ILE 7 HA ILE 7 7.611 9.459 0.166 43 HB ILE 7 HB ILE 7 7.324 9.250 -2.854 44 HG12 ILE 7 1HG1 ILE 7 7.562 11.734 -1.077 45 HG13 ILE 7 2HG1 ILE 7 8.505 11.282 -2.488 46 HG21 ILE 7 1HG2 ILE 7 5.359 10.122 -0.685 47 HG22 ILE 7 2HG2 ILE 7 5.027 10.026 -2.435 48 HG23 ILE 7 3HG2 ILE 7 5.354 8.556 -1.513 49 HD11 ILE 7 3HD1 ILE 7 7.180 12.990 -3.248 50 HD12 ILE 7 1HD1 ILE 7 6.508 11.510 -3.949 51 HD13 ILE 7 2HD1 ILE 7 5.693 12.293 -2.566 52 H ARG 8 H ARG 8 8.998 7.174 -2.288 53 HA ARG 8 HA ARG 8 7.260 4.961 -1.738 54 HB2 ARG 8 1HB ARG 8 10.088 5.235 -2.819 55 HB3 ARG 8 2HB ARG 8 9.402 3.649 -2.527 56 HG2 ARG 8 1HG ARG 8 7.879 5.645 -4.233 57 HG3 ARG 8 2HG ARG 8 9.232 4.724 -4.908 58 HD2 ARG 8 1HD ARG 8 8.171 2.598 -4.290 59 HD3 ARG 8 2HD ARG 8 6.842 3.454 -3.525 60 HE ARG 8 HE ARG 8 5.946 4.059 -5.577 61 HH11 ARG 8 1HH1 ARG 8 9.138 2.585 -6.236 62 HH12 ARG 8 2HH1 ARG 8 8.693 1.926 -7.743 63 HH21 ARG 8 1HH2 ARG 8 5.256 2.876 -7.539 64 HH22 ARG 8 2HH2 ARG 8 6.484 2.299 -8.598 65 H ALA 9 H ALA 9 10.388 5.945 -0.281 66 HA ALA 9 HA ALA 9 10.825 3.765 1.311 67 HB1 ALA 9 1HB ALA 9 12.305 5.151 2.574 68 HB2 ALA 9 2HB ALA 9 12.307 5.785 0.925 69 HB3 ALA 9 3HB ALA 9 11.384 6.625 2.196 70 H ALA 10 H ALA 10 8.510 6.400 2.062 71 HA ALA 10 HA ALA 10 8.183 5.544 4.828 72 HB1 ALA 10 1HB ALA 10 7.652 7.797 4.251 73 HB2 ALA 10 2HB ALA 10 6.421 7.284 3.061 74 HB3 ALA 10 3HB ALA 10 6.185 6.990 4.803 75 H PHE 11 H PHE 11 6.527 4.771 1.765 76 HA PHE 11 HA PHE 11 4.294 3.347 2.929 77 HB2 PHE 11 1HB PHE 11 5.658 3.171 0.201 78 HB3 PHE 11 2HB PHE 11 4.347 2.124 0.672 79 HD1 PHE 11 2HD PHE 11 4.888 5.895 0.934 80 HD2 PHE 11 1HD PHE 11 2.386 2.642 -0.422 81 HE1 PHE 11 2HE PHE 11 3.277 7.506 0.037 82 HE2 PHE 11 1HE PHE 11 0.766 4.278 -1.311 83 HZ PHE 11 HZ PHE 11 1.196 6.716 -1.103 84 H GLU 12 H GLU 12 7.512 2.415 1.718 85 HA GLU 12 HA GLU 12 7.355 -0.340 2.343 86 HB2 GLU 12 1HB GLU 12 9.608 1.593 1.790 87 HB3 GLU 12 2HB GLU 12 9.926 -0.118 2.166 88 HG2 GLU 12 1HG GLU 12 8.744 -0.897 0.281 89 HG3 GLU 12 2HG GLU 12 7.895 0.615 0.029 90 H LYS 13 H LYS 13 8.703 2.391 4.293 91 HA LYS 13 HA LYS 13 9.670 0.666 6.355 92 HB2 LYS 13 1HB LYS 13 10.544 2.918 5.851 93 HB3 LYS 13 2HB LYS 13 9.035 3.656 6.422 94 HG2 LYS 13 1HG LYS 13 9.451 2.968 8.689 95 HG3 LYS 13 2HG LYS 13 10.659 1.784 8.168 96 HD2 LYS 13 1HD LYS 13 12.104 3.674 7.390 97 HD3 LYS 13 2HD LYS 13 10.937 4.817 8.082 98 HE2 LYS 13 1HE LYS 13 11.343 3.916 10.316 99 HE3 LYS 13 2HE LYS 13 12.330 2.600 9.652 100 HZ1 LYS 13 3HZ LYS 13 13.018 5.465 9.478 101 HZ2 LYS 13 1HZ LYS 13 13.968 4.199 8.969 102 HZ3 LYS 13 2HZ LYS 13 13.650 4.411 10.569 103 H ARG 14 H ARG 14 6.502 1.993 5.635 104 HA ARG 14 HA ARG 14 5.622 1.330 8.317 105 HB2 ARG 14 1HB ARG 14 4.574 3.206 6.912 106 HB3 ARG 14 2HB ARG 14 3.811 1.941 5.952 107 HG2 ARG 14 1HG ARG 14 2.119 2.286 7.449 108 HG3 ARG 14 2HG ARG 14 3.001 1.086 8.374 109 HD2 ARG 14 1HD ARG 14 3.044 4.106 8.686 110 HD3 ARG 14 2HD ARG 14 2.325 2.943 9.808 111 HE ARG 14 HE ARG 14 4.799 2.127 10.053 112 HH11 ARG 14 1HH1 ARG 14 3.627 5.541 10.057 113 HH12 ARG 14 2HH1 ARG 14 5.086 6.109 10.782 114 HH21 ARG 14 1HH2 ARG 14 6.645 2.951 11.023 115 HH22 ARG 14 2HH2 ARG 14 6.832 4.661 11.293 116 H LEU 15 H LEU 15 4.862 0.028 5.068 117 HA LEU 15 HA LEU 15 3.244 -2.098 6.001 118 HB2 LEU 15 1HB LEU 15 3.437 -0.990 3.682 119 HB3 LEU 15 2HB LEU 15 4.807 -2.040 3.414 120 HG LEU 15 HG LEU 15 1.901 -2.761 3.746 121 HD11 LEU 15 1HD1 LEU 15 2.068 -3.611 1.498 122 HD12 LEU 15 2HD1 LEU 15 3.807 -3.308 1.465 123 HD13 LEU 15 3HD1 LEU 15 2.659 -1.952 1.549 124 HD21 LEU 15 3HD2 LEU 15 2.639 -5.185 3.237 125 HD22 LEU 15 1HD2 LEU 15 2.856 -4.608 4.874 126 HD23 LEU 15 2HD2 LEU 15 4.250 -4.689 3.780 127 H SER 16 H SER 16 6.720 -2.145 4.947 128 HA SER 16 HA SER 16 7.055 -4.968 5.174 129 HB2 SER 16 1HB SER 16 8.469 -3.101 3.999 130 HB3 SER 16 2HB SER 16 9.227 -2.866 5.580 131 HG SER 16 HG SER 16 9.849 -5.111 5.485 132 H ASP 17 H ASP 17 7.707 -2.285 7.407 133 HA ASP 17 HA ASP 17 8.872 -3.756 9.494 134 HB2 ASP 17 1HB ASP 17 8.716 -1.231 8.923 135 HB3 ASP 17 2HB ASP 17 7.208 -1.256 9.825 136 H TRP 18 H TRP 18 5.447 -3.181 8.693 137 HA TRP 18 HA TRP 18 4.384 -4.403 11.133 138 HB2 TRP 18 1HB TRP 18 2.977 -2.866 10.022 139 HB3 TRP 18 2HB TRP 18 3.254 -3.579 8.454 140 HD1 TRP 18 HD TRP 18 0.937 -3.771 11.389 141 HE1 TRP 18 1HE TRP 18 -0.998 -5.319 10.869 142 HE3 TRP 18 3HE TRP 18 2.675 -5.757 7.028 143 HZ2 TRP 18 2HZ TRP 18 -1.676 -7.298 8.845 144 HZ3 TRP 18 3HZ TRP 18 1.417 -7.532 5.852 145 HH2 TRP 18 HH TRP 18 -0.777 -8.316 6.764 146 H ALA 19 H ALA 19 5.101 -5.503 7.757 147 HA ALA 19 HA ALA 19 3.822 -8.030 8.090 148 HB1 ALA 19 1HB ALA 19 6.099 -7.342 6.181 149 HB2 ALA 19 2HB ALA 19 4.925 -8.661 6.031 150 HB3 ALA 19 3HB ALA 19 4.378 -6.976 5.874 151 H LYS 20 H LYS 20 6.931 -6.967 9.151 152 HA LYS 20 HA LYS 20 7.722 -9.739 9.912 153 HB2 LYS 20 1HB LYS 20 9.890 -8.810 10.392 154 HB3 LYS 20 2HB LYS 20 9.358 -8.238 8.826 155 HG2 LYS 20 1HG LYS 20 10.245 -6.339 9.751 156 HG3 LYS 20 2HG LYS 20 8.558 -6.091 10.045 157 HD2 LYS 20 1HD LYS 20 8.808 -6.443 12.395 158 HD3 LYS 20 2HD LYS 20 10.294 -7.367 12.177 159 HE2 LYS 20 1HE LYS 20 11.426 -5.256 11.425 160 HE3 LYS 20 2HE LYS 20 9.924 -4.375 11.770 161 HZ1 LYS 20 3HZ LYS 20 11.416 -4.192 13.603 162 HZ2 LYS 20 1HZ LYS 20 11.571 -5.840 13.745 163 HZ3 LYS 20 2HZ LYS 20 10.144 -5.105 14.089 164 H ALA 21 H ALA 21 6.292 -6.951 11.318 165 HA ALA 21 HA ALA 21 6.680 -7.983 14.086 166 HB1 ALA 21 1HB ALA 21 5.676 -5.878 14.803 167 HB2 ALA 21 2HB ALA 21 6.995 -5.572 13.672 168 HB3 ALA 21 3HB ALA 21 5.296 -5.442 13.124 169 H ARG 22 H ARG 22 4.438 -8.652 11.655 170 HA ARG 22 HA ARG 22 2.035 -8.745 13.258 171 HB2 ARG 22 1HB ARG 22 2.574 -8.868 10.540 172 HB3 ARG 22 2HB ARG 22 2.414 -10.588 10.908 173 HG2 ARG 22 1HG ARG 22 0.245 -9.846 12.174 174 HG3 ARG 22 2HG ARG 22 0.426 -8.331 11.287 175 HD2 ARG 22 1HD ARG 22 0.125 -9.448 9.168 176 HD3 ARG 22 2HD ARG 22 0.404 -11.027 9.903 177 HE ARG 22 HE ARG 22 -1.827 -9.570 11.045 178 HH11 ARG 22 1HH1 ARG 22 -0.941 -12.008 8.648 179 HH12 ARG 22 2HH1 ARG 22 -2.438 -12.877 8.734 180 HH21 ARG 22 1HH2 ARG 22 -3.792 -10.698 11.168 181 HH22 ARG 22 2HH2 ARG 22 -4.132 -12.080 10.174 182 H THR 23 H THR 23 0.959 -11.199 13.472 183 HA THR 23 HA THR 23 2.942 -12.837 14.836 184 HB THR 23 HB THR 23 0.012 -13.246 14.194 185 HG1 THR 23 1HG THR 23 1.022 -11.800 15.899 186 HG21 THR 23 3HG2 THR 23 0.257 -15.239 15.713 187 HG22 THR 23 1HG2 THR 23 2.040 -15.077 15.533 188 HG23 THR 23 2HG2 THR 23 1.030 -15.443 14.133 189 HA PRO 24 HA PRO 24 2.494 -16.068 11.504 190 HB2 PRO 24 1HB PRO 24 1.347 -15.498 9.023 191 HB3 PRO 24 2HB PRO 24 0.498 -16.228 10.427 192 HG2 PRO 24 1HG PRO 24 0.555 -13.372 9.493 193 HG3 PRO 24 2HG PRO 24 -0.836 -14.327 10.109 194 HD2 PRO 24 1HD PRO 24 0.464 -12.565 11.686 195 HD3 PRO 24 2HD PRO 24 -0.124 -14.133 12.318 196 H ALA 25 H ALA 25 3.520 -13.106 10.813 197 HA ALA 25 HA ALA 25 4.985 -11.952 9.475 198 HB1 ALA 25 1HB ALA 25 7.164 -12.860 9.402 199 HB2 ALA 25 2HB ALA 25 6.405 -13.380 10.926 200 HB3 ALA 25 3HB ALA 25 6.547 -14.524 9.583 201 H LEU 26 H LEU 26 4.244 -11.352 7.554 202 HA LEU 26 HA LEU 26 3.867 -13.399 5.448 203 HB2 LEU 26 1HB LEU 26 3.011 -10.471 5.525 204 HB3 LEU 26 2HB LEU 26 2.771 -11.555 4.171 205 HG LEU 26 HG LEU 26 0.724 -11.461 5.176 206 HD11 LEU 26 1HD1 LEU 26 0.186 -13.693 5.903 207 HD12 LEU 26 2HD1 LEU 26 1.859 -14.007 6.401 208 HD13 LEU 26 3HD1 LEU 26 1.469 -13.805 4.683 209 HD21 LEU 26 3HD2 LEU 26 1.507 -10.433 7.305 210 HD22 LEU 26 1HD2 LEU 26 1.808 -12.082 7.911 211 HD23 LEU 26 2HD2 LEU 26 0.161 -11.576 7.416 212 HA PRO 27 HA PRO 27 7.239 -11.528 3.051 213 HB2 PRO 27 1HB PRO 27 6.714 -12.630 0.618 214 HB3 PRO 27 2HB PRO 27 7.441 -13.556 1.962 215 HG2 PRO 27 1HG PRO 27 4.542 -13.486 1.086 216 HG3 PRO 27 2HG PRO 27 5.533 -14.918 1.499 217 HD2 PRO 27 1HD PRO 27 3.795 -13.681 3.291 218 HD3 PRO 27 2HD PRO 27 5.293 -14.518 3.800 219 H VAL 28 H VAL 28 7.330 -9.722 1.584 220 HA VAL 28 HA VAL 28 4.714 -8.636 0.699 221 HB VAL 28 HB VAL 28 5.171 -7.491 2.736 222 HG11 VAL 28 1HG1 VAL 28 7.848 -6.554 1.667 223 HG12 VAL 28 2HG1 VAL 28 7.079 -6.109 3.199 224 HG13 VAL 28 3HG1 VAL 28 7.620 -7.765 2.943 225 HG21 VAL 28 3HG2 VAL 28 5.268 -5.153 1.863 226 HG22 VAL 28 1HG2 VAL 28 5.703 -5.782 0.275 227 HG23 VAL 28 2HG2 VAL 28 4.131 -6.201 0.992 228 H ALA 29 H ALA 29 4.770 -8.711 -1.405 229 HA ALA 29 HA ALA 29 7.333 -8.560 -2.852 230 HB1 ALA 29 1HB ALA 29 5.946 -9.321 -4.776 231 HB2 ALA 29 2HB ALA 29 5.866 -10.441 -3.393 232 HB3 ALA 29 3HB ALA 29 4.513 -9.340 -3.730 233 H TRP 30 H TRP 30 7.890 -6.472 -3.184 234 HA TRP 30 HA TRP 30 5.939 -4.342 -3.811 235 HB2 TRP 30 1HB TRP 30 8.971 -4.362 -3.475 236 HB3 TRP 30 2HB TRP 30 7.986 -2.930 -3.704 237 HD1 TRP 30 HD TRP 30 9.106 -5.303 -1.013 238 HE1 TRP 30 1HE TRP 30 8.242 -4.487 1.267 239 HE3 TRP 30 3HE TRP 30 5.775 -1.801 -2.642 240 HZ2 TRP 30 2HZ TRP 30 6.515 -2.427 2.234 241 HZ3 TRP 30 3HZ TRP 30 4.534 -0.398 -1.038 242 HH2 TRP 30 HH TRP 30 4.916 -0.657 1.417 243 H GLN 31 H GLN 31 6.846 -2.821 -5.602 244 HA GLN 31 HA GLN 31 7.020 -4.189 -8.125 245 HB2 GLN 31 1HB GLN 31 7.581 -1.301 -7.498 246 HB3 GLN 31 2HB GLN 31 7.369 -2.047 -9.098 247 HG2 GLN 31 1HG GLN 31 5.335 -1.722 -6.880 248 HG3 GLN 31 2HG GLN 31 5.256 -1.176 -8.554 249 HE21 GLN 31 1HE2 GLN 31 4.927 -2.963 -10.259 250 HE22 GLN 31 2HE2 GLN 31 4.112 -4.429 -9.748 251 H ASN 32 H ASN 32 8.936 -4.415 -9.423 252 HA ASN 32 HA ASN 32 11.030 -4.765 -10.029 253 HB2 ASN 32 1HB ASN 32 11.509 -2.206 -8.486 254 HB3 ASN 32 2HB ASN 32 12.806 -3.058 -9.325 255 HD21 ASN 32 1HD2 ASN 32 10.249 -0.818 -9.811 256 HD22 ASN 32 2HD2 ASN 32 10.208 -0.926 -11.574 257 H THR 33 H THR 33 10.138 -5.691 -7.087 258 HA THR 33 HA THR 33 12.732 -6.261 -5.908 259 HB THR 33 HB THR 33 10.406 -5.851 -4.804 260 HG1 THR 33 1HG THR 33 11.486 -6.348 -3.241 261 HG21 THR 33 3HG2 THR 33 10.184 -8.854 -5.104 262 HG22 THR 33 1HG2 THR 33 9.231 -7.714 -6.062 263 HG23 THR 33 2HG2 THR 33 9.055 -7.764 -4.295 264 H LYS 34 H LYS 34 13.027 -8.742 -5.252 265 HA LYS 34 HA LYS 34 12.267 -10.561 -7.493 266 HB2 LYS 34 1HB LYS 34 14.919 -10.332 -6.034 267 HB3 LYS 34 2HB LYS 34 14.361 -11.851 -6.721 268 HG2 LYS 34 1HG LYS 34 15.705 -10.921 -8.368 269 HG3 LYS 34 2HG LYS 34 14.041 -10.736 -8.915 270 HD2 LYS 34 1HD LYS 34 14.685 -8.281 -7.642 271 HD3 LYS 34 2HD LYS 34 16.143 -8.736 -8.472 272 HE2 LYS 34 1HE LYS 34 13.441 -8.790 -9.882 273 HE3 LYS 34 2HE LYS 34 14.352 -7.284 -9.701 274 HZ1 LYS 34 3HZ LYS 34 16.154 -8.201 -10.911 275 HZ2 LYS 34 1HZ LYS 34 14.782 -8.418 -11.814 276 HZ3 LYS 34 2HZ LYS 34 15.423 -9.689 -11.036 277 H PHE 35 H PHE 35 10.434 -11.293 -6.540 278 HA PHE 35 HA PHE 35 10.542 -12.094 -3.676 279 HB2 PHE 35 1HB PHE 35 8.169 -11.860 -3.615 280 HB3 PHE 35 2HB PHE 35 8.885 -10.391 -4.172 281 HD1 PHE 35 1HD PHE 35 8.845 -9.960 -6.813 282 HD2 PHE 35 2HD PHE 35 6.339 -12.801 -4.725 283 HE1 PHE 35 1HE PHE 35 7.181 -9.820 -8.613 284 HE2 PHE 35 2HE PHE 35 4.655 -12.604 -6.501 285 HZ PHE 35 HZ PHE 35 5.070 -11.129 -8.474 286 H THR 36 H THR 36 8.576 -13.881 -3.494 287 HA THR 36 HA THR 36 7.949 -15.977 -3.714 288 HB THR 36 HB THR 36 8.455 -15.450 -6.367 289 HG1 THR 36 1HG THR 36 7.628 -18.022 -5.887 290 HG21 THR 36 3HG2 THR 36 9.482 -17.384 -7.396 291 HG22 THR 36 1HG2 THR 36 9.892 -18.085 -5.823 292 HG23 THR 36 2HG2 THR 36 10.674 -16.589 -6.366 293 HA PRO 37 HA PRO 37 8.093 -18.523 -3.883 294 HB2 PRO 37 1HB PRO 37 8.102 -20.327 -1.854 295 HB3 PRO 37 2HB PRO 37 9.178 -20.480 -3.277 296 HG2 PRO 37 1HG PRO 37 9.846 -19.322 -0.553 297 HG3 PRO 37 2HG PRO 37 10.782 -20.519 -1.506 298 HD2 PRO 37 1HD PRO 37 11.350 -17.834 -1.523 299 HD3 PRO 37 2HD PRO 37 11.588 -18.858 -2.962 300 HA PRO 38 HA PRO 38 5.472 -16.396 -0.851 301 HB2 PRO 38 1HB PRO 38 3.296 -18.093 -0.786 302 HB3 PRO 38 2HB PRO 38 3.541 -16.773 -2.005 303 HG2 PRO 38 1HG PRO 38 3.967 -19.713 -2.313 304 HG3 PRO 38 2HG PRO 38 3.404 -18.542 -3.534 305 HD2 PRO 38 1HD PRO 38 5.990 -19.515 -3.425 306 HD3 PRO 38 2HD PRO 38 5.583 -17.887 -4.046 307 H ALA 39 H ALA 39 4.134 -17.103 1.206 308 HA ALA 39 HA ALA 39 5.885 -18.963 2.591 309 HB1 ALA 39 1HB ALA 39 5.856 -16.666 3.459 310 HB2 ALA 39 2HB ALA 39 4.089 -16.754 3.690 311 HB3 ALA 39 3HB ALA 39 5.176 -17.791 4.637 312 H ALA 40 H ALA 40 4.767 -20.539 1.473 313 HA ALA 40 HA ALA 40 3.488 -22.432 1.399 314 HB1 ALA 40 1HB ALA 40 2.455 -23.314 3.370 315 HB2 ALA 40 2HB ALA 40 4.001 -22.578 3.840 316 HB3 ALA 40 3HB ALA 40 2.482 -21.736 4.176 317 H GLY 41 H GLY 41 2.660 -20.639 -0.134 318 HA2 GLY 41 2HA GLY 41 0.915 -19.908 -1.402 319 HA3 GLY 41 1HA GLY 41 -0.181 -20.872 -0.409 320 H VAL 42 H VAL 42 1.326 -18.883 1.746 321 HA VAL 42 HA VAL 42 -0.821 -16.847 1.594 322 HB VAL 42 HB VAL 42 1.127 -17.299 3.888 323 HG11 VAL 42 1HG1 VAL 42 -0.611 -16.179 5.204 324 HG12 VAL 42 2HG1 VAL 42 -0.129 -15.169 3.834 325 HG13 VAL 42 3HG1 VAL 42 -1.651 -16.075 3.761 326 HG21 VAL 42 3HG2 VAL 42 -0.644 -18.589 5.043 327 HG22 VAL 42 1HG2 VAL 42 -1.636 -18.556 3.578 328 HG23 VAL 42 2HG2 VAL 42 -0.093 -19.441 3.605 329 H TYR 43 H TYR 43 -0.324 -14.856 0.743 330 HA TYR 43 HA TYR 43 2.199 -13.612 1.325 331 HB2 TYR 43 1HB TYR 43 3.036 -13.359 -0.947 332 HB3 TYR 43 2HB TYR 43 3.043 -15.004 -0.435 333 HD1 TYR 43 1HD TYR 43 1.016 -16.528 -1.254 334 HD2 TYR 43 2HD TYR 43 2.198 -12.775 -3.062 335 HE1 TYR 43 1HE TYR 43 0.106 -17.286 -3.411 336 HE2 TYR 43 2HE TYR 43 1.236 -13.543 -5.227 337 HH TYR 43 HH TYR 43 0.487 -16.726 -5.927 338 H LEU 44 H LEU 44 2.369 -11.543 -0.270 339 HA LEU 44 HA LEU 44 -0.201 -10.089 -0.398 340 HB2 LEU 44 1HB LEU 44 2.173 -9.475 1.413 341 HB3 LEU 44 2HB LEU 44 1.087 -8.216 0.896 342 HG LEU 44 HG LEU 44 0.104 -10.648 2.419 343 HD11 LEU 44 1HD1 LEU 44 0.880 -7.902 3.490 344 HD12 LEU 44 2HD1 LEU 44 1.792 -9.395 3.746 345 HD13 LEU 44 3HD1 LEU 44 0.158 -9.229 4.425 346 HD21 LEU 44 3HD2 LEU 44 -1.557 -9.158 1.107 347 HD22 LEU 44 1HD2 LEU 44 -1.129 -7.876 2.239 348 HD23 LEU 44 2HD2 LEU 44 -1.873 -9.365 2.841 349 H ARG 45 H ARG 45 -0.136 -8.876 -2.242 350 HA ARG 45 HA ARG 45 2.524 -8.234 -3.483 351 HB2 ARG 45 1HB ARG 45 -0.169 -8.928 -4.681 352 HB3 ARG 45 2HB ARG 45 1.027 -7.947 -5.538 353 HG2 ARG 45 1HG ARG 45 2.665 -9.709 -5.528 354 HG3 ARG 45 2HG ARG 45 1.626 -10.747 -4.535 355 HD2 ARG 45 1HD ARG 45 1.605 -11.258 -7.046 356 HD3 ARG 45 2HD ARG 45 0.036 -11.011 -6.274 357 HE ARG 45 HE ARG 45 -0.316 -9.040 -7.379 358 HH11 ARG 45 1HH1 ARG 45 2.513 -10.467 -8.875 359 HH12 ARG 45 2HH1 ARG 45 3.126 -9.007 -9.545 360 HH21 ARG 45 1HH2 ARG 45 0.506 -7.034 -8.038 361 HH22 ARG 45 2HH2 ARG 45 1.788 -6.953 -9.211 362 H ALA 46 H ALA 46 3.046 -6.228 -3.005 363 HA ALA 46 HA ALA 46 1.018 -4.235 -2.240 364 HB1 ALA 46 1HB ALA 46 3.098 -3.245 -1.127 365 HB2 ALA 46 2HB ALA 46 2.773 -4.908 -0.612 366 HB3 ALA 46 3HB ALA 46 4.041 -4.564 -1.798 367 H TYR 47 H TYR 47 0.500 -3.713 -4.585 368 HA TYR 47 HA TYR 47 2.731 -2.562 -6.114 369 HB2 TYR 47 1HB TYR 47 1.054 -3.988 -7.243 370 HB3 TYR 47 2HB TYR 47 -0.194 -2.791 -6.901 371 HD1 TYR 47 1HD TYR 47 3.153 -1.537 -7.870 372 HD2 TYR 47 2HD TYR 47 -0.651 -2.851 -9.382 373 HE1 TYR 47 1HE TYR 47 3.687 -0.452 -9.977 374 HE2 TYR 47 2HE TYR 47 -0.096 -1.802 -11.570 375 HH TYR 47 HH TYR 47 3.110 -0.316 -12.210 376 H VAL 48 H VAL 48 3.017 -0.386 -6.526 377 HA VAL 48 HA VAL 48 1.265 1.599 -5.158 378 HB VAL 48 HB VAL 48 4.314 1.571 -5.365 379 HG11 VAL 48 1HG1 VAL 48 2.460 3.576 -4.000 380 HG12 VAL 48 2HG1 VAL 48 4.233 3.592 -3.952 381 HG13 VAL 48 3HG1 VAL 48 3.389 3.866 -5.483 382 HG21 VAL 48 3HG2 VAL 48 3.450 0.013 -3.572 383 HG22 VAL 48 1HG2 VAL 48 4.426 1.356 -2.979 384 HG23 VAL 48 2HG2 VAL 48 2.671 1.431 -2.815 385 H MET 49 H MET 49 0.304 2.755 -6.799 386 HA MET 49 HA MET 49 1.602 2.786 -9.475 387 HB2 MET 49 1HB MET 49 -1.279 2.722 -8.600 388 HB3 MET 49 2HB MET 49 -0.763 3.034 -10.264 389 HG2 MET 49 1HG MET 49 0.231 0.949 -10.522 390 HG3 MET 49 2HG MET 49 0.185 0.568 -8.796 391 HE1 MET 49 3HE MET 49 -1.614 -0.788 -7.688 392 HE2 MET 49 1HE MET 49 -2.374 0.805 -7.548 393 HE3 MET 49 2HE MET 49 -3.348 -0.592 -8.058 394 HA PRO 50 HA PRO 50 1.586 7.199 -8.106 395 HB2 PRO 50 1HB PRO 50 3.907 7.934 -9.455 396 HB3 PRO 50 2HB PRO 50 3.870 7.210 -7.820 397 HG2 PRO 50 1HG PRO 50 4.283 5.854 -10.483 398 HG3 PRO 50 2HG PRO 50 5.253 5.660 -8.978 399 HD2 PRO 50 1HD PRO 50 3.383 3.827 -9.572 400 HD3 PRO 50 2HD PRO 50 3.523 4.463 -7.907 401 H ALA 51 H ALA 51 1.332 9.197 -9.206 402 HA ALA 51 HA ALA 51 0.169 9.177 -11.877 403 HB1 ALA 51 1HB ALA 51 0.847 11.450 -9.961 404 HB2 ALA 51 2HB ALA 51 -0.030 11.609 -11.493 405 HB3 ALA 51 3HB ALA 51 -0.748 10.694 -10.162 406 H ALA 52 H ALA 52 2.032 8.311 -12.951 407 HA ALA 52 HA ALA 52 4.000 10.425 -13.708 408 HB1 ALA 52 1HB ALA 52 4.598 7.447 -13.382 409 HB2 ALA 52 2HB ALA 52 5.757 8.711 -13.847 410 HB3 ALA 52 3HB ALA 52 5.054 8.720 -12.220 411 H THR 53 H THR 53 1.461 9.274 -14.857 412 HA THR 53 HA THR 53 2.398 8.593 -17.590 413 HB THR 53 HB THR 53 0.647 6.772 -17.432 414 HG1 THR 53 1HG THR 53 -0.502 6.857 -15.719 415 HG21 THR 53 3HG2 THR 53 2.965 6.437 -15.481 416 HG22 THR 53 1HG2 THR 53 3.078 6.265 -17.247 417 HG23 THR 53 2HG2 THR 53 2.063 5.157 -16.310 418 H ILE 54 H ILE 54 1.565 11.118 -17.020 419 HA ILE 54 HA ILE 54 -0.919 11.358 -18.554 420 HB ILE 54 HB ILE 54 -0.424 13.059 -16.087 421 HG12 ILE 54 1HG1 ILE 54 -2.165 10.608 -16.331 422 HG13 ILE 54 2HG1 ILE 54 -0.779 10.788 -15.259 423 HG21 ILE 54 1HG2 ILE 54 -2.949 12.642 -17.737 424 HG22 ILE 54 2HG2 ILE 54 -2.722 13.809 -16.417 425 HG23 ILE 54 3HG2 ILE 54 -1.837 14.019 -17.905 426 HD11 ILE 54 3HD1 ILE 54 -3.393 12.283 -14.918 427 HD12 ILE 54 1HD1 ILE 54 -2.746 10.995 -13.912 428 HD13 ILE 54 2HD1 ILE 54 -1.915 12.545 -13.963 429 H SER 55 H SER 55 -0.658 12.820 -20.020 430 HA SER 55 HA SER 55 0.127 14.244 -21.516 431 HB2 SER 55 1HB SER 55 0.033 15.868 -19.551 432 HB3 SER 55 2HB SER 55 1.762 15.565 -19.364 433 HG SER 55 HG SER 55 1.409 17.385 -20.750 434 H ARG 56 H ARG 56 2.500 15.337 -22.058 435 HA ARG 56 HA ARG 56 4.424 13.071 -22.389 436 HB2 ARG 56 1HB ARG 56 3.589 14.492 -24.434 437 HB3 ARG 56 2HB ARG 56 4.556 15.788 -23.742 438 HG2 ARG 56 1HG ARG 56 6.450 13.899 -23.674 439 HG3 ARG 56 2HG ARG 56 5.425 13.126 -24.884 440 HD2 ARG 56 1HD ARG 56 5.807 14.834 -26.466 441 HD3 ARG 56 2HD ARG 56 6.223 15.997 -25.199 442 HE ARG 56 HE ARG 56 8.003 13.686 -25.490 443 HH11 ARG 56 1HH1 ARG 56 7.537 17.203 -25.977 444 HH12 ARG 56 2HH1 ARG 56 9.234 17.533 -25.995 445 HH21 ARG 56 1HH2 ARG 56 10.296 14.269 -25.374 446 HH22 ARG 56 2HH2 ARG 56 10.743 15.889 -25.610 447 H ASP 57 H ASP 57 4.123 14.041 -19.760 448 HA ASP 57 HA ASP 57 6.695 15.327 -19.256 449 HB2 ASP 57 1HB ASP 57 4.080 16.456 -18.169 450 HB3 ASP 57 2HB ASP 57 5.684 16.910 -17.631 451 H ALA 58 H ALA 58 7.001 15.201 -16.798 452 HA ALA 58 HA ALA 58 5.221 13.476 -15.300 453 HB1 ALA 58 1HB ALA 58 6.889 11.838 -14.587 454 HB2 ALA 58 2HB ALA 58 6.644 11.731 -16.336 455 HB3 ALA 58 3HB ALA 58 8.099 12.522 -15.680 456 H ALA 59 H ALA 59 5.063 15.669 -14.462 457 HA ALA 59 HA ALA 59 7.289 16.444 -12.651 458 HB1 ALA 59 1HB ALA 59 6.628 18.760 -13.028 459 HB2 ALA 59 2HB ALA 59 7.008 17.994 -14.577 460 HB3 ALA 59 3HB ALA 59 5.313 18.250 -14.102 461 H GLY 60 H GLY 60 4.280 15.037 -12.614 462 HA2 GLY 60 2HA GLY 60 2.576 14.874 -11.148 463 HA3 GLY 60 1HA GLY 60 3.654 15.556 -9.932 464 H ASP 61 H ASP 61 2.989 17.545 -12.679 465 HA ASP 61 HA ASP 61 2.859 19.699 -12.721 466 HB2 ASP 61 1HB ASP 61 0.577 18.882 -13.137 467 HB3 ASP 61 2HB ASP 61 0.316 18.973 -11.440 468 H HIS 62 H HIS 62 4.078 18.634 -10.258 469 HA HIS 62 HA HIS 62 4.568 18.956 -8.194 470 HB2 HIS 62 1HB HIS 62 4.980 21.407 -9.439 471 HB3 HIS 62 2HB HIS 62 3.999 21.875 -8.052 472 HD1 HIS 62 1HD HIS 62 7.271 22.382 -8.660 473 HD2 HIS 62 2HD HIS 62 5.378 19.736 -5.978 474 HE1 HIS 62 1HE HIS 62 8.959 21.867 -6.807 475 H ARG 63 H ARG 63 1.426 19.180 -8.995 476 HA ARG 63 HA ARG 63 0.424 19.421 -6.206 477 HB2 ARG 63 1HB ARG 63 -1.143 21.183 -6.807 478 HB3 ARG 63 2HB ARG 63 0.506 21.613 -7.291 479 HG2 ARG 63 1HG ARG 63 0.016 21.796 -9.463 480 HG3 ARG 63 2HG ARG 63 -0.903 20.310 -9.493 481 HD2 ARG 63 1HD ARG 63 -2.492 21.828 -10.103 482 HD3 ARG 63 2HD ARG 63 -2.820 21.676 -8.382 483 HE ARG 63 HE ARG 63 -2.389 23.900 -8.188 484 HH11 ARG 63 1HH1 ARG 63 -0.718 22.877 -11.245 485 HH12 ARG 63 2HH1 ARG 63 -0.333 24.506 -11.664 486 HH21 ARG 63 1HH2 ARG 63 -2.019 26.025 -8.937 487 HH22 ARG 63 2HH2 ARG 63 -1.054 26.298 -10.336 488 H GLN 64 H GLN 64 0.468 17.619 -8.610 489 HA GLN 64 HA GLN 64 -2.219 16.321 -8.263 490 HB2 GLN 64 1HB GLN 64 -1.003 17.265 -10.841 491 HB3 GLN 64 2HB GLN 64 -2.009 15.844 -10.876 492 HG2 GLN 64 1HG GLN 64 -2.977 18.482 -9.752 493 HG3 GLN 64 2HG GLN 64 -3.195 17.956 -11.399 494 HE21 GLN 64 1HE2 GLN 64 -4.834 18.025 -8.406 495 HE22 GLN 64 2HE2 GLN 64 -5.982 16.765 -8.834 496 H TYR 65 H TYR 65 0.560 15.647 -7.275 497 HA TYR 65 HA TYR 65 1.029 12.981 -8.397 498 HB2 TYR 65 1HB TYR 65 2.320 14.693 -6.370 499 HB3 TYR 65 2HB TYR 65 2.166 13.027 -5.874 500 HD1 TYR 65 1HD TYR 65 2.679 13.421 -9.489 501 HD2 TYR 65 2HD TYR 65 4.647 13.020 -5.638 502 HE1 TYR 65 1HE TYR 65 4.738 12.693 -10.610 503 HE2 TYR 65 2HE TYR 65 6.698 12.311 -6.775 504 HH TYR 65 HH TYR 65 7.832 12.379 -9.036 505 H ARG 66 H ARG 66 -1.119 12.416 -8.473 506 HA ARG 66 HA ARG 66 -2.380 11.451 -5.946 507 HB2 ARG 66 1HB ARG 66 -3.314 11.589 -8.842 508 HB3 ARG 66 2HB ARG 66 -4.270 10.871 -7.535 509 HG2 ARG 66 1HG ARG 66 -4.589 12.946 -6.431 510 HG3 ARG 66 2HG ARG 66 -3.220 13.698 -7.245 511 HD2 ARG 66 1HD ARG 66 -5.052 14.719 -8.177 512 HD3 ARG 66 2HD ARG 66 -4.479 13.577 -9.402 513 HE ARG 66 HE ARG 66 -6.642 12.670 -7.606 514 HH11 ARG 66 1HH1 ARG 66 -5.924 14.304 -10.695 515 HH12 ARG 66 2HH1 ARG 66 -7.363 13.758 -11.476 516 HH21 ARG 66 1HH2 ARG 66 -8.733 12.342 -8.507 517 HH22 ARG 66 2HH2 ARG 66 -8.953 12.407 -10.221 518 H GLY 67 H GLY 67 -3.202 9.007 -6.169 519 HA2 GLY 67 2HA GLY 67 -2.119 7.346 -8.169 520 HA3 GLY 67 1HA GLY 67 -1.039 7.285 -6.779 521 H VAL 68 H VAL 68 -1.905 4.944 -6.972 522 HA VAL 68 HA VAL 68 -3.916 4.642 -4.893 523 HB VAL 68 HB VAL 68 -5.375 4.433 -6.706 524 HG11 VAL 68 1HG1 VAL 68 -5.103 3.043 -8.692 525 HG12 VAL 68 2HG1 VAL 68 -3.862 4.281 -8.607 526 HG13 VAL 68 3HG1 VAL 68 -3.466 2.601 -8.184 527 HG21 VAL 68 3HG2 VAL 68 -6.068 2.065 -6.779 528 HG22 VAL 68 1HG2 VAL 68 -4.564 1.579 -6.003 529 HG23 VAL 68 2HG2 VAL 68 -5.735 2.612 -5.142 530 H PHE 69 H PHE 69 -3.552 2.773 -3.684 531 HA PHE 69 HA PHE 69 -1.113 1.205 -4.351 532 HB2 PHE 69 1HB PHE 69 -0.365 2.341 -2.452 533 HB3 PHE 69 2HB PHE 69 -1.949 2.368 -1.693 534 HD1 PHE 69 1HD PHE 69 0.953 0.206 -2.547 535 HD2 PHE 69 2HD PHE 69 -2.693 0.527 -0.287 536 HE1 PHE 69 1HE PHE 69 1.593 -1.770 -1.245 537 HE2 PHE 69 2HE PHE 69 -2.068 -1.493 0.993 538 HZ PHE 69 HZ PHE 69 0.076 -2.653 0.545 539 H GLN 70 H GLN 70 -1.303 -1.002 -3.856 540 HA GLN 70 HA GLN 70 -4.054 -2.056 -3.602 541 HB2 GLN 70 1HB GLN 70 -2.379 -1.805 -5.986 542 HB3 GLN 70 2HB GLN 70 -2.587 -3.487 -5.626 543 HG2 GLN 70 1HG GLN 70 -4.889 -1.489 -5.848 544 HG3 GLN 70 2HG GLN 70 -4.304 -2.490 -7.168 545 HE21 GLN 70 1HE2 GLN 70 -6.930 -2.816 -6.666 546 HE22 GLN 70 2HE2 GLN 70 -7.210 -4.327 -5.871 547 H VAL 71 H VAL 71 -4.134 -3.923 -2.546 548 HA VAL 71 HA VAL 71 -1.743 -5.493 -1.969 549 HB VAL 71 HB VAL 71 -1.602 -4.228 -0.097 550 HG11 VAL 71 1HG1 VAL 71 -3.620 -2.855 -0.240 551 HG12 VAL 71 2HG1 VAL 71 -4.612 -4.234 0.237 552 HG13 VAL 71 3HG1 VAL 71 -3.453 -3.535 1.381 553 HG21 VAL 71 3HG2 VAL 71 -2.251 -5.634 1.769 554 HG22 VAL 71 1HG2 VAL 71 -3.555 -6.375 0.854 555 HG23 VAL 71 2HG2 VAL 71 -1.882 -6.710 0.400 556 H ASN 72 H ASN 72 -2.357 -6.950 -3.362 557 HA ASN 72 HA ASN 72 -4.942 -8.390 -2.971 558 HB2 ASN 72 1HB ASN 72 -2.681 -8.708 -4.954 559 HB3 ASN 72 2HB ASN 72 -3.693 -10.085 -4.548 560 HD21 ASN 72 1HD2 ASN 72 -3.543 -8.583 -7.168 561 HD22 ASN 72 2HD2 ASN 72 -5.170 -7.962 -7.421 562 H VAL 73 H VAL 73 -4.902 -9.116 -0.962 563 HA VAL 73 HA VAL 73 -2.732 -10.656 0.234 564 HB VAL 73 HB VAL 73 -4.357 -9.380 1.592 565 HG11 VAL 73 1HG1 VAL 73 -6.678 -9.997 1.780 566 HG12 VAL 73 2HG1 VAL 73 -6.346 -9.652 0.091 567 HG13 VAL 73 3HG1 VAL 73 -6.504 -11.331 0.666 568 HG21 VAL 73 3HG2 VAL 73 -5.033 -11.138 3.195 569 HG22 VAL 73 1HG2 VAL 73 -4.611 -12.391 2.016 570 HG23 VAL 73 2HG2 VAL 73 -3.351 -11.311 2.667 571 H VAL 74 H VAL 74 -2.292 -12.725 -0.269 572 HA VAL 74 HA VAL 74 -4.377 -14.345 -1.624 573 HB VAL 74 HB VAL 74 -1.384 -14.788 -1.757 574 HG11 VAL 74 1HG1 VAL 74 -2.795 -16.650 -2.439 575 HG12 VAL 74 2HG1 VAL 74 -3.772 -15.579 -3.484 576 HG13 VAL 74 3HG1 VAL 74 -2.095 -15.947 -3.895 577 HG21 VAL 74 3HG2 VAL 74 -1.561 -12.566 -2.665 578 HG22 VAL 74 1HG2 VAL 74 -1.494 -13.674 -4.039 579 HG23 VAL 74 2HG2 VAL 74 -3.049 -12.983 -3.547 580 H MET 75 H MET 75 -4.918 -16.333 -0.675 581 HA MET 75 HA MET 75 -3.144 -17.488 1.284 582 HB2 MET 75 1HB MET 75 -4.688 -17.748 3.068 583 HB3 MET 75 2HB MET 75 -4.494 -16.036 2.738 584 HG2 MET 75 1HG MET 75 -6.782 -17.217 1.311 585 HG3 MET 75 2HG MET 75 -6.843 -17.465 3.044 586 HE1 MET 75 3HE MET 75 -7.708 -13.628 0.758 587 HE2 MET 75 1HE MET 75 -6.180 -14.457 0.404 588 HE3 MET 75 2HE MET 75 -7.721 -15.322 0.210 589 HA PRO 76 HA PRO 76 -4.414 -20.841 -1.098 590 HB2 PRO 76 1HB PRO 76 -3.587 -23.024 0.323 591 HB3 PRO 76 2HB PRO 76 -2.442 -21.800 -0.315 592 HG2 PRO 76 1HG PRO 76 -3.610 -21.998 2.482 593 HG3 PRO 76 2HG PRO 76 -1.895 -21.781 2.010 594 HD2 PRO 76 1HD PRO 76 -3.502 -19.677 2.697 595 HD3 PRO 76 2HD PRO 76 -2.232 -19.529 1.447 596 H ILE 77 H ILE 77 -5.976 -22.458 -1.459 597 HA ILE 77 HA ILE 77 -8.254 -22.360 0.398 598 HB ILE 77 HB ILE 77 -8.264 -23.487 -2.412 599 HG12 ILE 77 1HG1 ILE 77 -8.809 -20.639 -1.490 600 HG13 ILE 77 2HG1 ILE 77 -7.476 -21.125 -2.469 601 HG21 ILE 77 1HG2 ILE 77 -10.129 -24.028 -0.769 602 HG22 ILE 77 2HG2 ILE 77 -10.436 -22.281 -0.634 603 HG23 ILE 77 3HG2 ILE 77 -10.658 -23.133 -2.189 604 HD11 ILE 77 3HD1 ILE 77 -9.116 -20.103 -3.868 605 HD12 ILE 77 1HD1 ILE 77 -9.033 -21.833 -4.277 606 HD13 ILE 77 2HD1 ILE 77 -10.382 -21.195 -3.298 607 H GLY 78 H GLY 78 -6.808 -23.649 1.835 608 HA2 GLY 78 2HA GLY 78 -7.280 -26.589 1.454 609 HA3 GLY 78 1HA GLY 78 -5.705 -25.935 1.934 610 H ASP 79 H ASP 79 -9.145 -25.533 2.796 611 HA ASP 79 HA ASP 79 -10.242 -24.905 4.552 612 HB2 ASP 79 1HB ASP 79 -10.089 -27.379 4.605 613 HB3 ASP 79 2HB ASP 79 -8.866 -27.228 5.852 614 H GLY 80 H GLY 80 -9.801 -22.951 5.263 615 HA2 GLY 80 2HA GLY 80 -8.967 -22.028 7.558 616 HA3 GLY 80 1HA GLY 80 -7.382 -22.338 6.834 617 H SER 81 H SER 81 -9.525 -21.602 4.342 618 HA SER 81 HA SER 81 -8.045 -19.535 3.339 619 HB2 SER 81 1HB SER 81 -10.322 -19.530 1.874 620 HB3 SER 81 2HB SER 81 -9.087 -20.785 1.751 621 HG SER 81 HG SER 81 -11.134 -21.733 1.957 622 H ARG 82 H ARG 82 -10.103 -19.028 5.883 623 HA ARG 82 HA ARG 82 -11.559 -16.726 4.769 624 HB2 ARG 82 1HB ARG 82 -11.658 -17.743 7.604 625 HB3 ARG 82 2HB ARG 82 -12.830 -16.729 6.772 626 HG2 ARG 82 1HG ARG 82 -12.341 -19.686 6.501 627 HG3 ARG 82 2HG ARG 82 -13.810 -18.834 6.928 628 HD2 ARG 82 1HD ARG 82 -13.618 -17.890 4.443 629 HD3 ARG 82 2HD ARG 82 -12.617 -19.339 4.176 630 HE ARG 82 HE ARG 82 -15.493 -19.153 4.896 631 HH11 ARG 82 1HH1 ARG 82 -12.781 -21.476 4.430 632 HH12 ARG 82 2HH1 ARG 82 -13.875 -22.696 3.841 633 HH21 ARG 82 1HH2 ARG 82 -16.831 -20.924 4.339 634 HH22 ARG 82 2HH2 ARG 82 -16.083 -22.424 3.835 635 H SER 83 H SER 83 -8.451 -16.721 5.497 636 HA SER 83 HA SER 83 -8.056 -15.034 7.660 637 HB2 SER 83 1HB SER 83 -6.279 -15.005 5.219 638 HB3 SER 83 2HB SER 83 -5.827 -14.988 6.927 639 HG SER 83 HG SER 83 -5.449 -16.986 5.898 640 H ALA 84 H ALA 84 -9.237 -14.171 4.527 641 HA ALA 84 HA ALA 84 -8.131 -11.748 3.962 642 HB1 ALA 84 1HB ALA 84 -9.608 -12.903 2.410 643 HB2 ALA 84 2HB ALA 84 -11.000 -12.713 3.506 644 HB3 ALA 84 3HB ALA 84 -10.298 -11.298 2.712 645 H GLU 85 H GLU 85 -11.042 -12.189 6.118 646 HA GLU 85 HA GLU 85 -11.530 -9.409 6.392 647 HB2 GLU 85 1HB GLU 85 -12.181 -11.703 8.298 648 HB3 GLU 85 2HB GLU 85 -12.902 -10.090 8.301 649 HG2 GLU 85 1HG GLU 85 -13.663 -10.520 5.930 650 HG3 GLU 85 2HG GLU 85 -13.136 -12.194 6.114 651 H GLN 86 H GLN 86 -9.834 -11.719 8.577 652 HA GLN 86 HA GLN 86 -8.968 -10.060 10.564 653 HB2 GLN 86 1HB GLN 86 -8.367 -12.669 9.448 654 HB3 GLN 86 2HB GLN 86 -6.833 -11.889 9.748 655 HG2 GLN 86 1HG GLN 86 -8.999 -11.868 11.879 656 HG3 GLN 86 2HG GLN 86 -8.008 -13.284 11.570 657 HE21 GLN 86 1HE2 GLN 86 -5.571 -12.990 11.656 658 HE22 GLN 86 2HE2 GLN 86 -5.008 -11.872 12.942 659 H VAL 87 H VAL 87 -7.222 -10.733 7.495 660 HA VAL 87 HA VAL 87 -5.113 -8.897 8.179 661 HB VAL 87 HB VAL 87 -5.929 -10.310 5.587 662 HG11 VAL 87 1HG1 VAL 87 -4.644 -8.292 4.911 663 HG12 VAL 87 2HG1 VAL 87 -3.365 -8.725 6.074 664 HG13 VAL 87 3HG1 VAL 87 -3.689 -9.750 4.664 665 HG21 VAL 87 3HG2 VAL 87 -3.598 -10.776 7.448 666 HG22 VAL 87 1HG2 VAL 87 -5.094 -11.762 7.388 667 HG23 VAL 87 2HG2 VAL 87 -3.997 -11.710 5.995 668 H ALA 88 H ALA 88 -8.227 -8.466 6.443 669 HA ALA 88 HA ALA 88 -7.493 -5.985 5.223 670 HB1 ALA 88 1HB ALA 88 -9.533 -7.267 4.583 671 HB2 ALA 88 2HB ALA 88 -10.239 -6.921 6.176 672 HB3 ALA 88 3HB ALA 88 -9.908 -5.597 5.045 673 H ALA 89 H ALA 89 -8.704 -6.866 8.452 674 HA ALA 89 HA ALA 89 -9.010 -4.091 9.287 675 HB1 ALA 89 1HB ALA 89 -10.507 -5.753 10.187 676 HB2 ALA 89 2HB ALA 89 -9.152 -6.741 10.762 677 HB3 ALA 89 3HB ALA 89 -9.480 -5.159 11.507 678 H GLU 90 H GLU 90 -6.474 -6.632 9.672 679 HA GLU 90 HA GLU 90 -4.912 -5.065 11.539 680 HB2 GLU 90 1HB GLU 90 -4.054 -7.261 9.595 681 HB3 GLU 90 2HB GLU 90 -2.977 -6.432 10.719 682 HG2 GLU 90 1HG GLU 90 -4.928 -7.140 12.462 683 HG3 GLU 90 2HG GLU 90 -5.195 -8.393 11.274 684 H LEU 91 H LEU 91 -4.861 -5.365 8.029 685 HA LEU 91 HA LEU 91 -2.850 -3.464 7.430 686 HB2 LEU 91 1HB LEU 91 -5.285 -4.499 5.957 687 HB3 LEU 91 2HB LEU 91 -4.419 -3.146 5.299 688 HG LEU 91 HG LEU 91 -3.879 -5.551 4.460 689 HD11 LEU 91 1HD1 LEU 91 -1.417 -4.825 4.205 690 HD12 LEU 91 2HD1 LEU 91 -1.894 -3.386 5.134 691 HD13 LEU 91 3HD1 LEU 91 -2.678 -3.723 3.585 692 HD21 LEU 91 3HD2 LEU 91 -2.038 -6.670 5.489 693 HD22 LEU 91 1HD2 LEU 91 -3.275 -6.501 6.737 694 HD23 LEU 91 2HD2 LEU 91 -1.883 -5.416 6.742 695 H ASP 92 H ASP 92 -6.412 -3.006 7.874 696 HA ASP 92 HA ASP 92 -6.436 -0.209 7.391 697 HB2 ASP 92 1HB ASP 92 -8.400 -1.858 7.507 698 HB3 ASP 92 2HB ASP 92 -8.330 -1.694 9.268 699 H ALA 93 H ALA 93 -5.976 -2.075 10.404 700 HA ALA 93 HA ALA 93 -5.823 0.135 12.209 701 HB1 ALA 93 1HB ALA 93 -6.248 -2.104 13.004 702 HB2 ALA 93 2HB ALA 93 -4.667 -2.666 12.396 703 HB3 ALA 93 3HB ALA 93 -4.760 -1.497 13.729 704 H LEU 94 H LEU 94 -3.682 -0.828 9.736 705 HA LEU 94 HA LEU 94 -1.407 0.616 10.978 706 HB2 LEU 94 1HB LEU 94 -1.034 -1.712 10.195 707 HB3 LEU 94 2HB LEU 94 -1.570 -1.241 8.591 708 HG LEU 94 HG LEU 94 0.421 0.386 8.484 709 HD11 LEU 94 1HD1 LEU 94 1.169 -1.141 11.020 710 HD12 LEU 94 2HD1 LEU 94 0.948 0.617 10.856 711 HD13 LEU 94 3HD1 LEU 94 2.310 -0.190 10.060 712 HD21 LEU 94 3HD2 LEU 94 0.305 -1.763 7.381 713 HD22 LEU 94 1HD2 LEU 94 0.837 -2.554 8.814 714 HD23 LEU 94 2HD2 LEU 94 1.962 -1.456 7.966 715 H PHE 95 H PHE 95 -3.869 0.877 8.459 716 HA PHE 95 HA PHE 95 -2.468 3.264 7.346 717 HB2 PHE 95 1HB PHE 95 -3.705 0.943 5.829 718 HB3 PHE 95 2HB PHE 95 -3.523 2.520 5.138 719 HD1 PHE 95 1HD PHE 95 -1.431 3.417 4.424 720 HD2 PHE 95 2HD PHE 95 -1.600 -0.432 6.296 721 HE1 PHE 95 1HE PHE 95 0.942 3.098 3.872 722 HE2 PHE 95 2HE PHE 95 0.805 -0.807 5.606 723 HZ PHE 95 HZ PHE 95 2.069 0.962 4.471 724 HA PRO 96 HA PRO 96 -6.730 4.471 8.668 725 HB2 PRO 96 1HB PRO 96 -6.113 6.645 10.207 726 HB3 PRO 96 2HB PRO 96 -5.894 4.986 10.816 727 HG2 PRO 96 1HG PRO 96 -3.808 6.802 9.563 728 HG3 PRO 96 2HG PRO 96 -3.688 5.871 11.090 729 HD2 PRO 96 1HD PRO 96 -2.664 4.935 8.746 730 HD3 PRO 96 2HD PRO 96 -3.394 3.838 9.935 731 H VAL 97 H VAL 97 -7.984 6.456 8.239 732 HA VAL 97 HA VAL 97 -7.695 7.393 5.713 733 HB VAL 97 HB VAL 97 -9.714 7.212 7.153 734 HG11 VAL 97 1HG1 VAL 97 -8.937 8.369 9.175 735 HG12 VAL 97 2HG1 VAL 97 -8.831 9.902 8.285 736 HG13 VAL 97 3HG1 VAL 97 -10.399 9.137 8.548 737 HG21 VAL 97 3HG2 VAL 97 -9.774 8.411 4.947 738 HG22 VAL 97 1HG2 VAL 97 -11.030 8.876 6.106 739 HG23 VAL 97 2HG2 VAL 97 -9.639 9.939 5.838 740 H ASN 98 H ASN 98 -5.670 8.534 7.999 741 HA ASN 98 HA ASN 98 -5.327 11.220 6.706 742 HB2 ASN 98 1HB ASN 98 -4.215 10.174 9.352 743 HB3 ASN 98 2HB ASN 98 -3.824 11.732 8.630 744 HD21 ASN 98 1HD2 ASN 98 -5.965 10.228 10.795 745 HD22 ASN 98 2HD2 ASN 98 -7.270 11.385 10.703 746 H LEU 99 H LEU 99 -3.588 8.159 7.476 747 HA LEU 99 HA LEU 99 -1.461 7.654 7.462 748 HB2 LEU 99 1HB LEU 99 -2.275 8.202 4.672 749 HB3 LEU 99 2HB LEU 99 -0.552 8.204 4.920 750 HG LEU 99 HG LEU 99 -1.306 6.013 4.203 751 HD11 LEU 99 1HD1 LEU 99 -0.513 4.654 6.345 752 HD12 LEU 99 2HD1 LEU 99 -0.022 6.228 6.940 753 HD13 LEU 99 3HD1 LEU 99 0.619 5.597 5.418 754 HD21 LEU 99 3HD2 LEU 99 -3.554 6.156 5.200 755 HD22 LEU 99 1HD2 LEU 99 -2.837 5.877 6.801 756 HD23 LEU 99 2HD2 LEU 99 -2.764 4.645 5.538 757 H VAL 100 H VAL 100 -0.684 9.173 9.054 758 HA VAL 100 HA VAL 100 0.598 11.621 8.183 759 HB VAL 100 HB VAL 100 1.345 11.533 10.594 760 HG11 VAL 100 1HG1 VAL 100 -0.642 12.814 9.986 761 HG12 VAL 100 2HG1 VAL 100 -1.654 11.373 10.113 762 HG13 VAL 100 3HG1 VAL 100 -0.865 12.039 11.560 763 HG21 VAL 100 3HG2 VAL 100 0.716 9.825 12.030 764 HG22 VAL 100 1HG2 VAL 100 -0.657 9.339 11.002 765 HG23 VAL 100 2HG2 VAL 100 1.006 8.938 10.502 766 H MET 101 H MET 101 1.492 9.801 6.651 767 HA MET 101 HA MET 101 4.156 8.755 7.397 768 HB2 MET 101 1HB MET 101 2.782 9.087 4.715 769 HB3 MET 101 2HB MET 101 4.485 8.621 4.863 770 HG2 MET 101 1HG MET 101 3.796 6.742 6.365 771 HG3 MET 101 2HG MET 101 2.112 7.147 6.058 772 HE1 MET 101 3HE MET 101 1.637 6.068 2.312 773 HE2 MET 101 1HE MET 101 0.930 6.911 3.706 774 HE3 MET 101 2HE MET 101 2.187 7.695 2.751 775 H GLN 102 H GLN 102 5.019 10.529 8.454 776 HA GLN 102 HA GLN 102 5.947 12.805 6.835 777 HB2 GLN 102 1HB GLN 102 6.507 11.786 9.645 778 HB3 GLN 102 2HB GLN 102 7.611 12.932 8.881 779 HG2 GLN 102 1HG GLN 102 4.628 13.463 9.155 780 HG3 GLN 102 2HG GLN 102 5.815 13.901 10.381 781 HE21 GLN 102 1HE2 GLN 102 7.263 14.345 7.189 782 HE22 GLN 102 2HE2 GLN 102 6.836 16.015 7.035 783 H SER 103 H SER 103 6.819 11.778 5.054 784 HA SER 103 HA SER 103 9.284 10.195 5.466 785 HB2 SER 103 1HB SER 103 8.662 11.123 2.766 786 HB3 SER 103 2HB SER 103 8.986 9.491 3.334 787 HG SER 103 HG SER 103 6.745 10.536 2.507 788 H GLY 104 H GLY 104 11.249 11.186 4.268 789 HA2 GLY 104 2HA GLY 104 11.911 13.691 5.306 790 HA3 GLY 104 1HA GLY 104 12.836 12.719 4.209 791 H GLY 105 H GLY 105 9.663 13.990 3.315 792 HA2 GLY 105 2HA GLY 105 10.921 15.756 1.253 793 HA3 GLY 105 1HA GLY 105 9.843 14.398 0.803 794 H LEU 106 H LEU 106 7.753 14.401 2.392 795 HA LEU 106 HA LEU 106 6.565 16.835 3.083 796 HB2 LEU 106 1HB LEU 106 4.785 16.481 1.062 797 HB3 LEU 106 2HB LEU 106 6.040 17.688 1.096 798 HG LEU 106 HG LEU 106 7.456 16.425 -0.409 799 HD11 LEU 106 1HD1 LEU 106 6.852 14.394 -1.523 800 HD12 LEU 106 2HD1 LEU 106 5.310 14.286 -0.613 801 HD13 LEU 106 3HD1 LEU 106 6.875 14.067 0.185 802 HD21 LEU 106 3HD2 LEU 106 5.845 16.423 -2.389 803 HD22 LEU 106 1HD2 LEU 106 5.977 17.918 -1.442 804 HD23 LEU 106 2HD2 LEU 106 4.582 16.856 -1.213 805 H ALA 107 H ALA 107 4.317 16.478 3.658 806 HA ALA 107 HA ALA 107 3.839 13.827 4.730 807 HB1 ALA 107 1HB ALA 107 3.063 15.671 6.062 808 HB2 ALA 107 2HB ALA 107 2.173 16.378 4.698 809 HB3 ALA 107 3HB ALA 107 1.618 14.869 5.416 810 H VAL 108 H VAL 108 2.952 12.182 3.699 811 HA VAL 108 HA VAL 108 1.446 12.379 1.213 812 HB VAL 108 HB VAL 108 1.486 10.036 3.168 813 HG11 VAL 108 1HG1 VAL 108 -0.027 9.647 1.334 814 HG12 VAL 108 2HG1 VAL 108 1.148 10.294 0.169 815 HG13 VAL 108 3HG1 VAL 108 1.425 8.737 0.958 816 HG21 VAL 108 3HG2 VAL 108 3.839 10.561 2.914 817 HG22 VAL 108 1HG2 VAL 108 3.508 9.183 1.886 818 HG23 VAL 108 2HG2 VAL 108 3.649 10.791 1.155 819 H ARG 109 H ARG 109 -0.992 11.505 1.176 820 HA ARG 109 HA ARG 109 -2.238 11.446 3.747 821 HB2 ARG 109 1HB ARG 109 -2.514 13.828 3.249 822 HB3 ARG 109 2HB ARG 109 -3.239 13.461 1.681 823 HG2 ARG 109 1HG ARG 109 -5.264 13.004 2.581 824 HG3 ARG 109 2HG ARG 109 -4.615 12.226 4.030 825 HD2 ARG 109 1HD ARG 109 -4.522 15.241 3.595 826 HD3 ARG 109 2HD ARG 109 -5.880 14.410 4.373 827 HE ARG 109 HE ARG 109 -3.096 14.098 5.415 828 HH11 ARG 109 1HH1 ARG 109 -6.120 15.871 5.935 829 HH12 ARG 109 2HH1 ARG 109 -5.895 15.904 7.655 830 HH21 ARG 109 1HH2 ARG 109 -3.002 13.881 7.648 831 HH22 ARG 109 2HH2 ARG 109 -4.181 14.611 8.683 832 H VAL 110 H VAL 110 -3.565 9.626 3.624 833 HA VAL 110 HA VAL 110 -3.856 8.390 1.036 834 HB VAL 110 HB VAL 110 -3.662 7.078 3.058 835 HG11 VAL 110 1HG1 VAL 110 -5.017 8.364 4.618 836 HG12 VAL 110 2HG1 VAL 110 -6.487 8.059 3.655 837 HG13 VAL 110 3HG1 VAL 110 -5.674 6.725 4.478 838 HG21 VAL 110 3HG2 VAL 110 -4.626 6.141 0.982 839 HG22 VAL 110 1HG2 VAL 110 -5.319 5.408 2.443 840 HG23 VAL 110 2HG2 VAL 110 -6.258 6.570 1.542 841 H ARG 111 H ARG 111 -5.789 10.710 2.779 842 HA ARG 111 HA ARG 111 -7.379 12.093 2.034 843 HB2 ARG 111 1HB ARG 111 -5.945 11.554 -0.159 844 HB3 ARG 111 2HB ARG 111 -7.437 10.843 -0.714 845 HG2 ARG 111 1HG ARG 111 -7.356 13.679 0.405 846 HG3 ARG 111 2HG ARG 111 -6.777 13.291 -1.206 847 HD2 ARG 111 1HD ARG 111 -9.062 12.155 -1.601 848 HD3 ARG 111 2HD ARG 111 -9.608 13.040 -0.157 849 HE ARG 111 HE ARG 111 -8.172 14.683 -2.076 850 HH11 ARG 111 1HH1 ARG 111 -11.444 13.343 -1.581 851 HH12 ARG 111 2HH1 ARG 111 -12.190 14.695 -2.403 852 HH21 ARG 111 1HH2 ARG 111 -9.169 16.339 -3.102 853 HH22 ARG 111 2HH2 ARG 111 -10.932 16.395 -3.202 854 H THR 112 H THR 112 -7.977 8.684 1.136 855 HA THR 112 HA THR 112 -10.800 9.030 1.957 856 HB THR 112 HB THR 112 -11.242 7.388 0.091 857 HG1 THR 112 1HG THR 112 -9.271 6.545 -0.402 858 HG21 THR 112 3HG2 THR 112 -11.065 8.970 -1.761 859 HG22 THR 112 1HG2 THR 112 -9.852 9.922 -0.913 860 HG23 THR 112 2HG2 THR 112 -11.529 9.876 -0.312 861 HA PRO 113 HA PRO 113 -10.018 5.721 4.728 862 HB2 PRO 113 1HB PRO 113 -12.418 4.474 5.058 863 HB3 PRO 113 2HB PRO 113 -12.099 6.148 5.616 864 HG2 PRO 113 1HG PRO 113 -13.432 5.261 3.035 865 HG3 PRO 113 2HG PRO 113 -13.997 6.498 4.208 866 HD2 PRO 113 1HD PRO 113 -12.609 7.143 1.940 867 HD3 PRO 113 2HD PRO 113 -12.400 8.070 3.460 868 H ILE 114 H ILE 114 -9.809 3.325 4.926 869 HA ILE 114 HA ILE 114 -9.167 1.841 2.589 870 HB ILE 114 HB ILE 114 -10.122 1.020 5.339 871 HG12 ILE 114 1HG1 ILE 114 -7.990 2.078 5.538 872 HG13 ILE 114 2HG1 ILE 114 -7.834 0.363 5.837 873 HG21 ILE 114 1HG2 ILE 114 -9.320 -1.260 4.976 874 HG22 ILE 114 2HG2 ILE 114 -10.639 -0.874 3.915 875 HG23 ILE 114 3HG2 ILE 114 -8.992 -0.888 3.260 876 HD11 ILE 114 3HD1 ILE 114 -6.919 0.037 3.544 877 HD12 ILE 114 1HD1 ILE 114 -6.980 1.811 3.332 878 HD13 ILE 114 2HD1 ILE 114 -5.939 1.081 4.576 879 H SER 115 H SER 115 -10.437 0.586 1.145 880 HA SER 115 HA SER 115 -13.109 -0.169 2.039 881 HB2 SER 115 1HB SER 115 -12.429 1.633 -0.138 882 HB3 SER 115 2HB SER 115 -12.815 0.063 -0.808 883 HG SER 115 HG SER 115 -14.805 0.190 0.510 884 H ASN 116 H ASN 116 -13.563 -2.308 1.145 885 HA ASN 116 HA ASN 116 -11.499 -3.690 -0.381 886 HB2 ASN 116 1HB ASN 116 -11.357 -5.582 1.083 887 HB3 ASN 116 2HB ASN 116 -10.786 -4.120 1.903 888 HD21 ASN 116 1HD2 ASN 116 -13.283 -6.698 1.879 889 HD22 ASN 116 2HD2 ASN 116 -13.880 -6.258 3.458 890 H GLY 117 H GLY 117 -12.446 -5.964 -0.992 891 HA2 GLY 117 2HA GLY 117 -15.416 -5.728 -1.294 892 HA3 GLY 117 1HA GLY 117 -14.332 -6.017 -2.653 893 H GLN 118 H GLN 118 -16.324 -7.743 -2.306 894 HA GLN 118 HA GLN 118 -15.751 -10.101 -0.803 895 HB2 GLN 118 1HB GLN 118 -17.476 -9.179 -3.099 896 HB3 GLN 118 2HB GLN 118 -17.201 -10.885 -2.978 897 HG2 GLN 118 1HG GLN 118 -18.337 -11.127 -0.943 898 HG3 GLN 118 2HG GLN 118 -18.137 -9.418 -0.519 899 HE21 GLN 118 1HE2 GLN 118 -20.285 -11.700 -2.219 900 HE22 GLN 118 2HE2 GLN 118 -21.354 -10.435 -2.828 901 HA PRO 119 HA PRO 119 -12.362 -11.409 -3.203 902 HB2 PRO 119 1HB PRO 119 -12.410 -14.180 -2.947 903 HB3 PRO 119 2HB PRO 119 -11.922 -13.057 -1.652 904 HG2 PRO 119 1HG PRO 119 -14.587 -14.413 -2.064 905 HG3 PRO 119 2HG PRO 119 -13.686 -14.132 -0.537 906 HD2 PRO 119 1HD PRO 119 -15.790 -12.561 -1.397 907 HD3 PRO 119 2HD PRO 119 -14.467 -11.926 -0.381 908 H THR 120 H THR 120 -11.613 -12.633 -5.084 909 HA THR 120 HA THR 120 -13.822 -13.360 -6.941 910 HB THR 120 HB THR 120 -12.787 -11.225 -7.501 911 HG1 THR 120 1HG THR 120 -12.492 -13.452 -9.171 912 HG21 THR 120 3HG2 THR 120 -10.514 -11.609 -6.644 913 HG22 THR 120 1HG2 THR 120 -10.503 -11.127 -8.352 914 HG23 THR 120 2HG2 THR 120 -10.247 -12.836 -7.905 915 H THR 121 H THR 121 -11.823 -14.795 -5.073 916 HA THR 121 HA THR 121 -10.594 -16.706 -4.979 917 HB THR 121 HB THR 121 -12.605 -17.551 -7.086 918 HG1 THR 121 1HG THR 121 -13.788 -16.991 -5.502 919 HG21 THR 121 3HG2 THR 121 -12.462 -19.758 -5.794 920 HG22 THR 121 1HG2 THR 121 -10.913 -19.178 -5.136 921 HG23 THR 121 2HG2 THR 121 -11.129 -19.435 -6.886 922 H GLY 122 H GLY 122 -9.487 -18.551 -6.714 923 HA2 GLY 122 2HA GLY 122 -8.166 -17.481 -8.950 924 HA3 GLY 122 1HA GLY 122 -7.123 -17.455 -7.515 925 H ASP 123 H ASP 123 -5.924 -19.152 -8.815 926 HA ASP 123 HA ASP 123 -7.214 -21.499 -9.756 927 HB2 ASP 123 1HB ASP 123 -5.011 -20.455 -10.468 928 HB3 ASP 123 2HB ASP 123 -4.284 -21.206 -9.055 929 H ALA 124 H ALA 124 -5.321 -20.911 -6.791 930 HA ALA 124 HA ALA 124 -6.689 -23.091 -5.346 931 HB1 ALA 124 1HB ALA 124 -3.637 -22.796 -5.604 932 HB2 ALA 124 2HB ALA 124 -4.489 -24.065 -4.717 933 HB3 ALA 124 3HB ALA 124 -4.576 -24.023 -6.478 934 H ASP 125 H ASP 125 -6.533 -20.052 -5.447 935 HA ASP 125 HA ASP 125 -5.772 -19.529 -2.659 936 HB2 ASP 125 1HB ASP 125 -4.651 -17.486 -4.303 937 HB3 ASP 125 2HB ASP 125 -3.863 -18.514 -3.121 938 H HIS 126 H HIS 126 -7.236 -18.037 -1.880 939 HA HIS 126 HA HIS 126 -8.935 -16.629 -3.886 940 HB2 HIS 126 1HB HIS 126 -9.210 -16.470 -0.880 941 HB3 HIS 126 2HB HIS 126 -10.292 -15.772 -2.064 942 HD1 HIS 126 1HD HIS 126 -11.930 -17.774 -3.463 943 HD2 HIS 126 2HD HIS 126 -9.729 -18.705 0.024 944 HE1 HIS 126 1HE HIS 126 -12.941 -19.863 -2.519 945 H THR 127 H THR 127 -9.209 -14.341 -3.713 946 HA THR 127 HA THR 127 -7.277 -12.674 -2.275 947 HB THR 127 HB THR 127 -7.478 -11.485 -4.747 948 HG1 THR 127 1HG THR 127 -7.582 -12.818 -6.313 949 HG21 THR 127 3HG2 THR 127 -5.339 -11.667 -3.641 950 HG22 THR 127 1HG2 THR 127 -5.167 -12.328 -5.265 951 HG23 THR 127 2HG2 THR 127 -5.302 -13.427 -3.864 952 H VAL 128 H VAL 128 -8.286 -11.073 -1.401 953 HA VAL 128 HA VAL 128 -10.947 -10.220 -2.415 954 HB VAL 128 HB VAL 128 -10.806 -8.823 -0.289 955 HG11 VAL 128 1HG1 VAL 128 -12.407 -10.638 -0.616 956 HG12 VAL 128 2HG1 VAL 128 -11.246 -11.775 0.120 957 HG13 VAL 128 3HG1 VAL 128 -11.935 -10.438 1.067 958 HG21 VAL 128 3HG2 VAL 128 -9.633 -9.529 1.620 959 HG22 VAL 128 1HG2 VAL 128 -8.891 -10.890 0.739 960 HG23 VAL 128 2HG2 VAL 128 -8.509 -9.191 0.328 961 HA PRO 129 HA PRO 129 -8.403 -6.835 -3.964 962 HB2 PRO 129 1HB PRO 129 -10.399 -5.103 -4.703 963 HB3 PRO 129 2HB PRO 129 -10.029 -6.603 -5.611 964 HG2 PRO 129 1HG PRO 129 -12.210 -6.171 -3.554 965 HG3 PRO 129 2HG PRO 129 -12.320 -7.010 -5.137 966 HD2 PRO 129 1HD PRO 129 -12.019 -8.297 -2.760 967 HD3 PRO 129 2HD PRO 129 -11.370 -8.932 -4.298 968 H ILE 130 H ILE 130 -7.349 -5.333 -2.652 969 HA ILE 130 HA ILE 130 -8.925 -3.679 -0.813 970 HB ILE 130 HB ILE 130 -6.425 -5.160 0.040 971 HG12 ILE 130 1HG1 ILE 130 -9.297 -5.648 0.745 972 HG13 ILE 130 2HG1 ILE 130 -8.170 -6.745 -0.037 973 HG21 ILE 130 1HG2 ILE 130 -8.310 -3.353 1.636 974 HG22 ILE 130 2HG2 ILE 130 -6.805 -4.089 2.226 975 HG23 ILE 130 3HG2 ILE 130 -6.745 -2.830 0.992 976 HD11 ILE 130 3HD1 ILE 130 -6.836 -6.825 2.082 977 HD12 ILE 130 1HD1 ILE 130 -8.106 -5.834 2.857 978 HD13 ILE 130 2HD1 ILE 130 -8.503 -7.431 2.232 979 H SER 131 H SER 131 -8.312 -1.604 -1.047 980 HA SER 131 HA SER 131 -5.726 -0.664 -1.885 981 HB2 SER 131 1HB SER 131 -6.734 0.212 -4.114 982 HB3 SER 131 2HB SER 131 -6.202 -1.457 -4.017 983 HG SER 131 HG SER 131 -8.745 -1.484 -3.282 984 H LEU 132 H LEU 132 -5.702 1.645 -2.157 985 HA LEU 132 HA LEU 132 -8.093 3.208 -1.523 986 HB2 LEU 132 1HB LEU 132 -6.697 4.437 0.213 987 HB3 LEU 132 2HB LEU 132 -7.445 2.930 0.678 988 HG LEU 132 HG LEU 132 -5.227 3.440 1.556 989 HD11 LEU 132 1HD1 LEU 132 -6.206 1.066 1.367 990 HD12 LEU 132 2HD1 LEU 132 -4.536 1.346 1.924 991 HD13 LEU 132 3HD1 LEU 132 -4.872 0.794 0.251 992 HD21 LEU 132 3HD2 LEU 132 -4.071 2.695 -1.120 993 HD22 LEU 132 1HD2 LEU 132 -3.172 3.135 0.328 994 HD23 LEU 132 2HD2 LEU 132 -4.161 4.356 -0.490 995 H GLY 133 H GLY 133 -7.625 5.639 -1.873 996 HA2 GLY 133 2HA GLY 133 -5.718 5.823 -4.179 997 HA3 GLY 133 1HA GLY 133 -7.323 6.492 -4.148 998 H TYR 134 H TYR 134 -4.174 6.694 -2.927 999 HA TYR 134 HA TYR 134 -4.474 8.997 -1.164 1000 HB2 TYR 134 1HB TYR 134 -1.987 8.848 -0.998 1001 HB3 TYR 134 2HB TYR 134 -2.773 7.373 -0.584 1002 HD1 TYR 134 2HD TYR 134 -1.078 9.160 -3.398 1003 HD2 TYR 134 1HD TYR 134 -2.124 5.302 -1.773 1004 HE1 TYR 134 2HE TYR 134 0.382 8.101 -5.026 1005 HE2 TYR 134 1HE TYR 134 -0.621 4.235 -3.451 1006 HH TYR 134 HH TYR 134 1.574 6.084 -5.454 1007 H ASP 135 H ASP 135 -3.023 10.914 -1.357 1008 HA ASP 135 HA ASP 135 -1.886 11.406 -3.928 1009 HB2 ASP 135 1HB ASP 135 -2.805 13.533 -4.428 1010 HB3 ASP 135 2HB ASP 135 -4.099 12.371 -4.296 1011 H VAL 136 H VAL 136 -0.956 13.915 -3.626 1012 HA VAL 136 HA VAL 136 0.600 13.915 -1.094 1013 HB VAL 136 HB VAL 136 1.550 14.670 -3.905 1014 HG11 VAL 136 1HG1 VAL 136 3.017 14.691 -1.232 1015 HG12 VAL 136 2HG1 VAL 136 3.805 14.857 -2.820 1016 HG13 VAL 136 3HG1 VAL 136 2.662 16.080 -2.285 1017 HG21 VAL 136 3HG2 VAL 136 2.407 12.333 -2.141 1018 HG22 VAL 136 1HG2 VAL 136 1.525 12.238 -3.694 1019 HG23 VAL 136 2HG2 VAL 136 3.184 12.809 -3.668 1020 H GLN 137 H GLN 137 1.136 16.091 -0.382 1021 HA GLN 137 HA GLN 137 0.141 18.393 -1.788 1022 HB2 GLN 137 1HB GLN 137 -0.903 19.317 0.289 1023 HB3 GLN 137 2HB GLN 137 -1.843 18.025 -0.419 1024 HG2 GLN 137 1HG GLN 137 0.121 17.378 1.803 1025 HG3 GLN 137 2HG GLN 137 -1.414 18.121 2.188 1026 HE21 GLN 137 1HE2 GLN 137 0.121 15.101 1.645 1027 HE22 GLN 137 2HE2 GLN 137 -1.366 14.195 1.361 1028 H PHE 138 H PHE 138 1.107 20.366 -0.504 1029 HA PHE 138 HA PHE 138 3.683 19.611 0.729 1030 HB2 PHE 138 1HB PHE 138 2.403 22.326 0.326 1031 HB3 PHE 138 2HB PHE 138 4.000 22.024 0.995 1032 HD1 PHE 138 1HD PHE 138 3.947 19.618 -1.560 1033 HD2 PHE 138 2HD PHE 138 3.986 23.912 -1.017 1034 HE1 PHE 138 1HE PHE 138 4.717 19.904 -3.860 1035 HE2 PHE 138 2HE PHE 138 4.734 24.162 -3.382 1036 HZ PHE 138 HZ PHE 138 5.083 22.190 -4.800 1037 H TYR 139 H TYR 139 0.471 19.911 1.745 1038 HA TYR 139 HA TYR 139 -0.599 20.127 3.676 1039 HB2 TYR 139 1HB TYR 139 0.780 18.012 3.851 1040 HB3 TYR 139 2HB TYR 139 1.884 18.884 4.889 1041 HD1 TYR 139 1HD TYR 139 -1.688 17.962 4.438 1042 HD2 TYR 139 2HD TYR 139 1.401 19.038 7.206 1043 HE1 TYR 139 1HE TYR 139 -3.203 17.381 6.341 1044 HE2 TYR 139 2HE TYR 139 -0.054 18.466 9.103 1045 HH TYR 139 HH TYR 139 -2.246 17.954 9.773 1046 HA PRO 140 HA PRO 140 1.733 24.008 4.846 1047 HB2 PRO 140 1HB PRO 140 -0.293 25.810 4.474 1048 HB3 PRO 140 2HB PRO 140 0.816 25.283 3.171 1049 HG2 PRO 140 1HG PRO 140 -1.970 24.254 3.794 1050 HG3 PRO 140 2HG PRO 140 -1.286 24.703 2.201 1051 HD2 PRO 140 1HD PRO 140 -1.401 22.126 3.069 1052 HD3 PRO 140 2HD PRO 140 -0.023 22.706 2.089 1053 H GLU 141 H GLU 141 1.900 24.216 6.977 1054 HA GLU 141 HA GLU 141 -0.337 23.819 8.847 1055 HB2 GLU 141 1HB GLU 141 2.514 24.814 9.366 1056 HB3 GLU 141 2HB GLU 141 1.328 24.263 10.542 1057 HG2 GLU 141 1HG GLU 141 2.594 22.379 10.431 1058 HG3 GLU 141 2HG GLU 141 1.401 22.005 9.186 Start of MODEL 11 1 H1 GLY 1 H GLY 1 12.395 18.346 -8.571 2 HA2 GLY 1 2HA GLY 1 13.537 15.721 -9.334 3 HA3 GLY 1 1HA GLY 1 14.486 17.213 -9.182 4 H MET 2 H MET 2 14.509 14.527 -7.665 5 HA MET 2 HA MET 2 14.375 13.635 -5.623 6 HB2 MET 2 1HB MET 2 15.194 16.378 -4.604 7 HB3 MET 2 2HB MET 2 15.176 14.873 -3.670 8 HG2 MET 2 1HG MET 2 16.667 13.837 -5.417 9 HG3 MET 2 2HG MET 2 16.851 15.445 -6.124 10 HE1 MET 2 3HE MET 2 20.340 14.902 -4.571 11 HE2 MET 2 1HE MET 2 19.325 13.584 -5.196 12 HE3 MET 2 2HE MET 2 19.356 15.154 -6.024 13 H SER 3 H SER 3 13.239 14.876 -3.091 14 HA SER 3 HA SER 3 11.278 14.292 -2.131 15 HB2 SER 3 1HB SER 3 10.298 16.253 -4.229 16 HB3 SER 3 2HB SER 3 9.404 15.779 -2.775 17 HG SER 3 HG SER 3 11.809 17.219 -3.024 18 H GLN 4 H GLN 4 12.007 12.261 -3.798 19 HA GLN 4 HA GLN 4 9.392 11.250 -4.683 20 HB2 GLN 4 1HB GLN 4 11.510 12.000 -6.502 21 HB3 GLN 4 2HB GLN 4 11.345 10.248 -6.567 22 HG2 GLN 4 1HG GLN 4 8.970 12.147 -6.788 23 HG3 GLN 4 2HG GLN 4 9.923 11.611 -8.165 24 HE21 GLN 4 1HE2 GLN 4 8.733 9.530 -5.306 25 HE22 GLN 4 2HE2 GLN 4 7.680 8.616 -6.325 26 H ASP 5 H ASP 5 12.881 10.150 -4.381 27 HA ASP 5 HA ASP 5 11.930 7.488 -3.804 28 HB2 ASP 5 1HB ASP 5 14.653 8.765 -3.636 29 HB3 ASP 5 2HB ASP 5 14.344 7.123 -3.024 30 H LEU 6 H LEU 6 12.366 10.296 -1.900 31 HA LEU 6 HA LEU 6 12.291 9.078 0.720 32 HB2 LEU 6 1HB LEU 6 11.361 11.777 -0.310 33 HB3 LEU 6 2HB LEU 6 11.446 11.371 1.406 34 HG LEU 6 HG LEU 6 13.898 11.156 -0.395 35 HD11 LEU 6 1HD1 LEU 6 12.653 13.534 -0.226 36 HD12 LEU 6 2HD1 LEU 6 14.419 13.334 -0.211 37 HD13 LEU 6 3HD1 LEU 6 13.575 13.583 1.299 38 HD21 LEU 6 3HD2 LEU 6 14.120 10.003 1.714 39 HD22 LEU 6 1HD2 LEU 6 13.542 11.405 2.623 40 HD23 LEU 6 2HD2 LEU 6 15.095 11.470 1.768 41 H ILE 7 H ILE 7 9.807 10.318 -1.516 42 HA ILE 7 HA ILE 7 7.508 10.080 -0.028 43 HB ILE 7 HB ILE 7 7.763 9.450 -2.997 44 HG12 ILE 7 1HG1 ILE 7 8.824 11.579 -2.458 45 HG13 ILE 7 2HG1 ILE 7 7.302 11.801 -3.349 46 HG21 ILE 7 1HG2 ILE 7 5.626 8.727 -2.388 47 HG22 ILE 7 2HG2 ILE 7 5.353 10.115 -1.332 48 HG23 ILE 7 3HG2 ILE 7 5.419 10.335 -3.093 49 HD11 ILE 7 3HD1 ILE 7 6.527 11.992 -0.680 50 HD12 ILE 7 1HD1 ILE 7 8.184 12.635 -0.692 51 HD13 ILE 7 2HD1 ILE 7 6.913 13.312 -1.780 52 H ARG 8 H ARG 8 8.706 7.676 -2.410 53 HA ARG 8 HA ARG 8 6.958 5.595 -1.712 54 HB2 ARG 8 1HB ARG 8 8.619 4.145 -2.787 55 HB3 ARG 8 2HB ARG 8 7.983 5.445 -3.799 56 HG2 ARG 8 1HG ARG 8 10.020 6.535 -3.878 57 HG3 ARG 8 2HG ARG 8 10.544 5.815 -2.352 58 HD2 ARG 8 1HD ARG 8 10.351 3.561 -3.909 59 HD3 ARG 8 2HD ARG 8 10.780 4.753 -5.120 60 HE ARG 8 HE ARG 8 12.844 5.022 -4.221 61 HH11 ARG 8 1HH1 ARG 8 10.922 2.850 -2.142 62 HH12 ARG 8 2HH1 ARG 8 12.126 2.574 -0.955 63 HH21 ARG 8 1HH2 ARG 8 14.601 4.511 -2.718 64 HH22 ARG 8 2HH2 ARG 8 14.321 3.448 -1.389 65 H ALA 9 H ALA 9 10.240 6.301 -0.435 66 HA ALA 9 HA ALA 9 10.518 3.965 1.070 67 HB1 ALA 9 1HB ALA 9 11.550 6.760 1.635 68 HB2 ALA 9 2HB ALA 9 12.104 5.268 2.426 69 HB3 ALA 9 3HB ALA 9 12.326 5.479 0.669 70 H ALA 10 H ALA 10 8.594 6.895 1.803 71 HA ALA 10 HA ALA 10 8.224 6.426 4.558 72 HB1 ALA 10 1HB ALA 10 6.014 7.522 2.799 73 HB2 ALA 10 2HB ALA 10 6.518 8.022 4.431 74 HB3 ALA 10 3HB ALA 10 7.505 8.446 3.017 75 H PHE 11 H PHE 11 6.762 4.839 1.757 76 HA PHE 11 HA PHE 11 4.559 3.706 3.252 77 HB2 PHE 11 1HB PHE 11 5.689 3.139 0.487 78 HB3 PHE 11 2HB PHE 11 4.439 2.166 1.219 79 HD1 PHE 11 2HD PHE 11 4.925 5.970 0.892 80 HD2 PHE 11 1HD PHE 11 2.380 2.512 0.265 81 HE1 PHE 11 2HE PHE 11 3.241 7.389 -0.141 82 HE2 PHE 11 1HE PHE 11 0.675 3.979 -0.732 83 HZ PHE 11 HZ PHE 11 1.080 6.425 -0.933 84 H GLU 12 H GLU 12 7.685 2.329 1.905 85 HA GLU 12 HA GLU 12 7.314 -0.123 3.274 86 HB2 GLU 12 1HB GLU 12 9.784 -0.436 2.840 87 HB3 GLU 12 2HB GLU 12 8.719 -0.240 1.459 88 HG2 GLU 12 1HG GLU 12 9.401 2.082 1.209 89 HG3 GLU 12 2HG GLU 12 10.514 1.923 2.585 90 H LYS 13 H LYS 13 8.608 2.929 4.453 91 HA LYS 13 HA LYS 13 9.908 1.897 6.807 92 HB2 LYS 13 1HB LYS 13 8.688 4.584 6.043 93 HB3 LYS 13 2HB LYS 13 9.381 4.309 7.619 94 HG2 LYS 13 1HG LYS 13 11.066 3.786 5.146 95 HG3 LYS 13 2HG LYS 13 10.798 5.437 5.741 96 HD2 LYS 13 1HD LYS 13 11.599 4.686 7.989 97 HD3 LYS 13 2HD LYS 13 12.021 3.116 7.280 98 HE2 LYS 13 1HE LYS 13 13.537 4.350 5.671 99 HE3 LYS 13 2HE LYS 13 13.153 5.854 6.519 100 HZ1 LYS 13 3HZ LYS 13 15.151 5.035 7.473 101 HZ2 LYS 13 1HZ LYS 13 14.554 3.501 7.618 102 HZ3 LYS 13 2HZ LYS 13 13.970 4.678 8.559 103 H ARG 14 H ARG 14 6.541 2.227 5.856 104 HA ARG 14 HA ARG 14 5.793 1.869 8.674 105 HB2 ARG 14 1HB ARG 14 4.703 3.753 7.453 106 HB3 ARG 14 2HB ARG 14 4.011 2.600 6.317 107 HG2 ARG 14 1HG ARG 14 2.364 3.276 7.947 108 HG3 ARG 14 2HG ARG 14 2.705 1.563 8.165 109 HD2 ARG 14 1HD ARG 14 3.537 1.820 10.252 110 HD3 ARG 14 2HD ARG 14 4.367 3.333 9.869 111 HE ARG 14 HE ARG 14 1.928 4.290 9.849 112 HH11 ARG 14 1HH1 ARG 14 3.288 1.990 12.298 113 HH12 ARG 14 2HH1 ARG 14 2.494 2.770 13.581 114 HH21 ARG 14 1HH2 ARG 14 0.772 5.164 11.593 115 HH22 ARG 14 2HH2 ARG 14 0.808 4.361 13.129 116 H LEU 15 H LEU 15 4.855 0.560 5.452 117 HA LEU 15 HA LEU 15 3.401 -1.594 6.488 118 HB2 LEU 15 1HB LEU 15 3.197 -0.795 4.180 119 HB3 LEU 15 2HB LEU 15 4.843 -1.326 3.819 120 HG LEU 15 HG LEU 15 4.183 -3.696 4.158 121 HD11 LEU 15 1HD1 LEU 15 2.352 -3.444 5.803 122 HD12 LEU 15 2HD1 LEU 15 1.774 -4.291 4.371 123 HD13 LEU 15 3HD1 LEU 15 1.387 -2.572 4.604 124 HD21 LEU 15 3HD2 LEU 15 2.395 -2.160 2.244 125 HD22 LEU 15 1HD2 LEU 15 2.731 -3.899 2.171 126 HD23 LEU 15 2HD2 LEU 15 4.039 -2.755 1.923 127 H SER 16 H SER 16 6.936 -1.463 5.784 128 HA SER 16 HA SER 16 7.353 -4.296 5.928 129 HB2 SER 16 1HB SER 16 8.833 -2.324 5.050 130 HB3 SER 16 2HB SER 16 9.390 -2.189 6.727 131 HG SER 16 HG SER 16 10.652 -3.466 5.300 132 H ASP 17 H ASP 17 7.361 -1.647 8.314 133 HA ASP 17 HA ASP 17 8.168 -3.263 10.543 134 HB2 ASP 17 1HB ASP 17 7.693 -0.451 9.971 135 HB3 ASP 17 2HB ASP 17 6.857 -0.878 11.442 136 H TRP 18 H TRP 18 5.240 -3.188 8.900 137 HA TRP 18 HA TRP 18 3.722 -4.287 11.223 138 HB2 TRP 18 1HB TRP 18 2.435 -2.742 9.921 139 HB3 TRP 18 2HB TRP 18 2.877 -3.517 8.416 140 HD1 TRP 18 HD TRP 18 0.510 -3.922 11.377 141 HE1 TRP 18 1HE TRP 18 -1.335 -5.628 10.788 142 HE3 TRP 18 3HE TRP 18 2.327 -5.564 6.893 143 HZ2 TRP 18 2HZ TRP 18 -1.924 -7.437 8.668 144 HZ3 TRP 18 3HZ TRP 18 1.072 -7.258 5.582 145 HH2 TRP 18 HH TRP 18 -1.097 -8.140 6.460 146 H ALA 19 H ALA 19 4.729 -5.127 7.847 147 HA ALA 19 HA ALA 19 3.681 -7.746 7.961 148 HB1 ALA 19 1HB ALA 19 6.048 -6.754 6.293 149 HB2 ALA 19 2HB ALA 19 5.029 -8.163 5.961 150 HB3 ALA 19 3HB ALA 19 4.333 -6.539 5.862 151 H LYS 20 H LYS 20 7.034 -6.648 8.754 152 HA LYS 20 HA LYS 20 7.841 -9.333 9.496 153 HB2 LYS 20 1HB LYS 20 9.853 -8.373 10.254 154 HB3 LYS 20 2HB LYS 20 9.368 -7.483 8.821 155 HG2 LYS 20 1HG LYS 20 10.052 -5.746 10.144 156 HG3 LYS 20 2HG LYS 20 8.336 -5.763 10.569 157 HD2 LYS 20 1HD LYS 20 8.867 -6.989 12.660 158 HD3 LYS 20 2HD LYS 20 10.567 -7.066 12.195 159 HE2 LYS 20 1HE LYS 20 10.773 -4.680 12.312 160 HE3 LYS 20 2HE LYS 20 9.027 -4.452 12.447 161 HZ1 LYS 20 3HZ LYS 20 10.180 -4.220 14.540 162 HZ2 LYS 20 1HZ LYS 20 10.692 -5.793 14.491 163 HZ3 LYS 20 2HZ LYS 20 9.087 -5.421 14.621 164 H ALA 21 H ALA 21 6.057 -6.829 11.183 165 HA ALA 21 HA ALA 21 6.741 -7.809 13.862 166 HB1 ALA 21 1HB ALA 21 4.677 -5.754 12.975 167 HB2 ALA 21 2HB ALA 21 5.235 -6.064 14.627 168 HB3 ALA 21 3HB ALA 21 6.365 -5.401 13.429 169 H ARG 22 H ARG 22 4.319 -8.429 11.434 170 HA ARG 22 HA ARG 22 2.264 -9.498 13.026 171 HB2 ARG 22 1HB ARG 22 3.200 -9.698 10.183 172 HB3 ARG 22 2HB ARG 22 2.355 -11.109 10.732 173 HG2 ARG 22 1HG ARG 22 0.673 -9.147 11.677 174 HG3 ARG 22 2HG ARG 22 1.361 -8.356 10.252 175 HD2 ARG 22 1HD ARG 22 -0.427 -9.482 9.267 176 HD3 ARG 22 2HD ARG 22 0.834 -10.743 9.131 177 HE ARG 22 HE ARG 22 -0.573 -10.866 11.636 178 HH11 ARG 22 1HH1 ARG 22 -1.230 -11.585 8.215 179 HH12 ARG 22 2HH1 ARG 22 -2.406 -12.810 8.606 180 HH21 ARG 22 1HH2 ARG 22 -2.187 -12.401 12.054 181 HH22 ARG 22 2HH2 ARG 22 -2.855 -13.354 10.780 182 H THR 23 H THR 23 1.679 -11.719 13.383 183 HA THR 23 HA THR 23 3.860 -13.167 14.516 184 HB THR 23 HB THR 23 0.869 -13.546 14.355 185 HG1 THR 23 1HG THR 23 2.495 -12.220 15.828 186 HG21 THR 23 3HG2 THR 23 1.118 -15.515 15.853 187 HG22 THR 23 1HG2 THR 23 2.883 -15.489 15.543 188 HG23 THR 23 2HG2 THR 23 1.747 -15.797 14.213 189 HA PRO 24 HA PRO 24 3.350 -16.326 10.973 190 HB2 PRO 24 1HB PRO 24 2.041 -15.543 8.678 191 HB3 PRO 24 2HB PRO 24 1.307 -16.477 10.012 192 HG2 PRO 24 1HG PRO 24 1.131 -13.506 9.479 193 HG3 PRO 24 2HG PRO 24 -0.189 -14.640 9.934 194 HD2 PRO 24 1HD PRO 24 1.046 -13.034 11.751 195 HD3 PRO 24 2HD PRO 24 0.493 -14.674 12.186 196 H ALA 25 H ALA 25 3.622 -13.009 10.820 197 HA ALA 25 HA ALA 25 4.936 -11.437 9.824 198 HB1 ALA 25 1HB ALA 25 7.314 -11.919 9.795 199 HB2 ALA 25 2HB ALA 25 6.523 -12.513 11.281 200 HB3 ALA 25 3HB ALA 25 6.969 -13.661 10.005 201 H LEU 26 H LEU 26 4.252 -10.873 7.847 202 HA LEU 26 HA LEU 26 4.195 -12.936 5.715 203 HB2 LEU 26 1HB LEU 26 2.932 -10.172 5.914 204 HB3 LEU 26 2HB LEU 26 2.685 -11.282 4.570 205 HG LEU 26 HG LEU 26 1.922 -11.885 7.468 206 HD11 LEU 26 1HD1 LEU 26 0.284 -11.048 5.068 207 HD12 LEU 26 2HD1 LEU 26 0.582 -10.084 6.526 208 HD13 LEU 26 3HD1 LEU 26 -0.393 -11.567 6.613 209 HD21 LEU 26 3HD2 LEU 26 1.381 -13.439 4.894 210 HD22 LEU 26 1HD2 LEU 26 0.652 -13.780 6.478 211 HD23 LEU 26 2HD2 LEU 26 2.378 -13.976 6.263 212 HA PRO 27 HA PRO 27 7.295 -10.837 3.277 213 HB2 PRO 27 1HB PRO 27 6.701 -11.593 0.718 214 HB3 PRO 27 2HB PRO 27 7.295 -12.753 1.945 215 HG2 PRO 27 1HG PRO 27 4.425 -12.214 1.121 216 HG3 PRO 27 2HG PRO 27 5.254 -13.801 1.262 217 HD2 PRO 27 1HD PRO 27 3.695 -12.795 3.254 218 HD3 PRO 27 2HD PRO 27 5.171 -13.739 3.615 219 H VAL 28 H VAL 28 7.470 -9.296 1.310 220 HA VAL 28 HA VAL 28 5.045 -7.734 0.765 221 HB VAL 28 HB VAL 28 7.685 -6.336 1.323 222 HG11 VAL 28 1HG1 VAL 28 4.790 -5.391 1.196 223 HG12 VAL 28 2HG1 VAL 28 6.185 -4.375 1.586 224 HG13 VAL 28 3HG1 VAL 28 6.054 -5.112 -0.012 225 HG21 VAL 28 3HG2 VAL 28 6.833 -5.590 3.525 226 HG22 VAL 28 1HG2 VAL 28 5.528 -6.781 3.417 227 HG23 VAL 28 2HG2 VAL 28 7.208 -7.303 3.485 228 H ALA 29 H ALA 29 4.871 -7.874 -1.456 229 HA ALA 29 HA ALA 29 7.402 -7.773 -3.011 230 HB1 ALA 29 1HB ALA 29 4.777 -8.940 -4.008 231 HB2 ALA 29 2HB ALA 29 6.320 -8.798 -4.868 232 HB3 ALA 29 3HB ALA 29 6.203 -9.877 -3.474 233 H TRP 30 H TRP 30 7.582 -5.578 -3.001 234 HA TRP 30 HA TRP 30 5.548 -3.713 -3.788 235 HB2 TRP 30 1HB TRP 30 8.584 -3.581 -3.908 236 HB3 TRP 30 2HB TRP 30 7.492 -2.220 -4.127 237 HD1 TRP 30 HD TRP 30 9.425 -3.949 -1.491 238 HE1 TRP 30 1HE TRP 30 8.738 -3.137 0.867 239 HE3 TRP 30 3HE TRP 30 5.227 -1.373 -2.769 240 HZ2 TRP 30 2HZ TRP 30 6.599 -1.569 2.005 241 HZ3 TRP 30 3HZ TRP 30 3.910 -0.124 -1.043 242 HH2 TRP 30 HH TRP 30 4.574 -0.246 1.344 243 H GLN 31 H GLN 31 4.635 -3.746 -5.863 244 HA GLN 31 HA GLN 31 4.313 -4.252 -8.017 245 HB2 GLN 31 1HB GLN 31 6.826 -2.585 -7.900 246 HB3 GLN 31 2HB GLN 31 6.140 -3.105 -9.459 247 HG2 GLN 31 1HG GLN 31 3.940 -2.122 -8.711 248 HG3 GLN 31 2HG GLN 31 4.827 -1.343 -7.393 249 HE21 GLN 31 1HE2 GLN 31 3.521 0.068 -9.448 250 HE22 GLN 31 2HE2 GLN 31 4.664 0.917 -10.452 251 H ASN 32 H ASN 32 7.847 -4.600 -8.357 252 HA ASN 32 HA ASN 32 7.491 -7.327 -9.459 253 HB2 ASN 32 1HB ASN 32 9.164 -5.367 -10.997 254 HB3 ASN 32 2HB ASN 32 8.417 -6.849 -11.533 255 HD21 ASN 32 1HD2 ASN 32 5.974 -6.653 -11.685 256 HD22 ASN 32 2HD2 ASN 32 5.409 -5.102 -12.321 257 H THR 33 H THR 33 8.804 -5.939 -7.007 258 HA THR 33 HA THR 33 11.572 -5.812 -7.406 259 HB THR 33 HB THR 33 10.129 -4.710 -5.621 260 HG1 THR 33 1HG THR 33 11.888 -4.839 -4.101 261 HG21 THR 33 3HG2 THR 33 9.789 -5.772 -3.493 262 HG22 THR 33 1HG2 THR 33 10.503 -7.290 -4.069 263 HG23 THR 33 2HG2 THR 33 8.970 -6.723 -4.758 264 H LYS 34 H LYS 34 13.111 -7.065 -5.849 265 HA LYS 34 HA LYS 34 13.274 -9.901 -6.491 266 HB2 LYS 34 1HB LYS 34 14.717 -8.058 -4.553 267 HB3 LYS 34 2HB LYS 34 14.760 -9.782 -4.294 268 HG2 LYS 34 1HG LYS 34 16.694 -9.432 -5.435 269 HG3 LYS 34 2HG LYS 34 15.635 -10.068 -6.687 270 HD2 LYS 34 1HD LYS 34 16.044 -7.086 -6.256 271 HD3 LYS 34 2HD LYS 34 17.186 -8.042 -7.199 272 HE2 LYS 34 1HE LYS 34 15.573 -8.582 -8.858 273 HE3 LYS 34 2HE LYS 34 14.224 -8.048 -7.861 274 HZ1 LYS 34 3HZ LYS 34 16.327 -6.287 -8.916 275 HZ2 LYS 34 1HZ LYS 34 15.015 -5.806 -8.029 276 HZ3 LYS 34 2HZ LYS 34 14.821 -6.434 -9.553 277 H PHE 35 H PHE 35 11.795 -11.368 -5.727 278 HA PHE 35 HA PHE 35 11.015 -11.380 -2.986 279 HB2 PHE 35 1HB PHE 35 8.793 -11.290 -3.272 280 HB3 PHE 35 2HB PHE 35 9.276 -9.993 -4.332 281 HD1 PHE 35 2HD PHE 35 9.909 -11.366 -6.872 282 HD2 PHE 35 1HD PHE 35 6.781 -12.224 -4.023 283 HE1 PHE 35 2HE PHE 35 8.529 -12.329 -8.673 284 HE2 PHE 35 1HE PHE 35 5.398 -13.178 -5.838 285 HZ PHE 35 HZ PHE 35 6.255 -13.225 -8.187 286 H THR 36 H THR 36 9.227 -13.526 -3.339 287 HA THR 36 HA THR 36 8.987 -15.636 -3.704 288 HB THR 36 HB THR 36 10.242 -15.060 -6.080 289 HG1 THR 36 1HG THR 36 8.637 -16.379 -6.199 290 HG21 THR 36 3HG2 THR 36 11.792 -17.431 -4.909 291 HG22 THR 36 1HG2 THR 36 12.495 -15.862 -5.367 292 HG23 THR 36 2HG2 THR 36 11.772 -16.907 -6.593 293 HA PRO 37 HA PRO 37 9.202 -18.007 -3.573 294 HB2 PRO 37 1HB PRO 37 8.891 -19.792 -1.524 295 HB3 PRO 37 2HB PRO 37 10.204 -19.906 -2.734 296 HG2 PRO 37 1HG PRO 37 10.311 -18.760 0.054 297 HG3 PRO 37 2HG PRO 37 11.483 -19.853 -0.764 298 HD2 PRO 37 1HD PRO 37 11.814 -17.125 -0.563 299 HD3 PRO 37 2HD PRO 37 12.472 -18.103 -1.921 300 HA PRO 38 HA PRO 38 5.868 -16.246 -0.966 301 HB2 PRO 38 1HB PRO 38 3.971 -18.213 -0.885 302 HB3 PRO 38 2HB PRO 38 4.180 -17.113 -2.307 303 HG2 PRO 38 1HG PRO 38 5.097 -19.942 -1.945 304 HG3 PRO 38 2HG PRO 38 4.474 -19.162 -3.428 305 HD2 PRO 38 1HD PRO 38 7.158 -19.583 -2.951 306 HD3 PRO 38 2HD PRO 38 6.548 -18.235 -3.941 307 H ALA 39 H ALA 39 4.571 -16.943 1.058 308 HA ALA 39 HA ALA 39 6.300 -18.565 2.760 309 HB1 ALA 39 1HB ALA 39 5.153 -17.404 4.641 310 HB2 ALA 39 2HB ALA 39 5.957 -16.254 3.558 311 HB3 ALA 39 3HB ALA 39 4.193 -16.473 3.470 312 H ALA 40 H ALA 40 5.442 -20.299 1.542 313 HA ALA 40 HA ALA 40 4.139 -22.175 1.216 314 HB1 ALA 40 1HB ALA 40 3.231 -23.149 3.341 315 HB2 ALA 40 2HB ALA 40 4.930 -22.642 3.428 316 HB3 ALA 40 3HB ALA 40 3.662 -21.640 4.167 317 H GLY 41 H GLY 41 2.770 -21.027 -0.297 318 HA2 GLY 41 2HA GLY 41 0.751 -20.857 -1.242 319 HA3 GLY 41 1HA GLY 41 -0.009 -21.444 0.228 320 H VAL 42 H VAL 42 1.706 -18.891 1.282 321 HA VAL 42 HA VAL 42 -0.477 -16.933 0.809 322 HB VAL 42 HB VAL 42 1.078 -17.515 3.385 323 HG11 VAL 42 1HG1 VAL 42 -0.560 -15.991 4.465 324 HG12 VAL 42 2HG1 VAL 42 0.517 -15.188 3.325 325 HG13 VAL 42 3HG1 VAL 42 -1.160 -15.544 2.850 326 HG21 VAL 42 3HG2 VAL 42 -1.856 -18.044 2.773 327 HG22 VAL 42 1HG2 VAL 42 -0.599 -19.295 2.941 328 HG23 VAL 42 2HG2 VAL 42 -1.050 -18.309 4.326 329 H TYR 43 H TYR 43 0.132 -14.940 0.156 330 HA TYR 43 HA TYR 43 2.634 -13.820 0.851 331 HB2 TYR 43 1HB TYR 43 3.689 -13.572 -1.308 332 HB3 TYR 43 2HB TYR 43 3.560 -15.237 -0.860 333 HD1 TYR 43 1HD TYR 43 1.552 -16.636 -1.923 334 HD2 TYR 43 2HD TYR 43 3.090 -12.900 -3.471 335 HE1 TYR 43 1HE TYR 43 0.561 -17.127 -4.152 336 HE2 TYR 43 2HE TYR 43 2.162 -13.449 -5.716 337 HH TYR 43 HH TYR 43 -0.119 -15.153 -6.398 338 H LEU 44 H LEU 44 2.814 -11.691 -0.925 339 HA LEU 44 HA LEU 44 0.180 -10.383 -0.843 340 HB2 LEU 44 1HB LEU 44 2.394 -9.932 1.110 341 HB3 LEU 44 2HB LEU 44 1.716 -8.466 0.425 342 HG LEU 44 HG LEU 44 -0.012 -10.612 1.692 343 HD11 LEU 44 1HD1 LEU 44 -0.120 -9.206 3.682 344 HD12 LEU 44 2HD1 LEU 44 0.938 -8.011 2.961 345 HD13 LEU 44 3HD1 LEU 44 1.570 -9.618 3.357 346 HD21 LEU 44 3HD2 LEU 44 -1.254 -9.217 0.170 347 HD22 LEU 44 1HD2 LEU 44 -0.560 -7.745 0.874 348 HD23 LEU 44 2HD2 LEU 44 -1.670 -8.770 1.815 349 H ARG 45 H ARG 45 0.018 -9.574 -2.792 350 HA ARG 45 HA ARG 45 2.387 -8.301 -4.108 351 HB2 ARG 45 1HB ARG 45 -0.133 -9.529 -5.095 352 HB3 ARG 45 2HB ARG 45 0.131 -7.903 -5.738 353 HG2 ARG 45 1HG ARG 45 1.215 -9.267 -7.257 354 HG3 ARG 45 2HG ARG 45 2.450 -8.515 -6.326 355 HD2 ARG 45 1HD ARG 45 2.638 -10.613 -4.930 356 HD3 ARG 45 2HD ARG 45 1.512 -11.378 -6.071 357 HE ARG 45 HE ARG 45 4.317 -10.668 -6.489 358 HH11 ARG 45 1HH1 ARG 45 1.247 -11.241 -8.244 359 HH12 ARG 45 2HH1 ARG 45 2.064 -11.540 -9.730 360 HH21 ARG 45 1HH2 ARG 45 5.309 -10.879 -8.517 361 HH22 ARG 45 2HH2 ARG 45 4.387 -11.265 -9.929 362 H ALA 46 H ALA 46 2.798 -6.410 -3.217 363 HA ALA 46 HA ALA 46 0.667 -4.471 -2.491 364 HB1 ALA 46 1HB ALA 46 3.667 -4.718 -1.898 365 HB2 ALA 46 2HB ALA 46 2.709 -3.320 -1.466 366 HB3 ALA 46 3HB ALA 46 2.321 -4.888 -0.752 367 H TYR 47 H TYR 47 0.088 -3.883 -4.706 368 HA TYR 47 HA TYR 47 2.264 -3.112 -6.510 369 HB2 TYR 47 1HB TYR 47 0.189 -4.557 -7.189 370 HB3 TYR 47 2HB TYR 47 -0.624 -3.019 -7.321 371 HD1 TYR 47 2HD TYR 47 0.360 -1.220 -8.782 372 HD2 TYR 47 1HD TYR 47 1.872 -5.250 -8.843 373 HE1 TYR 47 2HE TYR 47 1.669 -0.667 -10.800 374 HE2 TYR 47 1HE TYR 47 3.150 -4.743 -10.911 375 HH TYR 47 HH TYR 47 3.098 -1.464 -12.404 376 H VAL 48 H VAL 48 2.983 -1.116 -6.336 377 HA VAL 48 HA VAL 48 1.399 1.166 -5.379 378 HB VAL 48 HB VAL 48 4.250 0.753 -6.381 379 HG11 VAL 48 1HG1 VAL 48 4.187 3.076 -4.828 380 HG12 VAL 48 2HG1 VAL 48 4.470 2.944 -6.561 381 HG13 VAL 48 3HG1 VAL 48 2.841 3.254 -5.922 382 HG21 VAL 48 3HG2 VAL 48 4.923 0.934 -4.040 383 HG22 VAL 48 1HG2 VAL 48 3.238 1.121 -3.540 384 HG23 VAL 48 2HG2 VAL 48 3.801 -0.401 -4.237 385 H MET 49 H MET 49 0.444 2.662 -6.846 386 HA MET 49 HA MET 49 1.242 2.473 -9.720 387 HB2 MET 49 1HB MET 49 -1.463 2.277 -8.498 388 HB3 MET 49 2HB MET 49 -1.301 3.301 -9.953 389 HG2 MET 49 1HG MET 49 -0.458 1.523 -11.265 390 HG3 MET 49 2HG MET 49 -0.201 0.489 -9.866 391 HE1 MET 49 3HE MET 49 -1.954 -1.272 -8.973 392 HE2 MET 49 1HE MET 49 -2.473 0.201 -8.136 393 HE3 MET 49 2HE MET 49 -3.676 -0.846 -8.916 394 HA PRO 50 HA PRO 50 2.068 6.591 -7.860 395 HB2 PRO 50 1HB PRO 50 4.272 7.174 -9.429 396 HB3 PRO 50 2HB PRO 50 4.343 6.218 -7.924 397 HG2 PRO 50 1HG PRO 50 4.183 5.234 -10.788 398 HG3 PRO 50 2HG PRO 50 5.298 4.690 -9.488 399 HD2 PRO 50 1HD PRO 50 3.047 3.294 -10.052 400 HD3 PRO 50 2HD PRO 50 3.565 3.525 -8.381 401 H ALA 51 H ALA 51 2.363 8.766 -9.011 402 HA ALA 51 HA ALA 51 0.569 8.951 -11.388 403 HB1 ALA 51 1HB ALA 51 1.176 10.904 -9.134 404 HB2 ALA 51 2HB ALA 51 0.119 11.235 -10.509 405 HB3 ALA 51 3HB ALA 51 -0.336 9.970 -9.344 406 H ALA 52 H ALA 52 1.368 9.977 -13.207 407 HA ALA 52 HA ALA 52 3.693 11.735 -13.101 408 HB1 ALA 52 1HB ALA 52 5.037 10.345 -14.651 409 HB2 ALA 52 2HB ALA 52 4.851 9.585 -13.063 410 HB3 ALA 52 3HB ALA 52 3.885 9.006 -14.448 411 H THR 53 H THR 53 2.142 13.238 -14.037 412 HA THR 53 HA THR 53 0.848 12.507 -16.522 413 HB THR 53 HB THR 53 -0.109 14.197 -15.030 414 HG1 THR 53 1HG THR 53 -0.464 14.160 -17.348 415 HG21 THR 53 3HG2 THR 53 1.864 15.419 -14.254 416 HG22 THR 53 1HG2 THR 53 0.717 16.516 -15.019 417 HG23 THR 53 2HG2 THR 53 2.178 16.017 -15.899 418 H ILE 54 H ILE 54 1.318 13.573 -18.614 419 HA ILE 54 HA ILE 54 4.239 13.623 -19.128 420 HB ILE 54 HB ILE 54 2.010 13.838 -21.156 421 HG12 ILE 54 1HG1 ILE 54 3.578 11.310 -20.452 422 HG13 ILE 54 2HG1 ILE 54 1.926 11.619 -19.907 423 HG21 ILE 54 1HG2 ILE 54 4.235 14.718 -21.854 424 HG22 ILE 54 2HG2 ILE 54 4.978 13.161 -21.443 425 HG23 ILE 54 3HG2 ILE 54 3.805 13.294 -22.777 426 HD11 ILE 54 3HD1 ILE 54 2.776 11.317 -22.807 427 HD12 ILE 54 1HD1 ILE 54 1.825 10.200 -21.829 428 HD13 ILE 54 2HD1 ILE 54 1.146 11.782 -22.249 429 H SER 55 H SER 55 5.214 15.414 -19.445 430 HA SER 55 HA SER 55 4.120 17.706 -20.698 431 HB2 SER 55 1HB SER 55 3.573 18.118 -18.233 432 HB3 SER 55 2HB SER 55 5.325 18.162 -17.941 433 HG SER 55 HG SER 55 4.093 20.189 -18.399 434 H ARG 56 H ARG 56 6.112 19.293 -21.030 435 HA ARG 56 HA ARG 56 8.477 17.534 -21.463 436 HB2 ARG 56 1HB ARG 56 7.154 19.516 -23.368 437 HB3 ARG 56 2HB ARG 56 8.682 18.717 -23.709 438 HG2 ARG 56 1HG ARG 56 7.511 16.489 -23.497 439 HG3 ARG 56 2HG ARG 56 5.977 17.352 -23.385 440 HD2 ARG 56 1HD ARG 56 7.952 17.623 -25.695 441 HD3 ARG 56 2HD ARG 56 6.547 16.547 -25.690 442 HE ARG 56 HE ARG 56 5.296 18.790 -25.120 443 HH11 ARG 56 1HH1 ARG 56 8.040 18.794 -27.312 444 HH12 ARG 56 2HH1 ARG 56 7.304 19.801 -28.493 445 HH21 ARG 56 1HH2 ARG 56 4.314 20.188 -26.632 446 HH22 ARG 56 2HH2 ARG 56 5.089 20.538 -28.144 447 H ASP 57 H ASP 57 7.695 20.012 -19.763 448 HA ASP 57 HA ASP 57 10.261 21.362 -19.559 449 HB2 ASP 57 1HB ASP 57 8.440 23.376 -19.751 450 HB3 ASP 57 2HB ASP 57 9.531 22.939 -21.077 451 H ALA 58 H ALA 58 10.208 22.580 -17.546 452 HA ALA 58 HA ALA 58 9.824 22.848 -15.397 453 HB1 ALA 58 1HB ALA 58 6.875 22.837 -16.009 454 HB2 ALA 58 2HB ALA 58 7.690 23.616 -14.645 455 HB3 ALA 58 3HB ALA 58 7.943 24.238 -16.288 456 H ALA 59 H ALA 59 9.505 20.100 -16.636 457 HA ALA 59 HA ALA 59 9.236 17.949 -16.187 458 HB1 ALA 59 1HB ALA 59 10.488 18.471 -14.073 459 HB2 ALA 59 2HB ALA 59 8.926 18.555 -13.230 460 HB3 ALA 59 3HB ALA 59 9.474 17.058 -14.004 461 H GLY 60 H GLY 60 7.581 16.338 -15.013 462 HA2 GLY 60 2HA GLY 60 4.850 17.250 -15.773 463 HA3 GLY 60 1HA GLY 60 5.434 15.570 -15.760 464 H ASP 61 H ASP 61 6.122 18.081 -13.248 465 HA ASP 61 HA ASP 61 4.157 16.959 -11.489 466 HB2 ASP 61 1HB ASP 61 5.449 16.036 -9.880 467 HB3 ASP 61 2HB ASP 61 6.358 15.536 -11.289 468 H HIS 62 H HIS 62 3.360 18.541 -10.392 469 HA HIS 62 HA HIS 62 5.080 20.287 -8.976 470 HB2 HIS 62 1HB HIS 62 4.291 21.441 -11.376 471 HB3 HIS 62 2HB HIS 62 3.026 22.007 -10.284 472 HD1 HIS 62 1HD HIS 62 6.865 21.971 -10.667 473 HD2 HIS 62 2HD HIS 62 3.809 23.675 -8.317 474 HE1 HIS 62 1HE HIS 62 7.973 23.860 -9.317 475 H ARG 63 H ARG 63 1.897 19.653 -9.968 476 HA ARG 63 HA ARG 63 0.869 19.681 -7.195 477 HB2 ARG 63 1HB ARG 63 0.842 21.981 -8.430 478 HB3 ARG 63 2HB ARG 63 -0.413 21.276 -9.454 479 HG2 ARG 63 1HG ARG 63 -1.546 20.677 -7.192 480 HG3 ARG 63 2HG ARG 63 -0.376 21.735 -6.424 481 HD2 ARG 63 1HD ARG 63 -1.178 23.622 -7.855 482 HD3 ARG 63 2HD ARG 63 -2.420 22.561 -8.521 483 HE ARG 63 HE ARG 63 -2.213 23.354 -5.630 484 HH11 ARG 63 1HH1 ARG 63 -4.342 22.640 -8.401 485 HH12 ARG 63 2HH1 ARG 63 -5.793 22.826 -7.479 486 HH21 ARG 63 1HH2 ARG 63 -4.077 23.679 -4.487 487 HH22 ARG 63 2HH2 ARG 63 -5.638 23.300 -5.175 488 H GLN 64 H GLN 64 1.305 17.516 -9.223 489 HA GLN 64 HA GLN 64 -1.473 16.517 -9.540 490 HB2 GLN 64 1HB GLN 64 0.684 16.922 -11.600 491 HB3 GLN 64 2HB GLN 64 -0.303 15.508 -11.790 492 HG2 GLN 64 1HG GLN 64 -1.480 18.307 -11.544 493 HG3 GLN 64 2HG GLN 64 -1.069 17.511 -13.073 494 HE21 GLN 64 1HE2 GLN 64 -3.739 18.192 -11.397 495 HE22 GLN 64 2HE2 GLN 64 -4.692 16.753 -11.668 496 H TYR 65 H TYR 65 0.894 15.908 -7.706 497 HA TYR 65 HA TYR 65 1.530 13.129 -8.489 498 HB2 TYR 65 1HB TYR 65 2.942 15.216 -7.057 499 HB3 TYR 65 2HB TYR 65 2.755 13.829 -6.007 500 HD1 TYR 65 1HD TYR 65 3.521 14.450 -9.660 501 HD2 TYR 65 2HD TYR 65 4.582 12.338 -6.044 502 HE1 TYR 65 1HE TYR 65 5.401 13.315 -10.855 503 HE2 TYR 65 2HE TYR 65 6.399 11.217 -7.216 504 HH TYR 65 HH TYR 65 7.535 10.916 -9.276 505 H ARG 66 H ARG 66 0.811 11.369 -7.394 506 HA ARG 66 HA ARG 66 -0.556 11.193 -4.979 507 HB2 ARG 66 1HB ARG 66 -2.922 10.898 -5.866 508 HB3 ARG 66 2HB ARG 66 -2.322 12.524 -5.874 509 HG2 ARG 66 1HG ARG 66 -3.493 12.418 -7.770 510 HG3 ARG 66 2HG ARG 66 -1.846 12.240 -8.370 511 HD2 ARG 66 1HD ARG 66 -3.107 10.711 -9.613 512 HD3 ARG 66 2HD ARG 66 -2.339 9.680 -8.406 513 HE ARG 66 HE ARG 66 -4.784 10.478 -7.304 514 HH11 ARG 66 1HH1 ARG 66 -3.741 8.560 -10.110 515 HH12 ARG 66 2HH1 ARG 66 -5.304 7.990 -10.484 516 HH21 ARG 66 1HH2 ARG 66 -6.873 9.641 -7.719 517 HH22 ARG 66 2HH2 ARG 66 -7.162 8.612 -9.065 518 H GLY 67 H GLY 67 -2.244 8.899 -5.592 519 HA2 GLY 67 2HA GLY 67 -1.312 7.512 -7.847 520 HA3 GLY 67 1HA GLY 67 -0.444 6.887 -6.447 521 H VAL 68 H VAL 68 -1.598 4.902 -6.907 522 HA VAL 68 HA VAL 68 -3.710 4.759 -4.961 523 HB VAL 68 HB VAL 68 -4.979 4.766 -7.101 524 HG11 VAL 68 1HG1 VAL 68 -3.242 3.699 -8.542 525 HG12 VAL 68 2HG1 VAL 68 -3.617 2.145 -7.768 526 HG13 VAL 68 3HG1 VAL 68 -4.849 2.994 -8.702 527 HG21 VAL 68 3HG2 VAL 68 -5.105 2.049 -5.706 528 HG22 VAL 68 1HG2 VAL 68 -6.010 3.541 -5.295 529 HG23 VAL 68 2HG2 VAL 68 -6.304 2.735 -6.826 530 H PHE 69 H PHE 69 -3.657 2.534 -3.996 531 HA PHE 69 HA PHE 69 -1.202 0.997 -4.637 532 HB2 PHE 69 1HB PHE 69 -0.706 2.508 -2.758 533 HB3 PHE 69 2HB PHE 69 -2.134 1.952 -1.916 534 HD1 PHE 69 2HD PHE 69 0.834 0.317 -3.546 535 HD2 PHE 69 1HD PHE 69 -1.690 0.624 -0.061 536 HE1 PHE 69 2HE PHE 69 2.255 -1.324 -2.382 537 HE2 PHE 69 1HE PHE 69 -0.260 -0.994 1.100 538 HZ PHE 69 HZ PHE 69 1.710 -1.974 -0.012 539 H GLN 70 H GLN 70 -1.731 -1.075 -4.881 540 HA GLN 70 HA GLN 70 -4.500 -1.966 -4.276 541 HB2 GLN 70 1HB GLN 70 -4.167 -1.631 -6.673 542 HB3 GLN 70 2HB GLN 70 -2.634 -2.443 -6.639 543 HG2 GLN 70 1HG GLN 70 -4.584 -3.716 -7.660 544 HG3 GLN 70 2HG GLN 70 -3.553 -4.570 -6.531 545 HE21 GLN 70 1HE2 GLN 70 -6.569 -2.618 -6.483 546 HE22 GLN 70 2HE2 GLN 70 -7.387 -3.596 -5.262 547 H VAL 71 H VAL 71 -4.520 -3.768 -2.851 548 HA VAL 71 HA VAL 71 -1.933 -5.236 -2.601 549 HB VAL 71 HB VAL 71 -3.716 -4.374 -0.334 550 HG11 VAL 71 1HG1 VAL 71 -1.015 -5.782 -0.366 551 HG12 VAL 71 2HG1 VAL 71 -1.921 -5.288 1.074 552 HG13 VAL 71 3HG1 VAL 71 -2.559 -6.560 0.032 553 HG21 VAL 71 3HG2 VAL 71 -2.519 -2.424 -1.136 554 HG22 VAL 71 1HG2 VAL 71 -1.688 -3.012 0.288 555 HG23 VAL 71 2HG2 VAL 71 -1.012 -3.353 -1.308 556 H ASN 72 H ASN 72 -2.115 -7.288 -2.972 557 HA ASN 72 HA ASN 72 -4.774 -8.647 -2.765 558 HB2 ASN 72 1HB ASN 72 -2.545 -8.923 -4.811 559 HB3 ASN 72 2HB ASN 72 -3.577 -10.292 -4.423 560 HD21 ASN 72 1HD2 ASN 72 -3.329 -8.326 -6.909 561 HD22 ASN 72 2HD2 ASN 72 -4.995 -7.837 -7.163 562 H VAL 73 H VAL 73 -4.650 -9.266 -0.696 563 HA VAL 73 HA VAL 73 -2.504 -11.033 0.211 564 HB VAL 73 HB VAL 73 -3.729 -10.026 1.910 565 HG11 VAL 73 1HG1 VAL 73 -5.798 -9.290 1.296 566 HG12 VAL 73 2HG1 VAL 73 -6.306 -10.851 0.594 567 HG13 VAL 73 3HG1 VAL 73 -6.199 -10.639 2.351 568 HG21 VAL 73 3HG2 VAL 73 -3.130 -12.489 2.138 569 HG22 VAL 73 1HG2 VAL 73 -4.463 -11.987 3.196 570 HG23 VAL 73 2HG2 VAL 73 -4.804 -12.887 1.711 571 H VAL 74 H VAL 74 -2.185 -12.892 -0.670 572 HA VAL 74 HA VAL 74 -4.483 -14.350 -1.881 573 HB VAL 74 HB VAL 74 -3.060 -13.704 -3.627 574 HG11 VAL 74 1HG1 VAL 74 -0.696 -14.786 -2.088 575 HG12 VAL 74 2HG1 VAL 74 -0.682 -14.213 -3.770 576 HG13 VAL 74 3HG1 VAL 74 -1.018 -13.078 -2.474 577 HG21 VAL 74 3HG2 VAL 74 -2.460 -16.611 -2.963 578 HG22 VAL 74 1HG2 VAL 74 -3.912 -15.973 -3.779 579 HG23 VAL 74 2HG2 VAL 74 -2.330 -15.852 -4.559 580 H MET 75 H MET 75 -4.884 -16.368 -1.086 581 HA MET 75 HA MET 75 -3.091 -17.563 0.895 582 HB2 MET 75 1HB MET 75 -4.650 -17.493 2.679 583 HB3 MET 75 2HB MET 75 -4.719 -15.876 1.994 584 HG2 MET 75 1HG MET 75 -6.742 -16.941 0.584 585 HG3 MET 75 2HG MET 75 -6.758 -18.077 1.932 586 HE1 MET 75 3HE MET 75 -7.541 -13.557 1.911 587 HE2 MET 75 1HE MET 75 -6.340 -14.452 0.967 588 HE3 MET 75 2HE MET 75 -8.063 -14.653 0.609 589 HA PRO 76 HA PRO 76 -4.785 -21.048 -1.248 590 HB2 PRO 76 1HB PRO 76 -4.299 -23.151 0.397 591 HB3 PRO 76 2HB PRO 76 -2.954 -22.157 -0.252 592 HG2 PRO 76 1HG PRO 76 -4.328 -21.866 2.441 593 HG3 PRO 76 2HG PRO 76 -2.574 -22.023 2.122 594 HD2 PRO 76 1HD PRO 76 -3.768 -19.598 2.426 595 HD3 PRO 76 2HD PRO 76 -2.430 -19.838 1.270 596 H ILE 77 H ILE 77 -6.474 -22.719 -1.173 597 HA ILE 77 HA ILE 77 -8.620 -22.158 0.818 598 HB ILE 77 HB ILE 77 -8.960 -23.478 -1.877 599 HG12 ILE 77 1HG1 ILE 77 -9.185 -20.571 -1.060 600 HG13 ILE 77 2HG1 ILE 77 -8.123 -21.217 -2.245 601 HG21 ILE 77 1HG2 ILE 77 -11.305 -23.056 -1.476 602 HG22 ILE 77 2HG2 ILE 77 -10.716 -23.825 -0.023 603 HG23 ILE 77 3HG2 ILE 77 -10.968 -22.079 -0.032 604 HD11 ILE 77 3HD1 ILE 77 -9.917 -20.018 -3.279 605 HD12 ILE 77 1HD1 ILE 77 -10.006 -21.731 -3.736 606 HD13 ILE 77 2HD1 ILE 77 -11.129 -21.033 -2.526 607 H GLY 78 H GLY 78 -7.027 -23.441 2.200 608 HA2 GLY 78 2HA GLY 78 -8.003 -26.272 2.175 609 HA3 GLY 78 1HA GLY 78 -6.421 -25.752 2.827 610 H ASP 79 H ASP 79 -6.514 -25.605 4.938 611 HA ASP 79 HA ASP 79 -9.051 -25.178 6.365 612 HB2 ASP 79 1HB ASP 79 -7.641 -27.102 6.897 613 HB3 ASP 79 2HB ASP 79 -6.238 -25.991 7.161 614 H GLY 80 H GLY 80 -6.733 -23.247 5.309 615 HA2 GLY 80 2HA GLY 80 -7.022 -21.152 7.437 616 HA3 GLY 80 1HA GLY 80 -5.598 -21.338 6.476 617 H SER 81 H SER 81 -8.778 -21.641 4.860 618 HA SER 81 HA SER 81 -8.384 -19.201 3.340 619 HB2 SER 81 1HB SER 81 -10.788 -19.864 2.634 620 HB3 SER 81 2HB SER 81 -9.455 -20.922 2.176 621 HG SER 81 HG SER 81 -11.282 -22.038 3.051 622 H ARG 82 H ARG 82 -10.662 -17.845 3.391 623 HA ARG 82 HA ARG 82 -11.784 -16.221 4.362 624 HB2 ARG 82 1HB ARG 82 -11.801 -17.745 6.934 625 HB3 ARG 82 2HB ARG 82 -12.895 -16.481 6.396 626 HG2 ARG 82 1HG ARG 82 -14.182 -18.352 6.242 627 HG3 ARG 82 2HG ARG 82 -13.674 -18.143 4.570 628 HD2 ARG 82 1HD ARG 82 -12.276 -20.042 4.651 629 HD3 ARG 82 2HD ARG 82 -12.043 -19.908 6.399 630 HE ARG 82 HE ARG 82 -14.698 -20.444 6.201 631 HH11 ARG 82 1HH1 ARG 82 -11.769 -22.184 5.110 632 HH12 ARG 82 2HH1 ARG 82 -12.414 -23.738 5.512 633 HH21 ARG 82 1HH2 ARG 82 -15.568 -22.520 6.549 634 HH22 ARG 82 2HH2 ARG 82 -14.603 -23.928 6.302 635 H SER 83 H SER 83 -8.675 -16.949 5.525 636 HA SER 83 HA SER 83 -8.210 -15.130 7.543 637 HB2 SER 83 1HB SER 83 -6.763 -16.962 6.433 638 HB3 SER 83 2HB SER 83 -6.249 -15.703 5.301 639 HG SER 83 HG SER 83 -4.879 -16.005 7.044 640 H ALA 84 H ALA 84 -9.000 -14.405 4.267 641 HA ALA 84 HA ALA 84 -8.116 -11.865 3.676 642 HB1 ALA 84 1HB ALA 84 -10.912 -13.091 3.519 643 HB2 ALA 84 2HB ALA 84 -10.492 -11.564 2.759 644 HB3 ALA 84 3HB ALA 84 -9.693 -13.059 2.224 645 H GLU 85 H GLU 85 -10.635 -12.771 6.065 646 HA GLU 85 HA GLU 85 -11.580 -10.123 6.506 647 HB2 GLU 85 1HB GLU 85 -11.752 -12.609 8.234 648 HB3 GLU 85 2HB GLU 85 -12.773 -11.176 8.378 649 HG2 GLU 85 1HG GLU 85 -13.634 -11.602 6.093 650 HG3 GLU 85 2HG GLU 85 -12.644 -13.023 5.940 651 H GLN 86 H GLN 86 -9.564 -12.308 8.501 652 HA GLN 86 HA GLN 86 -8.883 -10.631 10.580 653 HB2 GLN 86 1HB GLN 86 -7.915 -13.136 9.278 654 HB3 GLN 86 2HB GLN 86 -6.586 -12.228 10.003 655 HG2 GLN 86 1HG GLN 86 -9.171 -12.897 11.443 656 HG3 GLN 86 2HG GLN 86 -7.727 -13.852 11.497 657 HE21 GLN 86 1HE2 GLN 86 -5.566 -12.173 12.009 658 HE22 GLN 86 2HE2 GLN 86 -5.948 -11.276 13.479 659 H VAL 87 H VAL 87 -7.205 -11.073 7.464 660 HA VAL 87 HA VAL 87 -5.147 -9.142 8.054 661 HB VAL 87 HB VAL 87 -6.231 -10.518 5.535 662 HG11 VAL 87 1HG1 VAL 87 -5.133 -8.369 4.850 663 HG12 VAL 87 2HG1 VAL 87 -3.622 -8.951 5.596 664 HG13 VAL 87 3HG1 VAL 87 -4.388 -9.806 4.218 665 HG21 VAL 87 3HG2 VAL 87 -3.629 -10.881 7.086 666 HG22 VAL 87 1HG2 VAL 87 -5.049 -11.941 7.222 667 HG23 VAL 87 2HG2 VAL 87 -4.173 -11.848 5.690 668 H ALA 88 H ALA 88 -8.358 -8.883 6.301 669 HA ALA 88 HA ALA 88 -7.879 -6.239 5.483 670 HB1 ALA 88 1HB ALA 88 -10.510 -7.677 6.028 671 HB2 ALA 88 2HB ALA 88 -10.348 -6.109 5.218 672 HB3 ALA 88 3HB ALA 88 -9.658 -7.542 4.467 673 H ALA 89 H ALA 89 -8.885 -7.472 8.599 674 HA ALA 89 HA ALA 89 -9.694 -4.878 9.681 675 HB1 ALA 89 1HB ALA 89 -10.462 -6.985 10.721 676 HB2 ALA 89 2HB ALA 89 -8.780 -7.431 11.089 677 HB3 ALA 89 3HB ALA 89 -9.513 -6.011 11.862 678 H GLU 90 H GLU 90 -6.700 -6.879 9.776 679 HA GLU 90 HA GLU 90 -5.200 -5.067 11.378 680 HB2 GLU 90 1HB GLU 90 -4.307 -7.153 9.326 681 HB3 GLU 90 2HB GLU 90 -3.206 -6.191 10.302 682 HG2 GLU 90 1HG GLU 90 -4.927 -7.141 12.235 683 HG3 GLU 90 2HG GLU 90 -4.955 -8.457 11.101 684 H LEU 91 H LEU 91 -5.088 -5.488 7.798 685 HA LEU 91 HA LEU 91 -3.417 -3.397 7.217 686 HB2 LEU 91 1HB LEU 91 -5.600 -4.859 5.776 687 HB3 LEU 91 2HB LEU 91 -5.045 -3.404 5.030 688 HG LEU 91 HG LEU 91 -3.877 -5.298 4.155 689 HD11 LEU 91 1HD1 LEU 91 -2.580 -3.232 4.200 690 HD12 LEU 91 2HD1 LEU 91 -1.569 -4.690 4.349 691 HD13 LEU 91 3HD1 LEU 91 -1.882 -3.689 5.777 692 HD21 LEU 91 3HD2 LEU 91 -2.672 -5.771 6.869 693 HD22 LEU 91 1HD2 LEU 91 -2.391 -6.690 5.354 694 HD23 LEU 91 2HD2 LEU 91 -3.963 -6.741 6.142 695 H ASP 92 H ASP 92 -6.968 -3.231 7.789 696 HA ASP 92 HA ASP 92 -7.336 -0.479 7.102 697 HB2 ASP 92 1HB ASP 92 -9.293 -1.772 7.216 698 HB3 ASP 92 2HB ASP 92 -8.886 -2.436 8.800 699 H ALA 93 H ALA 93 -6.815 -2.070 10.299 700 HA ALA 93 HA ALA 93 -6.629 0.336 11.786 701 HB1 ALA 93 1HB ALA 93 -5.259 -2.348 12.280 702 HB2 ALA 93 2HB ALA 93 -5.517 -1.063 13.482 703 HB3 ALA 93 3HB ALA 93 -6.906 -1.916 12.782 704 H LEU 94 H LEU 94 -4.211 -1.439 9.909 705 HA LEU 94 HA LEU 94 -1.978 0.048 10.847 706 HB2 LEU 94 1HB LEU 94 -1.920 -2.243 9.879 707 HB3 LEU 94 2HB LEU 94 -2.136 -1.560 8.280 708 HG LEU 94 HG LEU 94 0.186 -2.246 9.077 709 HD11 LEU 94 1HD1 LEU 94 -0.012 0.538 7.952 710 HD12 LEU 94 2HD1 LEU 94 -0.050 -1.012 7.059 711 HD13 LEU 94 3HD1 LEU 94 1.412 -0.546 7.936 712 HD21 LEU 94 3HD2 LEU 94 0.210 0.417 10.530 713 HD22 LEU 94 1HD2 LEU 94 1.557 -0.713 10.357 714 HD23 LEU 94 2HD2 LEU 94 0.143 -1.196 11.307 715 H PHE 95 H PHE 95 -4.150 0.452 8.023 716 HA PHE 95 HA PHE 95 -2.749 2.978 7.345 717 HB2 PHE 95 1HB PHE 95 -4.310 1.086 5.597 718 HB3 PHE 95 2HB PHE 95 -3.924 2.700 5.106 719 HD1 PHE 95 1HD PHE 95 -2.430 -0.596 5.930 720 HD2 PHE 95 2HD PHE 95 -1.692 3.312 4.247 721 HE1 PHE 95 1HE PHE 95 -0.580 -1.510 4.595 722 HE2 PHE 95 2HE PHE 95 0.101 2.360 2.859 723 HZ PHE 95 HZ PHE 95 0.667 -0.050 3.004 724 HA PRO 96 HA PRO 96 -6.892 4.375 8.902 725 HB2 PRO 96 1HB PRO 96 -6.038 6.521 10.346 726 HB3 PRO 96 2HB PRO 96 -5.921 4.844 10.983 727 HG2 PRO 96 1HG PRO 96 -3.738 6.428 9.568 728 HG3 PRO 96 2HG PRO 96 -3.635 5.601 11.151 729 HD2 PRO 96 1HD PRO 96 -2.790 4.379 8.927 730 HD3 PRO 96 2HD PRO 96 -3.699 3.465 10.159 731 H VAL 97 H VAL 97 -8.043 6.333 8.294 732 HA VAL 97 HA VAL 97 -7.685 7.236 5.744 733 HB VAL 97 HB VAL 97 -9.719 7.074 7.196 734 HG11 VAL 97 1HG1 VAL 97 -8.902 8.428 9.118 735 HG12 VAL 97 2HG1 VAL 97 -8.913 9.884 8.089 736 HG13 VAL 97 3HG1 VAL 97 -10.426 9.043 8.465 737 HG21 VAL 97 3HG2 VAL 97 -9.683 8.100 4.890 738 HG22 VAL 97 1HG2 VAL 97 -10.991 8.628 5.953 739 HG23 VAL 97 2HG2 VAL 97 -9.598 9.686 5.679 740 H ASN 98 H ASN 98 -5.715 8.329 8.093 741 HA ASN 98 HA ASN 98 -5.518 11.112 6.998 742 HB2 ASN 98 1HB ASN 98 -4.179 10.212 9.576 743 HB3 ASN 98 2HB ASN 98 -4.643 11.839 9.057 744 HD21 ASN 98 1HD2 ASN 98 -5.726 8.916 10.610 745 HD22 ASN 98 2HD2 ASN 98 -7.330 9.446 11.027 746 H LEU 99 H LEU 99 -3.716 8.193 7.776 747 HA LEU 99 HA LEU 99 -1.636 7.448 7.319 748 HB2 LEU 99 1HB LEU 99 -3.438 7.268 5.381 749 HB3 LEU 99 2HB LEU 99 -2.215 8.158 4.484 750 HG LEU 99 HG LEU 99 -0.609 6.198 5.311 751 HD11 LEU 99 1HD1 LEU 99 -2.419 5.514 6.981 752 HD12 LEU 99 2HD1 LEU 99 -1.540 4.282 6.104 753 HD13 LEU 99 3HD1 LEU 99 -3.206 4.767 5.594 754 HD21 LEU 99 3HD2 LEU 99 -2.523 5.187 3.294 755 HD22 LEU 99 1HD2 LEU 99 -0.771 5.071 3.400 756 HD23 LEU 99 2HD2 LEU 99 -1.492 6.604 2.933 757 H VAL 100 H VAL 100 -1.116 10.077 8.208 758 HA VAL 100 HA VAL 100 0.816 11.289 6.501 759 HB VAL 100 HB VAL 100 -0.044 12.466 8.393 760 HG11 VAL 100 1HG1 VAL 100 0.495 11.998 10.710 761 HG12 VAL 100 2HG1 VAL 100 -0.400 10.636 10.026 762 HG13 VAL 100 3HG1 VAL 100 1.355 10.520 10.263 763 HG21 VAL 100 3HG2 VAL 100 2.166 13.077 7.584 764 HG22 VAL 100 1HG2 VAL 100 1.986 13.384 9.309 765 HG23 VAL 100 2HG2 VAL 100 2.921 11.975 8.763 766 H MET 101 H MET 101 2.336 10.089 5.563 767 HA MET 101 HA MET 101 4.130 8.531 7.362 768 HB2 MET 101 1HB MET 101 3.749 7.941 4.400 769 HB3 MET 101 2HB MET 101 4.705 7.041 5.598 770 HG2 MET 101 1HG MET 101 2.576 6.582 6.860 771 HG3 MET 101 2HG MET 101 1.703 7.373 5.532 772 HE1 MET 101 3HE MET 101 1.055 6.584 3.486 773 HE2 MET 101 1HE MET 101 2.733 6.440 2.910 774 HE3 MET 101 2HE MET 101 1.595 5.098 2.651 775 H GLN 102 H GLN 102 5.074 10.462 7.889 776 HA GLN 102 HA GLN 102 5.975 12.422 5.971 777 HB2 GLN 102 1HB GLN 102 7.402 13.204 7.854 778 HB3 GLN 102 2HB GLN 102 5.678 13.177 8.218 779 HG2 GLN 102 1HG GLN 102 5.888 11.577 9.846 780 HG3 GLN 102 2HG GLN 102 7.197 10.739 9.029 781 HE21 GLN 102 1HE2 GLN 102 9.055 10.831 10.088 782 HE22 GLN 102 2HE2 GLN 102 9.629 12.106 11.135 783 H SER 103 H SER 103 8.133 12.741 5.240 784 HA SER 103 HA SER 103 10.179 10.814 5.853 785 HB2 SER 103 1HB SER 103 8.733 9.846 3.964 786 HB3 SER 103 2HB SER 103 9.279 11.194 2.954 787 HG SER 103 HG SER 103 10.441 9.253 2.704 788 H GLY 104 H GLY 104 12.125 11.607 4.394 789 HA2 GLY 104 2HA GLY 104 12.803 14.127 5.219 790 HA3 GLY 104 1HA GLY 104 13.601 13.335 3.851 791 H GLY 105 H GLY 105 11.191 13.374 2.022 792 HA2 GLY 105 2HA GLY 105 11.548 16.028 1.036 793 HA3 GLY 105 1HA GLY 105 10.423 14.784 0.448 794 H LEU 106 H LEU 106 8.734 14.328 2.531 795 HA LEU 106 HA LEU 106 7.263 16.382 3.613 796 HB2 LEU 106 1HB LEU 106 5.603 16.822 1.908 797 HB3 LEU 106 2HB LEU 106 7.149 17.451 1.431 798 HG LEU 106 HG LEU 106 5.891 14.878 0.350 799 HD11 LEU 106 1HD1 LEU 106 5.501 16.147 -1.676 800 HD12 LEU 106 2HD1 LEU 106 6.285 17.587 -0.985 801 HD13 LEU 106 3HD1 LEU 106 4.751 17.001 -0.332 802 HD21 LEU 106 3HD2 LEU 106 8.254 14.612 0.041 803 HD22 LEU 106 1HD2 LEU 106 8.471 16.338 -0.396 804 HD23 LEU 106 2HD2 LEU 106 7.662 15.247 -1.496 805 H ALA 107 H ALA 107 4.697 15.444 3.121 806 HA ALA 107 HA ALA 107 4.904 12.594 3.979 807 HB1 ALA 107 1HB ALA 107 4.250 14.149 5.793 808 HB2 ALA 107 2HB ALA 107 2.892 14.734 4.808 809 HB3 ALA 107 3HB ALA 107 2.922 13.050 5.374 810 H VAL 108 H VAL 108 2.671 11.410 3.690 811 HA VAL 108 HA VAL 108 1.367 12.218 1.142 812 HB VAL 108 HB VAL 108 2.880 10.063 1.275 813 HG11 VAL 108 1HG1 VAL 108 1.903 8.060 1.859 814 HG12 VAL 108 2HG1 VAL 108 1.965 9.100 3.299 815 HG13 VAL 108 3HG1 VAL 108 0.419 8.830 2.458 816 HG21 VAL 108 3HG2 VAL 108 0.083 9.850 0.123 817 HG22 VAL 108 1HG2 VAL 108 1.456 10.671 -0.653 818 HG23 VAL 108 2HG2 VAL 108 1.514 8.927 -0.366 819 H ARG 109 H ARG 109 -1.025 11.364 1.131 820 HA ARG 109 HA ARG 109 -1.953 10.563 3.782 821 HB2 ARG 109 1HB ARG 109 -3.532 12.168 4.121 822 HB3 ARG 109 2HB ARG 109 -2.351 13.166 3.260 823 HG2 ARG 109 1HG ARG 109 -3.690 12.706 1.138 824 HG3 ARG 109 2HG ARG 109 -4.885 11.887 2.159 825 HD2 ARG 109 1HD ARG 109 -5.821 13.928 2.055 826 HD3 ARG 109 2HD ARG 109 -4.904 14.072 3.559 827 HE ARG 109 HE ARG 109 -3.860 14.945 0.867 828 HH11 ARG 109 1HH1 ARG 109 -4.514 15.807 4.295 829 HH12 ARG 109 2HH1 ARG 109 -4.038 17.438 4.139 830 HH21 ARG 109 1HH2 ARG 109 -3.262 17.147 0.653 831 HH22 ARG 109 2HH2 ARG 109 -3.439 18.275 1.957 832 H VAL 110 H VAL 110 -3.509 8.946 3.569 833 HA VAL 110 HA VAL 110 -3.836 7.593 1.174 834 HB VAL 110 HB VAL 110 -3.942 6.702 3.406 835 HG11 VAL 110 1HG1 VAL 110 -5.261 8.374 4.531 836 HG12 VAL 110 2HG1 VAL 110 -6.703 7.892 3.604 837 HG13 VAL 110 3HG1 VAL 110 -5.932 6.740 4.725 838 HG21 VAL 110 3HG2 VAL 110 -5.584 4.985 3.110 839 HG22 VAL 110 1HG2 VAL 110 -6.414 5.947 1.867 840 HG23 VAL 110 2HG2 VAL 110 -4.756 5.369 1.585 841 H ARG 111 H ARG 111 -5.738 10.294 2.244 842 HA ARG 111 HA ARG 111 -7.220 11.583 1.320 843 HB2 ARG 111 1HB ARG 111 -5.631 11.046 -0.640 844 HB3 ARG 111 2HB ARG 111 -6.904 9.997 -1.238 845 HG2 ARG 111 1HG ARG 111 -6.878 12.119 -2.318 846 HG3 ARG 111 2HG ARG 111 -8.421 11.903 -1.448 847 HD2 ARG 111 1HD ARG 111 -7.798 13.479 0.232 848 HD3 ARG 111 2HD ARG 111 -6.079 13.386 -0.234 849 HE ARG 111 HE ARG 111 -7.592 14.331 -2.447 850 HH11 ARG 111 1HH1 ARG 111 -6.826 15.528 0.789 851 HH12 ARG 111 2HH1 ARG 111 -6.486 17.150 0.288 852 HH21 ARG 111 1HH2 ARG 111 -7.189 16.481 -3.120 853 HH22 ARG 111 2HH2 ARG 111 -6.729 17.712 -1.980 854 H THR 112 H THR 112 -7.958 8.151 0.962 855 HA THR 112 HA THR 112 -10.789 8.761 1.559 856 HB THR 112 HB THR 112 -11.190 6.669 0.105 857 HG1 THR 112 1HG THR 112 -9.514 5.845 -0.775 858 HG21 THR 112 3HG2 THR 112 -10.203 9.171 -1.327 859 HG22 THR 112 1HG2 THR 112 -11.819 8.995 -0.586 860 HG23 THR 112 2HG2 THR 112 -11.353 7.971 -1.963 861 HA PRO 113 HA PRO 113 -10.011 5.591 4.616 862 HB2 PRO 113 1HB PRO 113 -12.379 4.260 4.824 863 HB3 PRO 113 2HB PRO 113 -12.175 5.950 5.398 864 HG2 PRO 113 1HG PRO 113 -13.297 5.015 2.743 865 HG3 PRO 113 2HG PRO 113 -14.021 6.202 3.887 866 HD2 PRO 113 1HD PRO 113 -12.573 6.981 1.733 867 HD3 PRO 113 2HD PRO 113 -12.446 7.851 3.292 868 H ILE 114 H ILE 114 -9.841 3.214 4.837 869 HA ILE 114 HA ILE 114 -8.942 1.861 2.500 870 HB ILE 114 HB ILE 114 -9.654 1.126 5.358 871 HG12 ILE 114 1HG1 ILE 114 -7.536 2.386 4.689 872 HG13 ILE 114 2HG1 ILE 114 -7.314 0.964 5.671 873 HG21 ILE 114 1HG2 ILE 114 -8.628 -1.154 4.985 874 HG22 ILE 114 2HG2 ILE 114 -10.267 -0.919 4.391 875 HG23 ILE 114 3HG2 ILE 114 -8.906 -0.924 3.242 876 HD11 ILE 114 3HD1 ILE 114 -5.681 1.155 3.783 877 HD12 ILE 114 1HD1 ILE 114 -6.615 -0.363 3.792 878 HD13 ILE 114 2HD1 ILE 114 -7.022 0.940 2.647 879 H SER 115 H SER 115 -9.968 0.466 1.023 880 HA SER 115 HA SER 115 -12.870 0.061 1.353 881 HB2 SER 115 1HB SER 115 -11.135 1.137 -0.775 882 HB3 SER 115 2HB SER 115 -11.939 -0.347 -1.249 883 HG SER 115 HG SER 115 -13.685 1.304 0.014 884 H ASN 116 H ASN 116 -13.639 -2.024 0.821 885 HA ASN 116 HA ASN 116 -11.812 -4.261 0.420 886 HB2 ASN 116 1HB ASN 116 -13.518 -3.464 2.824 887 HB3 ASN 116 2HB ASN 116 -13.319 -5.168 2.422 888 HD21 ASN 116 1HD2 ASN 116 -11.229 -5.943 2.118 889 HD22 ASN 116 2HD2 ASN 116 -9.881 -5.396 3.138 890 H GLY 117 H GLY 117 -12.967 -5.933 -0.647 891 HA2 GLY 117 2HA GLY 117 -15.906 -5.860 -0.693 892 HA3 GLY 117 1HA GLY 117 -15.043 -5.922 -2.242 893 H GLN 118 H GLN 118 -16.499 -8.062 -2.007 894 HA GLN 118 HA GLN 118 -15.453 -10.195 -0.369 895 HB2 GLN 118 1HB GLN 118 -17.585 -9.728 -2.377 896 HB3 GLN 118 2HB GLN 118 -16.881 -11.317 -2.502 897 HG2 GLN 118 1HG GLN 118 -17.532 -11.910 -0.279 898 HG3 GLN 118 2HG GLN 118 -17.828 -10.222 0.151 899 HE21 GLN 118 1HE2 GLN 118 -18.895 -12.434 -2.565 900 HE22 GLN 118 2HE2 GLN 118 -20.593 -12.048 -2.345 901 HA PRO 119 HA PRO 119 -12.326 -11.545 -3.151 902 HB2 PRO 119 1HB PRO 119 -12.103 -14.238 -2.665 903 HB3 PRO 119 2HB PRO 119 -11.631 -13.016 -1.448 904 HG2 PRO 119 1HG PRO 119 -14.247 -14.538 -1.670 905 HG3 PRO 119 2HG PRO 119 -13.249 -14.261 -0.204 906 HD2 PRO 119 1HD PRO 119 -15.444 -12.742 -0.852 907 HD3 PRO 119 2HD PRO 119 -14.045 -12.062 0.028 908 H THR 120 H THR 120 -11.959 -12.501 -5.172 909 HA THR 120 HA THR 120 -14.466 -13.384 -6.490 910 HB THR 120 HB THR 120 -13.211 -11.555 -7.521 911 HG1 THR 120 1HG THR 120 -13.567 -13.959 -8.926 912 HG21 THR 120 3HG2 THR 120 -10.915 -12.297 -7.070 913 HG22 THR 120 1HG2 THR 120 -11.185 -11.992 -8.793 914 HG23 THR 120 2HG2 THR 120 -11.142 -13.661 -8.190 915 H THR 121 H THR 121 -12.252 -14.829 -4.879 916 HA THR 121 HA THR 121 -11.265 -16.862 -4.654 917 HB THR 121 HB THR 121 -13.582 -17.984 -6.260 918 HG1 THR 121 1HG THR 121 -14.336 -16.648 -4.705 919 HG21 THR 121 3HG2 THR 121 -11.823 -19.130 -4.037 920 HG22 THR 121 1HG2 THR 121 -12.048 -19.795 -5.663 921 HG23 THR 121 2HG2 THR 121 -13.372 -19.849 -4.524 922 H GLY 122 H GLY 122 -10.678 -19.019 -6.408 923 HA2 GLY 122 2HA GLY 122 -9.538 -18.062 -8.869 924 HA3 GLY 122 1HA GLY 122 -8.406 -18.073 -7.500 925 H ASP 123 H ASP 123 -7.282 -19.708 -8.729 926 HA ASP 123 HA ASP 123 -8.422 -22.191 -9.561 927 HB2 ASP 123 1HB ASP 123 -6.314 -21.241 -10.405 928 HB3 ASP 123 2HB ASP 123 -5.552 -21.540 -8.841 929 H ALA 124 H ALA 124 -6.323 -21.436 -6.768 930 HA ALA 124 HA ALA 124 -7.699 -23.363 -4.989 931 HB1 ALA 124 1HB ALA 124 -5.369 -24.188 -4.374 932 HB2 ALA 124 2HB ALA 124 -5.809 -24.626 -6.046 933 HB3 ALA 124 3HB ALA 124 -4.718 -23.261 -5.727 934 H ASP 125 H ASP 125 -7.510 -20.335 -5.362 935 HA ASP 125 HA ASP 125 -6.361 -19.694 -2.741 936 HB2 ASP 125 1HB ASP 125 -5.738 -17.947 -5.125 937 HB3 ASP 125 2HB ASP 125 -4.923 -18.023 -3.567 938 H HIS 126 H HIS 126 -7.152 -17.620 -1.960 939 HA HIS 126 HA HIS 126 -9.357 -16.393 -3.578 940 HB2 HIS 126 1HB HIS 126 -9.063 -16.192 -0.564 941 HB3 HIS 126 2HB HIS 126 -10.333 -15.477 -1.542 942 HD1 HIS 126 1HD HIS 126 -12.316 -17.354 -2.416 943 HD2 HIS 126 2HD HIS 126 -9.428 -18.426 0.465 944 HE1 HIS 126 1HE HIS 126 -13.246 -19.341 -1.183 945 H THR 127 H THR 127 -9.388 -14.113 -3.539 946 HA THR 127 HA THR 127 -7.339 -12.519 -2.185 947 HB THR 127 HB THR 127 -7.817 -11.367 -4.722 948 HG1 THR 127 1HG THR 127 -7.522 -12.635 -6.209 949 HG21 THR 127 3HG2 THR 127 -5.761 -11.099 -3.439 950 HG22 THR 127 1HG2 THR 127 -5.406 -11.596 -5.104 951 HG23 THR 127 2HG2 THR 127 -5.307 -12.790 -3.775 952 H VAL 128 H VAL 128 -8.513 -11.149 -1.039 953 HA VAL 128 HA VAL 128 -11.145 -10.235 -2.009 954 HB VAL 128 HB VAL 128 -10.722 -8.704 0.090 955 HG11 VAL 128 1HG1 VAL 128 -11.960 -10.279 1.431 956 HG12 VAL 128 2HG1 VAL 128 -12.517 -10.350 -0.231 957 HG13 VAL 128 3HG1 VAL 128 -11.455 -11.632 0.380 958 HG21 VAL 128 3HG2 VAL 128 -8.428 -9.446 0.586 959 HG22 VAL 128 1HG2 VAL 128 -9.586 -9.732 1.926 960 HG23 VAL 128 2HG2 VAL 128 -9.045 -11.081 0.921 961 HA PRO 129 HA PRO 129 -9.023 -6.858 -3.999 962 HB2 PRO 129 1HB PRO 129 -11.166 -5.382 -4.802 963 HB3 PRO 129 2HB PRO 129 -10.808 -6.984 -5.503 964 HG2 PRO 129 1HG PRO 129 -12.786 -6.339 -3.283 965 HG3 PRO 129 2HG PRO 129 -13.044 -7.350 -4.734 966 HD2 PRO 129 1HD PRO 129 -12.383 -8.391 -2.308 967 HD3 PRO 129 2HD PRO 129 -11.816 -9.124 -3.830 968 H ILE 130 H ILE 130 -7.874 -5.368 -2.812 969 HA ILE 130 HA ILE 130 -9.327 -3.559 -0.997 970 HB ILE 130 HB ILE 130 -6.797 -5.027 -0.169 971 HG12 ILE 130 1HG1 ILE 130 -9.695 -5.726 0.465 972 HG13 ILE 130 2HG1 ILE 130 -8.553 -6.710 -0.419 973 HG21 ILE 130 1HG2 ILE 130 -8.881 -3.661 1.598 974 HG22 ILE 130 2HG2 ILE 130 -7.220 -4.122 2.013 975 HG23 ILE 130 3HG2 ILE 130 -7.494 -2.768 0.915 976 HD11 ILE 130 3HD1 ILE 130 -7.214 -7.141 1.538 977 HD12 ILE 130 1HD1 ILE 130 -8.239 -6.066 2.521 978 HD13 ILE 130 2HD1 ILE 130 -8.920 -7.525 1.863 979 H SER 131 H SER 131 -8.615 -1.531 -1.236 980 HA SER 131 HA SER 131 -5.921 -0.891 -1.964 981 HB2 SER 131 1HB SER 131 -6.533 0.329 -4.113 982 HB3 SER 131 2HB SER 131 -6.476 -1.421 -4.197 983 HG SER 131 HG SER 131 -8.491 0.266 -4.724 984 H LEU 132 H LEU 132 -5.578 1.465 -2.151 985 HA LEU 132 HA LEU 132 -7.795 3.218 -1.480 986 HB2 LEU 132 1HB LEU 132 -6.420 4.307 0.279 987 HB3 LEU 132 2HB LEU 132 -7.114 2.766 0.707 988 HG LEU 132 HG LEU 132 -4.922 3.070 1.627 989 HD11 LEU 132 1HD1 LEU 132 -5.738 0.739 0.887 990 HD12 LEU 132 2HD1 LEU 132 -4.089 0.990 1.486 991 HD13 LEU 132 3HD1 LEU 132 -4.381 0.828 -0.258 992 HD21 LEU 132 3HD2 LEU 132 -2.854 3.152 0.418 993 HD22 LEU 132 1HD2 LEU 132 -3.890 4.473 -0.172 994 HD23 LEU 132 2HD2 LEU 132 -3.721 3.003 -1.121 995 H GLY 133 H GLY 133 -7.141 5.569 -1.722 996 HA2 GLY 133 2HA GLY 133 -5.505 5.697 -4.224 997 HA3 GLY 133 1HA GLY 133 -7.088 6.387 -3.949 998 H TYR 134 H TYR 134 -3.927 6.466 -2.723 999 HA TYR 134 HA TYR 134 -4.183 8.735 -1.018 1000 HB2 TYR 134 1HB TYR 134 -1.802 8.483 -0.620 1001 HB3 TYR 134 2HB TYR 134 -2.556 6.910 -0.668 1002 HD1 TYR 134 2HD TYR 134 -0.246 9.241 -2.349 1003 HD2 TYR 134 1HD TYR 134 -2.008 5.296 -2.466 1004 HE1 TYR 134 2HE TYR 134 1.556 8.491 -3.862 1005 HE2 TYR 134 1HE TYR 134 -0.239 4.564 -4.035 1006 HH TYR 134 HH TYR 134 2.345 6.756 -5.208 1007 H ASP 135 H ASP 135 -3.033 10.793 -1.039 1008 HA ASP 135 HA ASP 135 -1.959 11.575 -3.597 1009 HB2 ASP 135 1HB ASP 135 -2.949 13.488 -4.023 1010 HB3 ASP 135 2HB ASP 135 -4.316 12.565 -3.505 1011 H VAL 136 H VAL 136 -0.481 13.451 -3.473 1012 HA VAL 136 HA VAL 136 1.264 13.038 -1.150 1013 HB VAL 136 HB VAL 136 1.552 14.454 -3.857 1014 HG11 VAL 136 1HG1 VAL 136 3.957 14.707 -3.285 1015 HG12 VAL 136 2HG1 VAL 136 2.931 15.685 -2.234 1016 HG13 VAL 136 3HG1 VAL 136 3.622 14.167 -1.632 1017 HG21 VAL 136 3HG2 VAL 136 3.263 12.607 -4.171 1018 HG22 VAL 136 1HG2 VAL 136 2.737 11.907 -2.643 1019 HG23 VAL 136 2HG2 VAL 136 1.608 12.003 -4.009 1020 H GLN 137 H GLN 137 1.765 14.749 0.289 1021 HA GLN 137 HA GLN 137 0.279 17.268 -0.017 1022 HB2 GLN 137 1HB GLN 137 -0.472 17.257 2.257 1023 HB3 GLN 137 2HB GLN 137 -1.196 15.884 1.387 1024 HG2 GLN 137 1HG GLN 137 0.237 14.312 2.487 1025 HG3 GLN 137 2HG GLN 137 1.265 15.567 3.162 1026 HE21 GLN 137 1HE2 GLN 137 -0.145 13.402 4.675 1027 HE22 GLN 137 2HE2 GLN 137 -1.029 14.364 5.863 1028 H PHE 138 H PHE 138 1.063 18.904 1.464 1029 HA PHE 138 HA PHE 138 3.599 18.464 2.826 1030 HB2 PHE 138 1HB PHE 138 4.389 20.699 1.803 1031 HB3 PHE 138 2HB PHE 138 4.622 19.215 0.905 1032 HD1 PHE 138 1HD PHE 138 2.559 22.308 1.081 1033 HD2 PHE 138 2HD PHE 138 3.517 18.787 -1.170 1034 HE1 PHE 138 1HE PHE 138 1.481 23.310 -0.938 1035 HE2 PHE 138 2HE PHE 138 2.464 19.780 -3.200 1036 HZ PHE 138 HZ PHE 138 1.458 22.063 -3.086 1037 H TYR 139 H TYR 139 3.672 19.827 4.649 1038 HA TYR 139 HA TYR 139 1.489 21.800 4.949 1039 HB2 TYR 139 1HB TYR 139 1.386 20.985 7.380 1040 HB3 TYR 139 2HB TYR 139 0.532 20.106 6.134 1041 HD1 TYR 139 1HD TYR 139 3.954 19.992 7.787 1042 HD2 TYR 139 2HD TYR 139 0.569 17.790 6.239 1043 HE1 TYR 139 1HE TYR 139 4.964 17.895 8.570 1044 HE2 TYR 139 2HE TYR 139 1.578 15.677 7.060 1045 HH TYR 139 HH TYR 139 4.878 15.527 8.128 1046 HA PRO 140 HA PRO 140 4.926 24.225 6.018 1047 HB2 PRO 140 1HB PRO 140 3.824 26.415 7.132 1048 HB3 PRO 140 2HB PRO 140 3.377 25.866 5.498 1049 HG2 PRO 140 1HG PRO 140 1.885 25.301 8.088 1050 HG3 PRO 140 2HG PRO 140 1.232 25.993 6.573 1051 HD2 PRO 140 1HD PRO 140 1.114 23.312 7.139 1052 HD3 PRO 140 2HD PRO 140 1.304 23.928 5.473 1053 H GLU 141 H GLU 141 5.318 22.289 7.424 1054 HA GLU 141 HA GLU 141 6.150 21.210 9.192 1055 HB2 GLU 141 1HB GLU 141 5.854 23.672 10.948 1056 HB3 GLU 141 2HB GLU 141 6.613 22.135 11.348 1057 HG2 GLU 141 1HG GLU 141 8.032 22.672 9.115 1058 HG3 GLU 141 2HG GLU 141 7.611 24.339 9.555 Start of MODEL 12 1 H1 GLY 1 H GLY 1 17.033 15.941 -6.421 2 HA2 GLY 1 2HA GLY 1 14.620 15.846 -5.878 3 HA3 GLY 1 1HA GLY 1 14.977 16.771 -7.348 4 H MET 2 H MET 2 14.927 13.116 -7.025 5 HA MET 2 HA MET 2 13.098 12.902 -9.294 6 HB2 MET 2 1HB MET 2 14.118 10.917 -7.219 7 HB3 MET 2 2HB MET 2 13.050 10.486 -8.558 8 HG2 MET 2 1HG MET 2 14.706 10.998 -10.201 9 HG3 MET 2 2HG MET 2 15.726 11.825 -9.010 10 HE1 MET 2 3HE MET 2 14.811 8.144 -10.495 11 HE2 MET 2 1HE MET 2 15.077 7.220 -9.014 12 HE3 MET 2 2HE MET 2 13.782 8.426 -9.084 13 H SER 3 H SER 3 12.828 13.248 -5.817 14 HA SER 3 HA SER 3 11.176 13.351 -4.361 15 HB2 SER 3 1HB SER 3 9.420 13.734 -6.783 16 HB3 SER 3 2HB SER 3 8.973 14.078 -5.122 17 HG SER 3 HG SER 3 10.924 15.529 -5.165 18 H GLN 4 H GLN 4 9.632 11.407 -6.966 19 HA GLN 4 HA GLN 4 7.913 9.976 -5.350 20 HB2 GLN 4 1HB GLN 4 8.809 10.021 -8.094 21 HB3 GLN 4 2HB GLN 4 8.800 8.356 -7.568 22 HG2 GLN 4 1HG GLN 4 6.442 10.279 -7.243 23 HG3 GLN 4 2HG GLN 4 6.637 9.171 -8.596 24 HE21 GLN 4 1HE2 GLN 4 7.159 6.911 -7.914 25 HE22 GLN 4 2HE2 GLN 4 6.214 6.141 -6.649 26 H ASP 5 H ASP 5 11.300 9.137 -5.994 27 HA ASP 5 HA ASP 5 11.520 6.570 -4.895 28 HB2 ASP 5 1HB ASP 5 13.300 9.016 -5.074 29 HB3 ASP 5 2HB ASP 5 13.821 7.696 -4.057 30 H LEU 6 H LEU 6 11.637 9.708 -3.341 31 HA LEU 6 HA LEU 6 12.412 8.688 -0.715 32 HB2 LEU 6 1HB LEU 6 12.953 10.822 -0.287 33 HB3 LEU 6 2HB LEU 6 12.966 10.916 -2.027 34 HG LEU 6 HG LEU 6 10.427 11.715 -1.679 35 HD11 LEU 6 1HD1 LEU 6 10.670 10.892 0.735 36 HD12 LEU 6 2HD1 LEU 6 10.006 12.520 0.508 37 HD13 LEU 6 3HD1 LEU 6 11.738 12.190 0.956 38 HD21 LEU 6 3HD2 LEU 6 12.411 13.059 -2.482 39 HD22 LEU 6 1HD2 LEU 6 12.713 13.522 -0.802 40 HD23 LEU 6 2HD2 LEU 6 11.188 13.963 -1.621 41 H ILE 7 H ILE 7 9.462 10.227 -2.032 42 HA ILE 7 HA ILE 7 7.693 9.565 -0.120 43 HB ILE 7 HB ILE 7 7.377 9.350 -3.103 44 HG12 ILE 7 1HG1 ILE 7 6.125 11.469 -1.348 45 HG13 ILE 7 2HG1 ILE 7 7.862 11.611 -1.592 46 HG21 ILE 7 1HG2 ILE 7 4.956 9.435 -2.849 47 HG22 ILE 7 2HG2 ILE 7 5.550 8.001 -2.039 48 HG23 ILE 7 3HG2 ILE 7 5.103 9.426 -1.079 49 HD11 ILE 7 3HD1 ILE 7 7.548 11.660 -4.015 50 HD12 ILE 7 1HD1 ILE 7 5.834 11.245 -3.877 51 HD13 ILE 7 2HD1 ILE 7 6.411 12.825 -3.312 52 H ARG 8 H ARG 8 8.580 7.090 -2.675 53 HA ARG 8 HA ARG 8 7.248 4.902 -1.593 54 HB2 ARG 8 1HB ARG 8 8.450 4.699 -3.707 55 HB3 ARG 8 2HB ARG 8 9.993 4.964 -2.909 56 HG2 ARG 8 1HG ARG 8 9.582 2.824 -1.578 57 HG3 ARG 8 2HG ARG 8 8.221 2.507 -2.654 58 HD2 ARG 8 1HD ARG 8 9.696 2.214 -4.529 59 HD3 ARG 8 2HD ARG 8 11.035 3.025 -3.691 60 HE ARG 8 HE ARG 8 10.362 0.803 -2.109 61 HH11 ARG 8 1HH1 ARG 8 11.949 1.395 -5.260 62 HH12 ARG 8 2HH1 ARG 8 12.948 -0.015 -5.096 63 HH21 ARG 8 1HH2 ARG 8 11.685 -0.854 -1.899 64 HH22 ARG 8 2HH2 ARG 8 12.771 -1.398 -3.156 65 H ALA 9 H ALA 9 10.480 6.122 -0.570 66 HA ALA 9 HA ALA 9 11.056 4.100 1.254 67 HB1 ALA 9 1HB ALA 9 12.616 5.922 0.462 68 HB2 ALA 9 2HB ALA 9 11.827 7.024 1.628 69 HB3 ALA 9 3HB ALA 9 12.680 5.584 2.202 70 H ALA 10 H ALA 10 8.625 6.631 1.729 71 HA ALA 10 HA ALA 10 8.615 6.180 4.662 72 HB1 ALA 10 1HB ALA 10 6.392 7.597 3.181 73 HB2 ALA 10 2HB ALA 10 7.023 7.872 4.812 74 HB3 ALA 10 3HB ALA 10 7.963 8.399 3.415 75 H PHE 11 H PHE 11 6.674 5.408 1.815 76 HA PHE 11 HA PHE 11 4.489 4.095 3.095 77 HB2 PHE 11 1HB PHE 11 5.742 3.857 0.323 78 HB3 PHE 11 2HB PHE 11 4.383 2.898 0.846 79 HD1 PHE 11 2HD PHE 11 5.128 6.645 1.066 80 HD2 PHE 11 1HD PHE 11 2.477 3.521 -0.280 81 HE1 PHE 11 2HE PHE 11 3.623 8.310 0.095 82 HE2 PHE 11 1HE PHE 11 0.921 5.203 -1.149 83 HZ PHE 11 HZ PHE 11 1.497 7.619 -1.018 84 H GLU 12 H GLU 12 7.536 2.855 1.613 85 HA GLU 12 HA GLU 12 7.071 0.159 2.176 86 HB2 GLU 12 1HB GLU 12 8.619 0.925 0.488 87 HB3 GLU 12 2HB GLU 12 9.637 1.734 1.698 88 HG2 GLU 12 1HG GLU 12 10.273 -0.360 2.687 89 HG3 GLU 12 2HG GLU 12 9.107 -1.261 1.725 90 H LYS 13 H LYS 13 8.549 2.694 4.187 91 HA LYS 13 HA LYS 13 9.857 1.017 6.080 92 HB2 LYS 13 1HB LYS 13 10.387 3.282 5.557 93 HB3 LYS 13 2HB LYS 13 8.869 3.877 6.226 94 HG2 LYS 13 1HG LYS 13 9.603 3.314 8.499 95 HG3 LYS 13 2HG LYS 13 11.021 2.451 7.862 96 HD2 LYS 13 1HD LYS 13 11.632 4.591 6.650 97 HD3 LYS 13 2HD LYS 13 10.415 5.424 7.630 98 HE2 LYS 13 1HE LYS 13 11.719 4.904 9.665 99 HE3 LYS 13 2HE LYS 13 12.864 3.965 8.690 100 HZ1 LYS 13 3HZ LYS 13 13.426 6.019 7.488 101 HZ2 LYS 13 1HZ LYS 13 13.724 6.180 9.081 102 HZ3 LYS 13 2HZ LYS 13 12.402 6.882 8.436 103 H ARG 14 H ARG 14 6.667 2.716 6.024 104 HA ARG 14 HA ARG 14 6.043 1.701 8.605 105 HB2 ARG 14 1HB ARG 14 5.067 3.801 7.742 106 HB3 ARG 14 2HB ARG 14 4.186 2.905 6.512 107 HG2 ARG 14 1HG ARG 14 2.747 3.580 8.390 108 HG3 ARG 14 2HG ARG 14 2.787 1.838 8.178 109 HD2 ARG 14 1HD ARG 14 2.771 2.459 10.531 110 HD3 ARG 14 2HD ARG 14 4.253 1.594 10.133 111 HE ARG 14 HE ARG 14 5.270 3.952 9.893 112 HH11 ARG 14 1HH1 ARG 14 2.760 3.233 12.385 113 HH12 ARG 14 2HH1 ARG 14 3.368 4.420 13.469 114 HH21 ARG 14 1HH2 ARG 14 5.897 5.580 11.260 115 HH22 ARG 14 2HH2 ARG 14 5.143 5.836 12.803 116 H LEU 15 H LEU 15 5.039 0.598 5.317 117 HA LEU 15 HA LEU 15 3.215 -1.353 6.280 118 HB2 LEU 15 1HB LEU 15 3.202 -0.642 3.925 119 HB3 LEU 15 2HB LEU 15 4.821 -1.303 3.691 120 HG LEU 15 HG LEU 15 3.940 -3.613 4.162 121 HD11 LEU 15 1HD1 LEU 15 1.164 -2.372 4.006 122 HD12 LEU 15 2HD1 LEU 15 1.901 -2.970 5.513 123 HD13 LEU 15 3HD1 LEU 15 1.569 -4.083 4.186 124 HD21 LEU 15 3HD2 LEU 15 4.182 -2.989 1.898 125 HD22 LEU 15 1HD2 LEU 15 2.698 -2.016 1.920 126 HD23 LEU 15 2HD2 LEU 15 2.620 -3.794 2.020 127 H SER 16 H SER 16 6.696 -1.741 5.272 128 HA SER 16 HA SER 16 6.534 -4.555 5.721 129 HB2 SER 16 1HB SER 16 8.137 -3.193 4.217 130 HB3 SER 16 2HB SER 16 9.104 -2.973 5.691 131 HG SER 16 HG SER 16 9.509 -5.075 5.759 132 H ASP 17 H ASP 17 7.530 -1.817 7.781 133 HA ASP 17 HA ASP 17 8.539 -3.416 9.920 134 HB2 ASP 17 1HB ASP 17 7.423 -0.608 9.857 135 HB3 ASP 17 2HB ASP 17 7.867 -1.388 11.355 136 H TRP 18 H TRP 18 5.203 -2.897 8.900 137 HA TRP 18 HA TRP 18 4.067 -3.831 11.464 138 HB2 TRP 18 1HB TRP 18 2.549 -2.498 10.348 139 HB3 TRP 18 2HB TRP 18 2.941 -3.127 8.774 140 HD1 TRP 18 HD TRP 18 0.680 -3.922 11.782 141 HE1 TRP 18 1HE TRP 18 -1.210 -5.486 10.983 142 HE3 TRP 18 3HE TRP 18 2.332 -4.867 7.042 143 HZ2 TRP 18 2HZ TRP 18 -1.625 -7.345 8.763 144 HZ3 TRP 18 3HZ TRP 18 1.194 -6.554 5.620 145 HH2 TRP 18 HH TRP 18 -0.778 -7.810 6.507 146 H ALA 19 H ALA 19 4.451 -5.218 8.155 147 HA ALA 19 HA ALA 19 3.462 -7.782 9.006 148 HB1 ALA 19 1HB ALA 19 5.306 -7.235 6.616 149 HB2 ALA 19 2HB ALA 19 4.090 -8.510 6.794 150 HB3 ALA 19 3HB ALA 19 3.578 -6.840 6.589 151 H LYS 20 H LYS 20 6.807 -6.530 9.082 152 HA LYS 20 HA LYS 20 7.840 -9.190 9.766 153 HB2 LYS 20 1HB LYS 20 9.953 -8.115 10.083 154 HB3 LYS 20 2HB LYS 20 9.186 -7.451 8.645 155 HG2 LYS 20 1HG LYS 20 9.872 -5.484 9.534 156 HG3 LYS 20 2HG LYS 20 8.335 -5.593 10.383 157 HD2 LYS 20 1HD LYS 20 9.569 -6.567 12.369 158 HD3 LYS 20 2HD LYS 20 11.085 -6.311 11.471 159 HE2 LYS 20 1HE LYS 20 10.576 -3.903 11.292 160 HE3 LYS 20 2HE LYS 20 9.041 -4.142 12.132 161 HZ1 LYS 20 3HZ LYS 20 10.835 -3.316 13.548 162 HZ2 LYS 20 1HZ LYS 20 11.685 -4.691 13.334 163 HZ3 LYS 20 2HZ LYS 20 10.234 -4.748 14.102 164 H ALA 21 H ALA 21 6.148 -6.736 11.544 165 HA ALA 21 HA ALA 21 7.277 -7.590 14.153 166 HB1 ALA 21 1HB ALA 21 6.115 -5.606 15.020 167 HB2 ALA 21 2HB ALA 21 7.214 -5.170 13.703 168 HB3 ALA 21 3HB ALA 21 5.454 -5.263 13.413 169 H ARG 22 H ARG 22 4.578 -8.324 12.121 170 HA ARG 22 HA ARG 22 2.791 -9.006 14.185 171 HB2 ARG 22 1HB ARG 22 2.148 -10.716 12.263 172 HB3 ARG 22 2HB ARG 22 1.351 -9.222 12.792 173 HG2 ARG 22 1HG ARG 22 2.635 -8.131 11.091 174 HG3 ARG 22 2HG ARG 22 3.547 -9.652 10.868 175 HD2 ARG 22 1HD ARG 22 1.339 -8.726 9.442 176 HD3 ARG 22 2HD ARG 22 2.120 -10.294 9.287 177 HE ARG 22 HE ARG 22 0.215 -11.252 10.164 178 HH11 ARG 22 1HH1 ARG 22 0.137 -7.776 10.867 179 HH12 ARG 22 2HH1 ARG 22 -1.222 -7.866 11.914 180 HH21 ARG 22 1HH2 ARG 22 -1.770 -11.367 11.467 181 HH22 ARG 22 2HH2 ARG 22 -2.227 -9.919 12.306 182 H THR 23 H THR 23 2.230 -11.063 14.727 183 HA THR 23 HA THR 23 4.294 -12.774 15.738 184 HB THR 23 HB THR 23 1.335 -12.765 15.589 185 HG1 THR 23 1HG THR 23 2.505 -11.754 17.337 186 HG21 THR 23 3HG2 THR 23 1.133 -14.901 16.849 187 HG22 THR 23 1HG2 THR 23 2.887 -15.174 16.684 188 HG23 THR 23 2HG2 THR 23 1.833 -15.236 15.272 189 HA PRO 24 HA PRO 24 3.406 -16.037 12.464 190 HB2 PRO 24 1HB PRO 24 1.701 -15.686 10.354 191 HB3 PRO 24 2HB PRO 24 1.174 -16.221 11.981 192 HG2 PRO 24 1HG PRO 24 1.079 -13.403 10.869 193 HG3 PRO 24 2HG PRO 24 -0.248 -14.329 11.646 194 HD2 PRO 24 1HD PRO 24 1.259 -12.594 13.079 195 HD3 PRO 24 2HD PRO 24 0.723 -14.143 13.767 196 H ALA 25 H ALA 25 3.407 -12.778 11.628 197 HA ALA 25 HA ALA 25 4.235 -11.371 10.146 198 HB1 ALA 25 1HB ALA 25 6.535 -11.716 9.337 199 HB2 ALA 25 2HB ALA 25 6.357 -12.091 11.064 200 HB3 ALA 25 3HB ALA 25 6.434 -13.409 9.885 201 H LEU 26 H LEU 26 4.597 -10.845 7.787 202 HA LEU 26 HA LEU 26 3.498 -12.925 5.985 203 HB2 LEU 26 1HB LEU 26 2.441 -10.107 6.408 204 HB3 LEU 26 2HB LEU 26 2.052 -11.092 5.014 205 HG LEU 26 HG LEU 26 1.436 -11.934 7.884 206 HD11 LEU 26 1HD1 LEU 26 -0.389 -10.606 5.855 207 HD12 LEU 26 2HD1 LEU 26 0.270 -9.863 7.328 208 HD13 LEU 26 3HD1 LEU 26 -0.865 -11.219 7.450 209 HD21 LEU 26 3HD2 LEU 26 -0.136 -13.492 6.866 210 HD22 LEU 26 1HD2 LEU 26 1.494 -13.846 6.304 211 HD23 LEU 26 2HD2 LEU 26 0.354 -12.992 5.234 212 HA PRO 27 HA PRO 27 6.778 -11.091 3.642 213 HB2 PRO 27 1HB PRO 27 6.372 -12.146 1.160 214 HB3 PRO 27 2HB PRO 27 6.863 -13.156 2.541 215 HG2 PRO 27 1HG PRO 27 4.085 -12.728 1.432 216 HG3 PRO 27 2HG PRO 27 4.865 -14.279 1.859 217 HD2 PRO 27 1HD PRO 27 3.136 -12.928 3.536 218 HD3 PRO 27 2HD PRO 27 4.492 -13.902 4.159 219 H VAL 28 H VAL 28 7.131 -9.324 2.170 220 HA VAL 28 HA VAL 28 4.689 -7.878 1.290 221 HB VAL 28 HB VAL 28 7.287 -6.811 2.480 222 HG11 VAL 28 1HG1 VAL 28 6.204 -4.598 2.390 223 HG12 VAL 28 2HG1 VAL 28 6.386 -5.257 0.767 224 HG13 VAL 28 3HG1 VAL 28 4.797 -5.294 1.554 225 HG21 VAL 28 3HG2 VAL 28 5.785 -6.010 4.305 226 HG22 VAL 28 1HG2 VAL 28 4.420 -6.873 3.568 227 HG23 VAL 28 2HG2 VAL 28 5.820 -7.763 4.209 228 H ALA 29 H ALA 29 4.680 -8.683 -0.817 229 HA ALA 29 HA ALA 29 7.142 -8.675 -2.359 230 HB1 ALA 29 1HB ALA 29 5.758 -9.556 -4.166 231 HB2 ALA 29 2HB ALA 29 5.574 -10.486 -2.668 232 HB3 ALA 29 3HB ALA 29 4.313 -9.325 -3.170 233 H TRP 30 H TRP 30 7.821 -6.563 -2.784 234 HA TRP 30 HA TRP 30 5.956 -4.549 -3.776 235 HB2 TRP 30 1HB TRP 30 8.995 -4.649 -3.749 236 HB3 TRP 30 2HB TRP 30 8.034 -3.263 -4.263 237 HD1 TRP 30 HD TRP 30 9.810 -4.476 -1.380 238 HE1 TRP 30 1HE TRP 30 9.070 -3.376 0.805 239 HE3 TRP 30 3HE TRP 30 5.458 -2.327 -3.022 240 HZ2 TRP 30 2HZ TRP 30 6.775 -1.882 1.750 241 HZ3 TRP 30 3HZ TRP 30 4.040 -1.042 -1.486 242 HH2 TRP 30 HH TRP 30 4.699 -0.764 0.913 243 H GLN 31 H GLN 31 4.954 -5.248 -5.568 244 HA GLN 31 HA GLN 31 4.462 -5.933 -7.604 245 HB2 GLN 31 1HB GLN 31 6.712 -3.980 -8.069 246 HB3 GLN 31 2HB GLN 31 5.655 -4.584 -9.352 247 HG2 GLN 31 1HG GLN 31 3.689 -3.680 -8.374 248 HG3 GLN 31 2HG GLN 31 4.473 -3.395 -6.814 249 HE21 GLN 31 1HE2 GLN 31 3.060 -1.583 -8.966 250 HE22 GLN 31 2HE2 GLN 31 4.126 -0.194 -8.948 251 H ASN 32 H ASN 32 8.063 -6.068 -8.073 252 HA ASN 32 HA ASN 32 7.664 -8.863 -9.121 253 HB2 ASN 32 1HB ASN 32 9.393 -6.685 -10.362 254 HB3 ASN 32 2HB ASN 32 9.314 -8.356 -10.876 255 HD21 ASN 32 1HD2 ASN 32 6.175 -8.300 -10.447 256 HD22 ASN 32 2HD2 ASN 32 5.664 -7.521 -11.919 257 H THR 33 H THR 33 9.029 -7.231 -6.659 258 HA THR 33 HA THR 33 11.784 -7.687 -6.816 259 HB THR 33 HB THR 33 9.853 -7.321 -4.511 260 HG1 THR 33 1HG THR 33 9.914 -5.581 -5.775 261 HG21 THR 33 3HG2 THR 33 12.895 -7.078 -4.375 262 HG22 THR 33 1HG2 THR 33 11.857 -8.211 -3.451 263 HG23 THR 33 2HG2 THR 33 11.739 -6.488 -3.158 264 H LYS 34 H LYS 34 13.131 -9.060 -5.599 265 HA LYS 34 HA LYS 34 12.858 -11.775 -6.102 266 HB2 LYS 34 1HB LYS 34 14.969 -11.974 -4.812 267 HB3 LYS 34 2HB LYS 34 14.989 -10.874 -6.194 268 HG2 LYS 34 1HG LYS 34 15.373 -9.037 -4.885 269 HG3 LYS 34 2HG LYS 34 14.155 -9.565 -3.726 270 HD2 LYS 34 1HD LYS 34 15.753 -11.111 -2.680 271 HD3 LYS 34 2HD LYS 34 17.025 -10.570 -3.812 272 HE2 LYS 34 1HE LYS 34 16.896 -8.295 -2.934 273 HE3 LYS 34 2HE LYS 34 15.468 -8.705 -1.972 274 HZ1 LYS 34 3HZ LYS 34 18.104 -9.928 -1.526 275 HZ2 LYS 34 1HZ LYS 34 16.763 -10.080 -0.575 276 HZ3 LYS 34 2HZ LYS 34 17.533 -8.633 -0.683 277 H PHE 35 H PHE 35 10.836 -12.468 -5.046 278 HA PHE 35 HA PHE 35 11.324 -13.425 -2.309 279 HB2 PHE 35 1HB PHE 35 10.261 -10.881 -2.634 280 HB3 PHE 35 2HB PHE 35 8.817 -11.826 -2.466 281 HD1 PHE 35 1HD PHE 35 12.188 -12.170 -0.733 282 HD2 PHE 35 2HD PHE 35 8.003 -11.169 -0.387 283 HE1 PHE 35 1HE PHE 35 12.498 -11.737 1.660 284 HE2 PHE 35 2HE PHE 35 8.351 -10.748 2.055 285 HZ PHE 35 HZ PHE 35 10.570 -11.021 3.064 286 H THR 36 H THR 36 11.136 -15.473 -3.381 287 HA THR 36 HA THR 36 8.635 -16.559 -2.831 288 HB THR 36 HB THR 36 8.401 -15.640 -5.282 289 HG1 THR 36 1HG THR 36 7.401 -18.206 -5.145 290 HG21 THR 36 3HG2 THR 36 8.798 -17.214 -7.056 291 HG22 THR 36 1HG2 THR 36 9.580 -18.349 -5.929 292 HG23 THR 36 2HG2 THR 36 10.327 -16.769 -6.271 293 HA PRO 37 HA PRO 37 7.848 -18.994 -3.179 294 HB2 PRO 37 1HB PRO 37 7.745 -21.063 -1.416 295 HB3 PRO 37 2HB PRO 37 8.379 -21.242 -3.081 296 HG2 PRO 37 1HG PRO 37 9.951 -20.785 -0.522 297 HG3 PRO 37 2HG PRO 37 10.224 -22.027 -1.793 298 HD2 PRO 37 1HD PRO 37 11.598 -19.664 -1.749 299 HD3 PRO 37 2HD PRO 37 11.130 -20.459 -3.273 300 HA PRO 38 HA PRO 38 6.366 -17.039 0.665 301 HB2 PRO 38 1HB PRO 38 3.903 -18.166 0.901 302 HB3 PRO 38 2HB PRO 38 4.287 -16.913 -0.347 303 HG2 PRO 38 1HG PRO 38 4.249 -19.945 -0.652 304 HG3 PRO 38 2HG PRO 38 3.472 -18.734 -1.717 305 HD2 PRO 38 1HD PRO 38 5.860 -19.809 -2.324 306 HD3 PRO 38 2HD PRO 38 5.546 -18.076 -2.630 307 H ALA 39 H ALA 39 5.044 -17.870 2.762 308 HA ALA 39 HA ALA 39 6.446 -20.079 3.863 309 HB1 ALA 39 1HB ALA 39 3.985 -18.507 4.673 310 HB2 ALA 39 2HB ALA 39 4.771 -19.701 5.755 311 HB3 ALA 39 3HB ALA 39 5.642 -18.241 5.263 312 H ALA 40 H ALA 40 3.545 -19.928 2.268 313 HA ALA 40 HA ALA 40 2.952 -22.759 2.195 314 HB1 ALA 40 1HB ALA 40 2.794 -22.075 4.758 315 HB2 ALA 40 2HB ALA 40 1.278 -21.317 4.273 316 HB3 ALA 40 3HB ALA 40 1.511 -23.055 4.029 317 H GLY 41 H GLY 41 2.790 -20.579 0.350 318 HA2 GLY 41 2HA GLY 41 1.369 -19.841 -1.286 319 HA3 GLY 41 1HA GLY 41 0.043 -20.700 -0.497 320 H VAL 42 H VAL 42 1.378 -18.671 1.807 321 HA VAL 42 HA VAL 42 -0.829 -16.749 1.447 322 HB VAL 42 HB VAL 42 0.879 -17.440 3.879 323 HG11 VAL 42 1HG1 VAL 42 -0.826 -16.452 5.304 324 HG12 VAL 42 2HG1 VAL 42 -0.194 -15.259 4.169 325 HG13 VAL 42 3HG1 VAL 42 -1.789 -16.005 3.880 326 HG21 VAL 42 3HG2 VAL 42 -1.917 -18.448 3.178 327 HG22 VAL 42 1HG2 VAL 42 -0.458 -19.440 3.272 328 HG23 VAL 42 2HG2 VAL 42 -1.131 -18.719 4.734 329 H TYR 43 H TYR 43 -0.429 -14.708 0.788 330 HA TYR 43 HA TYR 43 1.887 -13.259 1.623 331 HB2 TYR 43 1HB TYR 43 2.816 -13.058 -0.749 332 HB3 TYR 43 2HB TYR 43 3.145 -14.526 0.113 333 HD1 TYR 43 1HD TYR 43 2.003 -16.680 -0.512 334 HD2 TYR 43 2HD TYR 43 1.422 -13.063 -2.709 335 HE1 TYR 43 1HE TYR 43 1.589 -17.988 -2.635 336 HE2 TYR 43 2HE TYR 43 0.911 -14.312 -4.761 337 HH TYR 43 HH TYR 43 0.746 -16.377 -5.717 338 H LEU 44 H LEU 44 2.085 -11.128 0.354 339 HA LEU 44 HA LEU 44 -0.631 -9.946 -0.089 340 HB2 LEU 44 1HB LEU 44 1.535 -9.239 1.872 341 HB3 LEU 44 2HB LEU 44 0.666 -7.940 1.096 342 HG LEU 44 HG LEU 44 -1.445 -8.568 1.931 343 HD11 LEU 44 1HD1 LEU 44 -1.320 -10.934 2.007 344 HD12 LEU 44 2HD1 LEU 44 -1.717 -10.332 3.609 345 HD13 LEU 44 3HD1 LEU 44 -0.062 -10.910 3.263 346 HD21 LEU 44 3HD2 LEU 44 -1.064 -8.074 4.276 347 HD22 LEU 44 1HD2 LEU 44 0.071 -7.133 3.299 348 HD23 LEU 44 2HD2 LEU 44 0.637 -8.588 4.155 349 H ARG 45 H ARG 45 -0.478 -9.562 -2.256 350 HA ARG 45 HA ARG 45 2.013 -8.655 -3.448 351 HB2 ARG 45 1HB ARG 45 -0.464 -9.929 -4.376 352 HB3 ARG 45 2HB ARG 45 -0.120 -8.551 -5.351 353 HG2 ARG 45 1HG ARG 45 1.413 -9.627 -6.496 354 HG3 ARG 45 2HG ARG 45 2.378 -9.896 -5.066 355 HD2 ARG 45 1HD ARG 45 2.055 -12.030 -5.948 356 HD3 ARG 45 2HD ARG 45 0.970 -11.934 -4.566 357 HE ARG 45 HE ARG 45 -0.775 -12.352 -5.955 358 HH11 ARG 45 1HH1 ARG 45 1.867 -11.067 -7.942 359 HH12 ARG 45 2HH1 ARG 45 1.099 -11.391 -9.449 360 HH21 ARG 45 1HH2 ARG 45 -1.681 -13.063 -7.960 361 HH22 ARG 45 2HH2 ARG 45 -0.959 -12.560 -9.448 362 H ALA 46 H ALA 46 2.541 -6.680 -2.707 363 HA ALA 46 HA ALA 46 0.688 -4.459 -2.543 364 HB1 ALA 46 1HB ALA 46 2.872 -3.199 -2.226 365 HB2 ALA 46 2HB ALA 46 2.611 -4.505 -1.063 366 HB3 ALA 46 3HB ALA 46 3.736 -4.720 -2.424 367 H TYR 47 H TYR 47 0.256 -2.952 -4.212 368 HA TYR 47 HA TYR 47 2.128 -2.813 -6.472 369 HB2 TYR 47 1HB TYR 47 -0.031 -4.202 -6.952 370 HB3 TYR 47 2HB TYR 47 -0.867 -2.660 -6.904 371 HD1 TYR 47 2HD TYR 47 0.204 -0.756 -8.353 372 HD2 TYR 47 1HD TYR 47 0.952 -4.935 -8.937 373 HE1 TYR 47 2HE TYR 47 1.116 -0.243 -10.615 374 HE2 TYR 47 1HE TYR 47 1.784 -4.484 -11.227 375 HH TYR 47 HH TYR 47 1.764 -2.803 -12.963 376 H VAL 48 H VAL 48 2.705 -0.705 -6.783 377 HA VAL 48 HA VAL 48 1.223 1.434 -5.358 378 HB VAL 48 HB VAL 48 4.080 1.267 -6.453 379 HG11 VAL 48 1HG1 VAL 48 4.272 3.396 -4.943 380 HG12 VAL 48 2HG1 VAL 48 3.569 3.553 -6.541 381 HG13 VAL 48 3HG1 VAL 48 2.509 3.490 -5.132 382 HG21 VAL 48 3HG2 VAL 48 4.677 1.381 -3.973 383 HG22 VAL 48 1HG2 VAL 48 2.989 0.980 -3.636 384 HG23 VAL 48 2HG2 VAL 48 4.004 -0.153 -4.544 385 H MET 49 H MET 49 0.202 2.988 -6.698 386 HA MET 49 HA MET 49 0.673 2.792 -9.641 387 HB2 MET 49 1HB MET 49 -1.972 3.342 -8.308 388 HB3 MET 49 2HB MET 49 -1.644 3.237 -10.038 389 HG2 MET 49 1HG MET 49 -0.981 0.906 -9.781 390 HG3 MET 49 2HG MET 49 -1.293 0.984 -8.037 391 HE1 MET 49 3HE MET 49 -2.564 -1.352 -8.697 392 HE2 MET 49 1HE MET 49 -3.008 -0.399 -7.258 393 HE3 MET 49 2HE MET 49 -4.283 -1.116 -8.281 394 HA PRO 50 HA PRO 50 1.534 6.954 -7.802 395 HB2 PRO 50 1HB PRO 50 3.797 7.565 -9.227 396 HB3 PRO 50 2HB PRO 50 3.802 6.521 -7.773 397 HG2 PRO 50 1HG PRO 50 3.819 5.670 -10.679 398 HG3 PRO 50 2HG PRO 50 4.805 5.038 -9.321 399 HD2 PRO 50 1HD PRO 50 2.494 3.773 -10.205 400 HD3 PRO 50 2HD PRO 50 3.054 3.736 -8.529 401 H ALA 51 H ALA 51 0.465 8.718 -8.650 402 HA ALA 51 HA ALA 51 -0.493 8.724 -11.380 403 HB1 ALA 51 1HB ALA 51 -0.455 11.020 -9.371 404 HB2 ALA 51 2HB ALA 51 -1.467 10.895 -10.815 405 HB3 ALA 51 3HB ALA 51 -1.737 9.787 -9.463 406 H ALA 52 H ALA 52 -0.076 10.595 -12.831 407 HA ALA 52 HA ALA 52 1.175 11.907 -14.136 408 HB1 ALA 52 1HB ALA 52 2.289 12.876 -11.480 409 HB2 ALA 52 2HB ALA 52 2.376 13.736 -13.025 410 HB3 ALA 52 3HB ALA 52 0.801 13.439 -12.259 411 H THR 53 H THR 53 2.244 9.922 -14.997 412 HA THR 53 HA THR 53 5.104 9.668 -14.382 413 HB THR 53 HB THR 53 4.024 7.712 -15.230 414 HG1 THR 53 1HG THR 53 5.488 7.277 -16.836 415 HG21 THR 53 3HG2 THR 53 3.203 7.439 -17.504 416 HG22 THR 53 1HG2 THR 53 3.384 9.168 -17.827 417 HG23 THR 53 2HG2 THR 53 2.210 8.588 -16.620 418 H ILE 54 H ILE 54 6.485 11.394 -14.853 419 HA ILE 54 HA ILE 54 6.235 12.644 -17.518 420 HB ILE 54 HB ILE 54 7.006 14.111 -14.949 421 HG12 ILE 54 1HG1 ILE 54 4.412 14.144 -16.518 422 HG13 ILE 54 2HG1 ILE 54 4.632 13.615 -14.856 423 HG21 ILE 54 1HG2 ILE 54 8.157 15.040 -16.876 424 HG22 ILE 54 2HG2 ILE 54 6.655 15.066 -17.828 425 HG23 ILE 54 3HG2 ILE 54 6.890 16.143 -16.431 426 HD11 ILE 54 3HD1 ILE 54 3.595 15.735 -14.744 427 HD12 ILE 54 1HD1 ILE 54 5.276 15.944 -14.212 428 HD13 ILE 54 2HD1 ILE 54 4.777 16.468 -15.835 429 H SER 55 H SER 55 8.418 13.426 -18.257 430 HA SER 55 HA SER 55 10.784 12.374 -16.955 431 HB2 SER 55 1HB SER 55 9.776 11.647 -19.703 432 HB3 SER 55 2HB SER 55 11.477 11.602 -19.278 433 HG SER 55 HG SER 55 11.023 10.057 -17.691 434 H ARG 56 H ARG 56 12.702 13.281 -18.422 435 HA ARG 56 HA ARG 56 13.857 15.162 -18.721 436 HB2 ARG 56 1HB ARG 56 13.541 16.369 -20.735 437 HB3 ARG 56 2HB ARG 56 13.270 14.651 -20.946 438 HG2 ARG 56 1HG ARG 56 10.918 16.043 -20.637 439 HG3 ARG 56 2HG ARG 56 11.781 16.408 -22.137 440 HD2 ARG 56 1HD ARG 56 11.904 13.924 -22.522 441 HD3 ARG 56 2HD ARG 56 10.798 13.693 -21.165 442 HE ARG 56 HE ARG 56 9.432 15.471 -22.652 443 HH11 ARG 56 1HH1 ARG 56 11.031 12.465 -23.739 444 HH12 ARG 56 2HH1 ARG 56 9.576 11.887 -24.500 445 HH21 ARG 56 1HH2 ARG 56 7.790 14.904 -23.985 446 HH22 ARG 56 2HH2 ARG 56 7.751 13.415 -24.882 447 H ASP 57 H ASP 57 12.340 15.337 -16.508 448 HA ASP 57 HA ASP 57 12.499 18.179 -16.125 449 HB2 ASP 57 1HB ASP 57 10.082 17.773 -16.750 450 HB3 ASP 57 2HB ASP 57 9.952 16.684 -15.361 451 H ALA 58 H ALA 58 12.224 18.427 -13.521 452 HA ALA 58 HA ALA 58 12.858 16.074 -11.981 453 HB1 ALA 58 1HB ALA 58 15.043 16.770 -11.163 454 HB2 ALA 58 2HB ALA 58 15.128 16.573 -12.916 455 HB3 ALA 58 3HB ALA 58 15.035 18.207 -12.196 456 H ALA 59 H ALA 59 10.790 18.165 -12.124 457 HA ALA 59 HA ALA 59 11.095 19.587 -9.572 458 HB1 ALA 59 1HB ALA 59 10.351 20.845 -12.247 459 HB2 ALA 59 2HB ALA 59 10.505 21.683 -10.683 460 HB3 ALA 59 3HB ALA 59 11.937 20.997 -11.459 461 H GLY 60 H GLY 60 8.758 21.103 -9.983 462 HA2 GLY 60 2HA GLY 60 6.588 19.274 -10.692 463 HA3 GLY 60 1HA GLY 60 6.516 19.995 -9.062 464 H ASP 61 H ASP 61 6.507 22.320 -8.911 465 HA ASP 61 HA ASP 61 6.265 24.417 -9.195 466 HB2 ASP 61 1HB ASP 61 7.688 25.056 -10.765 467 HB3 ASP 61 2HB ASP 61 7.304 23.683 -11.773 468 H HIS 62 H HIS 62 4.802 22.948 -11.994 469 HA HIS 62 HA HIS 62 2.158 23.591 -10.967 470 HB2 HIS 62 1HB HIS 62 3.403 23.103 -13.648 471 HB3 HIS 62 2HB HIS 62 1.830 22.375 -13.521 472 HD1 HIS 62 1HD HIS 62 3.461 25.705 -13.916 473 HD2 HIS 62 2HD HIS 62 -0.301 24.034 -13.059 474 HE1 HIS 62 1HE HIS 62 1.696 27.498 -14.528 475 H ARG 63 H ARG 63 0.464 21.889 -11.773 476 HA ARG 63 HA ARG 63 -0.501 19.892 -11.849 477 HB2 ARG 63 1HB ARG 63 2.096 19.442 -12.847 478 HB3 ARG 63 2HB ARG 63 1.897 18.149 -11.691 479 HG2 ARG 63 1HG ARG 63 0.615 17.003 -13.151 480 HG3 ARG 63 2HG ARG 63 -0.505 18.357 -13.322 481 HD2 ARG 63 1HD ARG 63 1.195 19.415 -14.921 482 HD3 ARG 63 2HD ARG 63 2.088 17.883 -14.875 483 HE ARG 63 HE ARG 63 -0.264 16.928 -15.517 484 HH11 ARG 63 1HH1 ARG 63 1.497 19.623 -17.008 485 HH12 ARG 63 2HH1 ARG 63 0.473 19.735 -18.403 486 HH21 ARG 63 1HH2 ARG 63 -1.481 16.931 -17.404 487 HH22 ARG 63 2HH2 ARG 63 -1.377 18.207 -18.580 488 H GLN 64 H GLN 64 -0.494 17.516 -10.634 489 HA GLN 64 HA GLN 64 0.130 17.969 -7.810 490 HB2 GLN 64 1HB GLN 64 -2.001 17.097 -7.131 491 HB3 GLN 64 2HB GLN 64 -2.207 18.566 -8.080 492 HG2 GLN 64 1HG GLN 64 -2.826 17.126 -10.063 493 HG3 GLN 64 2HG GLN 64 -2.717 15.708 -9.013 494 HE21 GLN 64 1HE2 GLN 64 -4.409 18.982 -9.091 495 HE22 GLN 64 2HE2 GLN 64 -5.843 18.342 -8.344 496 H TYR 65 H TYR 65 0.938 16.236 -6.809 497 HA TYR 65 HA TYR 65 1.400 13.685 -8.225 498 HB2 TYR 65 1HB TYR 65 2.218 14.972 -5.627 499 HB3 TYR 65 2HB TYR 65 1.997 13.234 -5.627 500 HD1 TYR 65 2HD TYR 65 3.462 15.147 -8.548 501 HD2 TYR 65 1HD TYR 65 4.145 12.596 -5.126 502 HE1 TYR 65 2HE TYR 65 5.762 14.687 -9.342 503 HE2 TYR 65 1HE TYR 65 6.448 12.150 -5.947 504 HH TYR 65 HH TYR 65 7.582 12.704 -8.991 505 H ARG 66 H ARG 66 0.465 11.736 -7.421 506 HA ARG 66 HA ARG 66 -1.516 11.564 -5.404 507 HB2 ARG 66 1HB ARG 66 -2.477 12.412 -8.054 508 HB3 ARG 66 2HB ARG 66 -3.182 10.853 -7.636 509 HG2 ARG 66 1HG ARG 66 -4.100 11.664 -5.605 510 HG3 ARG 66 2HG ARG 66 -3.123 13.131 -5.643 511 HD2 ARG 66 1HD ARG 66 -5.152 13.962 -6.239 512 HD3 ARG 66 2HD ARG 66 -4.361 13.722 -7.807 513 HE ARG 66 HE ARG 66 -5.911 11.417 -6.958 514 HH11 ARG 66 1HH1 ARG 66 -6.205 14.679 -8.432 515 HH12 ARG 66 2HH1 ARG 66 -7.693 14.301 -9.245 516 HH21 ARG 66 1HH2 ARG 66 -7.995 10.997 -7.993 517 HH22 ARG 66 2HH2 ARG 66 -8.565 12.188 -9.128 518 H GLY 67 H GLY 67 -2.756 9.215 -5.771 519 HA2 GLY 67 2HA GLY 67 -1.818 7.582 -7.835 520 HA3 GLY 67 1HA GLY 67 -0.852 7.193 -6.407 521 H VAL 68 H VAL 68 -1.954 5.088 -6.951 522 HA VAL 68 HA VAL 68 -4.124 4.767 -4.997 523 HB VAL 68 HB VAL 68 -3.736 2.854 -7.312 524 HG11 VAL 68 1HG1 VAL 68 -6.142 3.148 -5.511 525 HG12 VAL 68 2HG1 VAL 68 -5.867 1.947 -6.778 526 HG13 VAL 68 3HG1 VAL 68 -4.875 1.899 -5.339 527 HG21 VAL 68 3HG2 VAL 68 -5.772 5.100 -7.240 528 HG22 VAL 68 1HG2 VAL 68 -4.446 4.871 -8.421 529 HG23 VAL 68 2HG2 VAL 68 -5.773 3.719 -8.381 530 H PHE 69 H PHE 69 -3.685 2.947 -3.628 531 HA PHE 69 HA PHE 69 -1.201 1.447 -4.178 532 HB2 PHE 69 1HB PHE 69 -0.574 2.940 -2.390 533 HB3 PHE 69 2HB PHE 69 -2.025 2.615 -1.510 534 HD1 PHE 69 1HD PHE 69 0.629 0.488 -3.107 535 HD2 PHE 69 2HD PHE 69 -1.574 1.406 0.492 536 HE1 PHE 69 1HE PHE 69 1.681 -1.423 -1.976 537 HE2 PHE 69 2HE PHE 69 -0.388 -0.415 1.661 538 HZ PHE 69 HZ PHE 69 1.133 -1.932 0.400 539 H GLN 70 H GLN 70 -1.454 -0.776 -3.695 540 HA GLN 70 HA GLN 70 -4.184 -1.685 -3.013 541 HB2 GLN 70 1HB GLN 70 -4.139 -1.459 -5.416 542 HB3 GLN 70 2HB GLN 70 -2.578 -2.276 -5.523 543 HG2 GLN 70 1HG GLN 70 -3.569 -4.409 -4.895 544 HG3 GLN 70 2HG GLN 70 -5.122 -3.638 -4.565 545 HE21 GLN 70 1HE2 GLN 70 -6.542 -3.235 -6.278 546 HE22 GLN 70 2HE2 GLN 70 -6.182 -3.594 -7.947 547 H VAL 71 H VAL 71 -4.132 -3.723 -1.932 548 HA VAL 71 HA VAL 71 -1.645 -5.275 -2.083 549 HB VAL 71 HB VAL 71 -1.320 -4.138 -0.033 550 HG11 VAL 71 1HG1 VAL 71 -2.732 -4.177 1.858 551 HG12 VAL 71 2HG1 VAL 71 -3.728 -3.625 0.521 552 HG13 VAL 71 3HG1 VAL 71 -3.890 -5.293 1.102 553 HG21 VAL 71 3HG2 VAL 71 -2.177 -7.029 0.486 554 HG22 VAL 71 1HG2 VAL 71 -0.624 -6.498 -0.205 555 HG23 VAL 71 2HG2 VAL 71 -1.051 -6.071 1.459 556 H ASN 72 H ASN 72 -2.463 -6.675 -3.431 557 HA ASN 72 HA ASN 72 -5.114 -7.925 -2.945 558 HB2 ASN 72 1HB ASN 72 -3.005 -8.109 -5.124 559 HB3 ASN 72 2HB ASN 72 -4.199 -9.378 -4.919 560 HD21 ASN 72 1HD2 ASN 72 -4.123 -7.884 -7.316 561 HD22 ASN 72 2HD2 ASN 72 -5.581 -6.930 -7.404 562 H VAL 73 H VAL 73 -4.891 -8.879 -0.981 563 HA VAL 73 HA VAL 73 -2.678 -10.637 -0.319 564 HB VAL 73 HB VAL 73 -3.688 -9.615 1.501 565 HG11 VAL 73 1HG1 VAL 73 -5.900 -8.983 0.568 566 HG12 VAL 73 2HG1 VAL 73 -6.374 -10.702 0.693 567 HG13 VAL 73 3HG1 VAL 73 -6.017 -9.761 2.148 568 HG21 VAL 73 3HG2 VAL 73 -4.914 -12.429 1.468 569 HG22 VAL 73 1HG2 VAL 73 -3.210 -12.074 1.761 570 HG23 VAL 73 2HG2 VAL 73 -4.448 -11.499 2.891 571 H VAL 74 H VAL 74 -2.480 -12.725 -0.665 572 HA VAL 74 HA VAL 74 -4.594 -14.240 -2.057 573 HB VAL 74 HB VAL 74 -1.561 -14.324 -2.425 574 HG11 VAL 74 1HG1 VAL 74 -2.560 -16.582 -2.682 575 HG12 VAL 74 2HG1 VAL 74 -3.722 -15.896 -3.860 576 HG13 VAL 74 3HG1 VAL 74 -1.984 -15.953 -4.229 577 HG21 VAL 74 3HG2 VAL 74 -2.789 -12.406 -3.650 578 HG22 VAL 74 1HG2 VAL 74 -1.870 -13.531 -4.659 579 HG23 VAL 74 2HG2 VAL 74 -3.636 -13.662 -4.553 580 H MET 75 H MET 75 -4.954 -16.270 -1.089 581 HA MET 75 HA MET 75 -2.929 -17.461 0.576 582 HB2 MET 75 1HB MET 75 -4.194 -17.920 2.495 583 HB3 MET 75 2HB MET 75 -4.240 -16.182 2.275 584 HG2 MET 75 1HG MET 75 -6.494 -17.791 1.166 585 HG3 MET 75 2HG MET 75 -6.348 -17.676 2.909 586 HE1 MET 75 3HE MET 75 -7.212 -15.947 -0.370 587 HE2 MET 75 1HE MET 75 -8.617 -16.557 0.529 588 HE3 MET 75 2HE MET 75 -8.429 -14.806 0.236 589 HA PRO 76 HA PRO 76 -4.524 -20.707 -1.936 590 HB2 PRO 76 1HB PRO 76 -3.795 -23.009 -0.724 591 HB3 PRO 76 2HB PRO 76 -2.574 -21.838 -1.326 592 HG2 PRO 76 1HG PRO 76 -3.647 -22.109 1.498 593 HG3 PRO 76 2HG PRO 76 -1.942 -22.060 0.962 594 HD2 PRO 76 1HD PRO 76 -3.263 -19.830 1.844 595 HD3 PRO 76 2HD PRO 76 -2.056 -19.746 0.534 596 H ILE 77 H ILE 77 -6.298 -22.137 -2.205 597 HA ILE 77 HA ILE 77 -8.387 -21.734 -0.203 598 HB ILE 77 HB ILE 77 -8.684 -23.088 -2.873 599 HG12 ILE 77 1HG1 ILE 77 -9.135 -20.155 -2.103 600 HG13 ILE 77 2HG1 ILE 77 -7.802 -20.740 -3.065 601 HG21 ILE 77 1HG2 ILE 77 -11.067 -22.471 -2.481 602 HG22 ILE 77 2HG2 ILE 77 -10.491 -23.504 -1.180 603 HG23 ILE 77 3HG2 ILE 77 -10.654 -21.754 -0.917 604 HD11 ILE 77 3HD1 ILE 77 -9.292 -21.487 -4.831 605 HD12 ILE 77 1HD1 ILE 77 -10.693 -20.845 -3.922 606 HD13 ILE 77 2HD1 ILE 77 -9.434 -19.755 -4.509 607 H GLY 78 H GLY 78 -7.147 -22.940 1.377 608 HA2 GLY 78 2HA GLY 78 -6.796 -25.804 1.163 609 HA3 GLY 78 1HA GLY 78 -6.637 -24.821 2.635 610 H ASP 79 H ASP 79 -8.776 -24.012 3.595 611 HA ASP 79 HA ASP 79 -11.106 -25.771 2.985 612 HB2 ASP 79 1HB ASP 79 -10.015 -26.615 5.023 613 HB3 ASP 79 2HB ASP 79 -10.150 -25.045 5.773 614 H GLY 80 H GLY 80 -11.878 -24.134 1.735 615 HA2 GLY 80 2HA GLY 80 -13.066 -22.301 1.168 616 HA3 GLY 80 1HA GLY 80 -13.487 -22.150 2.875 617 H SER 81 H SER 81 -10.199 -21.848 3.036 618 HA SER 81 HA SER 81 -8.910 -20.246 3.671 619 HB2 SER 81 1HB SER 81 -8.162 -19.010 1.748 620 HB3 SER 81 2HB SER 81 -8.359 -20.725 1.473 621 HG SER 81 HG SER 81 -10.564 -19.180 0.874 622 H ARG 82 H ARG 82 -10.005 -19.230 5.362 623 HA ARG 82 HA ARG 82 -11.708 -16.891 4.693 624 HB2 ARG 82 1HB ARG 82 -11.313 -18.537 7.195 625 HB3 ARG 82 2HB ARG 82 -12.181 -17.016 7.193 626 HG2 ARG 82 1HG ARG 82 -13.747 -18.844 7.081 627 HG3 ARG 82 2HG ARG 82 -13.848 -17.857 5.616 628 HD2 ARG 82 1HD ARG 82 -12.639 -19.497 4.337 629 HD3 ARG 82 2HD ARG 82 -12.209 -20.404 5.789 630 HE ARG 82 HE ARG 82 -14.733 -20.385 4.271 631 HH11 ARG 82 1HH1 ARG 82 -13.177 -21.528 7.319 632 HH12 ARG 82 2HH1 ARG 82 -14.055 -23.033 7.274 633 HH21 ARG 82 1HH2 ARG 82 -15.659 -22.605 4.240 634 HH22 ARG 82 2HH2 ARG 82 -15.483 -23.554 5.670 635 H SER 83 H SER 83 -8.426 -17.345 5.346 636 HA SER 83 HA SER 83 -7.887 -15.554 7.316 637 HB2 SER 83 1HB SER 83 -6.416 -17.251 5.707 638 HB3 SER 83 2HB SER 83 -5.766 -15.682 5.247 639 HG SER 83 HG SER 83 -4.632 -16.529 6.984 640 H ALA 84 H ALA 84 -8.998 -14.420 4.275 641 HA ALA 84 HA ALA 84 -7.746 -11.864 4.110 642 HB1 ALA 84 1HB ALA 84 -10.564 -12.823 3.427 643 HB2 ALA 84 2HB ALA 84 -9.944 -11.249 3.003 644 HB3 ALA 84 3HB ALA 84 -9.166 -12.695 2.313 645 H GLU 85 H GLU 85 -10.181 -13.196 6.293 646 HA GLU 85 HA GLU 85 -11.473 -10.755 6.974 647 HB2 GLU 85 1HB GLU 85 -11.269 -13.536 8.233 648 HB3 GLU 85 2HB GLU 85 -12.397 -12.279 8.800 649 HG2 GLU 85 1HG GLU 85 -13.472 -12.131 6.764 650 HG3 GLU 85 2HG GLU 85 -12.285 -12.996 5.821 651 H GLN 86 H GLN 86 -8.887 -12.534 8.336 652 HA GLN 86 HA GLN 86 -8.294 -10.749 10.569 653 HB2 GLN 86 1HB GLN 86 -6.895 -13.034 9.171 654 HB3 GLN 86 2HB GLN 86 -5.874 -11.848 9.928 655 HG2 GLN 86 1HG GLN 86 -7.831 -12.418 11.903 656 HG3 GLN 86 2HG GLN 86 -7.443 -13.963 11.156 657 HE21 GLN 86 1HE2 GLN 86 -5.936 -11.069 12.612 658 HE22 GLN 86 2HE2 GLN 86 -4.527 -11.881 13.268 659 H VAL 87 H VAL 87 -6.815 -11.178 7.326 660 HA VAL 87 HA VAL 87 -4.951 -9.099 7.644 661 HB VAL 87 HB VAL 87 -6.074 -10.521 5.196 662 HG11 VAL 87 1HG1 VAL 87 -3.932 -9.723 4.058 663 HG12 VAL 87 2HG1 VAL 87 -5.188 -8.516 4.288 664 HG13 VAL 87 3HG1 VAL 87 -3.765 -8.556 5.377 665 HG21 VAL 87 3HG2 VAL 87 -3.924 -11.739 5.283 666 HG22 VAL 87 1HG2 VAL 87 -3.430 -10.801 6.695 667 HG23 VAL 87 2HG2 VAL 87 -4.791 -11.931 6.814 668 H ALA 88 H ALA 88 -8.230 -8.876 6.228 669 HA ALA 88 HA ALA 88 -7.897 -6.232 5.242 670 HB1 ALA 88 1HB ALA 88 -10.417 -7.674 6.217 671 HB2 ALA 88 2HB ALA 88 -10.390 -6.180 5.256 672 HB3 ALA 88 3HB ALA 88 -9.783 -7.682 4.558 673 H ALA 89 H ALA 89 -8.637 -7.452 8.502 674 HA ALA 89 HA ALA 89 -9.501 -4.809 9.468 675 HB1 ALA 89 1HB ALA 89 -10.483 -6.861 10.405 676 HB2 ALA 89 2HB ALA 89 -8.870 -7.421 10.915 677 HB3 ALA 89 3HB ALA 89 -9.573 -5.955 11.639 678 H GLU 90 H GLU 90 -6.676 -6.934 9.640 679 HA GLU 90 HA GLU 90 -5.107 -5.442 11.489 680 HB2 GLU 90 1HB GLU 90 -4.699 -7.592 9.408 681 HB3 GLU 90 2HB GLU 90 -3.271 -6.786 10.012 682 HG2 GLU 90 1HG GLU 90 -5.315 -7.705 12.032 683 HG3 GLU 90 2HG GLU 90 -4.337 -8.932 11.224 684 H LEU 91 H LEU 91 -4.916 -5.580 7.937 685 HA LEU 91 HA LEU 91 -3.120 -3.397 7.594 686 HB2 LEU 91 1HB LEU 91 -5.315 -4.505 5.805 687 HB3 LEU 91 2HB LEU 91 -4.186 -3.263 5.278 688 HG LEU 91 HG LEU 91 -3.168 -5.927 6.345 689 HD11 LEU 91 1HD1 LEU 91 -4.732 -6.401 4.563 690 HD12 LEU 91 2HD1 LEU 91 -3.084 -6.673 3.982 691 HD13 LEU 91 3HD1 LEU 91 -3.975 -5.206 3.499 692 HD21 LEU 91 3HD2 LEU 91 -1.213 -5.355 4.925 693 HD22 LEU 91 1HD2 LEU 91 -1.496 -4.118 6.152 694 HD23 LEU 91 2HD2 LEU 91 -1.983 -3.829 4.462 695 H ASP 92 H ASP 92 -6.776 -3.375 7.763 696 HA ASP 92 HA ASP 92 -7.004 -0.642 7.146 697 HB2 ASP 92 1HB ASP 92 -9.031 -1.856 7.129 698 HB3 ASP 92 2HB ASP 92 -8.755 -2.500 8.747 699 H ALA 93 H ALA 93 -6.814 -2.195 10.378 700 HA ALA 93 HA ALA 93 -6.812 0.228 11.840 701 HB1 ALA 93 1HB ALA 93 -7.391 -1.961 12.788 702 HB2 ALA 93 2HB ALA 93 -5.723 -2.529 12.553 703 HB3 ALA 93 3HB ALA 93 -6.066 -1.218 13.705 704 H LEU 94 H LEU 94 -4.333 -1.061 9.866 705 HA LEU 94 HA LEU 94 -2.171 0.240 11.352 706 HB2 LEU 94 1HB LEU 94 -1.968 -2.005 10.168 707 HB3 LEU 94 2HB LEU 94 -2.020 -1.158 8.650 708 HG LEU 94 HG LEU 94 0.203 -1.887 9.403 709 HD11 LEU 94 1HD1 LEU 94 1.520 -0.066 8.801 710 HD12 LEU 94 2HD1 LEU 94 0.313 1.127 9.309 711 HD13 LEU 94 3HD1 LEU 94 0.020 0.106 7.889 712 HD21 LEU 94 3HD2 LEU 94 1.384 -0.795 11.245 713 HD22 LEU 94 1HD2 LEU 94 -0.116 -1.546 11.824 714 HD23 LEU 94 2HD2 LEU 94 -0.029 0.209 11.585 715 H PHE 95 H PHE 95 -4.213 0.742 8.491 716 HA PHE 95 HA PHE 95 -2.685 3.187 7.753 717 HB2 PHE 95 1HB PHE 95 -4.319 1.289 6.027 718 HB3 PHE 95 2HB PHE 95 -3.796 2.861 5.511 719 HD1 PHE 95 2HD PHE 95 -2.469 -0.464 6.626 720 HD2 PHE 95 1HD PHE 95 -1.696 3.195 4.509 721 HE1 PHE 95 2HE PHE 95 -0.437 -1.467 5.665 722 HE2 PHE 95 1HE PHE 95 0.266 2.180 3.477 723 HZ PHE 95 HZ PHE 95 0.953 -0.132 4.054 724 HA PRO 96 HA PRO 96 -6.824 4.731 9.273 725 HB2 PRO 96 1HB PRO 96 -5.976 6.893 10.677 726 HB3 PRO 96 2HB PRO 96 -5.749 5.221 11.305 727 HG2 PRO 96 1HG PRO 96 -3.720 6.872 9.750 728 HG3 PRO 96 2HG PRO 96 -3.521 6.124 11.367 729 HD2 PRO 96 1HD PRO 96 -2.719 4.803 9.160 730 HD3 PRO 96 2HD PRO 96 -3.584 3.931 10.465 731 H VAL 97 H VAL 97 -7.851 6.920 8.911 732 HA VAL 97 HA VAL 97 -7.671 7.655 6.224 733 HB VAL 97 HB VAL 97 -9.605 7.485 7.814 734 HG11 VAL 97 1HG1 VAL 97 -8.696 9.070 9.547 735 HG12 VAL 97 2HG1 VAL 97 -9.019 10.401 8.427 736 HG13 VAL 97 3HG1 VAL 97 -10.360 9.403 9.022 737 HG21 VAL 97 3HG2 VAL 97 -9.800 8.209 5.468 738 HG22 VAL 97 1HG2 VAL 97 -11.007 8.924 6.544 739 HG23 VAL 97 2HG2 VAL 97 -9.628 9.896 5.986 740 H ASN 98 H ASN 98 -5.318 8.399 7.951 741 HA ASN 98 HA ASN 98 -4.974 11.272 7.197 742 HB2 ASN 98 1HB ASN 98 -3.969 9.777 9.683 743 HB3 ASN 98 2HB ASN 98 -3.626 11.451 9.315 744 HD21 ASN 98 1HD2 ASN 98 -5.711 12.917 9.066 745 HD22 ASN 98 2HD2 ASN 98 -7.055 12.475 10.147 746 H LEU 99 H LEU 99 -3.312 8.122 7.799 747 HA LEU 99 HA LEU 99 -1.204 7.451 7.348 748 HB2 LEU 99 1HB LEU 99 -2.654 8.097 4.962 749 HB3 LEU 99 2HB LEU 99 -0.967 8.306 4.634 750 HG LEU 99 HG LEU 99 -0.519 6.028 5.560 751 HD11 LEU 99 1HD1 LEU 99 -2.688 5.916 6.923 752 HD12 LEU 99 2HD1 LEU 99 -2.083 4.491 6.129 753 HD13 LEU 99 3HD1 LEU 99 -3.449 5.384 5.420 754 HD21 LEU 99 3HD2 LEU 99 -0.991 6.646 3.059 755 HD22 LEU 99 1HD2 LEU 99 -2.378 5.576 3.305 756 HD23 LEU 99 2HD2 LEU 99 -0.742 4.989 3.599 757 H VAL 100 H VAL 100 -0.584 9.123 8.936 758 HA VAL 100 HA VAL 100 1.000 11.366 7.916 759 HB VAL 100 HB VAL 100 0.851 10.215 10.734 760 HG11 VAL 100 1HG1 VAL 100 1.824 12.362 11.415 761 HG12 VAL 100 2HG1 VAL 100 2.911 11.566 10.276 762 HG13 VAL 100 3HG1 VAL 100 1.892 12.907 9.716 763 HG21 VAL 100 3HG2 VAL 100 -0.597 12.199 11.193 764 HG22 VAL 100 1HG2 VAL 100 -0.617 12.570 9.454 765 HG23 VAL 100 2HG2 VAL 100 -1.344 11.070 10.064 766 H MET 101 H MET 101 2.167 10.196 6.444 767 HA MET 101 HA MET 101 4.464 8.574 7.499 768 HB2 MET 101 1HB MET 101 3.375 8.942 4.682 769 HB3 MET 101 2HB MET 101 4.817 8.016 5.100 770 HG2 MET 101 1HG MET 101 3.482 6.482 6.480 771 HG3 MET 101 2HG MET 101 2.018 7.386 6.103 772 HE1 MET 101 3HE MET 101 1.049 7.719 3.780 773 HE2 MET 101 1HE MET 101 2.523 7.965 2.842 774 HE3 MET 101 2HE MET 101 1.390 6.693 2.358 775 H GLN 102 H GLN 102 5.794 10.217 8.287 776 HA GLN 102 HA GLN 102 6.346 12.610 6.692 777 HB2 GLN 102 1HB GLN 102 7.908 13.138 8.411 778 HB3 GLN 102 2HB GLN 102 6.410 12.597 9.148 779 HG2 GLN 102 1HG GLN 102 7.552 10.348 9.561 780 HG3 GLN 102 2HG GLN 102 9.033 11.068 8.943 781 HE21 GLN 102 1HE2 GLN 102 10.353 11.613 10.603 782 HE22 GLN 102 2HE2 GLN 102 9.915 12.490 12.034 783 H SER 103 H SER 103 8.330 12.960 5.472 784 HA SER 103 HA SER 103 10.088 10.662 5.027 785 HB2 SER 103 1HB SER 103 9.340 11.624 2.424 786 HB3 SER 103 2HB SER 103 9.287 10.009 3.056 787 HG SER 103 HG SER 103 7.237 12.005 3.256 788 H GLY 104 H GLY 104 11.870 11.279 3.490 789 HA2 GLY 104 2HA GLY 104 13.205 13.680 4.105 790 HA3 GLY 104 1HA GLY 104 13.607 12.560 2.839 791 H GLY 105 H GLY 105 10.432 13.993 2.490 792 HA2 GLY 105 2HA GLY 105 11.413 15.920 0.451 793 HA3 GLY 105 1HA GLY 105 10.229 14.614 0.096 794 H LEU 106 H LEU 106 8.551 14.513 2.162 795 HA LEU 106 HA LEU 106 7.204 16.851 2.876 796 HB2 LEU 106 1HB LEU 106 5.648 17.065 1.114 797 HB3 LEU 106 2HB LEU 106 7.196 17.161 0.360 798 HG LEU 106 HG LEU 106 5.305 14.771 0.310 799 HD11 LEU 106 1HD1 LEU 106 5.294 15.280 -2.111 800 HD12 LEU 106 2HD1 LEU 106 6.378 16.650 -1.823 801 HD13 LEU 106 3HD1 LEU 106 4.737 16.653 -1.116 802 HD21 LEU 106 3HD2 LEU 106 6.918 13.812 -1.364 803 HD22 LEU 106 1HD2 LEU 106 7.444 13.715 0.311 804 HD23 LEU 106 2HD2 LEU 106 8.121 14.962 -0.780 805 H ALA 107 H ALA 107 4.671 15.985 2.571 806 HA ALA 107 HA ALA 107 4.526 13.546 4.244 807 HB1 ALA 107 1HB ALA 107 2.399 14.741 5.055 808 HB2 ALA 107 2HB ALA 107 3.933 15.556 5.435 809 HB3 ALA 107 3HB ALA 107 2.918 16.136 4.103 810 H VAL 108 H VAL 108 1.987 12.774 4.108 811 HA VAL 108 HA VAL 108 1.104 12.641 1.302 812 HB VAL 108 HB VAL 108 1.369 10.165 3.035 813 HG11 VAL 108 1HG1 VAL 108 1.480 10.504 0.004 814 HG12 VAL 108 2HG1 VAL 108 1.449 8.983 0.920 815 HG13 VAL 108 3HG1 VAL 108 0.032 10.020 0.920 816 HG21 VAL 108 3HG2 VAL 108 3.699 10.916 2.968 817 HG22 VAL 108 1HG2 VAL 108 3.493 9.557 1.900 818 HG23 VAL 108 2HG2 VAL 108 3.593 11.178 1.210 819 H ARG 109 H ARG 109 -1.221 11.668 1.312 820 HA ARG 109 HA ARG 109 -2.153 11.117 4.013 821 HB2 ARG 109 1HB ARG 109 -2.996 13.526 3.046 822 HB3 ARG 109 2HB ARG 109 -4.163 12.486 2.224 823 HG2 ARG 109 1HG ARG 109 -4.704 11.469 4.493 824 HG3 ARG 109 2HG ARG 109 -3.756 12.802 5.195 825 HD2 ARG 109 1HD ARG 109 -5.228 14.451 4.252 826 HD3 ARG 109 2HD ARG 109 -6.100 13.237 3.310 827 HE ARG 109 HE ARG 109 -6.754 12.189 5.521 828 HH11 ARG 109 1HH1 ARG 109 -6.129 15.759 5.369 829 HH12 ARG 109 2HH1 ARG 109 -6.979 16.057 6.800 830 HH21 ARG 109 1HH2 ARG 109 -8.016 12.653 7.291 831 HH22 ARG 109 2HH2 ARG 109 -8.175 14.266 7.897 832 H VAL 110 H VAL 110 -3.739 9.431 3.960 833 HA VAL 110 HA VAL 110 -3.843 7.796 1.568 834 HB VAL 110 HB VAL 110 -3.908 6.921 3.896 835 HG11 VAL 110 1HG1 VAL 110 -6.682 8.148 3.949 836 HG12 VAL 110 2HG1 VAL 110 -6.059 6.948 5.078 837 HG13 VAL 110 3HG1 VAL 110 -5.282 8.540 4.980 838 HG21 VAL 110 3HG2 VAL 110 -5.560 5.182 3.638 839 HG22 VAL 110 1HG2 VAL 110 -6.290 6.044 2.267 840 HG23 VAL 110 2HG2 VAL 110 -4.611 5.451 2.175 841 H ARG 111 H ARG 111 -5.608 10.542 2.653 842 HA ARG 111 HA ARG 111 -7.194 11.814 1.737 843 HB2 ARG 111 1HB ARG 111 -5.902 11.173 -0.317 844 HB3 ARG 111 2HB ARG 111 -7.196 10.051 -0.715 845 HG2 ARG 111 1HG ARG 111 -8.824 11.872 -0.868 846 HG3 ARG 111 2HG ARG 111 -7.701 12.982 -0.064 847 HD2 ARG 111 1HD ARG 111 -7.176 13.692 -2.092 848 HD3 ARG 111 2HD ARG 111 -6.148 12.270 -2.122 849 HE ARG 111 HE ARG 111 -7.918 11.071 -3.335 850 HH11 ARG 111 1HH1 ARG 111 -7.861 14.642 -3.558 851 HH12 ARG 111 2HH1 ARG 111 -8.680 14.681 -5.080 852 HH21 ARG 111 1HH2 ARG 111 -8.931 11.125 -5.285 853 HH22 ARG 111 2HH2 ARG 111 -9.433 12.616 -6.042 854 H THR 112 H THR 112 -8.002 8.301 1.211 855 HA THR 112 HA THR 112 -10.740 8.890 2.206 856 HB THR 112 HB THR 112 -11.398 7.114 0.608 857 HG1 THR 112 1HG THR 112 -9.579 5.979 0.264 858 HG21 THR 112 3HG2 THR 112 -11.344 8.544 -1.333 859 HG22 THR 112 1HG2 THR 112 -9.830 9.321 -0.842 860 HG23 THR 112 2HG2 THR 112 -11.346 9.629 0.038 861 HA PRO 113 HA PRO 113 -10.045 5.593 5.101 862 HB2 PRO 113 1HB PRO 113 -12.449 4.264 5.201 863 HB3 PRO 113 2HB PRO 113 -12.178 5.875 5.928 864 HG2 PRO 113 1HG PRO 113 -13.389 5.227 3.225 865 HG3 PRO 113 2HG PRO 113 -14.013 6.351 4.478 866 HD2 PRO 113 1HD PRO 113 -12.580 7.236 2.357 867 HD3 PRO 113 2HD PRO 113 -12.384 7.972 3.970 868 H ILE 114 H ILE 114 -9.964 3.211 5.205 869 HA ILE 114 HA ILE 114 -9.097 1.913 2.784 870 HB ILE 114 HB ILE 114 -9.952 0.794 5.494 871 HG12 ILE 114 1HG1 ILE 114 -8.062 2.487 5.540 872 HG13 ILE 114 2HG1 ILE 114 -7.744 0.971 6.266 873 HG21 ILE 114 1HG2 ILE 114 -8.482 -1.156 4.937 874 HG22 ILE 114 2HG2 ILE 114 -9.935 -1.051 3.960 875 HG23 ILE 114 3HG2 ILE 114 -8.380 -0.559 3.258 876 HD11 ILE 114 3HD1 ILE 114 -6.951 1.500 3.421 877 HD12 ILE 114 1HD1 ILE 114 -5.961 2.060 4.756 878 HD13 ILE 114 2HD1 ILE 114 -6.275 0.313 4.577 879 H SER 115 H SER 115 -10.266 0.252 1.601 880 HA SER 115 HA SER 115 -13.088 -0.140 2.313 881 HB2 SER 115 1HB SER 115 -12.217 0.318 -0.544 882 HB3 SER 115 2HB SER 115 -13.846 0.049 0.038 883 HG SER 115 HG SER 115 -12.285 2.270 0.894 884 H ASN 116 H ASN 116 -13.820 -2.122 0.752 885 HA ASN 116 HA ASN 116 -11.836 -4.246 0.702 886 HB2 ASN 116 1HB ASN 116 -12.316 -4.011 3.100 887 HB3 ASN 116 2HB ASN 116 -14.029 -3.706 2.777 888 HD21 ASN 116 1HD2 ASN 116 -11.735 -6.303 1.630 889 HD22 ASN 116 2HD2 ASN 116 -12.951 -7.513 1.952 890 H GLY 117 H GLY 117 -12.877 -5.999 -0.588 891 HA2 GLY 117 2HA GLY 117 -15.717 -5.623 -1.370 892 HA3 GLY 117 1HA GLY 117 -14.470 -5.682 -2.620 893 H GLN 118 H GLN 118 -16.392 -7.493 -2.847 894 HA GLN 118 HA GLN 118 -15.982 -9.970 -1.526 895 HB2 GLN 118 1HB GLN 118 -17.548 -8.891 -3.799 896 HB3 GLN 118 2HB GLN 118 -17.003 -10.508 -4.106 897 HG2 GLN 118 1HG GLN 118 -18.365 -9.818 -1.486 898 HG3 GLN 118 2HG GLN 118 -19.306 -10.104 -2.948 899 HE21 GLN 118 1HE2 GLN 118 -18.615 -11.620 -0.228 900 HE22 GLN 118 2HE2 GLN 118 -18.690 -13.259 -0.790 901 HA PRO 119 HA PRO 119 -12.285 -11.167 -3.697 902 HB2 PRO 119 1HB PRO 119 -12.908 -13.998 -3.682 903 HB3 PRO 119 2HB PRO 119 -11.731 -13.126 -2.669 904 HG2 PRO 119 1HG PRO 119 -14.171 -14.266 -1.755 905 HG3 PRO 119 2HG PRO 119 -13.210 -13.052 -0.895 906 HD2 PRO 119 1HD PRO 119 -15.678 -12.655 -2.510 907 HD3 PRO 119 2HD PRO 119 -15.076 -11.742 -1.108 908 H THR 120 H THR 120 -11.568 -12.474 -5.604 909 HA THR 120 HA THR 120 -13.725 -13.144 -7.531 910 HB THR 120 HB THR 120 -13.048 -10.871 -7.993 911 HG1 THR 120 1HG THR 120 -12.426 -12.933 -9.764 912 HG21 THR 120 3HG2 THR 120 -10.817 -10.319 -8.774 913 HG22 THR 120 1HG2 THR 120 -10.277 -11.990 -8.472 914 HG23 THR 120 2HG2 THR 120 -10.741 -10.934 -7.119 915 H THR 121 H THR 121 -11.630 -14.464 -5.728 916 HA THR 121 HA THR 121 -10.411 -16.341 -5.661 917 HB THR 121 HB THR 121 -12.031 -17.296 -8.023 918 HG1 THR 121 1HG THR 121 -13.822 -17.165 -6.823 919 HG21 THR 121 3HG2 THR 121 -12.454 -19.216 -6.447 920 HG22 THR 121 1HG2 THR 121 -11.390 -18.451 -5.250 921 HG23 THR 121 2HG2 THR 121 -10.738 -19.050 -6.785 922 H GLY 122 H GLY 122 -9.543 -18.211 -7.621 923 HA2 GLY 122 2HA GLY 122 -7.774 -17.186 -9.558 924 HA3 GLY 122 1HA GLY 122 -6.958 -17.534 -8.024 925 H ASP 123 H ASP 123 -5.934 -19.256 -9.336 926 HA ASP 123 HA ASP 123 -7.483 -21.379 -10.493 927 HB2 ASP 123 1HB ASP 123 -4.989 -20.611 -10.850 928 HB3 ASP 123 2HB ASP 123 -4.637 -21.719 -9.557 929 H ALA 124 H ALA 124 -5.470 -21.277 -7.500 930 HA ALA 124 HA ALA 124 -7.425 -22.844 -5.988 931 HB1 ALA 124 1HB ALA 124 -5.720 -24.457 -5.272 932 HB2 ALA 124 2HB ALA 124 -5.922 -24.536 -7.035 933 HB3 ALA 124 3HB ALA 124 -4.513 -23.699 -6.348 934 H ASP 125 H ASP 125 -6.411 -20.032 -6.133 935 HA ASP 125 HA ASP 125 -5.854 -19.808 -3.266 936 HB2 ASP 125 1HB ASP 125 -4.597 -17.915 -5.228 937 HB3 ASP 125 2HB ASP 125 -4.420 -17.980 -3.493 938 H HIS 126 H HIS 126 -6.946 -18.033 -2.486 939 HA HIS 126 HA HIS 126 -8.986 -16.838 -4.314 940 HB2 HIS 126 1HB HIS 126 -9.031 -17.522 -1.452 941 HB3 HIS 126 2HB HIS 126 -9.432 -15.830 -1.739 942 HD1 HIS 126 1HD HIS 126 -11.547 -15.432 -3.593 943 HD2 HIS 126 2HD HIS 126 -11.095 -19.037 -1.486 944 HE1 HIS 126 1HE HIS 126 -13.772 -16.594 -3.734 945 H THR 127 H THR 127 -9.022 -14.535 -4.535 946 HA THR 127 HA THR 127 -7.084 -13.010 -2.952 947 HB THR 127 HB THR 127 -7.550 -12.219 -5.821 948 HG1 THR 127 1HG THR 127 -5.767 -13.348 -6.473 949 HG21 THR 127 3HG2 THR 127 -5.120 -12.040 -3.993 950 HG22 THR 127 1HG2 THR 127 -6.312 -10.740 -4.215 951 HG23 THR 127 2HG2 THR 127 -5.304 -11.274 -5.583 952 H VAL 128 H VAL 128 -8.000 -11.356 -2.048 953 HA VAL 128 HA VAL 128 -10.673 -10.372 -2.880 954 HB VAL 128 HB VAL 128 -10.463 -9.306 -0.515 955 HG11 VAL 128 1HG1 VAL 128 -12.137 -10.942 -1.021 956 HG12 VAL 128 2HG1 VAL 128 -10.951 -12.269 -0.775 957 HG13 VAL 128 3HG1 VAL 128 -11.456 -11.243 0.582 958 HG21 VAL 128 3HG2 VAL 128 -9.261 -10.544 1.157 959 HG22 VAL 128 1HG2 VAL 128 -8.552 -11.615 -0.043 960 HG23 VAL 128 2HG2 VAL 128 -8.175 -9.857 -0.047 961 HA PRO 129 HA PRO 129 -8.445 -6.650 -3.976 962 HB2 PRO 129 1HB PRO 129 -10.550 -4.946 -4.262 963 HB3 PRO 129 2HB PRO 129 -10.244 -6.279 -5.413 964 HG2 PRO 129 1HG PRO 129 -12.200 -6.249 -3.088 965 HG3 PRO 129 2HG PRO 129 -12.477 -6.811 -4.767 966 HD2 PRO 129 1HD PRO 129 -11.871 -8.474 -2.700 967 HD3 PRO 129 2HD PRO 129 -11.368 -8.805 -4.389 968 H ILE 130 H ILE 130 -7.354 -5.302 -2.570 969 HA ILE 130 HA ILE 130 -8.986 -3.674 -0.820 970 HB ILE 130 HB ILE 130 -6.346 -4.358 0.397 971 HG12 ILE 130 1HG1 ILE 130 -8.704 -6.270 0.705 972 HG13 ILE 130 2HG1 ILE 130 -7.121 -6.608 -0.017 973 HG21 ILE 130 1HG2 ILE 130 -7.555 -3.790 2.437 974 HG22 ILE 130 2HG2 ILE 130 -8.022 -2.612 1.219 975 HG23 ILE 130 3HG2 ILE 130 -9.118 -3.948 1.619 976 HD11 ILE 130 3HD1 ILE 130 -6.996 -7.484 2.160 977 HD12 ILE 130 1HD1 ILE 130 -6.114 -5.961 2.262 978 HD13 ILE 130 2HD1 ILE 130 -7.789 -6.072 2.882 979 H SER 131 H SER 131 -8.294 -1.595 -1.025 980 HA SER 131 HA SER 131 -5.785 -0.701 -1.946 981 HB2 SER 131 1HB SER 131 -6.736 0.167 -4.261 982 HB3 SER 131 2HB SER 131 -6.159 -1.494 -4.132 983 HG SER 131 HG SER 131 -8.469 -1.896 -3.473 984 H LEU 132 H LEU 132 -5.804 1.655 -2.342 985 HA LEU 132 HA LEU 132 -8.216 3.211 -1.794 986 HB2 LEU 132 1HB LEU 132 -6.801 4.519 -0.098 987 HB3 LEU 132 2HB LEU 132 -7.673 3.110 0.440 988 HG LEU 132 HG LEU 132 -5.346 3.574 1.302 989 HD11 LEU 132 1HD1 LEU 132 -5.199 0.776 0.402 990 HD12 LEU 132 2HD1 LEU 132 -6.635 1.251 1.305 991 HD13 LEU 132 3HD1 LEU 132 -5.018 1.487 2.020 992 HD21 LEU 132 3HD2 LEU 132 -4.086 3.971 -0.787 993 HD22 LEU 132 1HD2 LEU 132 -4.340 2.288 -1.228 994 HD23 LEU 132 2HD2 LEU 132 -3.414 2.673 0.201 995 H GLY 133 H GLY 133 -7.731 5.617 -2.159 996 HA2 GLY 133 2HA GLY 133 -5.719 5.848 -4.367 997 HA3 GLY 133 1HA GLY 133 -7.268 6.634 -4.332 998 H TYR 134 H TYR 134 -4.042 6.799 -3.331 999 HA TYR 134 HA TYR 134 -4.439 8.708 -1.112 1000 HB2 TYR 134 1HB TYR 134 -2.050 8.455 -0.724 1001 HB3 TYR 134 2HB TYR 134 -2.770 6.912 -0.841 1002 HD1 TYR 134 2HD TYR 134 -0.726 9.379 -2.741 1003 HD2 TYR 134 1HD TYR 134 -2.025 5.273 -2.342 1004 HE1 TYR 134 2HE TYR 134 1.031 8.680 -4.347 1005 HE2 TYR 134 1HE TYR 134 -0.150 4.569 -3.865 1006 HH TYR 134 HH TYR 134 2.242 5.719 -4.495 1007 H ASP 135 H ASP 135 -2.997 10.672 -0.987 1008 HA ASP 135 HA ASP 135 -1.988 11.746 -3.442 1009 HB2 ASP 135 1HB ASP 135 -3.148 13.768 -3.521 1010 HB3 ASP 135 2HB ASP 135 -4.407 12.557 -3.407 1011 H VAL 136 H VAL 136 -1.294 14.196 -2.753 1012 HA VAL 136 HA VAL 136 0.862 13.336 -0.946 1013 HB VAL 136 HB VAL 136 1.007 13.988 -3.490 1014 HG11 VAL 136 1HG1 VAL 136 1.250 16.780 -2.311 1015 HG12 VAL 136 2HG1 VAL 136 1.605 16.309 -3.969 1016 HG13 VAL 136 3HG1 VAL 136 -0.057 16.204 -3.365 1017 HG21 VAL 136 3HG2 VAL 136 3.317 14.619 -3.186 1018 HG22 VAL 136 1HG2 VAL 136 3.011 14.848 -1.435 1019 HG23 VAL 136 2HG2 VAL 136 2.804 13.246 -2.187 1020 H GLN 137 H GLN 137 1.730 14.935 0.550 1021 HA GLN 137 HA GLN 137 0.244 17.418 0.802 1022 HB2 GLN 137 1HB GLN 137 0.283 15.242 2.867 1023 HB3 GLN 137 2HB GLN 137 0.820 16.836 3.465 1024 HG2 GLN 137 1HG GLN 137 -1.039 17.936 2.576 1025 HG3 GLN 137 2HG GLN 137 -1.584 16.460 1.733 1026 HE21 GLN 137 1HE2 GLN 137 -0.586 16.939 5.242 1027 HE22 GLN 137 2HE2 GLN 137 -2.138 16.399 5.832 1028 H PHE 138 H PHE 138 1.398 19.080 1.922 1029 HA PHE 138 HA PHE 138 4.047 18.563 2.813 1030 HB2 PHE 138 1HB PHE 138 5.172 19.874 1.291 1031 HB3 PHE 138 2HB PHE 138 4.105 18.855 0.303 1032 HD1 PHE 138 2HD PHE 138 2.008 19.776 -0.630 1033 HD2 PHE 138 1HD PHE 138 5.007 22.262 1.169 1034 HE1 PHE 138 2HE PHE 138 1.101 21.743 -1.866 1035 HE2 PHE 138 1HE PHE 138 4.112 24.249 -0.056 1036 HZ PHE 138 HZ PHE 138 2.163 23.983 -1.588 1037 H TYR 139 H TYR 139 4.717 20.427 4.119 1038 HA TYR 139 HA TYR 139 2.966 22.729 4.241 1039 HB2 TYR 139 1HB TYR 139 3.025 22.295 6.886 1040 HB3 TYR 139 2HB TYR 139 1.734 21.740 5.834 1041 HD1 TYR 139 1HD TYR 139 4.746 20.615 7.728 1042 HD2 TYR 139 2HD TYR 139 1.261 19.429 5.482 1043 HE1 TYR 139 1HE TYR 139 5.015 18.309 8.557 1044 HE2 TYR 139 2HE TYR 139 1.531 17.099 6.284 1045 HH TYR 139 HH TYR 139 4.075 16.154 8.655 1046 HA PRO 140 HA PRO 140 6.846 24.592 5.265 1047 HB2 PRO 140 1HB PRO 140 6.070 26.754 6.796 1048 HB3 PRO 140 2HB PRO 140 5.823 26.649 5.026 1049 HG2 PRO 140 1HG PRO 140 3.868 25.993 7.251 1050 HG3 PRO 140 2HG PRO 140 3.586 27.010 5.794 1051 HD2 PRO 140 1HD PRO 140 2.816 24.423 5.890 1052 HD3 PRO 140 2HD PRO 140 3.504 25.112 4.394 1053 H GLU 141 H GLU 141 8.121 25.448 7.228 1054 HA GLU 141 HA GLU 141 7.492 24.288 9.790 1055 HB2 GLU 141 1HB GLU 141 9.527 22.988 9.927 1056 HB3 GLU 141 2HB GLU 141 8.556 22.436 8.560 1057 HG2 GLU 141 1HG GLU 141 10.054 23.913 7.079 1058 HG3 GLU 141 2HG GLU 141 11.138 23.997 8.480 Start of MODEL 13 1 H1 GLY 1 H GLY 1 13.613 15.701 -8.646 2 HA2 GLY 1 2HA GLY 1 15.647 13.682 -7.870 3 HA3 GLY 1 1HA GLY 1 16.020 15.391 -8.215 4 H MET 2 H MET 2 16.077 13.587 -5.602 5 HA MET 2 HA MET 2 15.364 13.565 -3.516 6 HB2 MET 2 1HB MET 2 15.829 16.415 -4.095 7 HB3 MET 2 2HB MET 2 14.609 16.221 -2.851 8 HG2 MET 2 1HG MET 2 16.801 16.337 -1.835 9 HG3 MET 2 2HG MET 2 16.094 14.740 -1.580 10 HE1 MET 2 3HE MET 2 19.035 14.601 -0.829 11 HE2 MET 2 1HE MET 2 17.883 13.276 -1.048 12 HE3 MET 2 2HE MET 2 19.491 13.196 -1.803 13 H SER 3 H SER 3 13.265 14.884 -2.157 14 HA SER 3 HA SER 3 11.080 14.910 -1.787 15 HB2 SER 3 1HB SER 3 11.069 15.755 -4.693 16 HB3 SER 3 2HB SER 3 9.867 16.155 -3.448 17 HG SER 3 HG SER 3 11.060 17.566 -2.625 18 H GLN 4 H GLN 4 10.586 13.624 -5.111 19 HA GLN 4 HA GLN 4 8.624 11.712 -4.292 20 HB2 GLN 4 1HB GLN 4 8.672 12.484 -6.551 21 HB3 GLN 4 2HB GLN 4 10.355 12.017 -6.756 22 HG2 GLN 4 1HG GLN 4 8.944 10.532 -7.988 23 HG3 GLN 4 2HG GLN 4 9.749 9.637 -6.724 24 HE21 GLN 4 1HE2 GLN 4 8.389 8.983 -4.819 25 HE22 GLN 4 2HE2 GLN 4 6.706 8.598 -5.141 26 H ASP 5 H ASP 5 12.171 11.556 -4.460 27 HA ASP 5 HA ASP 5 12.644 8.794 -4.148 28 HB2 ASP 5 1HB ASP 5 14.445 10.323 -4.481 29 HB3 ASP 5 2HB ASP 5 13.997 11.279 -3.066 30 H LEU 6 H LEU 6 11.973 11.235 -1.554 31 HA LEU 6 HA LEU 6 12.063 9.418 0.619 32 HB2 LEU 6 1HB LEU 6 10.532 12.052 0.293 33 HB3 LEU 6 2HB LEU 6 10.814 11.235 1.792 34 HG LEU 6 HG LEU 6 12.389 12.791 1.896 35 HD11 LEU 6 1HD1 LEU 6 14.099 10.757 0.484 36 HD12 LEU 6 2HD1 LEU 6 13.528 10.628 2.167 37 HD13 LEU 6 3HD1 LEU 6 14.573 11.962 1.699 38 HD21 LEU 6 3HD2 LEU 6 13.657 13.804 0.181 39 HD22 LEU 6 1HD2 LEU 6 11.941 13.729 -0.286 40 HD23 LEU 6 2HD2 LEU 6 13.117 12.597 -1.007 41 H ILE 7 H ILE 7 9.342 10.695 -1.289 42 HA ILE 7 HA ILE 7 7.256 9.312 0.065 43 HB ILE 7 HB ILE 7 7.544 10.218 -2.806 44 HG12 ILE 7 1HG1 ILE 7 5.561 11.479 -0.972 45 HG13 ILE 7 2HG1 ILE 7 7.229 11.703 -0.459 46 HG21 ILE 7 1HG2 ILE 7 5.090 10.066 -3.049 47 HG22 ILE 7 2HG2 ILE 7 5.821 8.473 -2.839 48 HG23 ILE 7 3HG2 ILE 7 4.988 9.236 -1.474 49 HD11 ILE 7 3HD1 ILE 7 6.225 13.460 -2.047 50 HD12 ILE 7 1HD1 ILE 7 7.842 12.840 -2.390 51 HD13 ILE 7 2HD1 ILE 7 6.435 12.263 -3.329 52 H ARG 8 H ARG 8 9.363 8.105 -2.588 53 HA ARG 8 HA ARG 8 8.034 5.576 -2.983 54 HB2 ARG 8 1HB ARG 8 10.584 6.888 -3.728 55 HB3 ARG 8 2HB ARG 8 10.859 5.211 -3.313 56 HG2 ARG 8 1HG ARG 8 8.754 6.104 -5.328 57 HG3 ARG 8 2HG ARG 8 10.432 5.706 -5.732 58 HD2 ARG 8 1HD ARG 8 10.106 3.438 -4.682 59 HD3 ARG 8 2HD ARG 8 8.390 3.839 -4.487 60 HE ARG 8 HE ARG 8 9.201 4.230 -7.194 61 HH11 ARG 8 1HH1 ARG 8 8.918 1.521 -4.923 62 HH12 ARG 8 2HH1 ARG 8 8.634 0.351 -6.154 63 HH21 ARG 8 1HH2 ARG 8 8.332 2.658 -8.848 64 HH22 ARG 8 2HH2 ARG 8 8.064 1.050 -8.274 65 H ALA 9 H ALA 9 10.871 6.493 -0.920 66 HA ALA 9 HA ALA 9 11.174 3.993 0.346 67 HB1 ALA 9 1HB ALA 9 12.509 5.253 2.000 68 HB2 ALA 9 2HB ALA 9 12.867 5.813 0.357 69 HB3 ALA 9 3HB ALA 9 11.821 6.780 1.425 70 H ALA 10 H ALA 10 9.080 6.722 1.198 71 HA ALA 10 HA ALA 10 8.523 6.091 3.837 72 HB1 ALA 10 1HB ALA 10 6.581 7.357 1.842 73 HB2 ALA 10 2HB ALA 10 6.564 7.540 3.605 74 HB3 ALA 10 3HB ALA 10 7.897 8.222 2.659 75 H PHE 11 H PHE 11 7.138 4.617 0.956 76 HA PHE 11 HA PHE 11 4.735 3.583 2.146 77 HB2 PHE 11 1HB PHE 11 6.399 2.803 -0.274 78 HB3 PHE 11 2HB PHE 11 4.942 1.953 0.179 79 HD1 PHE 11 2HD PHE 11 5.080 5.740 0.460 80 HD2 PHE 11 1HD PHE 11 3.898 2.332 -1.906 81 HE1 PHE 11 2HE PHE 11 3.654 7.174 -0.883 82 HE2 PHE 11 1HE PHE 11 2.347 3.776 -3.202 83 HZ PHE 11 HZ PHE 11 2.254 6.216 -2.733 84 H GLU 12 H GLU 12 7.951 2.121 1.541 85 HA GLU 12 HA GLU 12 7.421 -0.421 2.693 86 HB2 GLU 12 1HB GLU 12 9.938 1.181 2.124 87 HB3 GLU 12 2HB GLU 12 10.023 -0.416 2.885 88 HG2 GLU 12 1HG GLU 12 9.036 -1.513 1.059 89 HG3 GLU 12 2HG GLU 12 8.441 -0.015 0.327 90 H LYS 13 H LYS 13 8.097 2.639 4.207 91 HA LYS 13 HA LYS 13 9.273 1.650 6.637 92 HB2 LYS 13 1HB LYS 13 9.704 3.845 5.560 93 HB3 LYS 13 2HB LYS 13 8.079 4.373 5.931 94 HG2 LYS 13 1HG LYS 13 9.881 3.432 8.165 95 HG3 LYS 13 2HG LYS 13 10.150 4.981 7.370 96 HD2 LYS 13 1HD LYS 13 7.833 5.697 7.954 97 HD3 LYS 13 2HD LYS 13 7.655 4.227 8.928 98 HE2 LYS 13 1HE LYS 13 9.614 4.833 10.264 99 HE3 LYS 13 2HE LYS 13 9.917 6.245 9.246 100 HZ1 LYS 13 3HZ LYS 13 7.863 7.221 10.029 101 HZ2 LYS 13 1HZ LYS 13 8.834 6.825 11.289 102 HZ3 LYS 13 2HZ LYS 13 7.541 5.887 10.962 103 H ARG 14 H ARG 14 6.064 2.034 5.500 104 HA ARG 14 HA ARG 14 5.150 1.226 8.218 105 HB2 ARG 14 1HB ARG 14 3.738 2.841 6.171 106 HB3 ARG 14 2HB ARG 14 2.744 1.617 6.956 107 HG2 ARG 14 1HG ARG 14 4.456 3.506 8.601 108 HG3 ARG 14 2HG ARG 14 2.843 3.960 8.045 109 HD2 ARG 14 1HD ARG 14 1.758 2.312 9.314 110 HD3 ARG 14 2HD ARG 14 3.216 1.368 9.531 111 HE ARG 14 HE ARG 14 2.332 3.664 11.095 112 HH11 ARG 14 1HH1 ARG 14 4.915 1.265 10.682 113 HH12 ARG 14 2HH1 ARG 14 5.972 1.977 11.831 114 HH21 ARG 14 1HH2 ARG 14 3.518 4.272 12.965 115 HH22 ARG 14 2HH2 ARG 14 5.145 3.710 13.201 116 H LEU 15 H LEU 15 4.877 0.223 4.768 117 HA LEU 15 HA LEU 15 3.149 -1.925 5.455 118 HB2 LEU 15 1HB LEU 15 3.817 -0.869 3.088 119 HB3 LEU 15 2HB LEU 15 4.932 -2.230 3.057 120 HG LEU 15 HG LEU 15 1.911 -2.259 3.257 121 HD11 LEU 15 1HD1 LEU 15 3.857 -3.420 1.212 122 HD12 LEU 15 2HD1 LEU 15 2.818 -1.999 1.011 123 HD13 LEU 15 3HD1 LEU 15 2.089 -3.601 1.171 124 HD21 LEU 15 3HD2 LEU 15 3.707 -4.680 3.620 125 HD22 LEU 15 1HD2 LEU 15 1.971 -4.748 3.227 126 HD23 LEU 15 2HD2 LEU 15 2.479 -4.034 4.740 127 H SER 16 H SER 16 6.691 -2.093 4.717 128 HA SER 16 HA SER 16 6.918 -4.901 5.266 129 HB2 SER 16 1HB SER 16 8.635 -2.774 4.397 130 HB3 SER 16 2HB SER 16 9.352 -3.417 5.878 131 HG SER 16 HG SER 16 8.847 -4.693 3.408 132 H ASP 17 H ASP 17 7.431 -1.957 7.166 133 HA ASP 17 HA ASP 17 8.343 -3.046 9.548 134 HB2 ASP 17 1HB ASP 17 8.144 -0.625 8.493 135 HB3 ASP 17 2HB ASP 17 6.695 -0.526 9.459 136 H TRP 18 H TRP 18 5.042 -3.009 8.344 137 HA TRP 18 HA TRP 18 3.907 -3.830 10.976 138 HB2 TRP 18 1HB TRP 18 2.404 -2.468 9.828 139 HB3 TRP 18 2HB TRP 18 2.712 -3.200 8.275 140 HD1 TRP 18 HD TRP 18 0.640 -3.689 11.445 141 HE1 TRP 18 1HE TRP 18 -1.197 -5.411 11.035 142 HE3 TRP 18 3HE TRP 18 2.141 -5.381 6.858 143 HZ2 TRP 18 2HZ TRP 18 -1.860 -7.383 9.047 144 HZ3 TRP 18 3HZ TRP 18 0.951 -7.267 5.775 145 HH2 TRP 18 HH TRP 18 -1.071 -8.259 6.863 146 H ALA 19 H ALA 19 4.566 -5.139 7.677 147 HA ALA 19 HA ALA 19 3.419 -7.663 8.139 148 HB1 ALA 19 1HB ALA 19 4.017 -6.821 5.909 149 HB2 ALA 19 2HB ALA 19 5.748 -6.934 6.314 150 HB3 ALA 19 3HB ALA 19 4.759 -8.406 6.212 151 H LYS 20 H LYS 20 6.799 -6.616 8.663 152 HA LYS 20 HA LYS 20 7.744 -9.103 9.746 153 HB2 LYS 20 1HB LYS 20 9.670 -7.774 10.506 154 HB3 LYS 20 2HB LYS 20 9.248 -7.416 8.843 155 HG2 LYS 20 1HG LYS 20 9.218 -5.231 9.352 156 HG3 LYS 20 2HG LYS 20 7.781 -5.501 10.311 157 HD2 LYS 20 1HD LYS 20 9.160 -4.385 11.774 158 HD3 LYS 20 2HD LYS 20 9.410 -6.075 12.257 159 HE2 LYS 20 1HE LYS 20 11.469 -6.139 10.828 160 HE3 LYS 20 2HE LYS 20 11.176 -4.457 10.348 161 HZ1 LYS 20 3HZ LYS 20 12.766 -4.538 12.134 162 HZ2 LYS 20 1HZ LYS 20 11.740 -5.425 13.071 163 HZ3 LYS 20 2HZ LYS 20 11.381 -3.872 12.732 164 H ALA 21 H ALA 21 5.882 -6.510 11.221 165 HA ALA 21 HA ALA 21 6.578 -7.259 13.966 166 HB1 ALA 21 1HB ALA 21 4.911 -5.542 14.556 167 HB2 ALA 21 2HB ALA 21 6.073 -4.898 13.381 168 HB3 ALA 21 3HB ALA 21 4.437 -5.374 12.865 169 H ARG 22 H ARG 22 4.184 -8.080 11.529 170 HA ARG 22 HA ARG 22 2.094 -8.852 13.202 171 HB2 ARG 22 1HB ARG 22 2.422 -8.646 10.495 172 HB3 ARG 22 2HB ARG 22 2.551 -10.405 10.669 173 HG2 ARG 22 1HG ARG 22 0.344 -10.198 12.057 174 HG3 ARG 22 2HG ARG 22 0.244 -8.563 11.398 175 HD2 ARG 22 1HD ARG 22 0.158 -9.430 9.132 176 HD3 ARG 22 2HD ARG 22 0.527 -11.079 9.703 177 HE ARG 22 HE ARG 22 -1.782 -9.734 10.866 178 HH11 ARG 22 1HH1 ARG 22 -1.041 -12.027 8.206 179 HH12 ARG 22 2HH1 ARG 22 -2.497 -12.941 8.502 180 HH21 ARG 22 1HH2 ARG 22 -3.451 -11.028 11.296 181 HH22 ARG 22 2HH2 ARG 22 -3.887 -12.420 10.351 182 H THR 23 H THR 23 1.228 -11.061 13.517 183 HA THR 23 HA THR 23 3.073 -12.855 14.703 184 HB THR 23 HB THR 23 0.122 -13.111 14.018 185 HG1 THR 23 1HG THR 23 -0.110 -12.574 16.154 186 HG21 THR 23 3HG2 THR 23 0.153 -15.042 15.591 187 HG22 THR 23 1HG2 THR 23 1.936 -14.941 15.653 188 HG23 THR 23 2HG2 THR 23 1.128 -15.344 14.134 189 HA PRO 24 HA PRO 24 2.743 -15.949 11.179 190 HB2 PRO 24 1HB PRO 24 1.542 -15.213 8.782 191 HB3 PRO 24 2HB PRO 24 0.823 -16.225 10.083 192 HG2 PRO 24 1HG PRO 24 0.499 -13.301 9.462 193 HG3 PRO 24 2HG PRO 24 -0.766 -14.459 10.010 194 HD2 PRO 24 1HD PRO 24 0.390 -12.681 11.713 195 HD3 PRO 24 2HD PRO 24 -0.034 -14.345 12.226 196 H ALA 25 H ALA 25 3.501 -12.874 10.867 197 HA ALA 25 HA ALA 25 4.855 -11.433 9.643 198 HB1 ALA 25 1HB ALA 25 6.640 -13.837 9.986 199 HB2 ALA 25 2HB ALA 25 7.157 -12.153 9.685 200 HB3 ALA 25 3HB ALA 25 6.300 -12.571 11.192 201 H LEU 26 H LEU 26 4.192 -10.916 7.655 202 HA LEU 26 HA LEU 26 4.085 -13.020 5.609 203 HB2 LEU 26 1HB LEU 26 3.175 -10.133 5.274 204 HB3 LEU 26 2HB LEU 26 2.930 -11.427 4.150 205 HG LEU 26 HG LEU 26 0.871 -11.239 5.067 206 HD11 LEU 26 1HD1 LEU 26 2.126 -13.309 6.904 207 HD12 LEU 26 2HD1 LEU 26 1.501 -13.639 5.276 208 HD13 LEU 26 3HD1 LEU 26 0.418 -13.146 6.609 209 HD21 LEU 26 3HD2 LEU 26 1.993 -11.044 7.856 210 HD22 LEU 26 1HD2 LEU 26 0.310 -10.770 7.298 211 HD23 LEU 26 2HD2 LEU 26 1.595 -9.646 6.834 212 HA PRO 27 HA PRO 27 7.367 -11.193 2.966 213 HB2 PRO 27 1HB PRO 27 6.678 -12.375 0.611 214 HB3 PRO 27 2HB PRO 27 7.528 -13.263 1.894 215 HG2 PRO 27 1HG PRO 27 4.562 -13.236 1.294 216 HG3 PRO 27 2HG PRO 27 5.597 -14.661 1.647 217 HD2 PRO 27 1HD PRO 27 3.996 -13.435 3.535 218 HD3 PRO 27 2HD PRO 27 5.572 -14.188 3.949 219 H VAL 28 H VAL 28 7.346 -9.587 1.306 220 HA VAL 28 HA VAL 28 4.699 -8.378 0.626 221 HB VAL 28 HB VAL 28 7.091 -7.112 2.044 222 HG11 VAL 28 1HG1 VAL 28 4.523 -5.845 1.031 223 HG12 VAL 28 2HG1 VAL 28 5.641 -5.071 2.193 224 HG13 VAL 28 3HG1 VAL 28 6.216 -5.455 0.582 225 HG21 VAL 28 3HG2 VAL 28 4.237 -7.630 2.984 226 HG22 VAL 28 1HG2 VAL 28 5.727 -8.345 3.633 227 HG23 VAL 28 2HG2 VAL 28 5.437 -6.633 3.845 228 H ALA 29 H ALA 29 4.748 -8.549 -1.588 229 HA ALA 29 HA ALA 29 7.312 -8.273 -3.069 230 HB1 ALA 29 1HB ALA 29 6.096 -9.306 -4.931 231 HB2 ALA 29 2HB ALA 29 6.201 -10.329 -3.506 232 HB3 ALA 29 3HB ALA 29 4.654 -9.500 -3.898 233 H TRP 30 H TRP 30 7.636 -6.094 -3.517 234 HA TRP 30 HA TRP 30 5.465 -4.324 -4.266 235 HB2 TRP 30 1HB TRP 30 8.484 -3.979 -4.430 236 HB3 TRP 30 2HB TRP 30 7.287 -2.728 -4.741 237 HD1 TRP 30 HD TRP 30 9.071 -4.488 -1.907 238 HE1 TRP 30 1HE TRP 30 8.296 -3.603 0.343 239 HE3 TRP 30 3HE TRP 30 5.419 -1.410 -3.560 240 HZ2 TRP 30 2HZ TRP 30 6.233 -1.788 1.324 241 HZ3 TRP 30 3HZ TRP 30 3.965 -0.137 -1.938 242 HH2 TRP 30 HH TRP 30 4.357 -0.360 0.485 243 H GLN 31 H GLN 31 4.454 -5.108 -6.108 244 HA GLN 31 HA GLN 31 4.003 -5.414 -8.261 245 HB2 GLN 31 1HB GLN 31 6.370 -3.568 -8.524 246 HB3 GLN 31 2HB GLN 31 5.613 -4.298 -9.959 247 HG2 GLN 31 1HG GLN 31 3.455 -3.326 -9.317 248 HG3 GLN 31 2HG GLN 31 4.217 -2.605 -7.888 249 HE21 GLN 31 1HE2 GLN 31 3.839 -0.427 -8.602 250 HE22 GLN 31 2HE2 GLN 31 4.741 0.295 -9.880 251 H ASN 32 H ASN 32 7.510 -5.484 -8.809 252 HA ASN 32 HA ASN 32 7.439 -8.373 -9.533 253 HB2 ASN 32 1HB ASN 32 8.439 -6.080 -11.254 254 HB3 ASN 32 2HB ASN 32 9.015 -7.733 -11.445 255 HD21 ASN 32 1HD2 ASN 32 6.479 -5.596 -12.300 256 HD22 ASN 32 2HD2 ASN 32 5.381 -6.797 -12.965 257 H THR 33 H THR 33 8.702 -6.107 -7.488 258 HA THR 33 HA THR 33 11.496 -6.619 -7.441 259 HB THR 33 HB THR 33 9.571 -6.112 -5.165 260 HG1 THR 33 1HG THR 33 9.312 -4.462 -6.528 261 HG21 THR 33 3HG2 THR 33 11.486 -5.042 -4.023 262 HG22 THR 33 1HG2 THR 33 12.555 -5.579 -5.341 263 HG23 THR 33 2HG2 THR 33 11.733 -6.767 -4.300 264 H LYS 34 H LYS 34 12.540 -8.252 -6.629 265 HA LYS 34 HA LYS 34 11.423 -10.729 -7.072 266 HB2 LYS 34 1HB LYS 34 13.513 -11.763 -6.582 267 HB3 LYS 34 2HB LYS 34 13.730 -10.258 -7.464 268 HG2 LYS 34 1HG LYS 34 13.757 -9.446 -4.811 269 HG3 LYS 34 2HG LYS 34 14.580 -11.005 -4.723 270 HD2 LYS 34 1HD LYS 34 16.236 -9.300 -5.007 271 HD3 LYS 34 2HD LYS 34 16.168 -10.226 -6.508 272 HE2 LYS 34 1HE LYS 34 14.930 -8.498 -7.629 273 HE3 LYS 34 2HE LYS 34 14.547 -7.674 -6.119 274 HZ1 LYS 34 3HZ LYS 34 16.415 -6.628 -7.421 275 HZ2 LYS 34 1HZ LYS 34 17.324 -7.968 -7.090 276 HZ3 LYS 34 2HZ LYS 34 16.823 -7.028 -5.870 277 H PHE 35 H PHE 35 10.967 -12.637 -5.876 278 HA PHE 35 HA PHE 35 10.439 -12.542 -3.076 279 HB2 PHE 35 1HB PHE 35 8.041 -12.441 -3.350 280 HB3 PHE 35 2HB PHE 35 8.717 -10.968 -3.995 281 HD1 PHE 35 2HD PHE 35 9.142 -10.980 -6.695 282 HD2 PHE 35 1HD PHE 35 6.448 -13.634 -4.589 283 HE1 PHE 35 2HE PHE 35 7.924 -11.415 -8.782 284 HE2 PHE 35 1HE PHE 35 5.260 -14.090 -6.712 285 HZ PHE 35 HZ PHE 35 5.999 -12.994 -8.819 286 H THR 36 H THR 36 9.059 -14.475 -2.598 287 HA THR 36 HA THR 36 8.184 -16.412 -2.756 288 HB THR 36 HB THR 36 7.936 -15.685 -5.372 289 HG1 THR 36 1HG THR 36 6.339 -16.584 -4.108 290 HG21 THR 36 3HG2 THR 36 8.973 -18.531 -5.450 291 HG22 THR 36 1HG2 THR 36 9.846 -17.126 -6.091 292 HG23 THR 36 2HG2 THR 36 8.293 -17.580 -6.788 293 HA PRO 37 HA PRO 37 7.982 -19.050 -3.068 294 HB2 PRO 37 1HB PRO 37 8.177 -20.704 -0.881 295 HB3 PRO 37 2HB PRO 37 8.893 -21.099 -2.471 296 HG2 PRO 37 1HG PRO 37 10.248 -19.863 -0.057 297 HG3 PRO 37 2HG PRO 37 10.821 -21.222 -1.076 298 HD2 PRO 37 1HD PRO 37 11.680 -18.660 -1.433 299 HD3 PRO 37 2HD PRO 37 11.448 -19.760 -2.825 300 HA PRO 38 HA PRO 38 5.953 -16.588 0.100 301 HB2 PRO 38 1HB PRO 38 3.833 -18.219 0.771 302 HB3 PRO 38 2HB PRO 38 3.894 -17.155 -0.695 303 HG2 PRO 38 1HG PRO 38 4.438 -20.097 -0.431 304 HG3 PRO 38 2HG PRO 38 3.508 -19.263 -1.728 305 HD2 PRO 38 1HD PRO 38 6.093 -19.984 -2.132 306 HD3 PRO 38 2HD PRO 38 5.470 -18.431 -2.746 307 H ALA 39 H ALA 39 4.719 -17.083 2.338 308 HA ALA 39 HA ALA 39 6.753 -18.247 3.991 309 HB1 ALA 39 1HB ALA 39 5.087 -17.490 5.786 310 HB2 ALA 39 2HB ALA 39 5.605 -16.200 4.681 311 HB3 ALA 39 3HB ALA 39 4.027 -16.993 4.439 312 H ALA 40 H ALA 40 3.895 -19.352 2.737 313 HA ALA 40 HA ALA 40 3.870 -21.943 4.053 314 HB1 ALA 40 1HB ALA 40 2.106 -21.375 5.707 315 HB2 ALA 40 2HB ALA 40 3.444 -20.216 5.921 316 HB3 ALA 40 3HB ALA 40 2.010 -19.715 5.048 317 H GLY 41 H GLY 41 3.574 -20.985 1.417 318 HA2 GLY 41 2HA GLY 41 2.209 -20.935 -0.416 319 HA3 GLY 41 1HA GLY 41 0.841 -21.561 0.519 320 H VAL 42 H VAL 42 1.263 -19.358 2.389 321 HA VAL 42 HA VAL 42 -0.549 -17.357 1.244 322 HB VAL 42 HB VAL 42 0.760 -17.514 4.003 323 HG11 VAL 42 1HG1 VAL 42 -0.043 -15.241 3.655 324 HG12 VAL 42 2HG1 VAL 42 -1.598 -15.832 3.012 325 HG13 VAL 42 3HG1 VAL 42 -1.171 -16.079 4.716 326 HG21 VAL 42 3HG2 VAL 42 -0.774 -19.463 3.459 327 HG22 VAL 42 1HG2 VAL 42 -1.390 -18.451 4.755 328 HG23 VAL 42 2HG2 VAL 42 -2.069 -18.289 3.134 329 H TYR 43 H TYR 43 -0.169 -15.211 0.705 330 HA TYR 43 HA TYR 43 2.134 -13.781 1.655 331 HB2 TYR 43 1HB TYR 43 3.195 -13.370 -0.538 332 HB3 TYR 43 2HB TYR 43 3.333 -15.029 -0.051 333 HD1 TYR 43 1HD TYR 43 1.813 -16.772 -1.104 334 HD2 TYR 43 2HD TYR 43 2.183 -12.754 -2.620 335 HE1 TYR 43 1HE TYR 43 0.972 -17.541 -3.331 336 HE2 TYR 43 2HE TYR 43 1.352 -13.503 -4.822 337 HH TYR 43 HH TYR 43 0.168 -16.783 -5.489 338 H LEU 44 H LEU 44 2.315 -11.708 0.034 339 HA LEU 44 HA LEU 44 -0.380 -10.458 -0.023 340 HB2 LEU 44 1HB LEU 44 1.746 -10.108 1.827 341 HB3 LEU 44 2HB LEU 44 2.038 -8.846 0.664 342 HG LEU 44 HG LEU 44 -0.259 -7.940 1.108 343 HD11 LEU 44 1HD1 LEU 44 -1.507 -8.807 3.071 344 HD12 LEU 44 2HD1 LEU 44 -0.403 -10.207 3.143 345 HD13 LEU 44 3HD1 LEU 44 -1.477 -9.942 1.751 346 HD21 LEU 44 3HD2 LEU 44 0.267 -7.194 3.427 347 HD22 LEU 44 1HD2 LEU 44 1.735 -7.216 2.426 348 HD23 LEU 44 2HD2 LEU 44 1.438 -8.531 3.581 349 H ARG 45 H ARG 45 -0.578 -8.963 -1.828 350 HA ARG 45 HA ARG 45 1.685 -8.854 -3.794 351 HB2 ARG 45 1HB ARG 45 -1.265 -9.493 -4.193 352 HB3 ARG 45 2HB ARG 45 -0.281 -8.806 -5.474 353 HG2 ARG 45 1HG ARG 45 1.302 -10.725 -5.323 354 HG3 ARG 45 2HG ARG 45 0.309 -11.423 -4.040 355 HD2 ARG 45 1HD ARG 45 -0.378 -12.514 -6.076 356 HD3 ARG 45 2HD ARG 45 -1.666 -11.343 -5.739 357 HE ARG 45 HE ARG 45 0.308 -10.092 -7.331 358 HH11 ARG 45 1HH1 ARG 45 -2.353 -12.498 -7.813 359 HH12 ARG 45 2HH1 ARG 45 -1.981 -12.637 -9.494 360 HH21 ARG 45 1HH2 ARG 45 0.557 -10.272 -9.639 361 HH22 ARG 45 2HH2 ARG 45 -0.534 -11.316 -10.512 362 H ALA 46 H ALA 46 2.329 -6.727 -3.683 363 HA ALA 46 HA ALA 46 0.237 -4.657 -3.263 364 HB1 ALA 46 1HB ALA 46 2.805 -5.187 -2.042 365 HB2 ALA 46 2HB ALA 46 2.824 -3.587 -2.774 366 HB3 ALA 46 3HB ALA 46 1.574 -4.006 -1.581 367 H TYR 47 H TYR 47 -0.095 -3.208 -4.892 368 HA TYR 47 HA TYR 47 1.995 -2.904 -6.977 369 HB2 TYR 47 1HB TYR 47 -0.032 -4.447 -7.528 370 HB3 TYR 47 2HB TYR 47 -0.909 -2.927 -7.652 371 HD1 TYR 47 2HD TYR 47 0.592 -1.046 -8.959 372 HD2 TYR 47 1HD TYR 47 0.562 -5.267 -9.623 373 HE1 TYR 47 2HE TYR 47 1.750 -0.659 -11.109 374 HE2 TYR 47 1HE TYR 47 1.606 -4.923 -11.878 375 HH TYR 47 HH TYR 47 2.922 -1.738 -12.886 376 H VAL 48 H VAL 48 2.700 -1.018 -6.243 377 HA VAL 48 HA VAL 48 1.123 1.383 -5.706 378 HB VAL 48 HB VAL 48 4.055 0.964 -6.491 379 HG11 VAL 48 1HG1 VAL 48 2.699 3.488 -5.422 380 HG12 VAL 48 2HG1 VAL 48 4.461 3.249 -5.484 381 HG13 VAL 48 3HG1 VAL 48 3.519 3.298 -6.977 382 HG21 VAL 48 3HG2 VAL 48 3.455 -0.047 -4.302 383 HG22 VAL 48 1HG2 VAL 48 4.520 1.341 -4.100 384 HG23 VAL 48 2HG2 VAL 48 2.779 1.497 -3.772 385 H MET 49 H MET 49 -0.053 2.434 -7.253 386 HA MET 49 HA MET 49 0.774 2.359 -10.108 387 HB2 MET 49 1HB MET 49 -1.844 2.005 -8.741 388 HB3 MET 49 2HB MET 49 -1.853 3.016 -10.183 389 HG2 MET 49 1HG MET 49 -1.067 1.303 -11.577 390 HG3 MET 49 2HG MET 49 -0.529 0.310 -10.230 391 HE1 MET 49 3HE MET 49 -3.676 -1.392 -8.855 392 HE2 MET 49 1HE MET 49 -1.916 -1.476 -9.036 393 HE3 MET 49 2HE MET 49 -2.655 -0.095 -8.194 394 HA PRO 50 HA PRO 50 1.326 6.514 -8.208 395 HB2 PRO 50 1HB PRO 50 3.496 7.330 -9.670 396 HB3 PRO 50 2HB PRO 50 3.619 6.161 -8.315 397 HG2 PRO 50 1HG PRO 50 3.469 5.546 -11.281 398 HG3 PRO 50 2HG PRO 50 4.636 4.919 -10.075 399 HD2 PRO 50 1HD PRO 50 2.396 3.532 -10.794 400 HD3 PRO 50 2HD PRO 50 3.030 3.486 -9.131 401 H ALA 51 H ALA 51 0.932 8.630 -9.047 402 HA ALA 51 HA ALA 51 -1.282 8.855 -10.550 403 HB1 ALA 51 1HB ALA 51 -0.326 10.661 -9.138 404 HB2 ALA 51 2HB ALA 51 0.835 11.044 -10.422 405 HB3 ALA 51 3HB ALA 51 -0.912 11.262 -10.688 406 H ALA 52 H ALA 52 -1.668 8.021 -12.509 407 HA ALA 52 HA ALA 52 -0.066 8.909 -14.840 408 HB1 ALA 52 1HB ALA 52 -0.783 6.037 -14.138 409 HB2 ALA 52 2HB ALA 52 -0.081 6.586 -15.671 410 HB3 ALA 52 3HB ALA 52 0.858 6.727 -14.176 411 H THR 53 H THR 53 -2.216 10.272 -14.448 412 HA THR 53 HA THR 53 -4.396 9.250 -16.070 413 HB THR 53 HB THR 53 -3.877 12.111 -16.374 414 HG1 THR 53 1HG THR 53 -2.816 12.128 -14.431 415 HG21 THR 53 3HG2 THR 53 -5.963 10.527 -14.827 416 HG22 THR 53 1HG2 THR 53 -6.074 10.957 -16.556 417 HG23 THR 53 2HG2 THR 53 -6.117 12.231 -15.314 418 H ILE 54 H ILE 54 -4.540 9.901 -18.435 419 HA ILE 54 HA ILE 54 -1.896 9.789 -19.772 420 HB ILE 54 HB ILE 54 -4.262 7.936 -20.360 421 HG12 ILE 54 1HG1 ILE 54 -1.815 7.287 -18.664 422 HG13 ILE 54 2HG1 ILE 54 -3.483 7.402 -18.093 423 HG21 ILE 54 1HG2 ILE 54 -2.671 8.164 -22.242 424 HG22 ILE 54 2HG2 ILE 54 -1.308 7.754 -21.171 425 HG23 ILE 54 3HG2 ILE 54 -2.588 6.587 -21.571 426 HD11 ILE 54 3HD1 ILE 54 -2.345 5.221 -19.805 427 HD12 ILE 54 1HD1 ILE 54 -3.106 5.125 -18.214 428 HD13 ILE 54 2HD1 ILE 54 -4.097 5.517 -19.637 429 H SER 55 H SER 55 -2.336 10.049 -22.238 430 HA SER 55 HA SER 55 -3.188 11.170 -24.000 431 HB2 SER 55 1HB SER 55 -5.114 9.648 -23.352 432 HB3 SER 55 2HB SER 55 -5.875 11.056 -22.593 433 HG SER 55 HG SER 55 -6.455 10.484 -24.810 434 H ARG 56 H ARG 56 -5.407 13.173 -23.864 435 HA ARG 56 HA ARG 56 -3.841 15.474 -22.843 436 HB2 ARG 56 1HB ARG 56 -5.147 16.879 -24.208 437 HB3 ARG 56 2HB ARG 56 -4.456 15.555 -25.137 438 HG2 ARG 56 1HG ARG 56 -6.675 14.336 -24.871 439 HG3 ARG 56 2HG ARG 56 -7.345 15.835 -24.193 440 HD2 ARG 56 1HD ARG 56 -7.853 16.025 -26.472 441 HD3 ARG 56 2HD ARG 56 -6.386 17.013 -26.233 442 HE ARG 56 HE ARG 56 -5.603 14.386 -26.957 443 HH11 ARG 56 1HH1 ARG 56 -7.157 17.189 -28.405 444 HH12 ARG 56 2HH1 ARG 56 -6.955 16.722 -30.039 445 HH21 ARG 56 1HH2 ARG 56 -5.083 13.752 -29.076 446 HH22 ARG 56 2HH2 ARG 56 -5.550 14.713 -30.424 447 H ASP 57 H ASP 57 -5.291 13.639 -21.069 448 HA ASP 57 HA ASP 57 -7.825 14.692 -20.195 449 HB2 ASP 57 1HB ASP 57 -6.696 12.356 -20.081 450 HB3 ASP 57 2HB ASP 57 -5.906 12.938 -18.612 451 H ALA 58 H ALA 58 -7.680 14.881 -17.516 452 HA ALA 58 HA ALA 58 -6.193 17.239 -16.698 453 HB1 ALA 58 1HB ALA 58 -7.604 15.015 -15.158 454 HB2 ALA 58 2HB ALA 58 -6.958 16.505 -14.439 455 HB3 ALA 58 3HB ALA 58 -8.292 16.590 -15.605 456 H ALA 59 H ALA 59 -4.145 16.586 -17.623 457 HA ALA 59 HA ALA 59 -2.713 14.249 -16.903 458 HB1 ALA 59 1HB ALA 59 -2.480 15.537 -19.027 459 HB2 ALA 59 2HB ALA 59 -1.756 16.883 -18.115 460 HB3 ALA 59 3HB ALA 59 -0.923 15.324 -18.216 461 H GLY 60 H GLY 60 -0.137 15.046 -16.431 462 HA2 GLY 60 2HA GLY 60 -0.027 16.779 -14.083 463 HA3 GLY 60 1HA GLY 60 0.770 15.195 -13.998 464 H ASP 61 H ASP 61 2.431 17.170 -13.726 465 HA ASP 61 HA ASP 61 4.228 16.984 -16.038 466 HB2 ASP 61 1HB ASP 61 3.142 18.955 -16.778 467 HB3 ASP 61 2HB ASP 61 2.976 19.584 -15.147 468 H HIS 62 H HIS 62 4.150 19.355 -13.496 469 HA HIS 62 HA HIS 62 6.810 18.958 -12.883 470 HB2 HIS 62 1HB HIS 62 6.006 20.466 -10.777 471 HB3 HIS 62 2HB HIS 62 6.165 21.102 -12.411 472 HD1 HIS 62 1HD HIS 62 4.123 22.367 -13.327 473 HD2 HIS 62 2HD HIS 62 3.131 19.471 -10.416 474 HE1 HIS 62 1HE HIS 62 1.620 22.449 -13.012 475 H ARG 63 H ARG 63 4.104 17.862 -11.167 476 HA ARG 63 HA ARG 63 5.382 15.941 -9.436 477 HB2 ARG 63 1HB ARG 63 4.919 17.145 -7.299 478 HB3 ARG 63 2HB ARG 63 6.195 17.831 -8.312 479 HG2 ARG 63 1HG ARG 63 4.635 19.569 -9.038 480 HG3 ARG 63 2HG ARG 63 3.387 18.940 -7.959 481 HD2 ARG 63 1HD ARG 63 4.690 19.585 -6.022 482 HD3 ARG 63 2HD ARG 63 6.039 20.069 -7.049 483 HE ARG 63 HE ARG 63 3.448 21.499 -6.694 484 HH11 ARG 63 1HH1 ARG 63 6.638 21.742 -8.029 485 HH12 ARG 63 2HH1 ARG 63 6.242 22.808 -9.334 486 HH21 ARG 63 1HH2 ARG 63 2.846 23.130 -8.277 487 HH22 ARG 63 2HH2 ARG 63 4.040 23.621 -9.443 488 H GLN 64 H GLN 64 3.832 14.476 -9.169 489 HA GLN 64 HA GLN 64 1.268 15.221 -8.140 490 HB2 GLN 64 1HB GLN 64 1.492 13.830 -10.862 491 HB3 GLN 64 2HB GLN 64 0.135 13.591 -9.773 492 HG2 GLN 64 1HG GLN 64 -0.048 16.219 -9.803 493 HG3 GLN 64 2HG GLN 64 0.878 16.078 -11.302 494 HE21 GLN 64 1HE2 GLN 64 -2.236 16.476 -10.294 495 HE22 GLN 64 2HE2 GLN 64 -3.049 15.516 -11.499 496 H TYR 65 H TYR 65 0.489 13.487 -6.860 497 HA TYR 65 HA TYR 65 1.750 10.819 -7.143 498 HB2 TYR 65 1HB TYR 65 1.187 12.060 -4.479 499 HB3 TYR 65 2HB TYR 65 2.278 10.743 -4.863 500 HD1 TYR 65 1HD TYR 65 4.553 11.206 -5.730 501 HD2 TYR 65 2HD TYR 65 1.749 14.381 -4.960 502 HE1 TYR 65 1HE TYR 65 6.358 12.854 -6.069 503 HE2 TYR 65 2HE TYR 65 3.590 16.077 -5.239 504 HH TYR 65 HH TYR 65 6.723 15.160 -6.546 505 H ARG 66 H ARG 66 -0.932 12.359 -7.457 506 HA ARG 66 HA ARG 66 -2.933 10.992 -5.882 507 HB2 ARG 66 1HB ARG 66 -3.630 12.133 -8.549 508 HB3 ARG 66 2HB ARG 66 -4.500 12.170 -7.001 509 HG2 ARG 66 1HG ARG 66 -2.826 13.758 -6.131 510 HG3 ARG 66 2HG ARG 66 -2.048 13.814 -7.737 511 HD2 ARG 66 1HD ARG 66 -3.371 15.577 -8.103 512 HD3 ARG 66 2HD ARG 66 -4.500 14.327 -8.609 513 HE ARG 66 HE ARG 66 -4.921 14.525 -5.899 514 HH11 ARG 66 1HH1 ARG 66 -5.221 16.954 -8.459 515 HH12 ARG 66 2HH1 ARG 66 -5.744 18.218 -7.404 516 HH21 ARG 66 1HH2 ARG 66 -5.217 16.175 -4.509 517 HH22 ARG 66 2HH2 ARG 66 -5.838 17.748 -4.996 518 H GLY 67 H GLY 67 -2.386 8.951 -5.920 519 HA2 GLY 67 2HA GLY 67 -2.455 7.407 -8.515 520 HA3 GLY 67 1HA GLY 67 -1.329 7.089 -7.188 521 H VAL 68 H VAL 68 -2.345 4.908 -7.626 522 HA VAL 68 HA VAL 68 -4.251 4.490 -5.443 523 HB VAL 68 HB VAL 68 -5.652 4.399 -7.402 524 HG11 VAL 68 1HG1 VAL 68 -4.031 2.081 -8.478 525 HG12 VAL 68 2HG1 VAL 68 -5.467 2.824 -9.197 526 HG13 VAL 68 3HG1 VAL 68 -3.962 3.741 -9.128 527 HG21 VAL 68 3HG2 VAL 68 -6.680 2.236 -7.132 528 HG22 VAL 68 1HG2 VAL 68 -5.252 1.574 -6.347 529 HG23 VAL 68 2HG2 VAL 68 -6.186 2.880 -5.557 530 H PHE 69 H PHE 69 -4.006 2.252 -4.553 531 HA PHE 69 HA PHE 69 -1.528 0.867 -5.334 532 HB2 PHE 69 1HB PHE 69 -0.579 2.155 -3.691 533 HB3 PHE 69 2HB PHE 69 -2.023 2.143 -2.673 534 HD1 PHE 69 2HD PHE 69 0.836 0.101 -3.905 535 HD2 PHE 69 1HD PHE 69 -2.300 0.494 -1.003 536 HE1 PHE 69 2HE PHE 69 1.949 -1.592 -2.491 537 HE2 PHE 69 1HE PHE 69 -1.162 -1.178 0.441 538 HZ PHE 69 HZ PHE 69 0.935 -2.228 -0.287 539 H GLN 70 H GLN 70 -2.261 -1.131 -5.718 540 HA GLN 70 HA GLN 70 -4.675 -2.260 -4.408 541 HB2 GLN 70 1HB GLN 70 -4.418 -2.697 -6.800 542 HB3 GLN 70 2HB GLN 70 -2.763 -3.226 -6.591 543 HG2 GLN 70 1HG GLN 70 -4.254 -5.129 -6.973 544 HG3 GLN 70 2HG GLN 70 -3.476 -5.237 -5.407 545 HE21 GLN 70 1HE2 GLN 70 -6.433 -3.228 -6.186 546 HE22 GLN 70 2HE2 GLN 70 -7.450 -4.202 -5.140 547 H VAL 71 H VAL 71 -4.465 -3.879 -2.778 548 HA VAL 71 HA VAL 71 -1.854 -5.099 -2.355 549 HB VAL 71 HB VAL 71 -1.463 -3.297 -1.052 550 HG11 VAL 71 1HG1 VAL 71 -4.284 -3.424 0.011 551 HG12 VAL 71 2HG1 VAL 71 -2.999 -2.512 0.817 552 HG13 VAL 71 3HG1 VAL 71 -3.475 -2.115 -0.836 553 HG21 VAL 71 3HG2 VAL 71 -2.040 -4.559 1.394 554 HG22 VAL 71 1HG2 VAL 71 -1.754 -5.875 0.256 555 HG23 VAL 71 2HG2 VAL 71 -0.553 -4.590 0.466 556 H ASN 72 H ASN 72 -2.588 -7.021 -2.874 557 HA ASN 72 HA ASN 72 -5.055 -8.083 -1.575 558 HB2 ASN 72 1HB ASN 72 -4.197 -8.132 -4.276 559 HB3 ASN 72 2HB ASN 72 -3.851 -9.754 -3.660 560 HD21 ASN 72 1HD2 ASN 72 -6.303 -7.778 -4.850 561 HD22 ASN 72 2HD2 ASN 72 -7.682 -8.633 -4.191 562 H VAL 73 H VAL 73 -5.185 -10.244 -1.022 563 HA VAL 73 HA VAL 73 -2.783 -11.024 0.493 564 HB VAL 73 HB VAL 73 -4.050 -11.064 2.305 565 HG11 VAL 73 1HG1 VAL 73 -5.263 -9.091 2.789 566 HG12 VAL 73 2HG1 VAL 73 -3.763 -8.744 1.844 567 HG13 VAL 73 3HG1 VAL 73 -5.379 -8.708 1.079 568 HG21 VAL 73 3HG2 VAL 73 -6.549 -11.177 0.764 569 HG22 VAL 73 1HG2 VAL 73 -5.887 -12.383 1.881 570 HG23 VAL 73 2HG2 VAL 73 -6.549 -10.859 2.516 571 H VAL 74 H VAL 74 -2.154 -12.776 -0.741 572 HA VAL 74 HA VAL 74 -4.274 -14.442 -1.968 573 HB VAL 74 HB VAL 74 -1.296 -14.959 -2.137 574 HG11 VAL 74 1HG1 VAL 74 -1.957 -16.048 -4.234 575 HG12 VAL 74 2HG1 VAL 74 -3.004 -16.669 -2.945 576 HG13 VAL 74 3HG1 VAL 74 -3.622 -15.457 -4.069 577 HG21 VAL 74 3HG2 VAL 74 -2.937 -13.048 -3.862 578 HG22 VAL 74 1HG2 VAL 74 -1.483 -12.656 -2.910 579 HG23 VAL 74 2HG2 VAL 74 -1.359 -13.716 -4.321 580 H MET 75 H MET 75 -4.897 -16.408 -0.979 581 HA MET 75 HA MET 75 -3.042 -17.619 0.847 582 HB2 MET 75 1HB MET 75 -4.621 -18.135 2.632 583 HB3 MET 75 2HB MET 75 -4.296 -16.427 2.521 584 HG2 MET 75 1HG MET 75 -6.643 -17.320 0.993 585 HG3 MET 75 2HG MET 75 -6.758 -17.583 2.735 586 HE1 MET 75 3HE MET 75 -7.762 -13.918 0.503 587 HE2 MET 75 1HE MET 75 -6.895 -15.319 -0.163 588 HE3 MET 75 2HE MET 75 -8.471 -15.552 0.622 589 HA PRO 76 HA PRO 76 -4.400 -21.001 -1.591 590 HB2 PRO 76 1HB PRO 76 -3.683 -23.157 -0.020 591 HB3 PRO 76 2HB PRO 76 -2.521 -22.116 -0.885 592 HG2 PRO 76 1HG PRO 76 -3.367 -21.993 2.014 593 HG3 PRO 76 2HG PRO 76 -1.706 -21.904 1.345 594 HD2 PRO 76 1HD PRO 76 -3.185 -19.717 2.059 595 HD3 PRO 76 2HD PRO 76 -2.022 -19.670 0.691 596 H ILE 77 H ILE 77 -5.997 -22.612 -1.812 597 HA ILE 77 HA ILE 77 -8.144 -22.657 0.221 598 HB ILE 77 HB ILE 77 -8.234 -23.883 -2.542 599 HG12 ILE 77 1HG1 ILE 77 -9.145 -21.147 -1.623 600 HG13 ILE 77 2HG1 ILE 77 -7.802 -21.408 -2.694 601 HG21 ILE 77 1HG2 ILE 77 -10.642 -23.833 -2.149 602 HG22 ILE 77 2HG2 ILE 77 -9.910 -24.620 -0.762 603 HG23 ILE 77 3HG2 ILE 77 -10.448 -22.932 -0.613 604 HD11 ILE 77 3HD1 ILE 77 -10.706 -21.933 -3.336 605 HD12 ILE 77 1HD1 ILE 77 -9.654 -20.690 -4.005 606 HD13 ILE 77 2HD1 ILE 77 -9.338 -22.399 -4.385 607 H GLY 78 H GLY 78 -6.585 -23.742 1.657 608 HA2 GLY 78 2HA GLY 78 -6.055 -26.608 1.158 609 HA3 GLY 78 1HA GLY 78 -5.734 -25.703 2.656 610 H ASP 79 H ASP 79 -7.926 -24.620 3.574 611 HA ASP 79 HA ASP 79 -10.334 -26.124 3.005 612 HB2 ASP 79 1HB ASP 79 -9.118 -27.317 4.892 613 HB3 ASP 79 2HB ASP 79 -9.343 -25.864 5.874 614 H GLY 80 H GLY 80 -11.712 -24.488 2.627 615 HA2 GLY 80 2HA GLY 80 -13.058 -22.686 3.107 616 HA3 GLY 80 1HA GLY 80 -12.122 -22.376 4.571 617 H SER 81 H SER 81 -9.826 -21.495 4.070 618 HA SER 81 HA SER 81 -8.417 -19.933 3.289 619 HB2 SER 81 1HB SER 81 -9.128 -21.118 1.070 620 HB3 SER 81 2HB SER 81 -10.024 -19.619 0.862 621 HG SER 81 HG SER 81 -7.245 -20.107 0.994 622 H ARG 82 H ARG 82 -10.401 -19.254 5.018 623 HA ARG 82 HA ARG 82 -11.711 -16.738 4.127 624 HB2 ARG 82 1HB ARG 82 -12.216 -18.872 6.171 625 HB3 ARG 82 2HB ARG 82 -12.677 -17.246 6.617 626 HG2 ARG 82 1HG ARG 82 -14.492 -18.583 5.583 627 HG3 ARG 82 2HG ARG 82 -14.185 -17.026 4.815 628 HD2 ARG 82 1HD ARG 82 -13.044 -18.099 2.955 629 HD3 ARG 82 2HD ARG 82 -13.211 -19.706 3.675 630 HE ARG 82 HE ARG 82 -15.755 -18.362 3.510 631 HH11 ARG 82 1HH1 ARG 82 -13.391 -19.967 1.409 632 HH12 ARG 82 2HH1 ARG 82 -14.495 -20.336 0.161 633 HH21 ARG 82 1HH2 ARG 82 -17.315 -19.215 2.025 634 HH22 ARG 82 2HH2 ARG 82 -16.807 -19.804 0.489 635 H SER 83 H SER 83 -8.728 -17.218 5.016 636 HA SER 83 HA SER 83 -8.418 -15.524 7.335 637 HB2 SER 83 1HB SER 83 -6.488 -16.511 5.215 638 HB3 SER 83 2HB SER 83 -5.985 -15.550 6.616 639 HG SER 83 HG SER 83 -5.837 -17.772 7.021 640 H ALA 84 H ALA 84 -9.292 -14.556 4.214 641 HA ALA 84 HA ALA 84 -7.814 -12.173 3.738 642 HB1 ALA 84 1HB ALA 84 -9.287 -13.077 2.047 643 HB2 ALA 84 2HB ALA 84 -10.689 -13.030 3.146 644 HB3 ALA 84 3HB ALA 84 -9.973 -11.519 2.580 645 H GLU 85 H GLU 85 -10.999 -12.535 5.454 646 HA GLU 85 HA GLU 85 -11.239 -9.808 6.017 647 HB2 GLU 85 1HB GLU 85 -12.445 -12.220 7.453 648 HB3 GLU 85 2HB GLU 85 -12.974 -10.543 7.623 649 HG2 GLU 85 1HG GLU 85 -13.060 -10.713 4.943 650 HG3 GLU 85 2HG GLU 85 -13.235 -12.430 5.279 651 H GLN 86 H GLN 86 -9.567 -12.336 7.818 652 HA GLN 86 HA GLN 86 -9.018 -11.038 10.194 653 HB2 GLN 86 1HB GLN 86 -8.483 -13.427 8.868 654 HB3 GLN 86 2HB GLN 86 -6.887 -12.691 8.790 655 HG2 GLN 86 1HG GLN 86 -8.390 -12.846 11.403 656 HG3 GLN 86 2HG GLN 86 -7.646 -14.263 10.655 657 HE21 GLN 86 1HE2 GLN 86 -6.918 -10.967 11.820 658 HE22 GLN 86 2HE2 GLN 86 -5.216 -11.163 12.056 659 H VAL 87 H VAL 87 -6.968 -11.089 7.232 660 HA VAL 87 HA VAL 87 -5.120 -9.149 8.207 661 HB VAL 87 HB VAL 87 -5.851 -10.238 5.417 662 HG11 VAL 87 1HG1 VAL 87 -3.396 -8.587 6.087 663 HG12 VAL 87 2HG1 VAL 87 -3.699 -9.418 4.554 664 HG13 VAL 87 3HG1 VAL 87 -4.743 -8.070 5.028 665 HG21 VAL 87 3HG2 VAL 87 -3.441 -10.770 7.186 666 HG22 VAL 87 1HG2 VAL 87 -4.837 -11.866 7.011 667 HG23 VAL 87 2HG2 VAL 87 -3.791 -11.540 5.623 668 H ALA 88 H ALA 88 -8.098 -8.845 6.182 669 HA ALA 88 HA ALA 88 -7.676 -6.165 5.435 670 HB1 ALA 88 1HB ALA 88 -10.302 -7.581 6.030 671 HB2 ALA 88 2HB ALA 88 -10.110 -6.073 5.113 672 HB3 ALA 88 3HB ALA 88 -9.440 -7.589 4.469 673 H ALA 89 H ALA 89 -8.870 -7.480 8.556 674 HA ALA 89 HA ALA 89 -9.691 -4.841 9.508 675 HB1 ALA 89 1HB ALA 89 -10.779 -6.924 10.279 676 HB2 ALA 89 2HB ALA 89 -9.233 -7.485 10.966 677 HB3 ALA 89 3HB ALA 89 -10.039 -6.051 11.627 678 H GLU 90 H GLU 90 -6.734 -6.768 9.545 679 HA GLU 90 HA GLU 90 -5.471 -5.229 11.682 680 HB2 GLU 90 1HB GLU 90 -4.341 -7.213 9.635 681 HB3 GLU 90 2HB GLU 90 -3.411 -6.410 10.923 682 HG2 GLU 90 1HG GLU 90 -5.261 -7.412 12.511 683 HG3 GLU 90 2HG GLU 90 -5.630 -8.455 11.168 684 H LEU 91 H LEU 91 -5.048 -5.459 8.180 685 HA LEU 91 HA LEU 91 -3.240 -3.463 7.663 686 HB2 LEU 91 1HB LEU 91 -5.552 -4.642 6.140 687 HB3 LEU 91 2HB LEU 91 -4.913 -3.136 5.519 688 HG LEU 91 HG LEU 91 -3.972 -5.200 4.527 689 HD11 LEU 91 1HD1 LEU 91 -1.937 -3.343 5.843 690 HD12 LEU 91 2HD1 LEU 91 -2.775 -3.063 4.305 691 HD13 LEU 91 3HD1 LEU 91 -1.621 -4.393 4.455 692 HD21 LEU 91 3HD2 LEU 91 -2.242 -6.454 5.625 693 HD22 LEU 91 1HD2 LEU 91 -3.668 -6.469 6.681 694 HD23 LEU 91 2HD2 LEU 91 -2.317 -5.405 7.050 695 H ASP 92 H ASP 92 -6.837 -2.949 7.632 696 HA ASP 92 HA ASP 92 -6.705 -0.222 7.111 697 HB2 ASP 92 1HB ASP 92 -8.722 -1.478 6.798 698 HB3 ASP 92 2HB ASP 92 -8.756 -1.978 8.491 699 H ALA 93 H ALA 93 -6.647 -1.823 10.268 700 HA ALA 93 HA ALA 93 -6.692 0.654 11.753 701 HB1 ALA 93 1HB ALA 93 -6.082 -0.773 13.601 702 HB2 ALA 93 2HB ALA 93 -7.318 -1.599 12.627 703 HB3 ALA 93 3HB ALA 93 -5.616 -2.089 12.492 704 H LEU 94 H LEU 94 -4.285 -0.617 9.737 705 HA LEU 94 HA LEU 94 -2.123 0.838 11.158 706 HB2 LEU 94 1HB LEU 94 -1.837 -1.613 10.811 707 HB3 LEU 94 2HB LEU 94 -1.857 -1.360 9.074 708 HG LEU 94 HG LEU 94 0.324 -1.705 10.367 709 HD11 LEU 94 1HD1 LEU 94 0.220 0.435 8.256 710 HD12 LEU 94 2HD1 LEU 94 0.451 -1.326 8.080 711 HD13 LEU 94 3HD1 LEU 94 1.697 -0.354 8.847 712 HD21 LEU 94 3HD2 LEU 94 0.037 0.007 12.090 713 HD22 LEU 94 1HD2 LEU 94 0.215 1.270 10.854 714 HD23 LEU 94 2HD2 LEU 94 1.553 0.155 11.197 715 H PHE 95 H PHE 95 -4.188 0.858 8.365 716 HA PHE 95 HA PHE 95 -2.677 3.190 7.360 717 HB2 PHE 95 1HB PHE 95 -3.940 1.020 5.645 718 HB3 PHE 95 2HB PHE 95 -3.416 2.563 5.036 719 HD1 PHE 95 1HD PHE 95 -2.301 -0.701 6.319 720 HD2 PHE 95 2HD PHE 95 -1.005 3.059 4.622 721 HE1 PHE 95 1HE PHE 95 -0.050 -1.642 5.897 722 HE2 PHE 95 2HE PHE 95 1.283 2.195 4.454 723 HZ PHE 95 HZ PHE 95 1.783 -0.155 5.104 724 HA PRO 96 HA PRO 96 -7.129 4.336 8.187 725 HB2 PRO 96 1HB PRO 96 -6.835 6.090 10.258 726 HB3 PRO 96 2HB PRO 96 -6.912 4.327 10.507 727 HG2 PRO 96 1HG PRO 96 -4.434 6.077 10.293 728 HG3 PRO 96 2HG PRO 96 -4.836 4.878 11.564 729 HD2 PRO 96 1HD PRO 96 -3.247 4.231 9.455 730 HD3 PRO 96 2HD PRO 96 -4.414 3.058 10.143 731 H VAL 97 H VAL 97 -8.017 6.665 8.134 732 HA VAL 97 HA VAL 97 -7.218 7.451 5.651 733 HB VAL 97 HB VAL 97 -9.479 7.516 6.840 734 HG11 VAL 97 1HG1 VAL 97 -8.758 10.438 7.320 735 HG12 VAL 97 2HG1 VAL 97 -10.295 9.625 7.658 736 HG13 VAL 97 3HG1 VAL 97 -8.856 9.202 8.596 737 HG21 VAL 97 3HG2 VAL 97 -9.112 8.041 4.481 738 HG22 VAL 97 1HG2 VAL 97 -10.425 8.997 5.185 739 HG23 VAL 97 2HG2 VAL 97 -8.854 9.748 4.878 740 H ASN 98 H ASN 98 -5.479 8.470 8.205 741 HA ASN 98 HA ASN 98 -4.883 11.186 7.034 742 HB2 ASN 98 1HB ASN 98 -4.122 9.994 9.743 743 HB3 ASN 98 2HB ASN 98 -3.394 11.447 9.065 744 HD21 ASN 98 1HD2 ASN 98 -6.846 10.634 8.747 745 HD22 ASN 98 2HD2 ASN 98 -7.441 11.936 9.729 746 H LEU 99 H LEU 99 -3.347 8.112 8.033 747 HA LEU 99 HA LEU 99 -1.433 7.110 7.525 748 HB2 LEU 99 1HB LEU 99 -2.947 7.416 5.377 749 HB3 LEU 99 2HB LEU 99 -1.526 8.248 4.773 750 HG LEU 99 HG LEU 99 -0.329 6.011 5.807 751 HD11 LEU 99 1HD1 LEU 99 -2.830 4.760 4.902 752 HD12 LEU 99 2HD1 LEU 99 -2.778 5.450 6.532 753 HD13 LEU 99 3HD1 LEU 99 -1.572 4.289 6.115 754 HD21 LEU 99 3HD2 LEU 99 -1.539 5.884 3.090 755 HD22 LEU 99 1HD2 LEU 99 -0.086 5.095 3.706 756 HD23 LEU 99 2HD2 LEU 99 -0.133 6.856 3.489 757 H VAL 100 H VAL 100 -0.811 9.765 8.645 758 HA VAL 100 HA VAL 100 0.967 11.192 7.028 759 HB VAL 100 HB VAL 100 1.001 11.054 10.067 760 HG11 VAL 100 1HG1 VAL 100 1.629 13.389 8.245 761 HG12 VAL 100 2HG1 VAL 100 1.929 13.254 9.984 762 HG13 VAL 100 3HG1 VAL 100 2.906 12.309 8.864 763 HG21 VAL 100 3HG2 VAL 100 -1.240 11.557 9.589 764 HG22 VAL 100 1HG2 VAL 100 -0.511 13.166 9.671 765 HG23 VAL 100 2HG2 VAL 100 -0.843 12.450 8.094 766 H MET 101 H MET 101 2.808 10.454 6.111 767 HA MET 101 HA MET 101 4.782 9.083 7.888 768 HB2 MET 101 1HB MET 101 4.992 8.508 4.973 769 HB3 MET 101 2HB MET 101 5.363 7.530 6.386 770 HG2 MET 101 1HG MET 101 2.888 7.259 6.758 771 HG3 MET 101 2HG MET 101 2.664 8.193 5.262 772 HE1 MET 101 3HE MET 101 1.917 7.447 3.461 773 HE2 MET 101 1HE MET 101 3.442 7.032 2.653 774 HE3 MET 101 2HE MET 101 2.116 5.849 2.705 775 H GLN 102 H GLN 102 5.677 11.030 8.485 776 HA GLN 102 HA GLN 102 6.758 12.912 6.559 777 HB2 GLN 102 1HB GLN 102 7.990 13.782 8.500 778 HB3 GLN 102 2HB GLN 102 6.254 13.757 8.709 779 HG2 GLN 102 1HG GLN 102 7.589 11.336 9.825 780 HG3 GLN 102 2HG GLN 102 8.177 12.847 10.483 781 HE21 GLN 102 1HE2 GLN 102 7.153 13.370 12.322 782 HE22 GLN 102 2HE2 GLN 102 5.483 13.067 12.727 783 H SER 103 H SER 103 8.396 12.383 5.194 784 HA SER 103 HA SER 103 10.400 10.379 6.150 785 HB2 SER 103 1HB SER 103 8.285 9.845 4.478 786 HB3 SER 103 2HB SER 103 9.540 10.196 3.297 787 HG SER 103 HG SER 103 10.793 8.554 4.253 788 H GLY 104 H GLY 104 10.769 13.292 5.802 789 HA2 GLY 104 2HA GLY 104 12.900 14.286 5.490 790 HA3 GLY 104 1HA GLY 104 13.291 13.119 4.240 791 H GLY 105 H GLY 105 10.381 13.899 3.251 792 HA2 GLY 105 2HA GLY 105 11.187 16.279 1.606 793 HA3 GLY 105 1HA GLY 105 10.112 14.950 1.061 794 H LEU 106 H LEU 106 8.080 14.654 2.127 795 HA LEU 106 HA LEU 106 7.045 16.757 3.891 796 HB2 LEU 106 1HB LEU 106 5.004 16.583 2.429 797 HB3 LEU 106 2HB LEU 106 6.372 17.374 1.729 798 HG LEU 106 HG LEU 106 4.946 15.734 0.339 799 HD11 LEU 106 1HD1 LEU 106 6.615 15.440 -1.228 800 HD12 LEU 106 2HD1 LEU 106 7.908 15.354 -0.020 801 HD13 LEU 106 3HD1 LEU 106 7.059 16.885 -0.356 802 HD21 LEU 106 3HD2 LEU 106 4.992 13.783 1.790 803 HD22 LEU 106 1HD2 LEU 106 6.726 13.559 1.432 804 HD23 LEU 106 2HD2 LEU 106 5.513 13.478 0.149 805 H ALA 107 H ALA 107 4.540 15.777 4.038 806 HA ALA 107 HA ALA 107 4.795 13.232 5.538 807 HB1 ALA 107 1HB ALA 107 4.593 15.180 6.995 808 HB2 ALA 107 2HB ALA 107 3.231 15.822 6.055 809 HB3 ALA 107 3HB ALA 107 3.048 14.326 6.986 810 H VAL 108 H VAL 108 4.161 11.942 3.726 811 HA VAL 108 HA VAL 108 2.046 12.585 1.948 812 HB VAL 108 HB VAL 108 3.729 11.180 1.182 813 HG11 VAL 108 1HG1 VAL 108 4.787 10.319 3.089 814 HG12 VAL 108 2HG1 VAL 108 3.346 9.380 3.547 815 HG13 VAL 108 3HG1 VAL 108 4.318 8.952 2.109 816 HG21 VAL 108 3HG2 VAL 108 1.436 10.382 0.415 817 HG22 VAL 108 1HG2 VAL 108 2.709 9.164 0.354 818 HG23 VAL 108 2HG2 VAL 108 1.525 9.127 1.663 819 H ARG 109 H ARG 109 0.017 11.171 1.611 820 HA ARG 109 HA ARG 109 -1.160 10.207 4.066 821 HB2 ARG 109 1HB ARG 109 -3.290 11.393 3.646 822 HB3 ARG 109 2HB ARG 109 -1.982 12.461 4.208 823 HG2 ARG 109 1HG ARG 109 -1.726 13.188 1.846 824 HG3 ARG 109 2HG ARG 109 -3.061 12.135 1.356 825 HD2 ARG 109 1HD ARG 109 -4.565 13.240 2.962 826 HD3 ARG 109 2HD ARG 109 -3.290 14.364 3.415 827 HE ARG 109 HE ARG 109 -3.465 14.750 0.699 828 HH11 ARG 109 1HH1 ARG 109 -5.730 14.928 3.433 829 HH12 ARG 109 2HH1 ARG 109 -6.745 16.104 2.714 830 HH21 ARG 109 1HH2 ARG 109 -4.748 16.308 -0.256 831 HH22 ARG 109 2HH2 ARG 109 -6.171 16.939 0.498 832 H VAL 110 H VAL 110 -2.992 9.124 3.672 833 HA VAL 110 HA VAL 110 -3.221 7.568 1.204 834 HB VAL 110 HB VAL 110 -3.386 6.607 3.498 835 HG11 VAL 110 1HG1 VAL 110 -6.195 7.719 3.513 836 HG12 VAL 110 2HG1 VAL 110 -5.415 6.670 4.714 837 HG13 VAL 110 3HG1 VAL 110 -4.840 8.335 4.491 838 HG21 VAL 110 3HG2 VAL 110 -4.096 5.393 1.521 839 HG22 VAL 110 1HG2 VAL 110 -5.037 4.957 2.973 840 HG23 VAL 110 2HG2 VAL 110 -5.745 5.996 1.722 841 H ARG 111 H ARG 111 -4.982 10.252 2.593 842 HA ARG 111 HA ARG 111 -6.559 11.655 1.759 843 HB2 ARG 111 1HB ARG 111 -5.342 11.625 -0.330 844 HB3 ARG 111 2HB ARG 111 -6.330 10.263 -0.909 845 HG2 ARG 111 1HG ARG 111 -8.355 11.543 -0.727 846 HG3 ARG 111 2HG ARG 111 -7.546 12.767 0.242 847 HD2 ARG 111 1HD ARG 111 -8.038 13.686 -1.805 848 HD3 ARG 111 2HD ARG 111 -6.302 13.578 -1.660 849 HE ARG 111 HE ARG 111 -6.245 12.439 -3.614 850 HH11 ARG 111 1HH1 ARG 111 -9.578 11.985 -2.388 851 HH12 ARG 111 2HH1 ARG 111 -10.039 11.002 -3.742 852 HH21 ARG 111 1HH2 ARG 111 -6.845 11.071 -5.285 853 HH22 ARG 111 2HH2 ARG 111 -8.495 10.640 -5.533 854 H THR 112 H THR 112 -7.370 8.296 0.631 855 HA THR 112 HA THR 112 -10.122 8.802 1.672 856 HB THR 112 HB THR 112 -10.774 7.097 -0.134 857 HG1 THR 112 1HG THR 112 -8.951 6.291 -0.864 858 HG21 THR 112 3HG2 THR 112 -11.176 9.576 -0.320 859 HG22 THR 112 1HG2 THR 112 -10.919 8.739 -1.869 860 HG23 THR 112 2HG2 THR 112 -9.604 9.694 -1.160 861 HA PRO 113 HA PRO 113 -9.456 5.352 4.289 862 HB2 PRO 113 1HB PRO 113 -11.942 4.261 4.643 863 HB3 PRO 113 2HB PRO 113 -11.494 5.880 5.267 864 HG2 PRO 113 1HG PRO 113 -12.961 5.208 2.693 865 HG3 PRO 113 2HG PRO 113 -13.386 6.422 3.937 866 HD2 PRO 113 1HD PRO 113 -12.060 7.109 1.667 867 HD3 PRO 113 2HD PRO 113 -11.709 7.901 3.232 868 H ILE 114 H ILE 114 -9.547 3.005 4.456 869 HA ILE 114 HA ILE 114 -8.659 1.708 2.098 870 HB ILE 114 HB ILE 114 -9.714 0.571 4.733 871 HG12 ILE 114 1HG1 ILE 114 -7.756 2.117 4.983 872 HG13 ILE 114 2HG1 ILE 114 -7.493 0.465 5.475 873 HG21 ILE 114 1HG2 ILE 114 -8.347 -1.467 4.073 874 HG22 ILE 114 2HG2 ILE 114 -9.790 -1.191 3.087 875 HG23 ILE 114 3HG2 ILE 114 -8.217 -0.755 2.430 876 HD11 ILE 114 3HD1 ILE 114 -5.587 1.504 4.238 877 HD12 ILE 114 1HD1 ILE 114 -6.150 -0.032 3.565 878 HD13 ILE 114 2HD1 ILE 114 -6.610 1.532 2.807 879 H SER 115 H SER 115 -9.772 0.866 0.375 880 HA SER 115 HA SER 115 -12.633 0.452 0.683 881 HB2 SER 115 1HB SER 115 -12.448 1.204 -1.198 882 HB3 SER 115 2HB SER 115 -10.722 1.021 -1.423 883 HG SER 115 HG SER 115 -12.791 -0.767 -2.070 884 H ASN 116 H ASN 116 -13.652 -1.438 0.156 885 HA ASN 116 HA ASN 116 -12.377 -3.960 0.838 886 HB2 ASN 116 1HB ASN 116 -12.993 -2.961 2.896 887 HB3 ASN 116 2HB ASN 116 -14.416 -2.137 2.207 888 HD21 ASN 116 1HD2 ASN 116 -13.080 -5.375 2.787 889 HD22 ASN 116 2HD2 ASN 116 -14.639 -6.043 3.189 890 H GLY 117 H GLY 117 -13.806 -5.738 0.328 891 HA2 GLY 117 2HA GLY 117 -16.407 -5.575 -0.684 892 HA3 GLY 117 1HA GLY 117 -15.296 -5.751 -2.060 893 H GLN 118 H GLN 118 -16.788 -7.907 -1.873 894 HA GLN 118 HA GLN 118 -15.969 -9.927 0.088 895 HB2 GLN 118 1HB GLN 118 -18.036 -9.633 -1.975 896 HB3 GLN 118 2HB GLN 118 -17.257 -11.199 -1.924 897 HG2 GLN 118 1HG GLN 118 -17.617 -11.009 0.719 898 HG3 GLN 118 2HG GLN 118 -18.846 -9.822 0.256 899 HE21 GLN 118 1HE2 GLN 118 -20.659 -10.582 -1.068 900 HE22 GLN 118 2HE2 GLN 118 -20.797 -12.301 -1.447 901 HA PRO 119 HA PRO 119 -12.520 -11.151 -2.350 902 HB2 PRO 119 1HB PRO 119 -12.438 -13.938 -1.916 903 HB3 PRO 119 2HB PRO 119 -11.703 -12.696 -0.899 904 HG2 PRO 119 1HG PRO 119 -14.273 -14.206 -0.534 905 HG3 PRO 119 2HG PRO 119 -13.207 -13.509 0.722 906 HD2 PRO 119 1HD PRO 119 -15.638 -12.426 -0.132 907 HD3 PRO 119 2HD PRO 119 -14.349 -11.483 0.663 908 H THR 120 H THR 120 -11.778 -12.313 -4.175 909 HA THR 120 HA THR 120 -13.865 -13.745 -5.691 910 HB THR 120 HB THR 120 -13.058 -11.474 -6.642 911 HG1 THR 120 1HG THR 120 -14.211 -13.118 -7.727 912 HG21 THR 120 3HG2 THR 120 -10.615 -11.874 -6.300 913 HG22 THR 120 1HG2 THR 120 -11.032 -11.552 -7.996 914 HG23 THR 120 2HG2 THR 120 -10.701 -13.211 -7.460 915 H THR 121 H THR 121 -12.728 -15.422 -7.149 916 HA THR 121 HA THR 121 -10.904 -16.902 -5.336 917 HB THR 121 HB THR 121 -12.848 -18.016 -7.389 918 HG1 THR 121 1HG THR 121 -13.784 -18.434 -5.002 919 HG21 THR 121 3HG2 THR 121 -11.119 -19.625 -6.660 920 HG22 THR 121 1HG2 THR 121 -12.682 -20.068 -5.976 921 HG23 THR 121 2HG2 THR 121 -11.462 -19.260 -4.960 922 H GLY 122 H GLY 122 -9.255 -18.162 -6.370 923 HA2 GLY 122 2HA GLY 122 -8.168 -16.958 -8.855 924 HA3 GLY 122 1HA GLY 122 -7.269 -17.512 -7.446 925 H ASP 123 H ASP 123 -6.126 -19.218 -8.242 926 HA ASP 123 HA ASP 123 -7.424 -21.137 -10.123 927 HB2 ASP 123 1HB ASP 123 -5.099 -20.060 -10.413 928 HB3 ASP 123 2HB ASP 123 -4.544 -21.266 -9.255 929 H ALA 124 H ALA 124 -5.580 -21.072 -7.099 930 HA ALA 124 HA ALA 124 -7.183 -23.178 -5.783 931 HB1 ALA 124 1HB ALA 124 -5.127 -24.351 -5.102 932 HB2 ALA 124 2HB ALA 124 -5.157 -24.282 -6.867 933 HB3 ALA 124 3HB ALA 124 -4.111 -23.168 -5.961 934 H ASP 125 H ASP 125 -6.930 -20.169 -5.717 935 HA ASP 125 HA ASP 125 -6.104 -19.755 -2.966 936 HB2 ASP 125 1HB ASP 125 -5.012 -17.567 -4.044 937 HB3 ASP 125 2HB ASP 125 -4.093 -19.027 -3.741 938 H HIS 126 H HIS 126 -6.833 -17.436 -2.391 939 HA HIS 126 HA HIS 126 -8.956 -16.373 -4.163 940 HB2 HIS 126 1HB HIS 126 -9.169 -16.533 -1.132 941 HB3 HIS 126 2HB HIS 126 -10.243 -15.595 -2.156 942 HD1 HIS 126 1HD HIS 126 -12.440 -16.826 -2.952 943 HD2 HIS 126 2HD HIS 126 -9.391 -19.110 -1.185 944 HE1 HIS 126 1HE HIS 126 -13.482 -19.046 -2.370 945 H THR 127 H THR 127 -9.447 -14.073 -3.390 946 HA THR 127 HA THR 127 -7.290 -12.480 -2.180 947 HB THR 127 HB THR 127 -7.634 -11.144 -4.483 948 HG1 THR 127 1HG THR 127 -9.022 -12.716 -5.335 949 HG21 THR 127 3HG2 THR 127 -5.420 -12.082 -3.535 950 HG22 THR 127 1HG2 THR 127 -5.517 -11.937 -5.295 951 HG23 THR 127 2HG2 THR 127 -5.725 -13.529 -4.529 952 H VAL 128 H VAL 128 -8.126 -10.606 -1.404 953 HA VAL 128 HA VAL 128 -10.996 -10.030 -1.854 954 HB VAL 128 HB VAL 128 -10.353 -8.458 0.202 955 HG11 VAL 128 1HG1 VAL 128 -11.143 -11.345 0.630 956 HG12 VAL 128 2HG1 VAL 128 -11.484 -9.962 1.683 957 HG13 VAL 128 3HG1 VAL 128 -12.252 -10.043 0.110 958 HG21 VAL 128 3HG2 VAL 128 -9.035 -9.504 1.888 959 HG22 VAL 128 1HG2 VAL 128 -8.683 -10.868 0.819 960 HG23 VAL 128 2HG2 VAL 128 -8.051 -9.235 0.437 961 HA PRO 129 HA PRO 129 -9.504 -6.500 -3.995 962 HB2 PRO 129 1HB PRO 129 -11.825 -5.091 -4.292 963 HB3 PRO 129 2HB PRO 129 -11.482 -6.643 -5.109 964 HG2 PRO 129 1HG PRO 129 -13.127 -6.171 -2.613 965 HG3 PRO 129 2HG PRO 129 -13.521 -7.226 -4.011 966 HD2 PRO 129 1HD PRO 129 -12.418 -8.114 -1.658 967 HD3 PRO 129 2HD PRO 129 -12.212 -8.911 -3.223 968 H ILE 130 H ILE 130 -8.081 -5.534 -2.530 969 HA ILE 130 HA ILE 130 -9.254 -3.428 -0.791 970 HB ILE 130 HB ILE 130 -6.697 -4.808 0.000 971 HG12 ILE 130 1HG1 ILE 130 -9.485 -5.628 0.856 972 HG13 ILE 130 2HG1 ILE 130 -8.353 -6.598 -0.074 973 HG21 ILE 130 1HG2 ILE 130 -7.437 -2.548 0.960 974 HG22 ILE 130 2HG2 ILE 130 -8.815 -3.406 1.701 975 HG23 ILE 130 3HG2 ILE 130 -7.160 -3.814 2.159 976 HD11 ILE 130 3HD1 ILE 130 -8.424 -7.362 2.240 977 HD12 ILE 130 1HD1 ILE 130 -6.818 -6.713 1.878 978 HD13 ILE 130 2HD1 ILE 130 -7.990 -5.773 2.838 979 H SER 131 H SER 131 -8.595 -1.515 -1.353 980 HA SER 131 HA SER 131 -5.894 -0.986 -2.137 981 HB2 SER 131 1HB SER 131 -7.155 0.532 -4.137 982 HB3 SER 131 2HB SER 131 -6.086 -0.827 -4.361 983 HG SER 131 HG SER 131 -8.901 -0.769 -4.382 984 H LEU 132 H LEU 132 -5.530 1.482 -2.279 985 HA LEU 132 HA LEU 132 -7.798 3.081 -1.537 986 HB2 LEU 132 1HB LEU 132 -6.408 4.300 0.181 987 HB3 LEU 132 2HB LEU 132 -7.008 2.733 0.652 988 HG LEU 132 HG LEU 132 -4.742 3.281 1.383 989 HD11 LEU 132 1HD1 LEU 132 -3.899 1.253 1.584 990 HD12 LEU 132 2HD1 LEU 132 -4.281 0.786 -0.113 991 HD13 LEU 132 3HD1 LEU 132 -5.560 0.859 1.067 992 HD21 LEU 132 3HD2 LEU 132 -2.808 3.170 -0.014 993 HD22 LEU 132 1HD2 LEU 132 -3.879 4.428 -0.628 994 HD23 LEU 132 2HD2 LEU 132 -3.776 2.838 -1.439 995 H GLY 133 H GLY 133 -7.129 5.591 -1.800 996 HA2 GLY 133 2HA GLY 133 -5.183 5.745 -4.065 997 HA3 GLY 133 1HA GLY 133 -6.763 6.472 -4.118 998 H TYR 134 H TYR 134 -3.648 6.599 -2.810 999 HA TYR 134 HA TYR 134 -3.827 8.899 -1.023 1000 HB2 TYR 134 1HB TYR 134 -1.273 8.764 -1.230 1001 HB3 TYR 134 2HB TYR 134 -1.997 7.375 -0.571 1002 HD1 TYR 134 1HD TYR 134 -2.270 5.303 -2.066 1003 HD2 TYR 134 2HD TYR 134 -0.067 8.788 -3.334 1004 HE1 TYR 134 1HE TYR 134 -1.368 4.065 -3.984 1005 HE2 TYR 134 2HE TYR 134 0.894 7.515 -5.213 1006 HH TYR 134 HH TYR 134 -0.337 4.379 -6.157 1007 H ASP 135 H ASP 135 -2.641 10.815 -1.258 1008 HA ASP 135 HA ASP 135 -2.590 11.806 -4.111 1009 HB2 ASP 135 1HB ASP 135 -4.523 12.386 -2.374 1010 HB3 ASP 135 2HB ASP 135 -3.368 13.643 -1.912 1011 H VAL 136 H VAL 136 -0.849 11.466 -1.270 1012 HA VAL 136 HA VAL 136 0.767 12.504 -0.114 1013 HB VAL 136 HB VAL 136 1.606 13.482 -2.851 1014 HG11 VAL 136 1HG1 VAL 136 3.847 13.939 -1.901 1015 HG12 VAL 136 2HG1 VAL 136 2.622 15.070 -1.368 1016 HG13 VAL 136 3HG1 VAL 136 3.166 13.777 -0.266 1017 HG21 VAL 136 3HG2 VAL 136 1.762 10.985 -2.338 1018 HG22 VAL 136 1HG2 VAL 136 3.314 11.754 -2.688 1019 HG23 VAL 136 2HG2 VAL 136 2.886 11.401 -1.025 1020 H GLN 137 H GLN 137 1.494 14.716 0.739 1021 HA GLN 137 HA GLN 137 0.118 17.005 -0.208 1022 HB2 GLN 137 1HB GLN 137 -0.692 17.712 1.963 1023 HB3 GLN 137 2HB GLN 137 -1.516 16.214 1.509 1024 HG2 GLN 137 1HG GLN 137 0.284 15.014 2.884 1025 HG3 GLN 137 2HG GLN 137 0.723 16.583 3.557 1026 HE21 GLN 137 1HE2 GLN 137 -0.115 14.265 4.962 1027 HE22 GLN 137 2HE2 GLN 137 -1.728 14.499 5.648 1028 H PHE 138 H PHE 138 1.435 18.850 0.476 1029 HA PHE 138 HA PHE 138 3.746 18.390 2.167 1030 HB2 PHE 138 1HB PHE 138 5.206 19.541 0.452 1031 HB3 PHE 138 2HB PHE 138 4.800 17.880 0.110 1032 HD1 PHE 138 2HD PHE 138 3.099 17.255 -1.568 1033 HD2 PHE 138 1HD PHE 138 4.565 21.260 -1.118 1034 HE1 PHE 138 2HE PHE 138 2.388 17.764 -3.908 1035 HE2 PHE 138 1HE PHE 138 3.819 21.796 -3.442 1036 HZ PHE 138 HZ PHE 138 2.779 20.039 -4.836 1037 H TYR 139 H TYR 139 3.977 20.138 3.395 1038 HA TYR 139 HA TYR 139 2.473 22.611 3.001 1039 HB2 TYR 139 1HB TYR 139 4.650 21.640 4.869 1040 HB3 TYR 139 2HB TYR 139 4.224 23.347 4.812 1041 HD1 TYR 139 2HD TYR 139 3.009 19.937 5.636 1042 HD2 TYR 139 1HD TYR 139 2.075 24.163 5.688 1043 HE1 TYR 139 2HE TYR 139 1.009 19.477 6.933 1044 HE2 TYR 139 1HE TYR 139 0.000 23.682 6.971 1045 HH TYR 139 HH TYR 139 -1.195 20.403 7.439 1046 HA PRO 140 HA PRO 140 5.680 24.674 0.469 1047 HB2 PRO 140 1HB PRO 140 5.932 27.079 1.751 1048 HB3 PRO 140 2HB PRO 140 4.568 26.700 0.651 1049 HG2 PRO 140 1HG PRO 140 4.641 26.494 3.685 1050 HG3 PRO 140 2HG PRO 140 3.393 27.279 2.664 1051 HD2 PRO 140 1HD PRO 140 3.031 24.795 3.597 1052 HD3 PRO 140 2HD PRO 140 2.551 25.191 1.925 1053 H GLU 141 H GLU 141 7.884 24.856 0.695 1054 HA GLU 141 HA GLU 141 9.159 24.627 3.346 1055 HB2 GLU 141 1HB GLU 141 11.258 24.822 2.075 1056 HB3 GLU 141 2HB GLU 141 10.418 23.341 1.725 1057 HG2 GLU 141 1HG GLU 141 10.290 25.765 -0.129 1058 HG3 GLU 141 2HG GLU 141 11.552 24.542 -0.217 Start of MODEL 14 1 H1 GLY 1 H GLY 1 16.277 17.899 -3.305 2 HA2 GLY 1 2HA GLY 1 14.294 17.247 -4.522 3 HA3 GLY 1 1HA GLY 1 15.731 16.753 -5.424 4 H MET 2 H MET 2 14.793 15.032 -6.427 5 HA MET 2 HA MET 2 13.838 13.119 -6.912 6 HB2 MET 2 1HB MET 2 14.335 12.154 -4.068 7 HB3 MET 2 2HB MET 2 13.818 11.190 -5.452 8 HG2 MET 2 1HG MET 2 15.926 11.816 -6.638 9 HG3 MET 2 2HG MET 2 16.461 12.663 -5.178 10 HE1 MET 2 3HE MET 2 18.650 11.338 -5.290 11 HE2 MET 2 1HE MET 2 18.796 9.566 -5.201 12 HE3 MET 2 2HE MET 2 18.152 10.330 -6.668 13 H SER 3 H SER 3 12.770 13.809 -3.552 14 HA SER 3 HA SER 3 10.800 14.127 -2.594 15 HB2 SER 3 1HB SER 3 9.601 14.809 -5.270 16 HB3 SER 3 2HB SER 3 9.037 15.269 -3.663 17 HG SER 3 HG SER 3 11.314 16.224 -3.512 18 H GLN 4 H GLN 4 9.935 12.586 -5.688 19 HA GLN 4 HA GLN 4 7.961 10.810 -5.033 20 HB2 GLN 4 1HB GLN 4 8.858 11.420 -7.252 21 HB3 GLN 4 2HB GLN 4 10.329 10.516 -6.957 22 HG2 GLN 4 1HG GLN 4 7.532 9.327 -7.133 23 HG3 GLN 4 2HG GLN 4 8.675 9.425 -8.469 24 HE21 GLN 4 1HE2 GLN 4 7.506 7.338 -6.206 25 HE22 GLN 4 2HE2 GLN 4 8.818 6.172 -6.213 26 H ASP 5 H ASP 5 11.492 10.098 -4.942 27 HA ASP 5 HA ASP 5 11.296 7.429 -4.215 28 HB2 ASP 5 1HB ASP 5 13.336 8.817 -4.932 29 HB3 ASP 5 2HB ASP 5 13.516 9.256 -3.235 30 H LEU 6 H LEU 6 11.143 10.297 -2.119 31 HA LEU 6 HA LEU 6 11.339 8.811 0.346 32 HB2 LEU 6 1HB LEU 6 10.491 11.700 -0.091 33 HB3 LEU 6 2HB LEU 6 11.063 10.947 1.387 34 HG LEU 6 HG LEU 6 12.870 12.139 0.727 35 HD11 LEU 6 1HD1 LEU 6 13.533 9.480 -0.551 36 HD12 LEU 6 2HD1 LEU 6 13.597 9.863 1.186 37 HD13 LEU 6 3HD1 LEU 6 14.661 10.694 0.048 38 HD21 LEU 6 3HD2 LEU 6 11.920 12.823 -1.415 39 HD22 LEU 6 1HD2 LEU 6 12.605 11.387 -2.185 40 HD23 LEU 6 2HD2 LEU 6 13.679 12.591 -1.430 41 H ILE 7 H ILE 7 8.753 10.170 -1.673 42 HA ILE 7 HA ILE 7 6.561 9.651 0.125 43 HB ILE 7 HB ILE 7 6.734 9.752 -2.909 44 HG12 ILE 7 1HG1 ILE 7 5.225 11.841 -1.426 45 HG13 ILE 7 2HG1 ILE 7 6.942 11.839 -1.061 46 HG21 ILE 7 1HG2 ILE 7 4.768 8.446 -2.434 47 HG22 ILE 7 2HG2 ILE 7 4.234 9.598 -1.192 48 HG23 ILE 7 3HG2 ILE 7 4.266 10.064 -2.911 49 HD11 ILE 7 3HD1 ILE 7 6.425 13.346 -2.946 50 HD12 ILE 7 1HD1 ILE 7 7.498 12.048 -3.385 51 HD13 ILE 7 2HD1 ILE 7 5.793 11.966 -3.877 52 H ARG 8 H ARG 8 8.273 7.599 -2.306 53 HA ARG 8 HA ARG 8 6.803 5.206 -1.690 54 HB2 ARG 8 1HB ARG 8 8.404 5.619 -3.678 55 HB3 ARG 8 2HB ARG 8 9.712 5.263 -2.550 56 HG2 ARG 8 1HG ARG 8 7.920 3.139 -2.149 57 HG3 ARG 8 2HG ARG 8 7.778 3.452 -3.872 58 HD2 ARG 8 1HD ARG 8 10.319 2.826 -2.308 59 HD3 ARG 8 2HD ARG 8 9.465 1.737 -3.408 60 HE ARG 8 HE ARG 8 10.068 3.909 -4.998 61 HH11 ARG 8 1HH1 ARG 8 11.903 1.394 -3.255 62 HH12 ARG 8 2HH1 ARG 8 13.355 1.678 -4.175 63 HH21 ARG 8 1HH2 ARG 8 12.117 4.410 -6.024 64 HH22 ARG 8 2HH2 ARG 8 13.536 3.649 -5.397 65 H ALA 9 H ALA 9 9.913 6.489 -0.367 66 HA ALA 9 HA ALA 9 10.419 4.380 1.382 67 HB1 ALA 9 1HB ALA 9 11.101 7.308 1.890 68 HB2 ALA 9 2HB ALA 9 11.924 5.896 2.556 69 HB3 ALA 9 3HB ALA 9 12.030 6.227 0.818 70 H ALA 10 H ALA 10 8.184 7.121 1.908 71 HA ALA 10 HA ALA 10 7.800 6.619 4.710 72 HB1 ALA 10 1HB ALA 10 7.101 8.704 3.459 73 HB2 ALA 10 2HB ALA 10 5.760 7.772 2.759 74 HB3 ALA 10 3HB ALA 10 5.871 8.020 4.521 75 H PHE 11 H PHE 11 6.195 5.381 1.778 76 HA PHE 11 HA PHE 11 4.190 3.828 3.129 77 HB2 PHE 11 1HB PHE 11 5.279 3.968 0.314 78 HB3 PHE 11 2HB PHE 11 4.322 2.587 0.796 79 HD1 PHE 11 1HD PHE 11 3.892 6.263 1.718 80 HD2 PHE 11 2HD PHE 11 2.286 2.813 -0.329 81 HE1 PHE 11 1HE PHE 11 1.750 7.437 1.372 82 HE2 PHE 11 2HE PHE 11 0.135 3.999 -0.610 83 HZ PHE 11 HZ PHE 11 -0.142 6.301 0.281 84 H GLU 12 H GLU 12 7.457 3.039 1.851 85 HA GLU 12 HA GLU 12 7.607 0.340 2.414 86 HB2 GLU 12 1HB GLU 12 9.173 1.986 1.150 87 HB3 GLU 12 2HB GLU 12 9.813 2.417 2.719 88 HG2 GLU 12 1HG GLU 12 11.343 0.844 2.050 89 HG3 GLU 12 2HG GLU 12 10.240 -0.115 3.031 90 H LYS 13 H LYS 13 8.183 3.149 4.587 91 HA LYS 13 HA LYS 13 9.211 1.539 6.780 92 HB2 LYS 13 1HB LYS 13 8.536 4.480 6.427 93 HB3 LYS 13 2HB LYS 13 9.076 3.819 7.956 94 HG2 LYS 13 1HG LYS 13 10.699 3.321 5.423 95 HG3 LYS 13 2HG LYS 13 10.803 4.853 6.303 96 HD2 LYS 13 1HD LYS 13 11.380 3.721 8.342 97 HD3 LYS 13 2HD LYS 13 11.213 2.121 7.588 98 HE2 LYS 13 1HE LYS 13 13.034 2.673 5.990 99 HE3 LYS 13 2HE LYS 13 13.242 4.244 6.782 100 HZ1 LYS 13 3HZ LYS 13 13.730 2.995 8.849 101 HZ2 LYS 13 1HZ LYS 13 14.827 2.719 7.634 102 HZ3 LYS 13 2HZ LYS 13 13.691 1.595 8.035 103 H ARG 14 H ARG 14 6.093 2.364 5.680 104 HA ARG 14 HA ARG 14 4.993 1.491 8.304 105 HB2 ARG 14 1HB ARG 14 3.700 2.584 5.815 106 HB3 ARG 14 2HB ARG 14 2.788 1.470 6.854 107 HG2 ARG 14 1HG ARG 14 3.205 2.869 8.816 108 HG3 ARG 14 2HG ARG 14 4.152 3.983 7.838 109 HD2 ARG 14 1HD ARG 14 2.055 4.425 6.481 110 HD3 ARG 14 2HD ARG 14 1.170 3.444 7.667 111 HE ARG 14 HE ARG 14 2.321 6.139 7.996 112 HH11 ARG 14 1HH1 ARG 14 0.968 3.348 9.755 113 HH12 ARG 14 2HH1 ARG 14 0.459 4.273 11.108 114 HH21 ARG 14 1HH2 ARG 14 1.737 7.376 9.921 115 HH22 ARG 14 2HH2 ARG 14 1.059 6.537 11.252 116 H LEU 15 H LEU 15 4.884 0.331 4.901 117 HA LEU 15 HA LEU 15 3.371 -1.870 5.644 118 HB2 LEU 15 1HB LEU 15 4.028 -0.819 3.253 119 HB3 LEU 15 2HB LEU 15 5.151 -2.170 3.235 120 HG LEU 15 HG LEU 15 2.118 -2.183 3.349 121 HD11 LEU 15 1HD1 LEU 15 3.164 -2.042 1.142 122 HD12 LEU 15 2HD1 LEU 15 2.370 -3.606 1.339 123 HD13 LEU 15 3HD1 LEU 15 4.132 -3.491 1.474 124 HD21 LEU 15 3HD2 LEU 15 2.655 -3.873 4.975 125 HD22 LEU 15 1HD2 LEU 15 3.897 -4.588 3.905 126 HD23 LEU 15 2HD2 LEU 15 2.177 -4.671 3.497 127 H SER 16 H SER 16 6.936 -1.886 4.983 128 HA SER 16 HA SER 16 7.258 -4.678 5.502 129 HB2 SER 16 1HB SER 16 8.864 -3.159 4.279 130 HB3 SER 16 2HB SER 16 9.264 -2.431 5.846 131 HG SER 16 HG SER 16 9.688 -5.124 4.996 132 H ASP 17 H ASP 17 7.377 -1.796 7.585 133 HA ASP 17 HA ASP 17 8.582 -3.107 9.815 134 HB2 ASP 17 1HB ASP 17 8.341 -0.561 9.279 135 HB3 ASP 17 2HB ASP 17 6.811 -0.682 10.144 136 H TRP 18 H TRP 18 5.204 -2.590 8.858 137 HA TRP 18 HA TRP 18 4.053 -3.895 11.206 138 HB2 TRP 18 1HB TRP 18 2.678 -2.440 9.967 139 HB3 TRP 18 2HB TRP 18 3.050 -3.203 8.433 140 HD1 TRP 18 HD TRP 18 0.856 -3.718 11.525 141 HE1 TRP 18 1HE TRP 18 -1.005 -5.408 10.969 142 HE3 TRP 18 3HE TRP 18 2.477 -5.210 6.936 143 HZ2 TRP 18 2HZ TRP 18 -1.647 -7.247 8.828 144 HZ3 TRP 18 3HZ TRP 18 1.374 -7.106 5.739 145 HH2 TRP 18 HH TRP 18 -0.734 -8.100 6.681 146 H ALA 19 H ALA 19 4.868 -4.948 7.859 147 HA ALA 19 HA ALA 19 3.755 -7.512 8.085 148 HB1 ALA 19 1HB ALA 19 5.112 -8.076 6.116 149 HB2 ALA 19 2HB ALA 19 4.474 -6.414 5.954 150 HB3 ALA 19 3HB ALA 19 6.173 -6.682 6.401 151 H LYS 20 H LYS 20 7.026 -6.418 8.959 152 HA LYS 20 HA LYS 20 7.887 -9.084 9.765 153 HB2 LYS 20 1HB LYS 20 9.926 -8.044 10.419 154 HB3 LYS 20 2HB LYS 20 9.399 -7.219 8.953 155 HG2 LYS 20 1HG LYS 20 8.412 -5.438 10.472 156 HG3 LYS 20 2HG LYS 20 9.186 -6.262 11.832 157 HD2 LYS 20 1HD LYS 20 11.389 -5.939 10.461 158 HD3 LYS 20 2HD LYS 20 10.436 -4.785 9.506 159 HE2 LYS 20 1HE LYS 20 11.499 -3.500 11.230 160 HE3 LYS 20 2HE LYS 20 9.795 -3.654 11.705 161 HZ1 LYS 20 3HZ LYS 20 10.507 -5.515 13.159 162 HZ2 LYS 20 1HZ LYS 20 11.198 -4.114 13.582 163 HZ3 LYS 20 2HZ LYS 20 12.077 -5.229 12.729 164 H ALA 21 H ALA 21 6.368 -6.268 11.435 165 HA ALA 21 HA ALA 21 6.929 -7.286 14.074 166 HB1 ALA 21 1HB ALA 21 5.070 -5.060 13.161 167 HB2 ALA 21 2HB ALA 21 5.570 -5.394 14.829 168 HB3 ALA 21 3HB ALA 21 6.777 -4.880 13.652 169 H ARG 22 H ARG 22 4.441 -7.975 11.758 170 HA ARG 22 HA ARG 22 2.372 -8.666 13.541 171 HB2 ARG 22 1HB ARG 22 2.647 -8.675 10.794 172 HB3 ARG 22 2HB ARG 22 2.810 -10.407 11.130 173 HG2 ARG 22 1HG ARG 22 0.640 -9.951 12.634 174 HG3 ARG 22 2HG ARG 22 0.483 -8.534 11.596 175 HD2 ARG 22 1HD ARG 22 -0.246 -9.759 9.853 176 HD3 ARG 22 2HD ARG 22 0.993 -11.012 10.057 177 HE ARG 22 HE ARG 22 -1.111 -11.014 12.085 178 HH11 ARG 22 1HH1 ARG 22 -0.872 -11.957 8.743 179 HH12 ARG 22 2HH1 ARG 22 -1.620 -13.525 8.993 180 HH21 ARG 22 1HH2 ARG 22 -2.294 -12.831 12.355 181 HH22 ARG 22 2HH2 ARG 22 -2.575 -13.967 11.036 182 H THR 23 H THR 23 1.641 -10.978 14.057 183 HA THR 23 HA THR 23 3.518 -12.506 15.401 184 HB THR 23 HB THR 23 0.783 -13.154 14.284 185 HG1 THR 23 1HG THR 23 1.818 -12.913 16.893 186 HG21 THR 23 3HG2 THR 23 1.821 -15.327 14.296 187 HG22 THR 23 1HG2 THR 23 0.842 -15.217 15.765 188 HG23 THR 23 2HG2 THR 23 2.603 -15.028 15.846 189 HA PRO 24 HA PRO 24 4.126 -15.818 12.231 190 HB2 PRO 24 1HB PRO 24 3.191 -15.750 9.654 191 HB3 PRO 24 2HB PRO 24 2.205 -16.312 11.040 192 HG2 PRO 24 1HG PRO 24 2.249 -13.551 9.764 193 HG3 PRO 24 2HG PRO 24 0.820 -14.568 10.124 194 HD2 PRO 24 1HD PRO 24 1.595 -12.628 11.836 195 HD3 PRO 24 2HD PRO 24 1.023 -14.214 12.439 196 H ALA 25 H ALA 25 4.342 -12.668 11.307 197 HA ALA 25 HA ALA 25 5.256 -11.304 9.823 198 HB1 ALA 25 1HB ALA 25 7.429 -11.980 10.709 199 HB2 ALA 25 2HB ALA 25 7.501 -13.317 9.536 200 HB3 ALA 25 3HB ALA 25 7.512 -11.633 8.963 201 H LEU 26 H LEU 26 5.452 -10.934 7.441 202 HA LEU 26 HA LEU 26 4.558 -13.205 5.745 203 HB2 LEU 26 1HB LEU 26 3.251 -10.472 6.075 204 HB3 LEU 26 2HB LEU 26 2.880 -11.567 4.764 205 HG LEU 26 HG LEU 26 2.408 -12.157 7.721 206 HD11 LEU 26 1HD1 LEU 26 1.010 -10.388 6.986 207 HD12 LEU 26 2HD1 LEU 26 0.025 -11.868 7.035 208 HD13 LEU 26 3HD1 LEU 26 0.587 -11.234 5.483 209 HD21 LEU 26 3HD2 LEU 26 1.161 -14.087 7.113 210 HD22 LEU 26 1HD2 LEU 26 2.688 -14.259 6.261 211 HD23 LEU 26 2HD2 LEU 26 1.234 -13.744 5.388 212 HA PRO 27 HA PRO 27 7.327 -11.343 2.852 213 HB2 PRO 27 1HB PRO 27 6.142 -11.825 0.400 214 HB3 PRO 27 2HB PRO 27 6.935 -13.088 1.382 215 HG2 PRO 27 1HG PRO 27 3.991 -12.407 1.259 216 HG3 PRO 27 2HG PRO 27 4.756 -14.031 1.155 217 HD2 PRO 27 1HD PRO 27 3.712 -13.172 3.440 218 HD3 PRO 27 2HD PRO 27 5.267 -14.046 3.457 219 H VAL 28 H VAL 28 7.512 -9.668 1.154 220 HA VAL 28 HA VAL 28 5.164 -7.935 0.744 221 HB VAL 28 HB VAL 28 7.936 -6.857 1.472 222 HG11 VAL 28 1HG1 VAL 28 6.878 -5.467 -0.254 223 HG12 VAL 28 2HG1 VAL 28 5.360 -5.429 0.662 224 HG13 VAL 28 3HG1 VAL 28 6.814 -4.619 1.292 225 HG21 VAL 28 3HG2 VAL 28 5.340 -6.413 2.965 226 HG22 VAL 28 1HG2 VAL 28 6.617 -7.542 3.500 227 HG23 VAL 28 2HG2 VAL 28 6.936 -5.806 3.401 228 H ALA 29 H ALA 29 4.882 -8.428 -1.385 229 HA ALA 29 HA ALA 29 7.262 -8.294 -3.177 230 HB1 ALA 29 1HB ALA 29 4.502 -9.389 -3.818 231 HB2 ALA 29 2HB ALA 29 5.914 -9.304 -4.886 232 HB3 ALA 29 3HB ALA 29 5.958 -10.354 -3.465 233 H TRP 30 H TRP 30 7.508 -6.146 -3.490 234 HA TRP 30 HA TRP 30 5.391 -4.242 -3.762 235 HB2 TRP 30 1HB TRP 30 8.308 -4.145 -4.615 236 HB3 TRP 30 2HB TRP 30 7.224 -2.779 -4.635 237 HD1 TRP 30 HD TRP 30 9.737 -4.144 -2.395 238 HE1 TRP 30 1HE TRP 30 9.502 -3.002 -0.074 239 HE3 TRP 30 3HE TRP 30 5.137 -1.995 -2.918 240 HZ2 TRP 30 2HZ TRP 30 7.511 -1.678 1.439 241 HZ3 TRP 30 3HZ TRP 30 4.133 -0.702 -1.055 242 HH2 TRP 30 HH TRP 30 5.296 -0.520 1.119 243 H GLN 31 H GLN 31 6.011 -2.856 -6.077 244 HA GLN 31 HA GLN 31 4.721 -3.958 -8.324 245 HB2 GLN 31 1HB GLN 31 7.183 -2.197 -8.042 246 HB3 GLN 31 2HB GLN 31 6.387 -2.527 -9.587 247 HG2 GLN 31 1HG GLN 31 4.277 -1.478 -8.635 248 HG3 GLN 31 2HG GLN 31 5.265 -0.924 -7.271 249 HE21 GLN 31 1HE2 GLN 31 3.997 0.892 -9.125 250 HE22 GLN 31 2HE2 GLN 31 5.227 1.741 -10.023 251 H ASN 32 H ASN 32 8.255 -3.799 -7.813 252 HA ASN 32 HA ASN 32 8.746 -6.281 -9.328 253 HB2 ASN 32 1HB ASN 32 9.917 -3.591 -9.996 254 HB3 ASN 32 2HB ASN 32 10.514 -5.129 -10.604 255 HD21 ASN 32 1HD2 ASN 32 8.302 -2.656 -11.070 256 HD22 ASN 32 2HD2 ASN 32 7.372 -3.368 -12.382 257 H THR 33 H THR 33 9.034 -6.493 -6.827 258 HA THR 33 HA THR 33 11.896 -5.846 -6.124 259 HB THR 33 HB THR 33 9.980 -5.301 -4.477 260 HG1 THR 33 1HG THR 33 11.895 -5.031 -3.752 261 HG21 THR 33 3HG2 THR 33 8.958 -7.622 -4.533 262 HG22 THR 33 1HG2 THR 33 9.364 -7.004 -2.907 263 HG23 THR 33 2HG2 THR 33 10.412 -8.203 -3.683 264 H LYS 34 H LYS 34 12.856 -7.670 -4.710 265 HA LYS 34 HA LYS 34 13.121 -9.952 -6.427 266 HB2 LYS 34 1HB LYS 34 14.919 -10.655 -4.932 267 HB3 LYS 34 2HB LYS 34 15.035 -9.180 -5.889 268 HG2 LYS 34 1HG LYS 34 16.017 -8.591 -3.879 269 HG3 LYS 34 2HG LYS 34 14.410 -7.876 -3.919 270 HD2 LYS 34 1HD LYS 34 14.901 -10.506 -2.477 271 HD3 LYS 34 2HD LYS 34 15.404 -8.997 -1.712 272 HE2 LYS 34 1HE LYS 34 13.179 -8.121 -1.653 273 HE3 LYS 34 2HE LYS 34 12.565 -9.395 -2.694 274 HZ1 LYS 34 3HZ LYS 34 13.056 -10.993 -0.941 275 HZ2 LYS 34 1HZ LYS 34 11.944 -9.862 -0.525 276 HZ3 LYS 34 2HZ LYS 34 13.468 -9.750 0.088 277 H PHE 35 H PHE 35 10.696 -10.132 -5.579 278 HA PHE 35 HA PHE 35 10.406 -11.487 -2.993 279 HB2 PHE 35 1HB PHE 35 8.109 -11.370 -3.232 280 HB3 PHE 35 2HB PHE 35 8.670 -9.923 -4.027 281 HD1 PHE 35 1HD PHE 35 8.705 -9.851 -6.594 282 HD2 PHE 35 2HD PHE 35 6.815 -13.023 -4.386 283 HE1 PHE 35 1HE PHE 35 7.391 -10.477 -8.609 284 HE2 PHE 35 2HE PHE 35 5.559 -13.684 -6.423 285 HZ PHE 35 HZ PHE 35 5.811 -12.385 -8.514 286 H THR 36 H THR 36 9.079 -13.471 -2.813 287 HA THR 36 HA THR 36 8.314 -15.464 -3.243 288 HB THR 36 HB THR 36 8.691 -14.728 -5.875 289 HG1 THR 36 1HG THR 36 7.010 -15.929 -4.777 290 HG21 THR 36 3HG2 THR 36 10.890 -15.939 -6.021 291 HG22 THR 36 1HG2 THR 36 9.631 -16.609 -7.072 292 HG23 THR 36 2HG2 THR 36 10.040 -17.431 -5.554 293 HA PRO 37 HA PRO 37 8.458 -18.103 -3.632 294 HB2 PRO 37 1HB PRO 37 8.524 -19.953 -1.593 295 HB3 PRO 37 2HB PRO 37 9.569 -20.039 -3.044 296 HG2 PRO 37 1HG PRO 37 10.239 -18.852 -0.328 297 HG3 PRO 37 2HG PRO 37 11.176 -20.068 -1.262 298 HD2 PRO 37 1HD PRO 37 11.784 -17.425 -1.393 299 HD3 PRO 37 2HD PRO 37 11.838 -18.425 -2.865 300 HA PRO 38 HA PRO 38 5.446 -16.426 -0.753 301 HB2 PRO 38 1HB PRO 38 3.406 -18.262 -0.798 302 HB3 PRO 38 2HB PRO 38 3.822 -17.232 -2.210 303 HG2 PRO 38 1HG PRO 38 4.677 -20.078 -1.638 304 HG3 PRO 38 2HG PRO 38 3.984 -19.423 -3.156 305 HD2 PRO 38 1HD PRO 38 6.659 -19.725 -2.842 306 HD3 PRO 38 2HD PRO 38 5.994 -18.302 -3.698 307 H ALA 39 H ALA 39 3.763 -17.483 1.065 308 HA ALA 39 HA ALA 39 5.397 -19.034 2.966 309 HB1 ALA 39 1HB ALA 39 5.184 -16.670 3.679 310 HB2 ALA 39 2HB ALA 39 3.420 -16.777 3.536 311 HB3 ALA 39 3HB ALA 39 4.266 -17.759 4.745 312 H ALA 40 H ALA 40 4.445 -20.822 1.819 313 HA ALA 40 HA ALA 40 2.992 -22.560 1.591 314 HB1 ALA 40 1HB ALA 40 1.973 -21.748 4.330 315 HB2 ALA 40 2HB ALA 40 2.004 -23.369 3.594 316 HB3 ALA 40 3HB ALA 40 3.515 -22.562 4.052 317 H GLY 41 H GLY 41 2.088 -21.037 -0.063 318 HA2 GLY 41 2HA GLY 41 0.322 -20.561 -1.357 319 HA3 GLY 41 1HA GLY 41 -0.750 -21.280 -0.143 320 H VAL 42 H VAL 42 0.817 -19.003 1.552 321 HA VAL 42 HA VAL 42 -1.110 -16.832 0.945 322 HB VAL 42 HB VAL 42 0.520 -17.440 3.475 323 HG11 VAL 42 1HG1 VAL 42 -1.407 -15.222 2.836 324 HG12 VAL 42 2HG1 VAL 42 -1.054 -15.724 4.510 325 HG13 VAL 42 3HG1 VAL 42 0.241 -15.137 3.473 326 HG21 VAL 42 3HG2 VAL 42 -1.592 -18.016 4.518 327 HG22 VAL 42 1HG2 VAL 42 -2.459 -17.745 3.000 328 HG23 VAL 42 2HG2 VAL 42 -1.293 -19.077 3.150 329 H TYR 43 H TYR 43 -0.410 -14.783 0.553 330 HA TYR 43 HA TYR 43 2.166 -13.841 0.974 331 HB2 TYR 43 1HB TYR 43 2.922 -13.608 -1.355 332 HB3 TYR 43 2HB TYR 43 2.934 -15.245 -0.825 333 HD1 TYR 43 2HD TYR 43 1.097 -16.858 -1.680 334 HD2 TYR 43 1HD TYR 43 1.487 -12.810 -3.162 335 HE1 TYR 43 2HE TYR 43 -0.082 -17.489 -3.745 336 HE2 TYR 43 1HE TYR 43 0.256 -13.457 -5.217 337 HH TYR 43 HH TYR 43 -0.869 -16.788 -5.824 338 H LEU 44 H LEU 44 2.368 -11.762 -0.610 339 HA LEU 44 HA LEU 44 -0.254 -10.424 -0.865 340 HB2 LEU 44 1HB LEU 44 2.217 -9.493 0.679 341 HB3 LEU 44 2HB LEU 44 0.921 -8.401 0.199 342 HG LEU 44 HG LEU 44 0.252 -10.882 1.801 343 HD11 LEU 44 1HD1 LEU 44 1.980 -9.849 3.108 344 HD12 LEU 44 2HD1 LEU 44 0.399 -9.562 3.863 345 HD13 LEU 44 3HD1 LEU 44 1.186 -8.268 2.938 346 HD21 LEU 44 3HD2 LEU 44 -1.649 -9.703 2.472 347 HD22 LEU 44 1HD2 LEU 44 -1.532 -9.469 0.714 348 HD23 LEU 44 2HD2 LEU 44 -1.025 -8.176 1.825 349 H ARG 45 H ARG 45 -0.176 -8.744 -2.393 350 HA ARG 45 HA ARG 45 2.308 -8.333 -3.963 351 HB2 ARG 45 1HB ARG 45 -0.383 -9.267 -4.990 352 HB3 ARG 45 2HB ARG 45 0.590 -8.160 -5.950 353 HG2 ARG 45 1HG ARG 45 2.472 -9.658 -5.993 354 HG3 ARG 45 2HG ARG 45 1.748 -10.737 -4.813 355 HD2 ARG 45 1HD ARG 45 1.744 -11.573 -7.181 356 HD3 ARG 45 2HD ARG 45 0.187 -11.588 -6.336 357 HE ARG 45 HE ARG 45 0.671 -9.221 -7.987 358 HH11 ARG 45 1HH1 ARG 45 -0.380 -12.597 -8.345 359 HH12 ARG 45 2HH1 ARG 45 -1.822 -12.176 -9.209 360 HH21 ARG 45 1HH2 ARG 45 -1.253 -8.699 -9.158 361 HH22 ARG 45 2HH2 ARG 45 -2.401 -9.947 -9.499 362 H ALA 46 H ALA 46 2.751 -6.456 -3.241 363 HA ALA 46 HA ALA 46 0.819 -4.413 -2.416 364 HB1 ALA 46 1HB ALA 46 2.478 -5.091 -0.773 365 HB2 ALA 46 2HB ALA 46 3.802 -4.882 -1.938 366 HB3 ALA 46 3HB ALA 46 2.929 -3.476 -1.351 367 H TYR 47 H TYR 47 0.345 -4.008 -4.822 368 HA TYR 47 HA TYR 47 2.624 -2.897 -6.364 369 HB2 TYR 47 1HB TYR 47 0.720 -4.293 -7.374 370 HB3 TYR 47 2HB TYR 47 -0.255 -2.836 -7.282 371 HD1 TYR 47 2HD TYR 47 0.790 -0.697 -8.378 372 HD2 TYR 47 1HD TYR 47 2.160 -4.690 -9.224 373 HE1 TYR 47 2HE TYR 47 1.904 0.128 -10.442 374 HE2 TYR 47 1HE TYR 47 3.266 -3.889 -11.283 375 HH TYR 47 HH TYR 47 3.165 -1.920 -12.898 376 H VAL 48 H VAL 48 3.130 -0.739 -6.339 377 HA VAL 48 HA VAL 48 1.222 1.176 -5.091 378 HB VAL 48 HB VAL 48 4.243 1.401 -5.469 379 HG11 VAL 48 1HG1 VAL 48 3.120 3.598 -5.431 380 HG12 VAL 48 2HG1 VAL 48 2.245 3.148 -3.950 381 HG13 VAL 48 3HG1 VAL 48 4.009 3.337 -3.921 382 HG21 VAL 48 3HG2 VAL 48 3.736 -0.301 -3.733 383 HG22 VAL 48 1HG2 VAL 48 4.421 1.153 -3.020 384 HG23 VAL 48 2HG2 VAL 48 2.674 0.855 -2.902 385 H MET 49 H MET 49 0.598 2.870 -6.428 386 HA MET 49 HA MET 49 1.302 2.667 -9.329 387 HB2 MET 49 1HB MET 49 -1.206 2.415 -7.804 388 HB3 MET 49 2HB MET 49 -1.342 3.519 -9.173 389 HG2 MET 49 1HG MET 49 -0.832 1.937 -10.724 390 HG3 MET 49 2HG MET 49 -0.079 0.836 -9.573 391 HE1 MET 49 3HE MET 49 -2.136 0.473 -7.202 392 HE2 MET 49 1HE MET 49 -3.194 -0.812 -7.823 393 HE3 MET 49 2HE MET 49 -1.440 -0.938 -8.042 394 HA PRO 50 HA PRO 50 2.101 6.955 -7.784 395 HB2 PRO 50 1HB PRO 50 4.389 7.405 -9.302 396 HB3 PRO 50 2HB PRO 50 4.358 6.680 -7.660 397 HG2 PRO 50 1HG PRO 50 4.551 5.315 -10.318 398 HG3 PRO 50 2HG PRO 50 5.447 4.949 -8.820 399 HD2 PRO 50 1HD PRO 50 3.248 3.533 -9.658 400 HD3 PRO 50 2HD PRO 50 3.623 3.789 -7.925 401 H ALA 51 H ALA 51 1.959 9.016 -8.935 402 HA ALA 51 HA ALA 51 0.385 8.785 -11.431 403 HB1 ALA 51 1HB ALA 51 -0.602 10.008 -9.498 404 HB2 ALA 51 2HB ALA 51 0.793 11.112 -9.489 405 HB3 ALA 51 3HB ALA 51 -0.318 11.078 -10.871 406 H ALA 52 H ALA 52 0.757 10.494 -13.127 407 HA ALA 52 HA ALA 52 3.378 11.783 -13.273 408 HB1 ALA 52 1HB ALA 52 3.907 9.426 -13.880 409 HB2 ALA 52 2HB ALA 52 2.684 9.495 -15.173 410 HB3 ALA 52 3HB ALA 52 4.134 10.521 -15.244 411 H THR 53 H THR 53 0.550 12.739 -13.417 412 HA THR 53 HA THR 53 0.462 13.709 -16.236 413 HB THR 53 HB THR 53 -2.130 13.455 -15.785 414 HG1 THR 53 1HG THR 53 -2.688 11.951 -14.355 415 HG21 THR 53 3HG2 THR 53 -0.803 12.329 -17.559 416 HG22 THR 53 1HG2 THR 53 -2.093 11.321 -16.919 417 HG23 THR 53 2HG2 THR 53 -0.403 11.027 -16.419 418 H ILE 54 H ILE 54 1.677 15.498 -15.078 419 HA ILE 54 HA ILE 54 -0.326 17.576 -14.511 420 HB ILE 54 HB ILE 54 2.301 17.363 -13.004 421 HG12 ILE 54 1HG1 ILE 54 -0.497 16.597 -12.128 422 HG13 ILE 54 2HG1 ILE 54 0.928 15.562 -12.176 423 HG21 ILE 54 1HG2 ILE 54 1.443 19.677 -13.337 424 HG22 ILE 54 2HG2 ILE 54 -0.097 19.204 -12.584 425 HG23 ILE 54 3HG2 ILE 54 1.409 19.222 -11.650 426 HD11 ILE 54 3HD1 ILE 54 0.422 17.799 -10.192 427 HD12 ILE 54 1HD1 ILE 54 0.471 16.060 -9.899 428 HD13 ILE 54 2HD1 ILE 54 1.964 16.911 -10.349 429 H SER 55 H SER 55 0.176 19.496 -15.553 430 HA SER 55 HA SER 55 2.118 19.539 -17.667 431 HB2 SER 55 1HB SER 55 0.196 21.568 -16.434 432 HB3 SER 55 2HB SER 55 1.111 21.815 -17.919 433 HG SER 55 HG SER 55 -0.989 20.048 -17.400 434 H ARG 56 H ARG 56 2.970 22.191 -17.599 435 HA ARG 56 HA ARG 56 4.676 22.528 -15.193 436 HB2 ARG 56 1HB ARG 56 5.404 22.493 -18.155 437 HB3 ARG 56 2HB ARG 56 6.438 23.258 -16.957 438 HG2 ARG 56 1HG ARG 56 6.854 21.239 -15.784 439 HG3 ARG 56 2HG ARG 56 5.596 20.360 -16.663 440 HD2 ARG 56 1HD ARG 56 8.032 21.556 -18.031 441 HD3 ARG 56 2HD ARG 56 7.976 19.918 -17.360 442 HE ARG 56 HE ARG 56 5.814 20.669 -19.236 443 HH11 ARG 56 1HH1 ARG 56 8.789 18.731 -18.715 444 HH12 ARG 56 2HH1 ARG 56 8.483 17.783 -20.147 445 HH21 ARG 56 1HH2 ARG 56 5.434 19.315 -20.944 446 HH22 ARG 56 2HH2 ARG 56 6.606 18.084 -21.403 447 H ASP 57 H ASP 57 2.088 23.635 -15.932 448 HA ASP 57 HA ASP 57 2.584 26.332 -17.099 449 HB2 ASP 57 1HB ASP 57 0.562 24.203 -17.965 450 HB3 ASP 57 2HB ASP 57 0.689 25.826 -18.622 451 H ALA 58 H ALA 58 0.363 27.523 -17.089 452 HA ALA 58 HA ALA 58 -1.050 27.212 -14.534 453 HB1 ALA 58 1HB ALA 58 -1.471 29.160 -16.836 454 HB2 ALA 58 2HB ALA 58 -2.230 29.236 -15.232 455 HB3 ALA 58 3HB ALA 58 -0.480 29.459 -15.381 456 H ALA 59 H ALA 59 -1.216 24.938 -16.135 457 HA ALA 59 HA ALA 59 -3.479 24.739 -17.859 458 HB1 ALA 59 1HB ALA 59 -3.018 22.304 -17.668 459 HB2 ALA 59 2HB ALA 59 -1.537 23.219 -17.940 460 HB3 ALA 59 3HB ALA 59 -1.929 22.619 -16.307 461 H GLY 60 H GLY 60 -3.525 25.228 -14.566 462 HA2 GLY 60 2HA GLY 60 -5.459 25.517 -13.302 463 HA3 GLY 60 1HA GLY 60 -6.369 24.476 -14.405 464 H ASP 61 H ASP 61 -4.215 22.428 -14.272 465 HA ASP 61 HA ASP 61 -3.788 20.475 -13.432 466 HB2 ASP 61 1HB ASP 61 -2.058 21.650 -12.372 467 HB3 ASP 61 2HB ASP 61 -3.185 22.312 -11.183 468 H HIS 62 H HIS 62 -5.696 19.482 -13.606 469 HA HIS 62 HA HIS 62 -7.869 19.899 -12.056 470 HB2 HIS 62 1HB HIS 62 -7.831 18.514 -14.156 471 HB3 HIS 62 2HB HIS 62 -7.060 17.204 -13.242 472 HD1 HIS 62 1HD HIS 62 -10.501 18.782 -13.807 473 HD2 HIS 62 2HD HIS 62 -8.611 15.722 -11.607 474 HE1 HIS 62 1HE HIS 62 -12.353 17.246 -12.968 475 H ARG 63 H ARG 63 -5.220 17.915 -11.327 476 HA ARG 63 HA ARG 63 -5.770 17.831 -8.554 477 HB2 ARG 63 1HB ARG 63 -6.640 15.514 -10.081 478 HB3 ARG 63 2HB ARG 63 -5.262 15.004 -9.139 479 HG2 ARG 63 1HG ARG 63 -6.595 14.748 -7.373 480 HG3 ARG 63 2HG ARG 63 -6.765 16.506 -7.311 481 HD2 ARG 63 1HD ARG 63 -8.729 16.358 -8.832 482 HD3 ARG 63 2HD ARG 63 -8.527 14.595 -8.899 483 HE ARG 63 HE ARG 63 -8.798 15.782 -6.225 484 HH11 ARG 63 1HH1 ARG 63 -10.591 14.361 -9.001 485 HH12 ARG 63 2HH1 ARG 63 -12.028 14.131 -8.061 486 HH21 ARG 63 1HH2 ARG 63 -10.727 15.118 -4.965 487 HH22 ARG 63 2HH2 ARG 63 -12.099 14.580 -5.868 488 H GLN 64 H GLN 64 -4.132 17.619 -7.456 489 HA GLN 64 HA GLN 64 -1.519 17.745 -8.676 490 HB2 GLN 64 1HB GLN 64 -2.612 18.850 -6.400 491 HB3 GLN 64 2HB GLN 64 -1.716 17.502 -5.694 492 HG2 GLN 64 1HG GLN 64 0.338 18.309 -6.933 493 HG3 GLN 64 2HG GLN 64 -0.642 19.630 -7.592 494 HE21 GLN 64 1HE2 GLN 64 0.610 21.314 -6.614 495 HE22 GLN 64 2HE2 GLN 64 0.572 21.602 -4.901 496 H TYR 65 H TYR 65 0.239 16.432 -7.048 497 HA TYR 65 HA TYR 65 0.222 13.949 -8.265 498 HB2 TYR 65 1HB TYR 65 2.073 15.629 -7.186 499 HB3 TYR 65 2HB TYR 65 1.997 14.447 -5.903 500 HD1 TYR 65 1HD TYR 65 1.841 14.153 -9.663 501 HD2 TYR 65 2HD TYR 65 4.049 13.265 -6.062 502 HE1 TYR 65 1HE TYR 65 3.346 12.698 -10.957 503 HE2 TYR 65 2HE TYR 65 5.620 11.869 -7.369 504 HH TYR 65 HH TYR 65 4.699 10.804 -10.599 505 H ARG 66 H ARG 66 -0.212 11.947 -7.684 506 HA ARG 66 HA ARG 66 -1.275 11.285 -4.990 507 HB2 ARG 66 1HB ARG 66 -2.587 10.911 -7.724 508 HB3 ARG 66 2HB ARG 66 -3.083 10.001 -6.307 509 HG2 ARG 66 1HG ARG 66 -3.641 12.075 -5.107 510 HG3 ARG 66 2HG ARG 66 -3.275 13.000 -6.580 511 HD2 ARG 66 1HD ARG 66 -5.072 12.166 -7.753 512 HD3 ARG 66 2HD ARG 66 -5.085 10.626 -6.908 513 HE ARG 66 HE ARG 66 -6.748 12.798 -6.384 514 HH11 ARG 66 1HH1 ARG 66 -4.843 10.498 -4.391 515 HH12 ARG 66 2HH1 ARG 66 -6.180 10.044 -3.429 516 HH21 ARG 66 1HH2 ARG 66 -8.444 12.234 -5.082 517 HH22 ARG 66 2HH2 ARG 66 -8.271 11.301 -3.656 518 H GLY 67 H GLY 67 -1.908 8.789 -5.128 519 HA2 GLY 67 2HA GLY 67 -0.867 7.459 -7.347 520 HA3 GLY 67 1HA GLY 67 0.002 6.892 -5.912 521 H VAL 68 H VAL 68 -1.209 4.876 -6.640 522 HA VAL 68 HA VAL 68 -3.557 4.615 -4.875 523 HB VAL 68 HB VAL 68 -3.159 3.196 -7.531 524 HG11 VAL 68 1HG1 VAL 68 -4.069 1.560 -5.899 525 HG12 VAL 68 2HG1 VAL 68 -5.419 2.678 -5.573 526 HG13 VAL 68 3HG1 VAL 68 -5.202 1.963 -7.173 527 HG21 VAL 68 3HG2 VAL 68 -5.315 4.107 -8.181 528 HG22 VAL 68 1HG2 VAL 68 -5.400 5.016 -6.642 529 HG23 VAL 68 2HG2 VAL 68 -4.147 5.365 -7.853 530 H PHE 69 H PHE 69 -3.406 2.576 -3.678 531 HA PHE 69 HA PHE 69 -0.889 1.050 -4.022 532 HB2 PHE 69 1HB PHE 69 -0.283 2.345 -2.152 533 HB3 PHE 69 2HB PHE 69 -1.905 2.303 -1.471 534 HD1 PHE 69 1HD PHE 69 0.579 -0.335 -2.581 535 HD2 PHE 69 2HD PHE 69 -2.021 1.143 0.543 536 HE1 PHE 69 1HE PHE 69 1.145 -2.274 -1.160 537 HE2 PHE 69 2HE PHE 69 -1.408 -0.783 1.966 538 HZ PHE 69 HZ PHE 69 0.179 -2.499 1.120 539 H GLN 70 H GLN 70 -1.288 -1.118 -3.941 540 HA GLN 70 HA GLN 70 -4.089 -2.034 -3.508 541 HB2 GLN 70 1HB GLN 70 -3.598 -1.684 -5.878 542 HB3 GLN 70 2HB GLN 70 -2.110 -2.616 -5.773 543 HG2 GLN 70 1HG GLN 70 -3.315 -4.673 -5.430 544 HG3 GLN 70 2HG GLN 70 -4.829 -3.810 -5.102 545 HE21 GLN 70 1HE2 GLN 70 -6.194 -4.478 -6.831 546 HE22 GLN 70 2HE2 GLN 70 -5.785 -4.222 -8.471 547 H VAL 71 H VAL 71 -4.121 -3.844 -2.228 548 HA VAL 71 HA VAL 71 -1.698 -5.461 -1.873 549 HB VAL 71 HB VAL 71 -1.429 -4.127 -0.048 550 HG11 VAL 71 1HG1 VAL 71 -3.005 -3.365 1.570 551 HG12 VAL 71 2HG1 VAL 71 -3.649 -2.909 -0.002 552 HG13 VAL 71 3HG1 VAL 71 -4.309 -4.313 0.867 553 HG21 VAL 71 3HG2 VAL 71 -3.117 -6.448 0.977 554 HG22 VAL 71 1HG2 VAL 71 -1.440 -6.558 0.416 555 HG23 VAL 71 2HG2 VAL 71 -1.869 -5.584 1.857 556 H ASN 72 H ASN 72 -2.397 -7.114 -3.047 557 HA ASN 72 HA ASN 72 -5.194 -8.056 -2.788 558 HB2 ASN 72 1HB ASN 72 -2.874 -8.586 -4.649 559 HB3 ASN 72 2HB ASN 72 -4.091 -9.816 -4.401 560 HD21 ASN 72 1HD2 ASN 72 -4.180 -9.225 -6.904 561 HD22 ASN 72 2HD2 ASN 72 -5.437 -8.113 -7.294 562 H VAL 73 H VAL 73 -5.373 -8.928 -0.750 563 HA VAL 73 HA VAL 73 -3.310 -10.731 0.293 564 HB VAL 73 HB VAL 73 -6.121 -10.385 1.386 565 HG11 VAL 73 1HG1 VAL 73 -4.933 -12.370 2.215 566 HG12 VAL 73 2HG1 VAL 73 -3.529 -11.368 2.640 567 HG13 VAL 73 3HG1 VAL 73 -5.075 -11.158 3.478 568 HG21 VAL 73 3HG2 VAL 73 -3.674 -8.823 2.270 569 HG22 VAL 73 1HG2 VAL 73 -4.985 -8.159 1.295 570 HG23 VAL 73 2HG2 VAL 73 -5.315 -8.740 2.929 571 H VAL 74 H VAL 74 -3.225 -12.862 -0.024 572 HA VAL 74 HA VAL 74 -5.558 -14.310 -1.087 573 HB VAL 74 HB VAL 74 -4.302 -13.904 -2.986 574 HG11 VAL 74 1HG1 VAL 74 -1.720 -14.638 -1.580 575 HG12 VAL 74 2HG1 VAL 74 -1.938 -14.202 -3.294 576 HG13 VAL 74 3HG1 VAL 74 -2.245 -12.998 -2.052 577 HG21 VAL 74 3HG2 VAL 74 -4.929 -16.271 -2.740 578 HG22 VAL 74 1HG2 VAL 74 -3.474 -16.054 -3.725 579 HG23 VAL 74 2HG2 VAL 74 -3.317 -16.629 -2.059 580 H MET 75 H MET 75 -5.698 -16.474 -0.430 581 HA MET 75 HA MET 75 -3.642 -17.588 1.177 582 HB2 MET 75 1HB MET 75 -5.400 -18.297 3.012 583 HB3 MET 75 2HB MET 75 -4.507 -16.782 3.124 584 HG2 MET 75 1HG MET 75 -6.749 -16.429 3.781 585 HG3 MET 75 2HG MET 75 -6.346 -15.517 2.331 586 HE1 MET 75 3HE MET 75 -9.504 -15.923 0.598 587 HE2 MET 75 1HE MET 75 -8.893 -14.995 1.979 588 HE3 MET 75 2HE MET 75 -7.855 -15.235 0.559 589 HA PRO 76 HA PRO 76 -5.123 -20.986 -1.125 590 HB2 PRO 76 1HB PRO 76 -4.162 -23.150 0.190 591 HB3 PRO 76 2HB PRO 76 -3.058 -21.920 -0.500 592 HG2 PRO 76 1HG PRO 76 -4.029 -22.156 2.373 593 HG3 PRO 76 2HG PRO 76 -2.351 -21.934 1.789 594 HD2 PRO 76 1HD PRO 76 -3.967 -19.831 2.595 595 HD3 PRO 76 2HD PRO 76 -2.714 -19.662 1.329 596 H ILE 77 H ILE 77 -6.679 -22.671 -1.213 597 HA ILE 77 HA ILE 77 -8.657 -22.687 0.974 598 HB ILE 77 HB ILE 77 -8.811 -24.055 -1.736 599 HG12 ILE 77 1HG1 ILE 77 -9.929 -21.406 -0.748 600 HG13 ILE 77 2HG1 ILE 77 -8.645 -21.553 -1.930 601 HG21 ILE 77 1HG2 ILE 77 -10.878 -23.347 0.427 602 HG22 ILE 77 2HG2 ILE 77 -11.238 -24.189 -1.102 603 HG23 ILE 77 3HG2 ILE 77 -10.263 -24.964 0.149 604 HD11 ILE 77 3HD1 ILE 77 -11.540 -22.332 -2.357 605 HD12 ILE 77 1HD1 ILE 77 -10.623 -21.031 -3.126 606 HD13 ILE 77 2HD1 ILE 77 -10.214 -22.715 -3.490 607 H GLY 78 H GLY 78 -6.828 -23.444 2.258 608 HA2 GLY 78 2HA GLY 78 -6.749 -26.428 2.421 609 HA3 GLY 78 1HA GLY 78 -5.667 -25.308 3.272 610 H ASP 79 H ASP 79 -6.241 -25.060 5.326 611 HA ASP 79 HA ASP 79 -9.121 -24.668 6.044 612 HB2 ASP 79 1HB ASP 79 -8.214 -26.764 6.958 613 HB3 ASP 79 2HB ASP 79 -6.872 -25.894 7.671 614 H GLY 80 H GLY 80 -6.314 -23.191 5.640 615 HA2 GLY 80 2HA GLY 80 -6.646 -20.976 7.604 616 HA3 GLY 80 1HA GLY 80 -5.278 -21.207 6.505 617 H SER 81 H SER 81 -8.512 -21.660 5.092 618 HA SER 81 HA SER 81 -8.308 -19.433 3.346 619 HB2 SER 81 1HB SER 81 -10.700 -20.373 2.912 620 HB3 SER 81 2HB SER 81 -9.303 -21.378 2.503 621 HG SER 81 HG SER 81 -10.687 -22.697 3.646 622 H ARG 82 H ARG 82 -10.523 -18.085 3.333 623 HA ARG 82 HA ARG 82 -11.653 -16.418 4.116 624 HB2 ARG 82 1HB ARG 82 -11.808 -17.748 6.803 625 HB3 ARG 82 2HB ARG 82 -12.838 -16.490 6.157 626 HG2 ARG 82 1HG ARG 82 -14.185 -18.302 5.868 627 HG3 ARG 82 2HG ARG 82 -13.426 -18.264 4.275 628 HD2 ARG 82 1HD ARG 82 -12.073 -20.198 4.781 629 HD3 ARG 82 2HD ARG 82 -12.175 -19.874 6.498 630 HE ARG 82 HE ARG 82 -14.002 -21.094 6.713 631 HH11 ARG 82 1HH1 ARG 82 -13.597 -20.738 3.139 632 HH12 ARG 82 2HH1 ARG 82 -15.021 -21.672 2.841 633 HH21 ARG 82 1HH2 ARG 82 -15.929 -22.270 6.122 634 HH22 ARG 82 2HH2 ARG 82 -16.393 -22.372 4.460 635 H SER 83 H SER 83 -8.892 -17.246 6.124 636 HA SER 83 HA SER 83 -8.606 -15.094 7.711 637 HB2 SER 83 1HB SER 83 -7.249 -17.372 7.281 638 HB3 SER 83 2HB SER 83 -6.149 -16.258 6.481 639 HG SER 83 HG SER 83 -5.608 -16.538 8.667 640 H ALA 84 H ALA 84 -8.782 -14.464 4.513 641 HA ALA 84 HA ALA 84 -6.898 -12.279 4.106 642 HB1 ALA 84 1HB ALA 84 -8.941 -11.477 2.653 643 HB2 ALA 84 2HB ALA 84 -8.040 -12.916 2.130 644 HB3 ALA 84 3HB ALA 84 -9.621 -13.058 2.967 645 H GLU 85 H GLU 85 -10.102 -12.720 5.605 646 HA GLU 85 HA GLU 85 -10.914 -10.062 5.911 647 HB2 GLU 85 1HB GLU 85 -11.365 -12.499 7.685 648 HB3 GLU 85 2HB GLU 85 -12.358 -11.032 7.700 649 HG2 GLU 85 1HG GLU 85 -13.009 -11.370 5.404 650 HG3 GLU 85 2HG GLU 85 -11.989 -12.742 5.189 651 H GLN 86 H GLN 86 -9.064 -12.159 8.037 652 HA GLN 86 HA GLN 86 -8.493 -10.597 10.223 653 HB2 GLN 86 1HB GLN 86 -7.784 -13.081 9.115 654 HB3 GLN 86 2HB GLN 86 -6.238 -12.267 9.171 655 HG2 GLN 86 1HG GLN 86 -8.031 -12.294 11.615 656 HG3 GLN 86 2HG GLN 86 -7.178 -13.743 11.091 657 HE21 GLN 86 1HE2 GLN 86 -6.472 -10.190 11.606 658 HE22 GLN 86 2HE2 GLN 86 -4.940 -10.489 12.402 659 H VAL 87 H VAL 87 -6.465 -10.889 7.258 660 HA VAL 87 HA VAL 87 -4.638 -8.802 8.000 661 HB VAL 87 HB VAL 87 -5.370 -9.732 5.177 662 HG11 VAL 87 1HG1 VAL 87 -2.694 -9.405 5.021 663 HG12 VAL 87 2HG1 VAL 87 -3.867 -8.153 4.734 664 HG13 VAL 87 3HG1 VAL 87 -3.060 -8.225 6.311 665 HG21 VAL 87 3HG2 VAL 87 -3.820 -11.247 7.244 666 HG22 VAL 87 1HG2 VAL 87 -4.993 -11.805 6.050 667 HG23 VAL 87 2HG2 VAL 87 -3.366 -11.374 5.537 668 H ALA 88 H ALA 88 -7.633 -8.671 6.025 669 HA ALA 88 HA ALA 88 -7.266 -6.039 5.148 670 HB1 ALA 88 1HB ALA 88 -9.676 -6.007 4.807 671 HB2 ALA 88 2HB ALA 88 -9.028 -7.586 4.334 672 HB3 ALA 88 3HB ALA 88 -9.893 -7.403 5.877 673 H ALA 89 H ALA 89 -8.417 -7.195 8.323 674 HA ALA 89 HA ALA 89 -9.155 -4.508 9.228 675 HB1 ALA 89 1HB ALA 89 -8.731 -7.104 10.757 676 HB2 ALA 89 2HB ALA 89 -9.472 -5.611 11.394 677 HB3 ALA 89 3HB ALA 89 -10.288 -6.513 10.104 678 H GLU 90 H GLU 90 -6.300 -6.678 9.593 679 HA GLU 90 HA GLU 90 -4.999 -5.042 11.591 680 HB2 GLU 90 1HB GLU 90 -3.847 -7.019 9.565 681 HB3 GLU 90 2HB GLU 90 -2.937 -6.238 10.862 682 HG2 GLU 90 1HG GLU 90 -4.934 -7.212 12.361 683 HG3 GLU 90 2HG GLU 90 -5.187 -8.259 11.008 684 H LEU 91 H LEU 91 -4.829 -5.266 8.113 685 HA LEU 91 HA LEU 91 -2.906 -3.327 7.494 686 HB2 LEU 91 1HB LEU 91 -5.430 -4.367 6.173 687 HB3 LEU 91 2HB LEU 91 -4.642 -2.987 5.464 688 HG LEU 91 HG LEU 91 -3.010 -5.478 6.013 689 HD11 LEU 91 1HD1 LEU 91 -4.881 -4.968 3.664 690 HD12 LEU 91 2HD1 LEU 91 -4.935 -6.306 4.846 691 HD13 LEU 91 3HD1 LEU 91 -3.602 -6.201 3.676 692 HD21 LEU 91 3HD2 LEU 91 -1.834 -3.444 5.348 693 HD22 LEU 91 1HD2 LEU 91 -2.913 -3.220 3.958 694 HD23 LEU 91 2HD2 LEU 91 -1.798 -4.584 4.003 695 H ASP 92 H ASP 92 -6.491 -3.027 7.825 696 HA ASP 92 HA ASP 92 -6.709 -0.257 7.402 697 HB2 ASP 92 1HB ASP 92 -8.542 -1.842 7.228 698 HB3 ASP 92 2HB ASP 92 -8.427 -2.238 8.947 699 H ALA 93 H ALA 93 -6.170 -2.061 10.435 700 HA ALA 93 HA ALA 93 -6.217 0.209 12.202 701 HB1 ALA 93 1HB ALA 93 -4.814 -1.446 13.640 702 HB2 ALA 93 2HB ALA 93 -6.448 -1.939 13.191 703 HB3 ALA 93 3HB ALA 93 -5.059 -2.604 12.331 704 H LEU 94 H LEU 94 -3.746 -1.034 10.022 705 HA LEU 94 HA LEU 94 -1.587 0.494 11.310 706 HB2 LEU 94 1HB LEU 94 -1.355 -1.807 10.209 707 HB3 LEU 94 2HB LEU 94 -1.540 -1.019 8.653 708 HG LEU 94 HG LEU 94 0.739 -1.634 9.507 709 HD11 LEU 94 1HD1 LEU 94 0.763 -0.437 7.572 710 HD12 LEU 94 2HD1 LEU 94 1.984 0.282 8.617 711 HD13 LEU 94 3HD1 LEU 94 0.437 1.126 8.384 712 HD21 LEU 94 3HD2 LEU 94 0.624 0.941 11.093 713 HD22 LEU 94 1HD2 LEU 94 1.964 -0.212 10.979 714 HD23 LEU 94 2HD2 LEU 94 0.477 -0.694 11.800 715 H PHE 95 H PHE 95 -3.735 0.600 8.536 716 HA PHE 95 HA PHE 95 -2.672 3.208 7.657 717 HB2 PHE 95 1HB PHE 95 -3.899 0.926 6.069 718 HB3 PHE 95 2HB PHE 95 -3.400 2.450 5.386 719 HD1 PHE 95 1HD PHE 95 -0.710 3.029 6.139 720 HD2 PHE 95 2HD PHE 95 -2.506 -0.849 5.549 721 HE1 PHE 95 1HE PHE 95 1.396 2.195 5.257 722 HE2 PHE 95 2HE PHE 95 -0.319 -1.730 4.802 723 HZ PHE 95 HZ PHE 95 1.641 -0.244 4.651 724 HA PRO 96 HA PRO 96 -7.260 3.692 8.662 725 HB2 PRO 96 1HB PRO 96 -7.039 5.833 10.388 726 HB3 PRO 96 2HB PRO 96 -6.964 4.137 10.953 727 HG2 PRO 96 1HG PRO 96 -4.641 5.974 10.275 728 HG3 PRO 96 2HG PRO 96 -4.879 5.014 11.769 729 HD2 PRO 96 1HD PRO 96 -3.352 4.054 9.767 730 HD3 PRO 96 2HD PRO 96 -4.486 2.961 10.616 731 H VAL 97 H VAL 97 -8.460 5.606 8.027 732 HA VAL 97 HA VAL 97 -7.766 6.890 5.701 733 HB VAL 97 HB VAL 97 -9.982 6.430 6.715 734 HG11 VAL 97 1HG1 VAL 97 -11.013 8.103 8.172 735 HG12 VAL 97 2HG1 VAL 97 -9.572 7.434 8.946 736 HG13 VAL 97 3HG1 VAL 97 -9.515 9.046 8.217 737 HG21 VAL 97 3HG2 VAL 97 -9.922 9.292 5.769 738 HG22 VAL 97 1HG2 VAL 97 -9.569 7.960 4.673 739 HG23 VAL 97 2HG2 VAL 97 -11.139 8.036 5.486 740 H ASN 98 H ASN 98 -6.138 7.623 8.399 741 HA ASN 98 HA ASN 98 -5.825 10.515 7.818 742 HB2 ASN 98 1HB ASN 98 -4.799 9.015 10.260 743 HB3 ASN 98 2HB ASN 98 -4.903 10.756 10.041 744 HD21 ASN 98 1HD2 ASN 98 -7.293 11.660 9.716 745 HD22 ASN 98 2HD2 ASN 98 -8.558 10.736 10.461 746 H LEU 99 H LEU 99 -4.012 7.460 8.234 747 HA LEU 99 HA LEU 99 -1.910 6.789 7.773 748 HB2 LEU 99 1HB LEU 99 -3.409 7.163 5.695 749 HB3 LEU 99 2HB LEU 99 -2.209 8.371 5.252 750 HG LEU 99 HG LEU 99 -0.565 6.235 5.737 751 HD11 LEU 99 1HD1 LEU 99 -3.265 5.035 5.057 752 HD12 LEU 99 2HD1 LEU 99 -2.168 4.715 6.383 753 HD13 LEU 99 3HD1 LEU 99 -1.736 4.236 4.712 754 HD21 LEU 99 3HD2 LEU 99 -0.699 7.544 3.570 755 HD22 LEU 99 1HD2 LEU 99 -1.965 6.425 3.037 756 HD23 LEU 99 2HD2 LEU 99 -0.387 5.803 3.405 757 H VAL 100 H VAL 100 -1.648 9.342 9.269 758 HA VAL 100 HA VAL 100 -0.126 11.197 7.818 759 HB VAL 100 HB VAL 100 -0.141 10.811 10.840 760 HG11 VAL 100 1HG1 VAL 100 1.554 12.430 10.093 761 HG12 VAL 100 2HG1 VAL 100 0.350 13.276 9.096 762 HG13 VAL 100 3HG1 VAL 100 0.215 13.274 10.870 763 HG21 VAL 100 3HG2 VAL 100 -2.098 12.329 9.048 764 HG22 VAL 100 1HG2 VAL 100 -2.465 10.937 10.089 765 HG23 VAL 100 2HG2 VAL 100 -2.022 12.470 10.821 766 H MET 101 H MET 101 1.928 11.122 7.058 767 HA MET 101 HA MET 101 4.073 10.262 8.810 768 HB2 MET 101 1HB MET 101 5.199 9.040 6.948 769 HB3 MET 101 2HB MET 101 3.889 8.211 7.824 770 HG2 MET 101 1HG MET 101 2.437 9.143 5.838 771 HG3 MET 101 2HG MET 101 4.005 9.289 5.046 772 HE1 MET 101 3HE MET 101 1.648 6.246 3.946 773 HE2 MET 101 1HE MET 101 1.249 7.810 4.751 774 HE3 MET 101 2HE MET 101 2.381 7.771 3.398 775 H GLN 102 H GLN 102 6.327 11.068 7.845 776 HA GLN 102 HA GLN 102 6.150 12.759 5.553 777 HB2 GLN 102 1HB GLN 102 7.577 14.363 6.667 778 HB3 GLN 102 2HB GLN 102 5.956 14.388 7.330 779 HG2 GLN 102 1HG GLN 102 7.518 12.634 8.999 780 HG3 GLN 102 2HG GLN 102 8.548 14.016 8.643 781 HE21 GLN 102 1HE2 GLN 102 8.058 16.073 9.754 782 HE22 GLN 102 2HE2 GLN 102 6.605 16.200 10.721 783 H SER 103 H SER 103 8.312 13.000 4.622 784 HA SER 103 HA SER 103 10.420 11.293 5.687 785 HB2 SER 103 1HB SER 103 8.900 9.854 4.235 786 HB3 SER 103 2HB SER 103 9.358 10.882 2.862 787 HG SER 103 HG SER 103 10.685 8.846 4.116 788 H GLY 104 H GLY 104 12.094 11.490 3.542 789 HA2 GLY 104 2HA GLY 104 13.376 13.901 4.144 790 HA3 GLY 104 1HA GLY 104 13.782 12.851 2.773 791 H GLY 105 H GLY 105 11.058 13.267 1.657 792 HA2 GLY 105 2HA GLY 105 11.509 15.806 0.222 793 HA3 GLY 105 1HA GLY 105 10.261 14.571 -0.108 794 H LEU 106 H LEU 106 8.386 14.482 1.271 795 HA LEU 106 HA LEU 106 7.821 16.583 3.200 796 HB2 LEU 106 1HB LEU 106 5.855 17.109 1.616 797 HB3 LEU 106 2HB LEU 106 7.416 17.731 1.175 798 HG LEU 106 HG LEU 106 5.980 16.758 -0.547 799 HD11 LEU 106 1HD1 LEU 106 7.492 16.374 -2.086 800 HD12 LEU 106 2HD1 LEU 106 8.609 15.550 -0.996 801 HD13 LEU 106 3HD1 LEU 106 8.381 17.319 -0.866 802 HD21 LEU 106 3HD2 LEU 106 5.338 14.616 0.454 803 HD22 LEU 106 1HD2 LEU 106 6.972 13.999 0.139 804 HD23 LEU 106 2HD2 LEU 106 5.906 14.507 -1.191 805 H ALA 107 H ALA 107 5.151 16.269 3.301 806 HA ALA 107 HA ALA 107 4.749 13.603 4.434 807 HB1 ALA 107 1HB ALA 107 2.749 14.663 5.420 808 HB2 ALA 107 2HB ALA 107 4.193 15.652 5.709 809 HB3 ALA 107 3HB ALA 107 3.043 16.103 4.427 810 H VAL 108 H VAL 108 2.631 12.528 4.205 811 HA VAL 108 HA VAL 108 1.237 12.818 1.605 812 HB VAL 108 HB VAL 108 3.186 11.498 1.009 813 HG11 VAL 108 1HG1 VAL 108 3.665 9.281 2.111 814 HG12 VAL 108 2HG1 VAL 108 4.072 10.724 3.032 815 HG13 VAL 108 3HG1 VAL 108 2.587 9.844 3.424 816 HG21 VAL 108 3HG2 VAL 108 0.799 9.644 1.215 817 HG22 VAL 108 1HG2 VAL 108 1.253 10.717 -0.131 818 HG23 VAL 108 2HG2 VAL 108 2.271 9.353 0.257 819 H ARG 109 H ARG 109 -0.879 11.589 1.667 820 HA ARG 109 HA ARG 109 -1.580 10.327 4.255 821 HB2 ARG 109 1HB ARG 109 -3.080 12.689 3.040 822 HB3 ARG 109 2HB ARG 109 -3.846 11.574 4.155 823 HG2 ARG 109 1HG ARG 109 -2.565 12.251 6.009 824 HG3 ARG 109 2HG ARG 109 -1.310 12.897 5.017 825 HD2 ARG 109 1HD ARG 109 -3.162 14.623 4.234 826 HD3 ARG 109 2HD ARG 109 -3.978 14.113 5.710 827 HE ARG 109 HE ARG 109 -1.219 15.263 5.501 828 HH11 ARG 109 1HH1 ARG 109 -4.263 15.098 7.479 829 HH12 ARG 109 2HH1 ARG 109 -3.805 16.487 8.405 830 HH21 ARG 109 1HH2 ARG 109 -0.659 17.012 6.997 831 HH22 ARG 109 2HH2 ARG 109 -1.915 17.580 8.052 832 H VAL 110 H VAL 110 -3.445 8.947 4.034 833 HA VAL 110 HA VAL 110 -3.593 7.527 1.581 834 HB VAL 110 HB VAL 110 -3.876 6.591 3.773 835 HG11 VAL 110 1HG1 VAL 110 -5.807 6.795 5.082 836 HG12 VAL 110 2HG1 VAL 110 -5.135 8.407 4.846 837 HG13 VAL 110 3HG1 VAL 110 -6.565 7.920 3.927 838 HG21 VAL 110 3HG2 VAL 110 -5.799 5.082 3.456 839 HG22 VAL 110 1HG2 VAL 110 -6.170 5.958 1.963 840 HG23 VAL 110 2HG2 VAL 110 -4.601 5.146 2.167 841 H ARG 111 H ARG 111 -5.452 10.236 2.705 842 HA ARG 111 HA ARG 111 -7.047 11.493 1.905 843 HB2 ARG 111 1HB ARG 111 -5.642 10.823 -0.340 844 HB3 ARG 111 2HB ARG 111 -7.204 10.151 -0.773 845 HG2 ARG 111 1HG ARG 111 -7.120 12.325 -1.575 846 HG3 ARG 111 2HG ARG 111 -8.237 12.393 -0.210 847 HD2 ARG 111 1HD ARG 111 -5.392 12.904 0.473 848 HD3 ARG 111 2HD ARG 111 -6.024 14.034 -0.736 849 HE ARG 111 HE ARG 111 -7.871 14.027 1.360 850 HH11 ARG 111 1HH1 ARG 111 -4.432 14.946 0.779 851 HH12 ARG 111 2HH1 ARG 111 -4.514 16.289 1.870 852 HH21 ARG 111 1HH2 ARG 111 -7.867 15.733 2.852 853 HH22 ARG 111 2HH2 ARG 111 -6.458 16.702 3.127 854 H THR 112 H THR 112 -7.657 8.275 0.532 855 HA THR 112 HA THR 112 -10.544 8.421 1.073 856 HB THR 112 HB THR 112 -10.541 6.332 -0.210 857 HG1 THR 112 1HG THR 112 -8.571 5.461 0.341 858 HG21 THR 112 3HG2 THR 112 -8.815 8.417 -1.635 859 HG22 THR 112 1HG2 THR 112 -10.590 8.454 -1.502 860 HG23 THR 112 2HG2 THR 112 -9.780 7.149 -2.397 861 HA PRO 113 HA PRO 113 -9.832 5.353 4.425 862 HB2 PRO 113 1HB PRO 113 -12.063 3.782 4.226 863 HB3 PRO 113 2HB PRO 113 -12.115 5.434 4.910 864 HG2 PRO 113 1HG PRO 113 -12.819 4.547 2.104 865 HG3 PRO 113 2HG PRO 113 -13.733 5.645 3.189 866 HD2 PRO 113 1HD PRO 113 -12.058 6.545 1.225 867 HD3 PRO 113 2HD PRO 113 -12.321 7.440 2.741 868 H ILE 114 H ILE 114 -9.957 2.825 4.392 869 HA ILE 114 HA ILE 114 -8.516 1.555 2.252 870 HB ILE 114 HB ILE 114 -10.319 0.605 4.532 871 HG12 ILE 114 1HG1 ILE 114 -8.458 1.646 5.553 872 HG13 ILE 114 2HG1 ILE 114 -8.158 -0.076 5.622 873 HG21 ILE 114 1HG2 ILE 114 -9.337 -1.597 4.376 874 HG22 ILE 114 2HG2 ILE 114 -10.243 -1.217 2.944 875 HG23 ILE 114 3HG2 ILE 114 -8.462 -1.148 2.880 876 HD11 ILE 114 3HD1 ILE 114 -6.086 0.892 5.061 877 HD12 ILE 114 1HD1 ILE 114 -6.683 0.222 3.534 878 HD13 ILE 114 2HD1 ILE 114 -6.809 1.967 3.851 879 H SER 115 H SER 115 -9.520 -0.014 0.711 880 HA SER 115 HA SER 115 -12.437 -0.125 0.801 881 HB2 SER 115 1HB SER 115 -11.323 1.230 -1.330 882 HB3 SER 115 2HB SER 115 -11.223 -0.490 -1.834 883 HG SER 115 HG SER 115 -13.230 -0.378 -2.293 884 H ASN 116 H ASN 116 -13.185 -2.090 0.091 885 HA ASN 116 HA ASN 116 -11.407 -4.439 -0.022 886 HB2 ASN 116 1HB ASN 116 -13.177 -3.422 2.206 887 HB3 ASN 116 2HB ASN 116 -13.284 -5.147 1.847 888 HD21 ASN 116 1HD2 ASN 116 -10.865 -6.048 1.336 889 HD22 ASN 116 2HD2 ASN 116 -9.739 -5.659 2.635 890 H GLY 117 H GLY 117 -12.240 -5.201 -1.984 891 HA2 GLY 117 2HA GLY 117 -15.122 -4.828 -2.624 892 HA3 GLY 117 1HA GLY 117 -13.861 -5.461 -3.688 893 H GLN 118 H GLN 118 -15.931 -6.897 -3.875 894 HA GLN 118 HA GLN 118 -16.108 -9.200 -2.156 895 HB2 GLN 118 1HB GLN 118 -17.077 -8.316 -4.837 896 HB3 GLN 118 2HB GLN 118 -16.666 -10.005 -4.758 897 HG2 GLN 118 1HG GLN 118 -18.331 -9.170 -2.461 898 HG3 GLN 118 2HG GLN 118 -19.086 -8.891 -4.030 899 HE21 GLN 118 1HE2 GLN 118 -18.597 -11.325 -1.665 900 HE22 GLN 118 2HE2 GLN 118 -18.928 -12.706 -2.696 901 HA PRO 119 HA PRO 119 -12.188 -10.920 -3.550 902 HB2 PRO 119 1HB PRO 119 -13.265 -13.628 -3.146 903 HB3 PRO 119 2HB PRO 119 -11.910 -12.818 -2.309 904 HG2 PRO 119 1HG PRO 119 -14.391 -13.330 -1.118 905 HG3 PRO 119 2HG PRO 119 -13.330 -11.985 -0.652 906 HD2 PRO 119 1HD PRO 119 -15.775 -11.908 -2.395 907 HD3 PRO 119 2HD PRO 119 -15.146 -10.728 -1.211 908 H THR 120 H THR 120 -11.433 -12.881 -4.991 909 HA THR 120 HA THR 120 -13.443 -14.078 -6.655 910 HB THR 120 HB THR 120 -11.018 -12.657 -7.869 911 HG1 THR 120 1HG THR 120 -13.473 -11.929 -7.323 912 HG21 THR 120 3HG2 THR 120 -13.118 -14.408 -9.229 913 HG22 THR 120 1HG2 THR 120 -11.366 -14.704 -9.150 914 HG23 THR 120 2HG2 THR 120 -11.991 -13.337 -10.076 915 H THR 121 H THR 121 -12.508 -16.211 -7.407 916 HA THR 121 HA THR 121 -9.893 -16.863 -6.274 917 HB THR 121 HB THR 121 -11.430 -17.730 -4.682 918 HG1 THR 121 1HG THR 121 -9.526 -18.964 -5.267 919 HG21 THR 121 3HG2 THR 121 -13.340 -18.021 -6.206 920 HG22 THR 121 1HG2 THR 121 -12.992 -19.441 -5.168 921 HG23 THR 121 2HG2 THR 121 -12.493 -19.423 -6.889 922 H GLY 122 H GLY 122 -8.828 -18.495 -7.542 923 HA2 GLY 122 2HA GLY 122 -9.650 -18.717 -10.382 924 HA3 GLY 122 1HA GLY 122 -8.152 -19.216 -9.625 925 H ASP 123 H ASP 123 -8.324 -20.749 -7.952 926 HA ASP 123 HA ASP 123 -9.781 -23.113 -9.004 927 HB2 ASP 123 1HB ASP 123 -7.838 -22.392 -10.344 928 HB3 ASP 123 2HB ASP 123 -6.834 -22.334 -8.929 929 H ALA 124 H ALA 124 -7.317 -21.874 -6.664 930 HA ALA 124 HA ALA 124 -8.290 -23.769 -4.618 931 HB1 ALA 124 1HB ALA 124 -6.669 -24.986 -6.080 932 HB2 ALA 124 2HB ALA 124 -5.442 -23.735 -5.684 933 HB3 ALA 124 3HB ALA 124 -6.103 -24.796 -4.426 934 H ASP 125 H ASP 125 -7.461 -20.664 -5.297 935 HA ASP 125 HA ASP 125 -6.882 -20.053 -2.502 936 HB2 ASP 125 1HB ASP 125 -5.241 -18.239 -3.935 937 HB3 ASP 125 2HB ASP 125 -4.747 -19.413 -2.749 938 H HIS 126 H HIS 126 -7.869 -18.059 -2.001 939 HA HIS 126 HA HIS 126 -9.316 -16.759 -4.277 940 HB2 HIS 126 1HB HIS 126 -10.058 -16.270 -1.464 941 HB3 HIS 126 2HB HIS 126 -11.018 -16.035 -2.886 942 HD1 HIS 126 1HD HIS 126 -13.092 -17.555 -2.596 943 HD2 HIS 126 2HD HIS 126 -9.635 -18.869 -0.603 944 HE1 HIS 126 1HE HIS 126 -13.819 -19.474 -1.165 945 H THR 127 H THR 127 -9.058 -14.531 -4.500 946 HA THR 127 HA THR 127 -7.073 -13.213 -2.725 947 HB THR 127 HB THR 127 -7.350 -12.796 -5.723 948 HG1 THR 127 1HG THR 127 -6.439 -14.822 -5.487 949 HG21 THR 127 3HG2 THR 127 -6.426 -10.887 -4.428 950 HG22 THR 127 1HG2 THR 127 -5.189 -11.647 -5.433 951 HG23 THR 127 2HG2 THR 127 -5.228 -11.962 -3.679 952 H VAL 128 H VAL 128 -7.977 -11.606 -1.650 953 HA VAL 128 HA VAL 128 -10.504 -10.353 -2.509 954 HB VAL 128 HB VAL 128 -9.725 -8.944 -0.320 955 HG11 VAL 128 1HG1 VAL 128 -11.139 -10.323 1.032 956 HG12 VAL 128 2HG1 VAL 128 -11.851 -10.106 -0.564 957 HG13 VAL 128 3HG1 VAL 128 -11.062 -11.648 -0.146 958 HG21 VAL 128 3HG2 VAL 128 -7.610 -10.126 -0.178 959 HG22 VAL 128 1HG2 VAL 128 -8.599 -10.024 1.266 960 HG23 VAL 128 2HG2 VAL 128 -8.525 -11.581 0.363 961 HA PRO 129 HA PRO 129 -8.100 -6.878 -4.229 962 HB2 PRO 129 1HB PRO 129 -10.155 -5.392 -5.114 963 HB3 PRO 129 2HB PRO 129 -9.811 -7.006 -5.824 964 HG2 PRO 129 1HG PRO 129 -11.881 -6.336 -3.727 965 HG3 PRO 129 2HG PRO 129 -12.090 -7.285 -5.214 966 HD2 PRO 129 1HD PRO 129 -11.594 -8.374 -2.725 967 HD3 PRO 129 2HD PRO 129 -11.078 -9.137 -4.265 968 H ILE 130 H ILE 130 -7.089 -5.760 -2.505 969 HA ILE 130 HA ILE 130 -8.825 -3.856 -1.022 970 HB ILE 130 HB ILE 130 -6.174 -4.751 0.027 971 HG12 ILE 130 1HG1 ILE 130 -8.779 -6.221 0.480 972 HG13 ILE 130 2HG1 ILE 130 -7.274 -6.821 -0.181 973 HG21 ILE 130 1HG2 ILE 130 -8.606 -3.731 1.518 974 HG22 ILE 130 2HG2 ILE 130 -6.940 -3.901 2.113 975 HG23 ILE 130 3HG2 ILE 130 -7.309 -2.687 0.901 976 HD11 ILE 130 3HD1 ILE 130 -7.773 -6.027 2.718 977 HD12 ILE 130 1HD1 ILE 130 -7.456 -7.648 2.085 978 HD13 ILE 130 2HD1 ILE 130 -6.171 -6.422 2.078 979 H SER 131 H SER 131 -8.321 -1.825 -1.429 980 HA SER 131 HA SER 131 -5.709 -0.892 -2.063 981 HB2 SER 131 1HB SER 131 -6.102 -1.905 -4.241 982 HB3 SER 131 2HB SER 131 -7.603 -1.038 -4.452 983 HG SER 131 HG SER 131 -5.092 0.196 -4.162 984 H LEU 132 H LEU 132 -5.670 1.370 -2.660 985 HA LEU 132 HA LEU 132 -7.865 3.128 -1.800 986 HB2 LEU 132 1HB LEU 132 -6.492 4.113 0.042 987 HB3 LEU 132 2HB LEU 132 -7.069 2.483 0.333 988 HG LEU 132 HG LEU 132 -4.635 1.764 -0.504 989 HD11 LEU 132 1HD1 LEU 132 -3.642 3.765 -1.229 990 HD12 LEU 132 2HD1 LEU 132 -2.967 3.534 0.382 991 HD13 LEU 132 3HD1 LEU 132 -4.272 4.712 0.109 992 HD21 LEU 132 3HD2 LEU 132 -5.243 2.937 2.222 993 HD22 LEU 132 1HD2 LEU 132 -3.881 1.859 1.851 994 HD23 LEU 132 2HD2 LEU 132 -5.542 1.288 1.659 995 H GLY 133 H GLY 133 -7.181 5.489 -2.012 996 HA2 GLY 133 2HA GLY 133 -5.158 5.777 -4.208 997 HA3 GLY 133 1HA GLY 133 -6.744 6.495 -4.255 998 H TYR 134 H TYR 134 -3.642 6.663 -2.919 999 HA TYR 134 HA TYR 134 -4.197 8.710 -0.884 1000 HB2 TYR 134 1HB TYR 134 -1.860 8.346 -0.200 1001 HB3 TYR 134 2HB TYR 134 -2.627 6.808 -0.473 1002 HD1 TYR 134 1HD TYR 134 -0.188 9.281 -1.782 1003 HD2 TYR 134 2HD TYR 134 -1.842 5.311 -2.221 1004 HE1 TYR 134 1HE TYR 134 1.716 8.659 -3.232 1005 HE2 TYR 134 2HE TYR 134 0.113 4.676 -3.635 1006 HH TYR 134 HH TYR 134 2.485 7.076 -4.759 1007 H ASP 135 H ASP 135 -2.628 10.583 -0.652 1008 HA ASP 135 HA ASP 135 -2.042 11.836 -3.230 1009 HB2 ASP 135 1HB ASP 135 -3.454 13.491 -3.140 1010 HB3 ASP 135 2HB ASP 135 -4.422 12.458 -2.109 1011 H VAL 136 H VAL 136 -0.749 13.777 -3.005 1012 HA VAL 136 HA VAL 136 1.267 13.350 -0.873 1013 HB VAL 136 HB VAL 136 1.498 14.137 -3.812 1014 HG11 VAL 136 1HG1 VAL 136 3.605 13.762 -1.660 1015 HG12 VAL 136 2HG1 VAL 136 3.973 13.735 -3.411 1016 HG13 VAL 136 3HG1 VAL 136 3.284 15.176 -2.687 1017 HG21 VAL 136 3HG2 VAL 136 0.956 11.738 -3.605 1018 HG22 VAL 136 1HG2 VAL 136 2.637 11.927 -4.084 1019 HG23 VAL 136 2HG2 VAL 136 2.242 11.531 -2.395 1020 H GLN 137 H GLN 137 2.257 15.199 -0.005 1021 HA GLN 137 HA GLN 137 0.956 17.814 -0.573 1022 HB2 GLN 137 1HB GLN 137 2.204 16.602 1.918 1023 HB3 GLN 137 2HB GLN 137 2.090 18.356 1.736 1024 HG2 GLN 137 1HG GLN 137 -0.297 18.256 1.384 1025 HG3 GLN 137 2HG GLN 137 -0.253 16.498 1.371 1026 HE21 GLN 137 1HE2 GLN 137 1.874 17.680 3.777 1027 HE22 GLN 137 2HE2 GLN 137 0.868 17.187 5.110 1028 H PHE 138 H PHE 138 2.649 19.585 0.063 1029 HA PHE 138 HA PHE 138 5.327 19.100 -1.058 1030 HB2 PHE 138 1HB PHE 138 3.104 20.794 -2.253 1031 HB3 PHE 138 2HB PHE 138 4.823 21.079 -2.616 1032 HD1 PHE 138 2HD PHE 138 6.200 19.172 -3.598 1033 HD2 PHE 138 1HD PHE 138 1.913 19.001 -3.360 1034 HE1 PHE 138 2HE PHE 138 6.183 17.291 -5.235 1035 HE2 PHE 138 1HE PHE 138 1.887 17.118 -4.952 1036 HZ PHE 138 HZ PHE 138 4.042 16.248 -5.899 1037 H TYR 139 H TYR 139 6.548 20.006 0.429 1038 HA TYR 139 HA TYR 139 5.671 22.326 2.085 1039 HB2 TYR 139 1HB TYR 139 6.618 19.578 2.860 1040 HB3 TYR 139 2HB TYR 139 7.236 20.942 3.751 1041 HD1 TYR 139 2HD TYR 139 3.732 20.036 2.508 1042 HD2 TYR 139 1HD TYR 139 6.274 21.307 5.749 1043 HE1 TYR 139 2HE TYR 139 1.809 19.946 4.070 1044 HE2 TYR 139 1HE TYR 139 4.411 21.143 7.307 1045 HH TYR 139 HH TYR 139 2.251 20.457 7.608 1046 HA PRO 140 HA PRO 140 9.804 23.176 0.077 1047 HB2 PRO 140 1HB PRO 140 9.483 25.846 -0.321 1048 HB3 PRO 140 2HB PRO 140 8.731 24.638 -1.396 1049 HG2 PRO 140 1HG PRO 140 7.472 26.066 0.976 1050 HG3 PRO 140 2HG PRO 140 6.832 25.928 -0.699 1051 HD2 PRO 140 1HD PRO 140 6.063 24.246 1.305 1052 HD3 PRO 140 2HD PRO 140 6.230 23.665 -0.376 1053 H GLU 141 H GLU 141 11.301 25.182 0.808 1054 HA GLU 141 HA GLU 141 12.684 25.989 2.401 1055 HB2 GLU 141 1HB GLU 141 10.037 26.568 3.771 1056 HB3 GLU 141 2HB GLU 141 11.591 27.288 4.187 1057 HG2 GLU 141 1HG GLU 141 11.755 28.481 2.157 1058 HG3 GLU 141 2HG GLU 141 10.466 27.582 1.366 Start of MODEL 15 1 H1 GLY 1 H GLY 1 18.432 9.603 -8.530 2 HA2 GLY 1 2HA GLY 1 16.175 8.790 -8.288 3 HA3 GLY 1 1HA GLY 1 16.676 7.963 -6.803 4 H MET 2 H MET 2 14.847 10.527 -7.735 5 HA MET 2 HA MET 2 15.311 11.952 -5.184 6 HB2 MET 2 1HB MET 2 14.909 13.202 -7.921 7 HB3 MET 2 2HB MET 2 14.367 13.999 -6.450 8 HG2 MET 2 1HG MET 2 16.422 14.950 -6.861 9 HG3 MET 2 2HG MET 2 16.734 13.806 -5.559 10 HE1 MET 2 3HE MET 2 20.012 14.132 -7.832 11 HE2 MET 2 1HE MET 2 18.759 15.388 -7.715 12 HE3 MET 2 2HE MET 2 19.283 14.520 -6.254 13 H SER 3 H SER 3 13.324 12.889 -4.397 14 HA SER 3 HA SER 3 11.356 12.482 -3.514 15 HB2 SER 3 1HB SER 3 11.186 14.041 -5.684 16 HB3 SER 3 2HB SER 3 10.062 12.785 -6.212 17 HG SER 3 HG SER 3 9.936 14.333 -3.817 18 H GLN 4 H GLN 4 10.520 10.776 -6.560 19 HA GLN 4 HA GLN 4 8.642 9.137 -5.404 20 HB2 GLN 4 1HB GLN 4 10.186 9.174 -7.951 21 HB3 GLN 4 2HB GLN 4 9.528 7.603 -7.535 22 HG2 GLN 4 1HG GLN 4 7.878 10.160 -7.668 23 HG3 GLN 4 2HG GLN 4 8.011 8.965 -8.961 24 HE21 GLN 4 1HE2 GLN 4 7.611 6.520 -7.987 25 HE22 GLN 4 2HE2 GLN 4 6.160 6.424 -7.008 26 H ASP 5 H ASP 5 12.145 8.435 -5.353 27 HA ASP 5 HA ASP 5 11.869 5.629 -4.696 28 HB2 ASP 5 1HB ASP 5 14.062 7.541 -4.815 29 HB3 ASP 5 2HB ASP 5 14.112 6.782 -3.254 30 H LEU 6 H LEU 6 12.392 8.530 -2.815 31 HA LEU 6 HA LEU 6 12.399 7.401 -0.217 32 HB2 LEU 6 1HB LEU 6 13.100 9.508 0.311 33 HB3 LEU 6 2HB LEU 6 13.247 9.663 -1.410 34 HG LEU 6 HG LEU 6 10.684 10.502 -1.223 35 HD11 LEU 6 1HD1 LEU 6 10.221 11.310 0.968 36 HD12 LEU 6 2HD1 LEU 6 11.905 10.879 1.509 37 HD13 LEU 6 3HD1 LEU 6 10.737 9.669 1.164 38 HD21 LEU 6 3HD2 LEU 6 12.772 11.809 -1.907 39 HD22 LEU 6 1HD2 LEU 6 12.810 12.402 -0.221 40 HD23 LEU 6 2HD2 LEU 6 11.397 12.675 -1.280 41 H ILE 7 H ILE 7 9.774 9.100 -2.026 42 HA ILE 7 HA ILE 7 7.713 8.678 -0.284 43 HB ILE 7 HB ILE 7 7.401 8.283 -3.267 44 HG12 ILE 7 1HG1 ILE 7 8.077 10.719 -1.617 45 HG13 ILE 7 2HG1 ILE 7 8.489 10.272 -3.253 46 HG21 ILE 7 1HG2 ILE 7 5.132 9.073 -2.899 47 HG22 ILE 7 2HG2 ILE 7 5.414 7.695 -1.846 48 HG23 ILE 7 3HG2 ILE 7 5.442 9.338 -1.179 49 HD11 ILE 7 3HD1 ILE 7 5.869 11.459 -2.377 50 HD12 ILE 7 1HD1 ILE 7 7.177 12.220 -3.315 51 HD13 ILE 7 2HD1 ILE 7 6.233 10.880 -4.020 52 H ARG 8 H ARG 8 8.925 6.132 -2.620 53 HA ARG 8 HA ARG 8 7.079 4.127 -1.590 54 HB2 ARG 8 1HB ARG 8 9.135 4.132 -3.639 55 HB3 ARG 8 2HB ARG 8 9.564 2.897 -2.481 56 HG2 ARG 8 1HG ARG 8 7.078 2.117 -2.645 57 HG3 ARG 8 2HG ARG 8 6.993 3.073 -4.098 58 HD2 ARG 8 1HD ARG 8 9.079 0.914 -3.590 59 HD3 ARG 8 2HD ARG 8 7.541 0.610 -4.397 60 HE ARG 8 HE ARG 8 8.449 2.555 -5.967 61 HH11 ARG 8 1HH1 ARG 8 10.131 -0.286 -4.723 62 HH12 ARG 8 2HH1 ARG 8 11.163 -0.502 -6.091 63 HH21 ARG 8 1HH2 ARG 8 9.805 2.374 -7.765 64 HH22 ARG 8 2HH2 ARG 8 10.964 1.115 -7.951 65 H ALA 9 H ALA 9 10.259 5.248 -0.450 66 HA ALA 9 HA ALA 9 10.768 3.081 1.320 67 HB1 ALA 9 1HB ALA 9 11.595 5.988 1.763 68 HB2 ALA 9 2HB ALA 9 12.393 4.547 2.347 69 HB3 ALA 9 3HB ALA 9 12.415 4.902 0.612 70 H ALA 10 H ALA 10 8.912 6.095 1.729 71 HA ALA 10 HA ALA 10 8.354 5.910 4.487 72 HB1 ALA 10 1HB ALA 10 6.698 7.524 4.078 73 HB2 ALA 10 2HB ALA 10 7.767 7.731 2.659 74 HB3 ALA 10 3HB ALA 10 6.262 6.839 2.504 75 H PHE 11 H PHE 11 6.808 4.345 1.722 76 HA PHE 11 HA PHE 11 4.566 3.262 3.182 77 HB2 PHE 11 1HB PHE 11 5.754 2.712 0.436 78 HB3 PHE 11 2HB PHE 11 4.467 1.753 1.113 79 HD1 PHE 11 1HD PHE 11 4.906 5.563 1.121 80 HD2 PHE 11 2HD PHE 11 2.564 2.137 -0.127 81 HE1 PHE 11 1HE PHE 11 3.250 7.052 0.151 82 HE2 PHE 11 2HE PHE 11 0.874 3.667 -1.063 83 HZ PHE 11 HZ PHE 11 1.197 6.138 -0.934 84 H GLU 12 H GLU 12 7.879 1.958 2.339 85 HA GLU 12 HA GLU 12 7.392 -0.643 3.445 86 HB2 GLU 12 1HB GLU 12 9.934 1.028 3.178 87 HB3 GLU 12 2HB GLU 12 9.900 -0.542 3.958 88 HG2 GLU 12 1HG GLU 12 8.918 -1.510 1.825 89 HG3 GLU 12 2HG GLU 12 9.303 0.055 1.065 90 H LYS 13 H LYS 13 8.154 2.501 4.890 91 HA LYS 13 HA LYS 13 8.933 1.511 7.476 92 HB2 LYS 13 1HB LYS 13 9.720 3.581 6.240 93 HB3 LYS 13 2HB LYS 13 8.182 4.350 6.672 94 HG2 LYS 13 1HG LYS 13 8.675 4.251 9.007 95 HG3 LYS 13 2HG LYS 13 9.930 3.037 8.769 96 HD2 LYS 13 1HD LYS 13 11.133 4.877 7.342 97 HD3 LYS 13 2HD LYS 13 10.046 5.997 8.183 98 HE2 LYS 13 1HE LYS 13 11.954 5.959 9.561 99 HE3 LYS 13 2HE LYS 13 10.861 4.810 10.357 100 HZ1 LYS 13 3HZ LYS 13 13.191 4.204 8.647 101 HZ2 LYS 13 1HZ LYS 13 12.098 3.032 9.103 102 HZ3 LYS 13 2HZ LYS 13 12.973 3.831 10.226 103 H ARG 14 H ARG 14 6.011 1.524 5.986 104 HA ARG 14 HA ARG 14 4.690 1.516 8.616 105 HB2 ARG 14 1HB ARG 14 3.821 3.306 6.983 106 HB3 ARG 14 2HB ARG 14 3.144 1.958 6.084 107 HG2 ARG 14 1HG ARG 14 1.448 2.619 7.491 108 HG3 ARG 14 2HG ARG 14 2.068 1.216 8.327 109 HD2 ARG 14 1HD ARG 14 3.024 2.590 10.050 110 HD3 ARG 14 2HD ARG 14 2.969 4.032 9.020 111 HE ARG 14 HE ARG 14 0.422 2.706 9.818 112 HH11 ARG 14 1HH1 ARG 14 2.502 5.566 10.275 113 HH12 ARG 14 2HH1 ARG 14 1.182 6.635 10.539 114 HH21 ARG 14 1HH2 ARG 14 -1.266 4.081 10.185 115 HH22 ARG 14 2HH2 ARG 14 -1.047 5.796 10.479 116 H LEU 15 H LEU 15 4.430 0.195 5.307 117 HA LEU 15 HA LEU 15 2.812 -1.991 6.058 118 HB2 LEU 15 1HB LEU 15 3.390 -0.722 3.746 119 HB3 LEU 15 2HB LEU 15 4.485 -2.077 3.534 120 HG LEU 15 HG LEU 15 1.478 -2.203 4.020 121 HD11 LEU 15 1HD1 LEU 15 2.232 -1.289 1.831 122 HD12 LEU 15 2HD1 LEU 15 1.299 -2.771 1.716 123 HD13 LEU 15 3HD1 LEU 15 3.079 -2.797 1.483 124 HD21 LEU 15 3HD2 LEU 15 1.602 -4.594 3.394 125 HD22 LEU 15 1HD2 LEU 15 2.441 -4.264 4.899 126 HD23 LEU 15 2HD2 LEU 15 3.379 -4.492 3.412 127 H SER 16 H SER 16 6.319 -1.869 5.240 128 HA SER 16 HA SER 16 6.737 -4.715 5.579 129 HB2 SER 16 1HB SER 16 8.203 -2.492 4.596 130 HB3 SER 16 2HB SER 16 9.054 -3.005 6.062 131 HG SER 16 HG SER 16 9.259 -5.057 5.172 132 H ASP 17 H ASP 17 7.299 -1.770 7.502 133 HA ASP 17 HA ASP 17 8.388 -2.674 9.833 134 HB2 ASP 17 1HB ASP 17 6.902 -0.357 8.916 135 HB3 ASP 17 2HB ASP 17 6.235 -0.797 10.472 136 H TRP 18 H TRP 18 4.956 -2.684 9.030 137 HA TRP 18 HA TRP 18 4.081 -4.010 11.480 138 HB2 TRP 18 1HB TRP 18 2.484 -2.680 10.456 139 HB3 TRP 18 2HB TRP 18 2.838 -3.260 8.833 140 HD1 TRP 18 HD TRP 18 0.835 -4.248 11.948 141 HE1 TRP 18 1HE TRP 18 -0.898 -6.000 11.323 142 HE3 TRP 18 3HE TRP 18 2.222 -5.072 7.109 143 HZ2 TRP 18 2HZ TRP 18 -1.604 -7.572 9.012 144 HZ3 TRP 18 3HZ TRP 18 1.093 -6.805 5.739 145 HH2 TRP 18 HH TRP 18 -0.825 -8.087 6.687 146 H ALA 19 H ALA 19 4.507 -5.111 8.060 147 HA ALA 19 HA ALA 19 3.433 -7.699 8.643 148 HB1 ALA 19 1HB ALA 19 3.597 -6.649 6.308 149 HB2 ALA 19 2HB ALA 19 5.359 -6.909 6.370 150 HB3 ALA 19 3HB ALA 19 4.233 -8.293 6.390 151 H LYS 20 H LYS 20 6.780 -6.389 9.002 152 HA LYS 20 HA LYS 20 7.736 -9.144 9.479 153 HB2 LYS 20 1HB LYS 20 9.918 -8.252 9.561 154 HB3 LYS 20 2HB LYS 20 9.032 -7.535 8.236 155 HG2 LYS 20 1HG LYS 20 10.066 -5.691 8.912 156 HG3 LYS 20 2HG LYS 20 8.643 -5.524 9.932 157 HD2 LYS 20 1HD LYS 20 9.809 -5.842 11.863 158 HD3 LYS 20 2HD LYS 20 10.941 -7.015 11.157 159 HE2 LYS 20 1HE LYS 20 12.266 -5.358 10.121 160 HE3 LYS 20 2HE LYS 20 11.003 -4.122 10.282 161 HZ1 LYS 20 3HZ LYS 20 12.451 -5.240 12.601 162 HZ2 LYS 20 1HZ LYS 20 11.335 -4.030 12.588 163 HZ3 LYS 20 2HZ LYS 20 12.784 -3.793 11.879 164 H ALA 21 H ALA 21 6.037 -6.986 11.253 165 HA ALA 21 HA ALA 21 7.113 -7.979 13.851 166 HB1 ALA 21 1HB ALA 21 7.311 -5.516 13.467 167 HB2 ALA 21 2HB ALA 21 5.546 -5.432 13.317 168 HB3 ALA 21 3HB ALA 21 6.284 -5.929 14.850 169 H ARG 22 H ARG 22 4.366 -8.498 11.749 170 HA ARG 22 HA ARG 22 2.357 -8.766 13.746 171 HB2 ARG 22 1HB ARG 22 1.319 -10.044 11.965 172 HB3 ARG 22 2HB ARG 22 1.655 -8.365 11.681 173 HG2 ARG 22 1HG ARG 22 3.265 -8.775 10.254 174 HG3 ARG 22 2HG ARG 22 3.231 -10.485 10.761 175 HD2 ARG 22 1HD ARG 22 1.769 -9.371 8.699 176 HD3 ARG 22 2HD ARG 22 1.711 -11.007 9.362 177 HE ARG 22 HE ARG 22 -0.118 -9.315 10.805 178 HH11 ARG 22 1HH1 ARG 22 -0.100 -10.025 7.468 179 HH12 ARG 22 2HH1 ARG 22 -1.650 -10.831 7.410 180 HH21 ARG 22 1HH2 ARG 22 -2.134 -10.510 10.884 181 HH22 ARG 22 2HH2 ARG 22 -2.902 -11.015 9.432 182 H THR 23 H THR 23 1.478 -11.061 14.260 183 HA THR 23 HA THR 23 3.335 -13.002 14.963 184 HB THR 23 HB THR 23 0.402 -13.105 14.321 185 HG1 THR 23 1HG THR 23 1.768 -13.257 16.769 186 HG21 THR 23 3HG2 THR 23 2.162 -15.291 15.421 187 HG22 THR 23 1HG2 THR 23 1.230 -15.334 13.926 188 HG23 THR 23 2HG2 THR 23 0.375 -15.306 15.505 189 HA PRO 24 HA PRO 24 2.856 -15.766 11.244 190 HB2 PRO 24 1HB PRO 24 1.361 -15.234 9.025 191 HB3 PRO 24 2HB PRO 24 0.654 -15.873 10.548 192 HG2 PRO 24 1HG PRO 24 0.800 -12.982 9.621 193 HG3 PRO 24 2HG PRO 24 -0.647 -13.869 10.169 194 HD2 PRO 24 1HD PRO 24 0.741 -12.308 11.892 195 HD3 PRO 24 2HD PRO 24 0.119 -13.902 12.413 196 H ALA 25 H ALA 25 3.175 -12.510 10.706 197 HA ALA 25 HA ALA 25 4.488 -11.122 9.538 198 HB1 ALA 25 1HB ALA 25 5.973 -12.042 11.225 199 HB2 ALA 25 2HB ALA 25 6.449 -13.353 10.123 200 HB3 ALA 25 3HB ALA 25 6.886 -11.667 9.738 201 H LEU 26 H LEU 26 3.995 -10.740 7.492 202 HA LEU 26 HA LEU 26 4.313 -12.901 5.452 203 HB2 LEU 26 1HB LEU 26 2.667 -10.335 5.422 204 HB3 LEU 26 2HB LEU 26 2.909 -11.316 3.995 205 HG LEU 26 HG LEU 26 0.756 -11.710 4.981 206 HD11 LEU 26 1HD1 LEU 26 2.456 -14.199 5.373 207 HD12 LEU 26 2HD1 LEU 26 1.874 -13.612 3.788 208 HD13 LEU 26 3HD1 LEU 26 0.726 -14.141 5.020 209 HD21 LEU 26 3HD2 LEU 26 0.279 -12.652 7.063 210 HD22 LEU 26 1HD2 LEU 26 1.371 -11.256 7.275 211 HD23 LEU 26 2HD2 LEU 26 2.009 -12.916 7.413 212 HA PRO 27 HA PRO 27 7.212 -10.133 3.275 213 HB2 PRO 27 1HB PRO 27 7.474 -11.352 0.932 214 HB3 PRO 27 2HB PRO 27 8.002 -12.178 2.428 215 HG2 PRO 27 1HG PRO 27 5.354 -12.555 0.971 216 HG3 PRO 27 2HG PRO 27 6.513 -13.821 1.498 217 HD2 PRO 27 1HD PRO 27 4.352 -13.045 3.025 218 HD3 PRO 27 2HD PRO 27 5.902 -13.584 3.742 219 H VAL 28 H VAL 28 7.192 -8.750 1.269 220 HA VAL 28 HA VAL 28 4.468 -7.945 0.394 221 HB VAL 28 HB VAL 28 6.668 -6.146 1.510 222 HG11 VAL 28 1HG1 VAL 28 5.265 -5.012 -0.153 223 HG12 VAL 28 2HG1 VAL 28 3.802 -5.520 0.720 224 HG13 VAL 28 3HG1 VAL 28 4.958 -4.381 1.461 225 HG21 VAL 28 3HG2 VAL 28 5.716 -7.418 3.384 226 HG22 VAL 28 1HG2 VAL 28 5.237 -5.745 3.458 227 HG23 VAL 28 2HG2 VAL 28 4.071 -6.970 2.875 228 H ALA 29 H ALA 29 4.588 -8.135 -1.875 229 HA ALA 29 HA ALA 29 7.251 -7.744 -3.172 230 HB1 ALA 29 1HB ALA 29 6.224 -9.863 -3.632 231 HB2 ALA 29 2HB ALA 29 4.726 -9.065 -4.186 232 HB3 ALA 29 3HB ALA 29 6.264 -8.863 -5.082 233 H TRP 30 H TRP 30 7.307 -5.407 -3.260 234 HA TRP 30 HA TRP 30 5.207 -3.801 -4.365 235 HB2 TRP 30 1HB TRP 30 8.159 -3.170 -4.471 236 HB3 TRP 30 2HB TRP 30 6.816 -2.069 -4.607 237 HD1 TRP 30 HD TRP 30 8.958 -3.850 -2.054 238 HE1 TRP 30 1HE TRP 30 8.306 -3.227 0.274 239 HE3 TRP 30 3HE TRP 30 4.697 -1.115 -3.173 240 HZ2 TRP 30 2HZ TRP 30 6.164 -1.683 1.576 241 HZ3 TRP 30 3HZ TRP 30 3.402 -0.164 -1.378 242 HH2 TRP 30 HH TRP 30 4.107 -0.411 1.019 243 H GLN 31 H GLN 31 4.453 -4.680 -6.334 244 HA GLN 31 HA GLN 31 4.259 -4.884 -8.571 245 HB2 GLN 31 1HB GLN 31 6.280 -2.712 -8.177 246 HB3 GLN 31 2HB GLN 31 6.119 -3.374 -9.827 247 HG2 GLN 31 1HG GLN 31 3.726 -2.853 -9.802 248 HG3 GLN 31 2HG GLN 31 3.889 -2.256 -8.138 249 HE21 GLN 31 1HE2 GLN 31 3.381 0.021 -8.593 250 HE22 GLN 31 2HE2 GLN 31 4.385 0.948 -9.653 251 H ASN 32 H ASN 32 7.799 -4.579 -8.878 252 HA ASN 32 HA ASN 32 8.139 -7.467 -9.260 253 HB2 ASN 32 1HB ASN 32 8.729 -5.508 -11.472 254 HB3 ASN 32 2HB ASN 32 9.458 -7.109 -11.350 255 HD21 ASN 32 1HD2 ASN 32 6.804 -5.486 -12.533 256 HD22 ASN 32 2HD2 ASN 32 5.915 -6.938 -13.039 257 H THR 33 H THR 33 8.916 -5.285 -7.344 258 HA THR 33 HA THR 33 11.807 -5.152 -7.201 259 HB THR 33 HB THR 33 9.517 -5.091 -5.175 260 HG1 THR 33 1HG THR 33 9.453 -3.332 -6.414 261 HG21 THR 33 3HG2 THR 33 11.124 -4.034 -3.609 262 HG22 THR 33 1HG2 THR 33 12.451 -4.492 -4.715 263 HG23 THR 33 2HG2 THR 33 11.442 -5.735 -3.943 264 H LYS 34 H LYS 34 13.059 -6.629 -5.781 265 HA LYS 34 HA LYS 34 12.596 -9.384 -6.416 266 HB2 LYS 34 1HB LYS 34 14.517 -7.922 -4.577 267 HB3 LYS 34 2HB LYS 34 14.407 -9.677 -4.564 268 HG2 LYS 34 1HG LYS 34 16.213 -8.971 -5.961 269 HG3 LYS 34 2HG LYS 34 15.013 -9.838 -6.908 270 HD2 LYS 34 1HD LYS 34 14.848 -6.822 -6.854 271 HD3 LYS 34 2HD LYS 34 16.201 -7.533 -7.697 272 HE2 LYS 34 1HE LYS 34 13.393 -8.490 -8.319 273 HE3 LYS 34 2HE LYS 34 14.061 -7.022 -9.059 274 HZ1 LYS 34 3HZ LYS 34 14.507 -8.943 -10.455 275 HZ2 LYS 34 1HZ LYS 34 15.286 -9.703 -9.243 276 HZ3 LYS 34 2HZ LYS 34 15.911 -8.321 -9.872 277 H PHE 35 H PHE 35 11.989 -11.095 -5.169 278 HA PHE 35 HA PHE 35 10.671 -10.884 -2.631 279 HB2 PHE 35 1HB PHE 35 8.480 -11.143 -3.535 280 HB3 PHE 35 2HB PHE 35 9.126 -9.680 -4.234 281 HD1 PHE 35 1HD PHE 35 10.415 -10.209 -6.681 282 HD2 PHE 35 2HD PHE 35 7.205 -12.477 -4.915 283 HE1 PHE 35 1HE PHE 35 9.866 -11.102 -8.889 284 HE2 PHE 35 2HE PHE 35 6.702 -13.426 -7.150 285 HZ PHE 35 HZ PHE 35 7.992 -12.722 -9.142 286 H THR 36 H THR 36 9.280 -13.046 -2.552 287 HA THR 36 HA THR 36 8.897 -15.151 -2.748 288 HB THR 36 HB THR 36 9.339 -14.598 -5.331 289 HG1 THR 36 1HG THR 36 7.759 -15.938 -4.713 290 HG21 THR 36 3HG2 THR 36 11.702 -15.366 -5.425 291 HG22 THR 36 1HG2 THR 36 10.640 -16.388 -6.380 292 HG23 THR 36 2HG2 THR 36 11.222 -16.933 -4.790 293 HA PRO 37 HA PRO 37 9.152 -17.792 -2.668 294 HB2 PRO 37 1HB PRO 37 9.029 -19.216 -0.331 295 HB3 PRO 37 2HB PRO 37 10.265 -19.524 -1.590 296 HG2 PRO 37 1HG PRO 37 10.511 -17.786 0.891 297 HG3 PRO 37 2HG PRO 37 11.610 -19.106 0.368 298 HD2 PRO 37 1HD PRO 37 12.156 -16.537 -0.191 299 HD3 PRO 37 2HD PRO 37 12.464 -17.815 -1.403 300 HA PRO 38 HA PRO 38 5.980 -15.743 -0.128 301 HB2 PRO 38 1HB PRO 38 3.926 -17.533 -0.081 302 HB3 PRO 38 2HB PRO 38 4.368 -16.612 -1.570 303 HG2 PRO 38 1HG PRO 38 5.092 -19.435 -0.796 304 HG3 PRO 38 2HG PRO 38 4.531 -18.843 -2.391 305 HD2 PRO 38 1HD PRO 38 7.180 -19.272 -1.769 306 HD3 PRO 38 2HD PRO 38 6.659 -18.001 -2.918 307 H ALA 39 H ALA 39 4.514 -16.152 1.734 308 HA ALA 39 HA ALA 39 5.709 -17.758 3.860 309 HB1 ALA 39 1HB ALA 39 5.175 -15.516 4.588 310 HB2 ALA 39 2HB ALA 39 3.568 -15.591 3.809 311 HB3 ALA 39 3HB ALA 39 3.918 -16.582 5.235 312 H ALA 40 H ALA 40 5.227 -19.499 2.470 313 HA ALA 40 HA ALA 40 4.118 -21.435 1.945 314 HB1 ALA 40 1HB ALA 40 4.233 -21.693 4.338 315 HB2 ALA 40 2HB ALA 40 2.690 -20.817 4.535 316 HB3 ALA 40 3HB ALA 40 2.720 -22.388 3.704 317 H GLY 41 H GLY 41 3.256 -20.283 0.091 318 HA2 GLY 41 2HA GLY 41 1.629 -19.894 -1.418 319 HA3 GLY 41 1HA GLY 41 0.484 -20.696 -0.332 320 H VAL 42 H VAL 42 1.704 -18.161 1.432 321 HA VAL 42 HA VAL 42 -0.356 -16.275 0.449 322 HB VAL 42 HB VAL 42 0.769 -16.358 3.284 323 HG11 VAL 42 1HG1 VAL 42 -1.228 -15.170 3.933 324 HG12 VAL 42 2HG1 VAL 42 -0.434 -14.286 2.621 325 HG13 VAL 42 3HG1 VAL 42 -1.878 -15.258 2.277 326 HG21 VAL 42 3HG2 VAL 42 -0.306 -18.563 2.944 327 HG22 VAL 42 1HG2 VAL 42 -1.199 -17.566 4.082 328 HG23 VAL 42 2HG2 VAL 42 -1.792 -17.740 2.417 329 H TYR 43 H TYR 43 0.150 -14.197 0.026 330 HA TYR 43 HA TYR 43 2.451 -12.915 1.130 331 HB2 TYR 43 1HB TYR 43 3.609 -12.442 -0.993 332 HB3 TYR 43 2HB TYR 43 3.665 -14.142 -0.597 333 HD1 TYR 43 2HD TYR 43 2.129 -15.804 -1.865 334 HD2 TYR 43 1HD TYR 43 2.465 -11.620 -2.956 335 HE1 TYR 43 2HE TYR 43 1.373 -16.333 -4.159 336 HE2 TYR 43 1HE TYR 43 1.512 -12.130 -5.150 337 HH TYR 43 HH TYR 43 0.996 -15.420 -6.405 338 H LEU 44 H LEU 44 2.584 -10.621 0.055 339 HA LEU 44 HA LEU 44 -0.193 -9.676 -0.502 340 HB2 LEU 44 1HB LEU 44 2.003 -8.715 1.302 341 HB3 LEU 44 2HB LEU 44 1.079 -7.510 0.431 342 HG LEU 44 HG LEU 44 -0.999 -8.165 1.404 343 HD11 LEU 44 1HD1 LEU 44 0.447 -10.534 2.619 344 HD12 LEU 44 2HD1 LEU 44 -0.942 -10.537 1.493 345 HD13 LEU 44 3HD1 LEU 44 -1.148 -9.948 3.146 346 HD21 LEU 44 3HD2 LEU 44 -0.559 -7.719 3.779 347 HD22 LEU 44 1HD2 LEU 44 0.471 -6.716 2.756 348 HD23 LEU 44 2HD2 LEU 44 1.162 -8.142 3.556 349 H ARG 45 H ARG 45 -0.386 -9.322 -2.551 350 HA ARG 45 HA ARG 45 1.856 -8.691 -4.309 351 HB2 ARG 45 1HB ARG 45 -0.372 -10.116 -4.654 352 HB3 ARG 45 2HB ARG 45 -1.052 -8.585 -5.172 353 HG2 ARG 45 1HG ARG 45 0.872 -8.385 -6.819 354 HG3 ARG 45 2HG ARG 45 1.383 -9.981 -6.307 355 HD2 ARG 45 1HD ARG 45 0.210 -10.471 -8.217 356 HD3 ARG 45 2HD ARG 45 -0.990 -10.802 -6.967 357 HE ARG 45 HE ARG 45 -1.866 -8.457 -7.454 358 HH11 ARG 45 1HH1 ARG 45 -0.787 -10.599 -10.012 359 HH12 ARG 45 2HH1 ARG 45 -0.974 -9.453 -11.303 360 HH21 ARG 45 1HH2 ARG 45 -2.617 -7.231 -9.076 361 HH22 ARG 45 2HH2 ARG 45 -2.241 -7.485 -10.747 362 H ALA 46 H ALA 46 2.638 -6.608 -3.716 363 HA ALA 46 HA ALA 46 0.695 -4.487 -3.087 364 HB1 ALA 46 1HB ALA 46 2.743 -3.329 -2.237 365 HB2 ALA 46 2HB ALA 46 2.599 -4.962 -1.572 366 HB3 ALA 46 3HB ALA 46 3.744 -4.630 -2.873 367 H TYR 47 H TYR 47 -0.002 -3.165 -4.791 368 HA TYR 47 HA TYR 47 1.970 -2.328 -6.849 369 HB2 TYR 47 1HB TYR 47 0.036 -3.971 -7.491 370 HB3 TYR 47 2HB TYR 47 -0.963 -2.549 -7.382 371 HD1 TYR 47 1HD TYR 47 0.043 -0.411 -8.624 372 HD2 TYR 47 2HD TYR 47 0.914 -4.467 -9.628 373 HE1 TYR 47 1HE TYR 47 0.759 0.329 -10.911 374 HE2 TYR 47 2HE TYR 47 1.518 -3.798 -11.940 375 HH TYR 47 HH TYR 47 1.307 -2.031 -13.463 376 H VAL 48 H VAL 48 2.479 -0.427 -5.855 377 HA VAL 48 HA VAL 48 0.430 1.647 -5.383 378 HB VAL 48 HB VAL 48 2.601 3.085 -5.398 379 HG11 VAL 48 1HG1 VAL 48 2.864 2.908 -3.041 380 HG12 VAL 48 2HG1 VAL 48 1.147 2.660 -3.397 381 HG13 VAL 48 3HG1 VAL 48 2.198 1.270 -3.025 382 HG21 VAL 48 3HG2 VAL 48 4.042 1.260 -6.166 383 HG22 VAL 48 1HG2 VAL 48 4.597 2.178 -4.743 384 HG23 VAL 48 2HG2 VAL 48 3.867 0.577 -4.515 385 H MET 49 H MET 49 0.153 3.364 -6.778 386 HA MET 49 HA MET 49 0.766 2.881 -9.662 387 HB2 MET 49 1HB MET 49 -1.866 3.665 -8.356 388 HB3 MET 49 2HB MET 49 -1.580 3.587 -10.094 389 HG2 MET 49 1HG MET 49 -0.990 1.215 -9.868 390 HG3 MET 49 2HG MET 49 -1.355 1.287 -8.135 391 HE1 MET 49 3HE MET 49 -3.076 -0.132 -7.507 392 HE2 MET 49 1HE MET 49 -4.382 -0.727 -8.554 393 HE3 MET 49 2HE MET 49 -2.680 -1.036 -8.984 394 HA PRO 50 HA PRO 50 1.855 7.036 -7.946 395 HB2 PRO 50 1HB PRO 50 4.349 7.370 -9.031 396 HB3 PRO 50 2HB PRO 50 4.036 6.327 -7.615 397 HG2 PRO 50 1HG PRO 50 4.276 5.449 -10.509 398 HG3 PRO 50 2HG PRO 50 5.105 4.774 -9.068 399 HD2 PRO 50 1HD PRO 50 2.812 3.648 -10.021 400 HD3 PRO 50 2HD PRO 50 3.124 3.789 -8.266 401 H ALA 51 H ALA 51 1.102 8.935 -8.861 402 HA ALA 51 HA ALA 51 0.714 9.121 -11.731 403 HB1 ALA 51 1HB ALA 51 -0.313 11.275 -11.211 404 HB2 ALA 51 2HB ALA 51 -0.925 10.018 -10.114 405 HB3 ALA 51 3HB ALA 51 0.273 11.185 -9.544 406 H ALA 52 H ALA 52 3.551 8.991 -10.556 407 HA ALA 52 HA ALA 52 4.730 11.002 -12.277 408 HB1 ALA 52 1HB ALA 52 5.403 10.902 -9.299 409 HB2 ALA 52 2HB ALA 52 6.307 11.801 -10.531 410 HB3 ALA 52 3HB ALA 52 4.632 12.256 -10.163 411 H THR 53 H THR 53 6.145 9.854 -13.446 412 HA THR 53 HA THR 53 7.595 7.520 -12.494 413 HB THR 53 HB THR 53 9.066 8.368 -14.559 414 HG1 THR 53 1HG THR 53 8.131 10.262 -15.029 415 HG21 THR 53 3HG2 THR 53 6.294 7.184 -14.923 416 HG22 THR 53 1HG2 THR 53 7.748 6.275 -14.469 417 HG23 THR 53 2HG2 THR 53 7.661 7.056 -16.054 418 H ILE 54 H ILE 54 10.040 7.634 -12.220 419 HA ILE 54 HA ILE 54 10.682 9.638 -10.247 420 HB ILE 54 HB ILE 54 12.521 7.777 -11.738 421 HG12 ILE 54 1HG1 ILE 54 11.319 7.228 -8.992 422 HG13 ILE 54 2HG1 ILE 54 10.657 6.557 -10.482 423 HG21 ILE 54 1HG2 ILE 54 14.090 8.067 -9.859 424 HG22 ILE 54 2HG2 ILE 54 13.748 9.588 -10.625 425 HG23 ILE 54 3HG2 ILE 54 12.945 9.209 -9.092 426 HD11 ILE 54 3HD1 ILE 54 12.031 4.885 -9.464 427 HD12 ILE 54 1HD1 ILE 54 12.828 5.435 -10.947 428 HD13 ILE 54 2HD1 ILE 54 13.419 5.977 -9.361 429 H SER 55 H SER 55 11.686 11.457 -10.508 430 HA SER 55 HA SER 55 13.628 12.024 -12.467 431 HB2 SER 55 1HB SER 55 11.537 12.659 -13.741 432 HB3 SER 55 2HB SER 55 11.259 13.891 -12.505 433 HG SER 55 HG SER 55 12.513 14.415 -14.566 434 H ARG 56 H ARG 56 13.916 14.688 -11.991 435 HA ARG 56 HA ARG 56 13.730 15.084 -9.068 436 HB2 ARG 56 1HB ARG 56 15.771 16.466 -9.069 437 HB3 ARG 56 2HB ARG 56 16.008 14.764 -9.422 438 HG2 ARG 56 1HG ARG 56 17.472 15.873 -10.867 439 HG3 ARG 56 2HG ARG 56 16.112 15.307 -11.845 440 HD2 ARG 56 1HD ARG 56 15.645 17.396 -12.540 441 HD3 ARG 56 2HD ARG 56 15.544 17.959 -10.858 442 HE ARG 56 HE ARG 56 18.272 17.767 -11.682 443 HH11 ARG 56 1HH1 ARG 56 15.352 19.760 -11.989 444 HH12 ARG 56 2HH1 ARG 56 16.210 21.268 -12.162 445 HH21 ARG 56 1HH2 ARG 56 19.450 19.825 -11.859 446 HH22 ARG 56 2HH2 ARG 56 18.542 21.286 -11.872 447 H ASP 57 H ASP 57 12.178 15.784 -11.631 448 HA ASP 57 HA ASP 57 11.156 17.369 -12.795 449 HB2 ASP 57 1HB ASP 57 10.808 18.489 -10.048 450 HB3 ASP 57 2HB ASP 57 10.199 19.362 -11.422 451 H ALA 58 H ALA 58 11.021 19.761 -13.277 452 HA ALA 58 HA ALA 58 13.435 21.325 -13.034 453 HB1 ALA 58 1HB ALA 58 14.362 21.105 -15.293 454 HB2 ALA 58 2HB ALA 58 14.309 19.512 -14.542 455 HB3 ALA 58 3HB ALA 58 13.083 19.951 -15.743 456 H ALA 59 H ALA 59 10.410 21.389 -13.258 457 HA ALA 59 HA ALA 59 10.224 24.089 -14.137 458 HB1 ALA 59 1HB ALA 59 9.530 22.913 -16.248 459 HB2 ALA 59 2HB ALA 59 8.298 22.025 -15.314 460 HB3 ALA 59 3HB ALA 59 8.181 23.785 -15.493 461 H GLY 60 H GLY 60 7.607 24.558 -13.462 462 HA2 GLY 60 2HA GLY 60 7.010 22.956 -11.017 463 HA3 GLY 60 1HA GLY 60 6.423 24.592 -11.335 464 H ASP 61 H ASP 61 4.635 22.802 -10.720 465 HA ASP 61 HA ASP 61 2.756 22.917 -12.822 466 HB2 ASP 61 1HB ASP 61 3.477 20.868 -13.703 467 HB3 ASP 61 2HB ASP 61 3.982 20.247 -12.154 468 H HIS 62 H HIS 62 0.854 23.192 -11.811 469 HA HIS 62 HA HIS 62 0.731 23.506 -8.992 470 HB2 HIS 62 1HB HIS 62 -0.666 24.443 -11.222 471 HB3 HIS 62 2HB HIS 62 -1.826 23.335 -10.523 472 HD1 HIS 62 1HD HIS 62 -2.039 26.613 -10.582 473 HD2 HIS 62 2HD HIS 62 -0.701 24.234 -7.362 474 HE1 HIS 62 1HE HIS 62 -2.367 27.989 -8.464 475 H ARG 63 H ARG 63 -1.860 22.525 -8.368 476 HA ARG 63 HA ARG 63 -2.801 20.721 -7.362 477 HB2 ARG 63 1HB ARG 63 -2.080 19.760 -10.052 478 HB3 ARG 63 2HB ARG 63 -2.028 18.453 -8.891 479 HG2 ARG 63 1HG ARG 63 -4.237 18.424 -9.654 480 HG3 ARG 63 2HG ARG 63 -4.312 19.199 -8.072 481 HD2 ARG 63 1HD ARG 63 -5.730 20.402 -9.696 482 HD3 ARG 63 2HD ARG 63 -4.374 21.446 -9.242 483 HE ARG 63 HE ARG 63 -3.301 20.320 -11.373 484 HH11 ARG 63 1HH1 ARG 63 -6.666 21.593 -11.200 485 HH12 ARG 63 2HH1 ARG 63 -6.710 21.801 -12.928 486 HH21 ARG 63 1HH2 ARG 63 -3.484 20.534 -13.514 487 HH22 ARG 63 2HH2 ARG 63 -4.970 20.899 -14.302 488 H GLN 64 H GLN 64 -2.028 18.160 -6.805 489 HA GLN 64 HA GLN 64 0.641 18.395 -5.632 490 HB2 GLN 64 1HB GLN 64 -1.929 17.659 -4.166 491 HB3 GLN 64 2HB GLN 64 -0.333 17.221 -3.546 492 HG2 GLN 64 1HG GLN 64 0.354 19.552 -3.419 493 HG3 GLN 64 2HG GLN 64 -1.082 20.090 -4.264 494 HE21 GLN 64 1HE2 GLN 64 -2.506 21.116 -3.018 495 HE22 GLN 64 2HE2 GLN 64 -2.675 20.860 -1.296 496 H TYR 65 H TYR 65 1.125 15.928 -4.801 497 HA TYR 65 HA TYR 65 1.187 14.349 -7.192 498 HB2 TYR 65 1HB TYR 65 2.173 14.212 -4.369 499 HB3 TYR 65 2HB TYR 65 1.724 12.679 -5.082 500 HD1 TYR 65 1HD TYR 65 3.427 15.467 -6.961 501 HD2 TYR 65 2HD TYR 65 3.725 11.572 -5.123 502 HE1 TYR 65 1HE TYR 65 5.655 15.131 -7.997 503 HE2 TYR 65 2HE TYR 65 5.895 11.235 -6.156 504 HH TYR 65 HH TYR 65 7.494 13.749 -8.179 505 H ARG 66 H ARG 66 0.366 11.951 -6.995 506 HA ARG 66 HA ARG 66 -1.976 11.510 -5.389 507 HB2 ARG 66 1HB ARG 66 -2.599 13.029 -7.491 508 HB3 ARG 66 2HB ARG 66 -2.465 11.516 -8.413 509 HG2 ARG 66 1HG ARG 66 -4.176 10.508 -6.954 510 HG3 ARG 66 2HG ARG 66 -4.030 11.909 -5.864 511 HD2 ARG 66 1HD ARG 66 -4.952 13.383 -7.601 512 HD3 ARG 66 2HD ARG 66 -5.058 12.027 -8.735 513 HE ARG 66 HE ARG 66 -6.489 12.319 -6.134 514 HH11 ARG 66 1HH1 ARG 66 -6.284 10.681 -9.288 515 HH12 ARG 66 2HH1 ARG 66 -7.704 9.736 -9.055 516 HH21 ARG 66 1HH2 ARG 66 -8.383 10.999 -5.844 517 HH22 ARG 66 2HH2 ARG 66 -8.945 9.982 -7.124 518 H GLY 67 H GLY 67 -2.825 9.228 -5.931 519 HA2 GLY 67 2HA GLY 67 -2.050 7.686 -8.044 520 HA3 GLY 67 1HA GLY 67 -0.805 7.372 -6.822 521 H VAL 68 H VAL 68 -1.940 5.197 -7.185 522 HA VAL 68 HA VAL 68 -3.994 4.870 -5.059 523 HB VAL 68 HB VAL 68 -3.799 3.046 -7.440 524 HG11 VAL 68 1HG1 VAL 68 -6.080 2.376 -6.901 525 HG12 VAL 68 2HG1 VAL 68 -5.032 2.097 -5.522 526 HG13 VAL 68 3HG1 VAL 68 -6.119 3.508 -5.539 527 HG21 VAL 68 3HG2 VAL 68 -4.366 5.125 -8.465 528 HG22 VAL 68 1HG2 VAL 68 -5.862 4.202 -8.335 529 HG23 VAL 68 2HG2 VAL 68 -5.546 5.518 -7.186 530 H PHE 69 H PHE 69 -3.815 2.832 -3.900 531 HA PHE 69 HA PHE 69 -1.325 1.341 -4.380 532 HB2 PHE 69 1HB PHE 69 -1.107 2.644 -2.201 533 HB3 PHE 69 2HB PHE 69 -2.560 1.829 -1.637 534 HD1 PHE 69 1HD PHE 69 0.067 0.093 -3.675 535 HD2 PHE 69 2HD PHE 69 -1.491 0.797 0.282 536 HE1 PHE 69 1HE PHE 69 1.530 -1.620 -2.833 537 HE2 PHE 69 2HE PHE 69 0.035 -0.921 1.150 538 HZ PHE 69 HZ PHE 69 1.575 -2.156 -0.432 539 H GLN 70 H GLN 70 -1.855 -0.814 -4.637 540 HA GLN 70 HA GLN 70 -4.498 -1.774 -3.735 541 HB2 GLN 70 1HB GLN 70 -4.389 -1.422 -6.216 542 HB3 GLN 70 2HB GLN 70 -3.001 -2.505 -6.312 543 HG2 GLN 70 1HG GLN 70 -4.315 -4.407 -5.802 544 HG3 GLN 70 2HG GLN 70 -5.610 -3.449 -5.085 545 HE21 GLN 70 1HE2 GLN 70 -7.390 -3.188 -6.314 546 HE22 GLN 70 2HE2 GLN 70 -7.459 -3.321 -8.044 547 H VAL 71 H VAL 71 -4.375 -3.735 -2.661 548 HA VAL 71 HA VAL 71 -1.894 -5.300 -2.834 549 HB VAL 71 HB VAL 71 -3.273 -4.585 -0.228 550 HG11 VAL 71 1HG1 VAL 71 -1.395 -5.844 0.837 551 HG12 VAL 71 2HG1 VAL 71 -2.387 -6.887 -0.138 552 HG13 VAL 71 3HG1 VAL 71 -0.817 -6.330 -0.781 553 HG21 VAL 71 3HG2 VAL 71 -1.918 -2.699 -0.929 554 HG22 VAL 71 1HG2 VAL 71 -1.152 -3.515 0.423 555 HG23 VAL 71 2HG2 VAL 71 -0.536 -3.776 -1.234 556 H ASN 72 H ASN 72 -2.343 -7.498 -2.458 557 HA ASN 72 HA ASN 72 -5.175 -8.356 -2.614 558 HB2 ASN 72 1HB ASN 72 -3.239 -8.189 -4.842 559 HB3 ASN 72 2HB ASN 72 -3.759 -9.832 -4.574 560 HD21 ASN 72 1HD2 ASN 72 -5.608 -6.685 -4.146 561 HD22 ASN 72 2HD2 ASN 72 -6.809 -7.102 -5.345 562 H VAL 73 H VAL 73 -5.248 -9.558 -0.871 563 HA VAL 73 HA VAL 73 -2.866 -10.678 0.364 564 HB VAL 73 HB VAL 73 -5.777 -10.876 1.267 565 HG11 VAL 73 1HG1 VAL 73 -4.864 -11.191 3.481 566 HG12 VAL 73 2HG1 VAL 73 -4.084 -12.361 2.421 567 HG13 VAL 73 3HG1 VAL 73 -3.199 -10.911 2.889 568 HG21 VAL 73 3HG2 VAL 73 -3.819 -8.668 1.950 569 HG22 VAL 73 1HG2 VAL 73 -5.303 -8.495 0.990 570 HG23 VAL 73 2HG2 VAL 73 -5.413 -8.942 2.692 571 H VAL 74 H VAL 74 -2.524 -12.156 -1.585 572 HA VAL 74 HA VAL 74 -4.626 -14.086 -2.188 573 HB VAL 74 HB VAL 74 -3.301 -13.384 -3.969 574 HG11 VAL 74 1HG1 VAL 74 -0.792 -14.298 -2.537 575 HG12 VAL 74 2HG1 VAL 74 -0.936 -13.696 -4.212 576 HG13 VAL 74 3HG1 VAL 74 -1.262 -12.613 -2.878 577 HG21 VAL 74 3HG2 VAL 74 -2.414 -16.215 -3.309 578 HG22 VAL 74 1HG2 VAL 74 -3.966 -15.726 -4.050 579 HG23 VAL 74 2HG2 VAL 74 -2.452 -15.460 -4.915 580 H MET 75 H MET 75 -4.990 -16.096 -1.284 581 HA MET 75 HA MET 75 -2.930 -17.226 0.502 582 HB2 MET 75 1HB MET 75 -4.288 -17.240 2.442 583 HB3 MET 75 2HB MET 75 -4.724 -15.717 1.703 584 HG2 MET 75 1HG MET 75 -6.636 -17.051 0.534 585 HG3 MET 75 2HG MET 75 -6.301 -18.277 1.759 586 HE1 MET 75 3HE MET 75 -9.036 -15.956 1.190 587 HE2 MET 75 1HE MET 75 -8.563 -14.423 1.953 588 HE3 MET 75 2HE MET 75 -7.559 -15.126 0.657 589 HA PRO 76 HA PRO 76 -4.283 -20.768 -1.750 590 HB2 PRO 76 1HB PRO 76 -3.271 -22.856 -0.344 591 HB3 PRO 76 2HB PRO 76 -2.210 -21.582 -1.034 592 HG2 PRO 76 1HG PRO 76 -3.228 -21.791 1.813 593 HG3 PRO 76 2HG PRO 76 -1.548 -21.521 1.254 594 HD2 PRO 76 1HD PRO 76 -3.229 -19.454 1.962 595 HD3 PRO 76 2HD PRO 76 -1.985 -19.293 0.686 596 H ILE 77 H ILE 77 -5.853 -22.444 -1.933 597 HA ILE 77 HA ILE 77 -7.882 -22.572 0.203 598 HB ILE 77 HB ILE 77 -7.915 -23.870 -2.548 599 HG12 ILE 77 1HG1 ILE 77 -9.175 -21.314 -1.493 600 HG13 ILE 77 2HG1 ILE 77 -7.865 -21.369 -2.644 601 HG21 ILE 77 1HG2 ILE 77 -9.363 -24.975 -0.805 602 HG22 ILE 77 2HG2 ILE 77 -10.122 -23.405 -0.458 603 HG23 ILE 77 3HG2 ILE 77 -10.328 -24.189 -2.036 604 HD11 ILE 77 3HD1 ILE 77 -9.898 -20.835 -3.786 605 HD12 ILE 77 1HD1 ILE 77 -9.359 -22.447 -4.307 606 HD13 ILE 77 2HD1 ILE 77 -10.716 -22.266 -3.160 607 H GLY 78 H GLY 78 -6.860 -23.660 1.834 608 HA2 GLY 78 2HA GLY 78 -6.540 -26.601 1.393 609 HA3 GLY 78 1HA GLY 78 -5.491 -25.708 2.511 610 H ASP 79 H ASP 79 -6.369 -24.963 4.546 611 HA ASP 79 HA ASP 79 -9.146 -25.235 5.152 612 HB2 ASP 79 1HB ASP 79 -8.042 -27.259 6.071 613 HB3 ASP 79 2HB ASP 79 -6.811 -26.249 6.845 614 H GLY 80 H GLY 80 -9.629 -23.545 6.216 615 HA2 GLY 80 2HA GLY 80 -9.591 -21.495 7.384 616 HA3 GLY 80 1HA GLY 80 -7.889 -21.808 7.748 617 H SER 81 H SER 81 -9.322 -21.579 4.467 618 HA SER 81 HA SER 81 -7.518 -19.505 3.562 619 HB2 SER 81 1HB SER 81 -8.825 -19.725 1.513 620 HB3 SER 81 2HB SER 81 -8.287 -21.310 2.108 621 HG SER 81 HG SER 81 -10.369 -21.880 2.259 622 H ARG 82 H ARG 82 -9.066 -18.707 5.855 623 HA ARG 82 HA ARG 82 -11.103 -16.791 4.810 624 HB2 ARG 82 1HB ARG 82 -11.197 -18.216 7.466 625 HB3 ARG 82 2HB ARG 82 -12.440 -17.247 6.695 626 HG2 ARG 82 1HG ARG 82 -11.465 -20.011 5.920 627 HG3 ARG 82 2HG ARG 82 -13.064 -19.572 6.477 628 HD2 ARG 82 1HD ARG 82 -12.110 -18.382 3.870 629 HD3 ARG 82 2HD ARG 82 -12.498 -20.078 3.899 630 HE ARG 82 HE ARG 82 -14.245 -17.778 4.021 631 HH11 ARG 82 1HH1 ARG 82 -14.044 -21.272 4.577 632 HH12 ARG 82 2HH1 ARG 82 -15.652 -21.618 4.036 633 HH21 ARG 82 1HH2 ARG 82 -16.327 -18.240 3.186 634 HH22 ARG 82 2HH2 ARG 82 -16.892 -19.876 3.071 635 H SER 83 H SER 83 -8.206 -16.430 5.173 636 HA SER 83 HA SER 83 -7.818 -14.910 7.639 637 HB2 SER 83 1HB SER 83 -6.128 -15.680 5.251 638 HB3 SER 83 2HB SER 83 -5.544 -14.479 6.380 639 HG SER 83 HG SER 83 -4.976 -16.655 6.902 640 H ALA 84 H ALA 84 -9.149 -14.027 4.554 641 HA ALA 84 HA ALA 84 -8.166 -11.539 4.066 642 HB1 ALA 84 1HB ALA 84 -10.454 -11.070 3.111 643 HB2 ALA 84 2HB ALA 84 -9.801 -12.657 2.639 644 HB3 ALA 84 3HB ALA 84 -11.056 -12.531 3.895 645 H GLU 85 H GLU 85 -11.012 -12.161 6.285 646 HA GLU 85 HA GLU 85 -11.377 -9.479 7.011 647 HB2 GLU 85 1HB GLU 85 -11.927 -12.073 8.519 648 HB3 GLU 85 2HB GLU 85 -12.394 -10.472 9.091 649 HG2 GLU 85 1HG GLU 85 -13.331 -10.512 6.438 650 HG3 GLU 85 2HG GLU 85 -13.613 -12.143 7.040 651 H GLN 86 H GLN 86 -9.362 -12.015 8.646 652 HA GLN 86 HA GLN 86 -8.459 -10.505 10.751 653 HB2 GLN 86 1HB GLN 86 -8.111 -13.054 9.600 654 HB3 GLN 86 2HB GLN 86 -6.494 -12.398 9.565 655 HG2 GLN 86 1HG GLN 86 -8.125 -12.155 12.112 656 HG3 GLN 86 2HG GLN 86 -7.552 -13.726 11.578 657 HE21 GLN 86 1HE2 GLN 86 -5.099 -13.923 11.178 658 HE22 GLN 86 2HE2 GLN 86 -4.050 -12.916 12.147 659 H VAL 87 H VAL 87 -6.836 -10.916 7.565 660 HA VAL 87 HA VAL 87 -4.661 -9.142 8.245 661 HB VAL 87 HB VAL 87 -5.696 -10.297 5.597 662 HG11 VAL 87 1HG1 VAL 87 -3.237 -8.650 6.192 663 HG12 VAL 87 2HG1 VAL 87 -3.226 -9.833 4.875 664 HG13 VAL 87 3HG1 VAL 87 -4.410 -8.528 4.851 665 HG21 VAL 87 3HG2 VAL 87 -3.802 -11.876 5.798 666 HG22 VAL 87 1HG2 VAL 87 -3.402 -11.193 7.385 667 HG23 VAL 87 2HG2 VAL 87 -4.931 -12.052 7.137 668 H ALA 88 H ALA 88 -7.785 -8.590 6.498 669 HA ALA 88 HA ALA 88 -7.205 -5.841 5.920 670 HB1 ALA 88 1HB ALA 88 -9.870 -7.185 6.552 671 HB2 ALA 88 2HB ALA 88 -9.644 -5.588 5.814 672 HB3 ALA 88 3HB ALA 88 -9.139 -7.051 4.935 673 H ALA 89 H ALA 89 -8.405 -7.534 8.883 674 HA ALA 89 HA ALA 89 -9.161 -5.084 10.125 675 HB1 ALA 89 1HB ALA 89 -10.060 -7.352 10.728 676 HB2 ALA 89 2HB ALA 89 -8.502 -7.691 11.529 677 HB3 ALA 89 3HB ALA 89 -9.557 -6.355 12.083 678 H GLU 90 H GLU 90 -6.193 -7.042 10.206 679 HA GLU 90 HA GLU 90 -4.765 -5.382 12.068 680 HB2 GLU 90 1HB GLU 90 -3.825 -7.207 9.779 681 HB3 GLU 90 2HB GLU 90 -2.751 -6.377 10.921 682 HG2 GLU 90 1HG GLU 90 -4.374 -7.716 12.651 683 HG3 GLU 90 2HG GLU 90 -4.525 -8.760 11.271 684 H LEU 91 H LEU 91 -4.715 -5.469 8.493 685 HA LEU 91 HA LEU 91 -2.830 -3.393 8.173 686 HB2 LEU 91 1HB LEU 91 -4.982 -4.550 6.380 687 HB3 LEU 91 2HB LEU 91 -3.952 -3.243 5.817 688 HG LEU 91 HG LEU 91 -2.709 -5.762 6.979 689 HD11 LEU 91 1HD1 LEU 91 -4.261 -6.410 5.193 690 HD12 LEU 91 2HD1 LEU 91 -2.573 -6.691 4.745 691 HD13 LEU 91 3HD1 LEU 91 -3.444 -5.286 4.080 692 HD21 LEU 91 3HD2 LEU 91 -1.169 -3.895 6.706 693 HD22 LEU 91 1HD2 LEU 91 -1.789 -3.576 5.062 694 HD23 LEU 91 2HD2 LEU 91 -0.856 -5.042 5.398 695 H ASP 92 H ASP 92 -6.429 -3.260 8.005 696 HA ASP 92 HA ASP 92 -6.504 -0.548 7.328 697 HB2 ASP 92 1HB ASP 92 -8.654 -2.292 8.579 698 HB3 ASP 92 2HB ASP 92 -8.914 -0.732 7.808 699 H ALA 93 H ALA 93 -6.126 -2.106 10.486 700 HA ALA 93 HA ALA 93 -6.757 0.287 12.037 701 HB1 ALA 93 1HB ALA 93 -5.558 -0.874 13.851 702 HB2 ALA 93 2HB ALA 93 -6.773 -1.934 13.106 703 HB3 ALA 93 3HB ALA 93 -5.053 -2.148 12.727 704 H LEU 94 H LEU 94 -3.822 -1.245 10.725 705 HA LEU 94 HA LEU 94 -1.995 0.757 11.560 706 HB2 LEU 94 1HB LEU 94 -1.378 -1.518 10.852 707 HB3 LEU 94 2HB LEU 94 -1.936 -1.181 9.224 708 HG LEU 94 HG LEU 94 -0.144 0.635 9.045 709 HD11 LEU 94 1HD1 LEU 94 0.302 0.959 11.464 710 HD12 LEU 94 2HD1 LEU 94 1.771 0.408 10.624 711 HD13 LEU 94 3HD1 LEU 94 0.821 -0.728 11.599 712 HD21 LEU 94 3HD2 LEU 94 0.057 -1.469 7.953 713 HD22 LEU 94 1HD2 LEU 94 0.470 -2.269 9.444 714 HD23 LEU 94 2HD2 LEU 94 1.625 -1.119 8.707 715 H PHE 95 H PHE 95 -4.087 0.587 8.720 716 HA PHE 95 HA PHE 95 -2.940 3.109 7.625 717 HB2 PHE 95 1HB PHE 95 -4.199 0.737 6.233 718 HB3 PHE 95 2HB PHE 95 -3.781 2.247 5.456 719 HD1 PHE 95 2HD PHE 95 -1.258 3.082 5.916 720 HD2 PHE 95 1HD PHE 95 -2.570 -1.016 6.139 721 HE1 PHE 95 2HE PHE 95 0.973 2.333 5.174 722 HE2 PHE 95 1HE PHE 95 -0.283 -1.760 5.551 723 HZ PHE 95 HZ PHE 95 1.484 -0.070 5.023 724 HA PRO 96 HA PRO 96 -7.289 4.162 8.825 725 HB2 PRO 96 1HB PRO 96 -6.792 6.381 10.302 726 HB3 PRO 96 2HB PRO 96 -6.447 4.757 10.981 727 HG2 PRO 96 1HG PRO 96 -4.493 6.606 9.533 728 HG3 PRO 96 2HG PRO 96 -4.277 5.874 11.144 729 HD2 PRO 96 1HD PRO 96 -3.234 4.716 8.987 730 HD3 PRO 96 2HD PRO 96 -3.980 3.737 10.298 731 H VAL 97 H VAL 97 -8.417 6.266 8.314 732 HA VAL 97 HA VAL 97 -7.952 7.346 5.798 733 HB VAL 97 HB VAL 97 -10.032 7.130 7.250 734 HG11 VAL 97 1HG1 VAL 97 -9.216 9.873 8.290 735 HG12 VAL 97 2HG1 VAL 97 -10.711 8.998 8.628 736 HG13 VAL 97 3HG1 VAL 97 -9.182 8.364 9.241 737 HG21 VAL 97 3HG2 VAL 97 -11.245 8.855 6.117 738 HG22 VAL 97 1HG2 VAL 97 -9.751 9.753 5.756 739 HG23 VAL 97 2HG2 VAL 97 -10.045 8.165 5.026 740 H ASN 98 H ASN 98 -5.824 7.916 8.134 741 HA ASN 98 HA ASN 98 -5.303 10.779 7.399 742 HB2 ASN 98 1HB ASN 98 -4.404 9.145 9.821 743 HB3 ASN 98 2HB ASN 98 -3.603 10.610 9.272 744 HD21 ASN 98 1HD2 ASN 98 -7.131 9.776 9.762 745 HD22 ASN 98 2HD2 ASN 98 -7.383 11.213 10.725 746 H LEU 99 H LEU 99 -3.654 7.640 7.973 747 HA LEU 99 HA LEU 99 -1.814 6.679 7.091 748 HB2 LEU 99 1HB LEU 99 -3.572 6.973 5.244 749 HB3 LEU 99 2HB LEU 99 -2.466 8.183 4.573 750 HG LEU 99 HG LEU 99 -0.830 5.999 4.892 751 HD11 LEU 99 1HD1 LEU 99 -2.010 4.039 4.017 752 HD12 LEU 99 2HD1 LEU 99 -3.527 4.936 3.932 753 HD13 LEU 99 3HD1 LEU 99 -2.809 4.609 5.508 754 HD21 LEU 99 3HD2 LEU 99 -0.916 7.406 2.876 755 HD22 LEU 99 1HD2 LEU 99 -2.390 6.589 2.340 756 HD23 LEU 99 2HD2 LEU 99 -0.910 5.676 2.482 757 H VAL 100 H VAL 100 -1.177 9.128 8.523 758 HA VAL 100 HA VAL 100 0.531 10.784 6.936 759 HB VAL 100 HB VAL 100 0.716 10.527 9.956 760 HG11 VAL 100 1HG1 VAL 100 1.403 12.876 9.822 761 HG12 VAL 100 2HG1 VAL 100 2.437 11.897 8.793 762 HG13 VAL 100 3HG1 VAL 100 1.158 12.885 8.056 763 HG21 VAL 100 3HG2 VAL 100 -1.369 12.020 8.324 764 HG22 VAL 100 1HG2 VAL 100 -1.580 10.849 9.661 765 HG23 VAL 100 2HG2 VAL 100 -0.950 12.446 10.001 766 H MET 101 H MET 101 2.415 10.165 6.102 767 HA MET 101 HA MET 101 4.349 8.721 7.837 768 HB2 MET 101 1HB MET 101 4.401 8.286 4.846 769 HB3 MET 101 2HB MET 101 5.122 7.345 6.120 770 HG2 MET 101 1HG MET 101 2.844 6.585 6.829 771 HG3 MET 101 2HG MET 101 2.150 7.614 5.587 772 HE1 MET 101 3HE MET 101 2.114 6.541 2.592 773 HE2 MET 101 1HE MET 101 1.041 5.329 3.278 774 HE3 MET 101 2HE MET 101 1.087 6.980 3.956 775 H GLN 102 H GLN 102 5.319 10.624 8.470 776 HA GLN 102 HA GLN 102 6.090 12.802 6.710 777 HB2 GLN 102 1HB GLN 102 6.819 12.041 9.573 778 HB3 GLN 102 2HB GLN 102 7.408 13.503 8.764 779 HG2 GLN 102 1HG GLN 102 5.152 14.351 8.482 780 HG3 GLN 102 2HG GLN 102 4.454 12.874 9.141 781 HE21 GLN 102 1HE2 GLN 102 4.062 15.567 10.093 782 HE22 GLN 102 2HE2 GLN 102 4.744 15.779 11.667 783 H SER 103 H SER 103 7.196 11.672 5.046 784 HA SER 103 HA SER 103 9.520 10.043 5.695 785 HB2 SER 103 1HB SER 103 9.223 10.544 2.873 786 HB3 SER 103 2HB SER 103 8.974 9.066 3.794 787 HG SER 103 HG SER 103 7.121 11.120 3.132 788 H GLY 104 H GLY 104 11.480 10.313 4.198 789 HA2 GLY 104 2HA GLY 104 13.045 12.546 4.591 790 HA3 GLY 104 1HA GLY 104 13.275 11.332 3.384 791 H GLY 105 H GLY 105 10.329 12.923 2.731 792 HA2 GLY 105 2HA GLY 105 11.519 14.684 0.653 793 HA3 GLY 105 1HA GLY 105 10.287 13.407 0.307 794 H LEU 106 H LEU 106 8.328 13.388 1.543 795 HA LEU 106 HA LEU 106 7.544 15.777 2.911 796 HB2 LEU 106 1HB LEU 106 5.748 16.434 1.481 797 HB3 LEU 106 2HB LEU 106 7.240 16.458 0.555 798 HG LEU 106 HG LEU 106 5.046 14.372 0.375 799 HD11 LEU 106 1HD1 LEU 106 5.993 16.474 -1.625 800 HD12 LEU 106 2HD1 LEU 106 4.563 16.643 -0.600 801 HD13 LEU 106 3HD1 LEU 106 4.619 15.369 -1.822 802 HD21 LEU 106 3HD2 LEU 106 6.256 13.617 -1.686 803 HD22 LEU 106 1HD2 LEU 106 7.059 13.199 -0.177 804 HD23 LEU 106 2HD2 LEU 106 7.658 14.558 -1.162 805 H ALA 107 H ALA 107 5.235 15.541 3.571 806 HA ALA 107 HA ALA 107 4.756 12.907 4.714 807 HB1 ALA 107 1HB ALA 107 3.166 15.500 4.830 808 HB2 ALA 107 2HB ALA 107 2.763 14.033 5.749 809 HB3 ALA 107 3HB ALA 107 4.290 14.884 6.049 810 H VAL 108 H VAL 108 2.748 11.553 4.274 811 HA VAL 108 HA VAL 108 1.381 12.248 1.741 812 HB VAL 108 HB VAL 108 2.844 10.448 1.329 813 HG11 VAL 108 1HG1 VAL 108 1.861 9.050 3.808 814 HG12 VAL 108 2HG1 VAL 108 3.017 8.410 2.587 815 HG13 VAL 108 3HG1 VAL 108 3.461 9.784 3.541 816 HG21 VAL 108 3HG2 VAL 108 0.667 10.048 0.313 817 HG22 VAL 108 1HG2 VAL 108 1.462 8.553 0.751 818 HG23 VAL 108 2HG2 VAL 108 0.141 9.152 1.765 819 H ARG 109 H ARG 109 -0.912 11.461 1.658 820 HA ARG 109 HA ARG 109 -2.178 10.932 4.209 821 HB2 ARG 109 1HB ARG 109 -2.249 13.356 4.115 822 HB3 ARG 109 2HB ARG 109 -2.895 13.354 2.472 823 HG2 ARG 109 1HG ARG 109 -4.547 11.878 4.441 824 HG3 ARG 109 2HG ARG 109 -4.279 13.550 4.895 825 HD2 ARG 109 1HD ARG 109 -5.342 12.772 2.173 826 HD3 ARG 109 2HD ARG 109 -6.386 13.043 3.580 827 HE ARG 109 HE ARG 109 -4.609 15.080 2.299 828 HH11 ARG 109 1HH1 ARG 109 -7.811 14.519 3.971 829 HH12 ARG 109 2HH1 ARG 109 -8.387 16.032 3.417 830 HH21 ARG 109 1HH2 ARG 109 -5.427 17.042 1.790 831 HH22 ARG 109 2HH2 ARG 109 -7.012 17.530 2.277 832 H VAL 110 H VAL 110 -3.639 9.299 3.796 833 HA VAL 110 HA VAL 110 -3.931 8.189 1.246 834 HB VAL 110 HB VAL 110 -4.204 6.932 3.240 835 HG11 VAL 110 1HG1 VAL 110 -6.183 7.029 4.631 836 HG12 VAL 110 2HG1 VAL 110 -5.255 8.536 4.715 837 HG13 VAL 110 3HG1 VAL 110 -6.745 8.473 3.763 838 HG21 VAL 110 3HG2 VAL 110 -6.025 5.510 2.668 839 HG22 VAL 110 1HG2 VAL 110 -6.783 6.779 1.695 840 HG23 VAL 110 2HG2 VAL 110 -5.250 6.131 1.181 841 H ARG 111 H ARG 111 -5.890 10.701 2.708 842 HA ARG 111 HA ARG 111 -7.533 12.026 1.919 843 HB2 ARG 111 1HB ARG 111 -6.211 11.372 -0.451 844 HB3 ARG 111 2HB ARG 111 -7.874 10.916 -0.799 845 HG2 ARG 111 1HG ARG 111 -6.953 13.621 0.280 846 HG3 ARG 111 2HG ARG 111 -7.246 13.239 -1.417 847 HD2 ARG 111 1HD ARG 111 -9.591 12.788 -1.001 848 HD3 ARG 111 2HD ARG 111 -9.376 13.053 0.744 849 HE ARG 111 HE ARG 111 -8.403 15.346 -0.496 850 HH11 ARG 111 1HH1 ARG 111 -11.378 13.676 -1.114 851 HH12 ARG 111 2HH1 ARG 111 -12.416 15.018 -1.146 852 HH21 ARG 111 1HH2 ARG 111 -9.627 17.246 -0.419 853 HH22 ARG 111 2HH2 ARG 111 -11.256 17.211 -0.992 854 H THR 112 H THR 112 -7.997 8.591 0.849 855 HA THR 112 HA THR 112 -10.850 8.840 1.566 856 HB THR 112 HB THR 112 -11.020 6.792 0.155 857 HG1 THR 112 1HG THR 112 -9.403 5.910 -0.688 858 HG21 THR 112 3HG2 THR 112 -10.793 7.916 -2.000 859 HG22 THR 112 1HG2 THR 112 -9.742 9.152 -1.279 860 HG23 THR 112 2HG2 THR 112 -11.459 9.035 -0.799 861 HA PRO 113 HA PRO 113 -10.056 5.607 4.678 862 HB2 PRO 113 1HB PRO 113 -12.324 4.079 4.530 863 HB3 PRO 113 2HB PRO 113 -12.287 5.698 5.295 864 HG2 PRO 113 1HG PRO 113 -13.195 4.952 2.502 865 HG3 PRO 113 2HG PRO 113 -13.997 6.028 3.698 866 HD2 PRO 113 1HD PRO 113 -12.465 6.995 1.674 867 HD3 PRO 113 2HD PRO 113 -12.559 7.789 3.273 868 H ILE 114 H ILE 114 -10.001 3.098 4.662 869 HA ILE 114 HA ILE 114 -8.742 1.983 2.320 870 HB ILE 114 HB ILE 114 -10.266 0.573 4.564 871 HG12 ILE 114 1HG1 ILE 114 -8.451 1.911 5.541 872 HG13 ILE 114 2HG1 ILE 114 -8.217 0.191 5.702 873 HG21 ILE 114 1HG2 ILE 114 -10.057 -1.030 2.866 874 HG22 ILE 114 2HG2 ILE 114 -8.438 -0.487 2.387 875 HG23 ILE 114 3HG2 ILE 114 -8.699 -1.358 3.906 876 HD11 ILE 114 3HD1 ILE 114 -6.117 0.813 5.120 877 HD12 ILE 114 1HD1 ILE 114 -6.744 0.447 3.512 878 HD13 ILE 114 2HD1 ILE 114 -6.669 2.137 4.051 879 H SER 115 H SER 115 -9.669 0.749 0.642 880 HA SER 115 HA SER 115 -12.641 0.389 0.761 881 HB2 SER 115 1HB SER 115 -11.380 -0.033 -1.821 882 HB3 SER 115 2HB SER 115 -12.943 0.660 -1.446 883 HG SER 115 HG SER 115 -10.744 1.866 -2.203 884 H ASN 116 H ASN 116 -13.439 -1.595 0.062 885 HA ASN 116 HA ASN 116 -11.852 -4.014 0.249 886 HB2 ASN 116 1HB ASN 116 -12.756 -3.434 2.423 887 HB3 ASN 116 2HB ASN 116 -14.228 -2.781 1.744 888 HD21 ASN 116 1HD2 ASN 116 -12.420 -5.671 2.320 889 HD22 ASN 116 2HD2 ASN 116 -13.805 -6.773 2.153 890 H GLY 117 H GLY 117 -13.271 -5.818 -0.723 891 HA2 GLY 117 2HA GLY 117 -15.866 -5.185 -1.704 892 HA3 GLY 117 1HA GLY 117 -14.731 -5.467 -3.046 893 H GLN 118 H GLN 118 -16.618 -7.339 -3.038 894 HA GLN 118 HA GLN 118 -16.162 -9.601 -1.386 895 HB2 GLN 118 1HB GLN 118 -17.600 -8.937 -3.903 896 HB3 GLN 118 2HB GLN 118 -16.921 -10.541 -3.891 897 HG2 GLN 118 1HG GLN 118 -18.049 -10.895 -1.614 898 HG3 GLN 118 2HG GLN 118 -18.891 -9.374 -1.923 899 HE21 GLN 118 1HE2 GLN 118 -20.948 -10.309 -2.010 900 HE22 GLN 118 2HE2 GLN 118 -21.494 -11.330 -3.323 901 HA PRO 119 HA PRO 119 -12.289 -10.898 -3.206 902 HB2 PRO 119 1HB PRO 119 -12.264 -13.573 -2.611 903 HB3 PRO 119 2HB PRO 119 -12.078 -12.321 -1.364 904 HG2 PRO 119 1HG PRO 119 -14.583 -13.835 -2.124 905 HG3 PRO 119 2HG PRO 119 -13.971 -13.465 -0.487 906 HD2 PRO 119 1HD PRO 119 -15.922 -12.006 -1.793 907 HD3 PRO 119 2HD PRO 119 -14.840 -11.269 -0.585 908 H THR 120 H THR 120 -11.429 -12.089 -4.954 909 HA THR 120 HA THR 120 -13.389 -13.478 -6.713 910 HB THR 120 HB THR 120 -10.880 -11.990 -7.542 911 HG1 THR 120 1HG THR 120 -12.682 -10.833 -8.736 912 HG21 THR 120 3HG2 THR 120 -13.015 -13.394 -9.206 913 HG22 THR 120 1HG2 THR 120 -11.329 -13.926 -8.983 914 HG23 THR 120 2HG2 THR 120 -11.664 -12.433 -9.841 915 H THR 121 H THR 121 -12.971 -15.629 -6.817 916 HA THR 121 HA THR 121 -10.817 -16.822 -5.298 917 HB THR 121 HB THR 121 -12.514 -18.167 -7.400 918 HG1 THR 121 1HG THR 121 -14.253 -18.078 -6.337 919 HG21 THR 121 3HG2 THR 121 -11.018 -19.673 -6.258 920 HG22 THR 121 1HG2 THR 121 -12.632 -19.985 -5.614 921 HG23 THR 121 2HG2 THR 121 -11.469 -19.037 -4.673 922 H GLY 122 H GLY 122 -9.175 -18.257 -6.378 923 HA2 GLY 122 2HA GLY 122 -8.625 -17.725 -9.235 924 HA3 GLY 122 1HA GLY 122 -7.335 -17.646 -8.033 925 H ASP 123 H ASP 123 -6.401 -19.404 -9.227 926 HA ASP 123 HA ASP 123 -7.755 -21.718 -10.105 927 HB2 ASP 123 1HB ASP 123 -5.413 -20.656 -10.678 928 HB3 ASP 123 2HB ASP 123 -4.810 -21.735 -9.433 929 H ALA 124 H ALA 124 -5.768 -21.166 -7.216 930 HA ALA 124 HA ALA 124 -7.212 -23.223 -5.709 931 HB1 ALA 124 1HB ALA 124 -5.189 -24.389 -4.983 932 HB2 ALA 124 2HB ALA 124 -5.318 -24.492 -6.742 933 HB3 ALA 124 3HB ALA 124 -4.172 -23.340 -5.993 934 H ASP 125 H ASP 125 -6.967 -20.223 -5.809 935 HA ASP 125 HA ASP 125 -6.030 -19.721 -3.103 936 HB2 ASP 125 1HB ASP 125 -5.223 -17.589 -3.959 937 HB3 ASP 125 2HB ASP 125 -4.282 -18.931 -4.574 938 H HIS 126 H HIS 126 -6.926 -17.681 -2.340 939 HA HIS 126 HA HIS 126 -9.274 -16.613 -3.794 940 HB2 HIS 126 1HB HIS 126 -9.060 -16.896 -0.782 941 HB3 HIS 126 2HB HIS 126 -10.232 -15.873 -1.593 942 HD1 HIS 126 1HD HIS 126 -12.363 -17.084 -2.700 943 HD2 HIS 126 2HD HIS 126 -9.651 -19.426 -0.487 944 HE1 HIS 126 1HE HIS 126 -13.505 -19.310 -2.297 945 H THR 127 H THR 127 -9.323 -14.271 -3.651 946 HA THR 127 HA THR 127 -7.312 -12.937 -1.988 947 HB THR 127 HB THR 127 -7.566 -12.225 -4.935 948 HG1 THR 127 1HG THR 127 -6.659 -14.393 -4.753 949 HG21 THR 127 3HG2 THR 127 -6.547 -10.565 -3.435 950 HG22 THR 127 1HG2 THR 127 -5.321 -11.290 -4.507 951 HG23 THR 127 2HG2 THR 127 -5.420 -11.801 -2.819 952 H VAL 128 H VAL 128 -8.292 -11.385 -0.917 953 HA VAL 128 HA VAL 128 -10.756 -10.217 -1.997 954 HB VAL 128 HB VAL 128 -10.238 -8.625 0.035 955 HG11 VAL 128 1HG1 VAL 128 -12.253 -10.043 -0.274 956 HG12 VAL 128 2HG1 VAL 128 -11.378 -11.381 0.527 957 HG13 VAL 128 3HG1 VAL 128 -11.730 -9.881 1.404 958 HG21 VAL 128 3HG2 VAL 128 -9.246 -9.513 1.932 959 HG22 VAL 128 1HG2 VAL 128 -9.069 -11.112 1.196 960 HG23 VAL 128 2HG2 VAL 128 -8.067 -9.746 0.625 961 HA PRO 129 HA PRO 129 -8.525 -6.709 -3.820 962 HB2 PRO 129 1HB PRO 129 -10.689 -5.142 -4.345 963 HB3 PRO 129 2HB PRO 129 -10.384 -6.654 -5.236 964 HG2 PRO 129 1HG PRO 129 -12.282 -6.231 -2.952 965 HG3 PRO 129 2HG PRO 129 -12.568 -7.078 -4.500 966 HD2 PRO 129 1HD PRO 129 -11.893 -8.348 -2.171 967 HD3 PRO 129 2HD PRO 129 -11.406 -8.967 -3.775 968 H ILE 130 H ILE 130 -7.315 -5.443 -2.298 969 HA ILE 130 HA ILE 130 -8.944 -3.651 -0.597 970 HB ILE 130 HB ILE 130 -6.329 -4.859 0.336 971 HG12 ILE 130 1HG1 ILE 130 -9.207 -5.583 1.064 972 HG13 ILE 130 2HG1 ILE 130 -8.035 -6.623 0.271 973 HG21 ILE 130 1HG2 ILE 130 -6.931 -2.570 1.194 974 HG22 ILE 130 2HG2 ILE 130 -8.486 -3.221 1.774 975 HG23 ILE 130 3HG2 ILE 130 -6.954 -3.774 2.473 976 HD11 ILE 130 3HD1 ILE 130 -7.902 -5.696 3.158 977 HD12 ILE 130 1HD1 ILE 130 -8.290 -7.312 2.561 978 HD13 ILE 130 2HD1 ILE 130 -6.655 -6.666 2.352 979 H SER 131 H SER 131 -8.398 -1.520 -0.864 980 HA SER 131 HA SER 131 -5.843 -0.716 -1.886 981 HB2 SER 131 1HB SER 131 -6.741 0.309 -4.041 982 HB3 SER 131 2HB SER 131 -6.545 -1.439 -4.036 983 HG SER 131 HG SER 131 -8.628 -1.746 -4.091 984 H LEU 132 H LEU 132 -5.961 1.721 -2.585 985 HA LEU 132 HA LEU 132 -7.969 3.420 -1.469 986 HB2 LEU 132 1HB LEU 132 -6.422 4.486 0.218 987 HB3 LEU 132 2HB LEU 132 -7.098 2.940 0.643 988 HG LEU 132 HG LEU 132 -4.775 1.963 -0.255 989 HD11 LEU 132 1HD1 LEU 132 -3.812 4.700 0.650 990 HD12 LEU 132 2HD1 LEU 132 -3.814 4.142 -1.033 991 HD13 LEU 132 3HD1 LEU 132 -2.846 3.305 0.180 992 HD21 LEU 132 3HD2 LEU 132 -5.162 3.319 2.421 993 HD22 LEU 132 1HD2 LEU 132 -3.951 2.075 2.048 994 HD23 LEU 132 2HD2 LEU 132 -5.680 1.692 1.927 995 H GLY 133 H GLY 133 -7.305 5.780 -1.881 996 HA2 GLY 133 2HA GLY 133 -5.315 5.913 -4.105 997 HA3 GLY 133 1HA GLY 133 -6.926 6.533 -4.245 998 H TYR 134 H TYR 134 -3.817 6.999 -3.014 999 HA TYR 134 HA TYR 134 -4.339 9.199 -1.159 1000 HB2 TYR 134 1HB TYR 134 -1.821 9.306 -1.036 1001 HB3 TYR 134 2HB TYR 134 -2.514 7.802 -0.504 1002 HD1 TYR 134 2HD TYR 134 -0.682 9.426 -3.361 1003 HD2 TYR 134 1HD TYR 134 -2.018 5.729 -1.562 1004 HE1 TYR 134 2HE TYR 134 0.616 8.144 -5.022 1005 HE2 TYR 134 1HE TYR 134 -0.687 4.464 -3.210 1006 HH TYR 134 HH TYR 134 0.114 4.675 -5.340 1007 H ASP 135 H ASP 135 -3.602 11.229 -1.354 1008 HA ASP 135 HA ASP 135 -3.124 12.443 -4.062 1009 HB2 ASP 135 1HB ASP 135 -4.785 13.054 -1.742 1010 HB3 ASP 135 2HB ASP 135 -3.944 14.416 -2.441 1011 H VAL 136 H VAL 136 -1.748 11.607 -1.172 1012 HA VAL 136 HA VAL 136 0.117 12.055 -0.039 1013 HB VAL 136 HB VAL 136 1.024 13.909 -2.281 1014 HG11 VAL 136 1HG1 VAL 136 2.583 12.243 -0.259 1015 HG12 VAL 136 2HG1 VAL 136 3.300 13.104 -1.634 1016 HG13 VAL 136 3HG1 VAL 136 2.547 14.022 -0.368 1017 HG21 VAL 136 3HG2 VAL 136 1.286 10.870 -2.013 1018 HG22 VAL 136 1HG2 VAL 136 0.507 11.758 -3.338 1019 HG23 VAL 136 2HG2 VAL 136 2.254 11.841 -3.122 1020 H GLN 137 H GLN 137 1.275 14.526 0.665 1021 HA GLN 137 HA GLN 137 -0.575 16.627 0.589 1022 HB2 GLN 137 1HB GLN 137 -0.654 17.061 2.960 1023 HB3 GLN 137 2HB GLN 137 -1.505 15.569 2.586 1024 HG2 GLN 137 1HG GLN 137 0.579 14.326 3.378 1025 HG3 GLN 137 2HG GLN 137 1.185 15.899 3.928 1026 HE21 GLN 137 1HE2 GLN 137 0.254 13.318 5.495 1027 HE22 GLN 137 2HE2 GLN 137 -0.804 14.061 6.681 1028 H PHE 138 H PHE 138 0.782 18.448 2.164 1029 HA PHE 138 HA PHE 138 3.672 18.151 1.553 1030 HB2 PHE 138 1HB PHE 138 1.725 20.239 0.531 1031 HB3 PHE 138 2HB PHE 138 3.407 20.645 0.822 1032 HD1 PHE 138 2HD PHE 138 1.282 18.239 -1.166 1033 HD2 PHE 138 1HD PHE 138 5.073 20.265 -0.806 1034 HE1 PHE 138 2HE PHE 138 1.998 17.323 -3.354 1035 HE2 PHE 138 1HE PHE 138 5.784 19.306 -2.949 1036 HZ PHE 138 HZ PHE 138 4.254 17.855 -4.258 1037 H TYR 139 H TYR 139 4.770 18.796 3.398 1038 HA TYR 139 HA TYR 139 3.547 20.843 5.159 1039 HB2 TYR 139 1HB TYR 139 4.382 18.074 5.914 1040 HB3 TYR 139 2HB TYR 139 4.904 19.374 6.962 1041 HD1 TYR 139 1HD TYR 139 1.851 17.794 5.473 1042 HD2 TYR 139 2HD TYR 139 3.452 20.448 8.467 1043 HE1 TYR 139 1HE TYR 139 -0.355 17.842 6.627 1044 HE2 TYR 139 2HE TYR 139 1.308 20.474 9.623 1045 HH TYR 139 HH TYR 139 -0.931 19.803 9.576 1046 HA PRO 140 HA PRO 140 7.820 21.960 3.820 1047 HB2 PRO 140 1HB PRO 140 7.343 24.491 3.016 1048 HB3 PRO 140 2HB PRO 140 6.995 23.105 1.953 1049 HG2 PRO 140 1HG PRO 140 5.088 24.697 3.645 1050 HG3 PRO 140 2HG PRO 140 4.861 24.132 1.977 1051 HD2 PRO 140 1HD PRO 140 3.881 22.812 4.239 1052 HD3 PRO 140 2HD PRO 140 4.227 21.991 2.695 1053 H GLU 141 H GLU 141 8.988 22.409 5.608 1054 HA GLU 141 HA GLU 141 7.950 24.239 7.669 1055 HB2 GLU 141 1HB GLU 141 8.546 21.244 7.923 1056 HB3 GLU 141 2HB GLU 141 8.599 22.313 9.308 1057 HG2 GLU 141 1HG GLU 141 6.186 23.083 8.425 1058 HG3 GLU 141 2HG GLU 141 6.207 21.496 7.645 Start of MODEL 16 1 H1 GLY 1 H GLY 1 18.226 12.146 -1.094 2 HA2 GLY 1 2HA GLY 1 16.150 10.528 -2.464 3 HA3 GLY 1 1HA GLY 1 15.944 11.341 -0.893 4 H MET 2 H MET 2 15.493 11.679 -4.292 5 HA MET 2 HA MET 2 15.878 14.544 -4.484 6 HB2 MET 2 1HB MET 2 14.777 12.516 -6.473 7 HB3 MET 2 2HB MET 2 15.262 14.156 -6.826 8 HG2 MET 2 1HG MET 2 17.592 13.652 -6.234 9 HG3 MET 2 2HG MET 2 17.141 11.981 -5.857 10 HE1 MET 2 3HE MET 2 19.246 11.772 -9.210 11 HE2 MET 2 1HE MET 2 19.396 13.170 -8.119 12 HE3 MET 2 2HE MET 2 19.264 11.534 -7.450 13 H SER 3 H SER 3 13.832 13.891 -2.498 14 HA SER 3 HA SER 3 11.769 14.371 -1.862 15 HB2 SER 3 1HB SER 3 11.932 16.404 -3.371 16 HB3 SER 3 2HB SER 3 10.984 15.471 -4.543 17 HG SER 3 HG SER 3 10.285 16.345 -1.957 18 H GLN 4 H GLN 4 11.366 13.365 -5.319 19 HA GLN 4 HA GLN 4 9.046 11.889 -4.833 20 HB2 GLN 4 1HB GLN 4 9.105 11.228 -7.015 21 HB3 GLN 4 2HB GLN 4 10.000 12.720 -7.034 22 HG2 GLN 4 1HG GLN 4 11.453 11.583 -8.291 23 HG3 GLN 4 2HG GLN 4 12.095 10.961 -6.797 24 HE21 GLN 4 1HE2 GLN 4 9.772 8.970 -6.290 25 HE22 GLN 4 2HE2 GLN 4 9.913 7.830 -7.595 26 H ASP 5 H ASP 5 12.424 10.813 -4.547 27 HA ASP 5 HA ASP 5 12.071 8.083 -4.387 28 HB2 ASP 5 1HB ASP 5 13.953 9.750 -2.656 29 HB3 ASP 5 2HB ASP 5 14.120 8.034 -3.027 30 H LEU 6 H LEU 6 11.729 10.591 -1.816 31 HA LEU 6 HA LEU 6 11.563 8.737 0.329 32 HB2 LEU 6 1HB LEU 6 10.744 11.668 0.185 33 HB3 LEU 6 2HB LEU 6 10.995 10.717 1.641 34 HG LEU 6 HG LEU 6 12.926 11.826 1.585 35 HD11 LEU 6 1HD1 LEU 6 14.816 10.530 0.865 36 HD12 LEU 6 2HD1 LEU 6 13.798 9.523 -0.173 37 HD13 LEU 6 3HD1 LEU 6 13.587 9.493 1.594 38 HD21 LEU 6 3HD2 LEU 6 14.086 12.741 -0.234 39 HD22 LEU 6 1HD2 LEU 6 12.360 13.058 -0.398 40 HD23 LEU 6 2HD2 LEU 6 13.097 11.809 -1.417 41 H ILE 7 H ILE 7 9.131 10.313 -1.742 42 HA ILE 7 HA ILE 7 6.810 9.616 -0.254 43 HB ILE 7 HB ILE 7 7.431 10.040 -3.196 44 HG12 ILE 7 1HG1 ILE 7 5.503 11.820 -1.858 45 HG13 ILE 7 2HG1 ILE 7 7.040 11.821 -1.027 46 HG21 ILE 7 1HG2 ILE 7 4.705 9.439 -2.012 47 HG22 ILE 7 2HG2 ILE 7 4.973 10.185 -3.610 48 HG23 ILE 7 3HG2 ILE 7 5.557 8.554 -3.300 49 HD11 ILE 7 3HD1 ILE 7 6.905 12.210 -4.021 50 HD12 ILE 7 1HD1 ILE 7 6.725 13.547 -2.875 51 HD13 ILE 7 2HD1 ILE 7 8.226 12.606 -2.877 52 H ARG 8 H ARG 8 8.384 7.823 -2.999 53 HA ARG 8 HA ARG 8 6.802 5.499 -2.632 54 HB2 ARG 8 1HB ARG 8 8.259 6.135 -4.651 55 HB3 ARG 8 2HB ARG 8 9.643 5.566 -3.710 56 HG2 ARG 8 1HG ARG 8 8.215 3.368 -3.460 57 HG3 ARG 8 2HG ARG 8 7.302 3.971 -4.839 58 HD2 ARG 8 1HD ARG 8 10.337 3.743 -4.847 59 HD3 ARG 8 2HD ARG 8 9.313 2.332 -5.147 60 HE ARG 8 HE ARG 8 8.384 4.099 -6.992 61 HH11 ARG 8 1HH1 ARG 8 11.485 2.526 -6.197 62 HH12 ARG 8 2HH1 ARG 8 12.032 2.532 -7.847 63 HH21 ARG 8 1HH2 ARG 8 9.130 3.943 -9.252 64 HH22 ARG 8 2HH2 ARG 8 10.647 3.230 -9.561 65 H ALA 9 H ALA 9 9.982 6.374 -1.198 66 HA ALA 9 HA ALA 9 10.331 3.912 0.204 67 HB1 ALA 9 1HB ALA 9 12.141 5.034 1.319 68 HB2 ALA 9 2HB ALA 9 12.133 5.600 -0.359 69 HB3 ALA 9 3HB ALA 9 11.483 6.634 0.928 70 H ALA 10 H ALA 10 8.190 6.583 0.958 71 HA ALA 10 HA ALA 10 8.315 6.406 3.825 72 HB1 ALA 10 1HB ALA 10 5.859 7.168 2.162 73 HB2 ALA 10 2HB ALA 10 6.320 7.742 3.777 74 HB3 ALA 10 3HB ALA 10 7.209 8.275 2.349 75 H PHE 11 H PHE 11 6.451 4.818 1.334 76 HA PHE 11 HA PHE 11 4.623 3.362 2.938 77 HB2 PHE 11 1HB PHE 11 5.779 3.128 0.160 78 HB3 PHE 11 2HB PHE 11 4.731 1.884 0.785 79 HD1 PHE 11 2HD PHE 11 4.684 5.743 0.395 80 HD2 PHE 11 1HD PHE 11 2.537 1.955 0.329 81 HE1 PHE 11 2HE PHE 11 2.728 6.836 -0.552 82 HE2 PHE 11 1HE PHE 11 0.637 3.077 -0.653 83 HZ PHE 11 HZ PHE 11 0.657 5.549 -1.041 84 H GLU 12 H GLU 12 7.837 2.342 1.500 85 HA GLU 12 HA GLU 12 7.623 -0.121 2.937 86 HB2 GLU 12 1HB GLU 12 9.094 0.450 0.805 87 HB3 GLU 12 2HB GLU 12 10.349 0.792 2.005 88 HG2 GLU 12 1HG GLU 12 8.877 -1.658 2.641 89 HG3 GLU 12 2HG GLU 12 9.482 -1.734 0.987 90 H LYS 13 H LYS 13 8.212 2.894 4.113 91 HA LYS 13 HA LYS 13 9.762 1.918 6.416 92 HB2 LYS 13 1HB LYS 13 10.154 4.153 5.171 93 HB3 LYS 13 2HB LYS 13 8.772 4.773 6.098 94 HG2 LYS 13 1HG LYS 13 9.901 4.374 8.162 95 HG3 LYS 13 2HG LYS 13 10.985 3.226 7.395 96 HD2 LYS 13 1HD LYS 13 12.076 5.129 6.136 97 HD3 LYS 13 2HD LYS 13 11.016 6.252 7.002 98 HE2 LYS 13 1HE LYS 13 13.193 6.219 8.079 99 HE3 LYS 13 2HE LYS 13 11.986 5.496 9.154 100 HZ1 LYS 13 3HZ LYS 13 13.983 4.167 9.138 101 HZ2 LYS 13 1HZ LYS 13 13.915 3.936 7.513 102 HZ3 LYS 13 2HZ LYS 13 12.765 3.315 8.504 103 H ARG 14 H ARG 14 6.647 1.894 5.568 104 HA ARG 14 HA ARG 14 5.770 1.590 8.436 105 HB2 ARG 14 1HB ARG 14 4.635 3.517 7.562 106 HB3 ARG 14 2HB ARG 14 4.107 2.640 6.127 107 HG2 ARG 14 1HG ARG 14 2.614 1.258 7.434 108 HG3 ARG 14 2HG ARG 14 3.252 1.886 8.961 109 HD2 ARG 14 1HD ARG 14 1.861 3.612 6.874 110 HD3 ARG 14 2HD ARG 14 0.998 2.824 8.183 111 HE ARG 14 HE ARG 14 3.080 4.945 8.477 112 HH11 ARG 14 1HH1 ARG 14 0.226 3.295 9.982 113 HH12 ARG 14 2HH1 ARG 14 0.569 4.047 11.513 114 HH21 ARG 14 1HH2 ARG 14 3.133 6.146 10.278 115 HH22 ARG 14 2HH2 ARG 14 1.948 6.010 11.552 116 H LEU 15 H LEU 15 4.934 0.470 5.119 117 HA LEU 15 HA LEU 15 3.267 -1.587 6.046 118 HB2 LEU 15 1HB LEU 15 3.273 -0.574 3.759 119 HB3 LEU 15 2HB LEU 15 4.809 -1.366 3.428 120 HG LEU 15 HG LEU 15 3.727 -3.580 3.660 121 HD11 LEU 15 1HD1 LEU 15 1.148 -1.972 3.953 122 HD12 LEU 15 2HD1 LEU 15 1.874 -3.050 5.168 123 HD13 LEU 15 3HD1 LEU 15 1.221 -3.716 3.679 124 HD21 LEU 15 3HD2 LEU 15 2.249 -3.407 1.607 125 HD22 LEU 15 1HD2 LEU 15 3.898 -2.828 1.443 126 HD23 LEU 15 2HD2 LEU 15 2.576 -1.657 1.631 127 H SER 16 H SER 16 6.743 -1.654 5.478 128 HA SER 16 HA SER 16 7.114 -4.524 5.380 129 HB2 SER 16 1HB SER 16 8.585 -2.334 4.749 130 HB3 SER 16 2HB SER 16 9.213 -2.636 6.384 131 HG SER 16 HG SER 16 10.316 -3.518 4.508 132 H ASP 17 H ASP 17 7.274 -1.943 7.794 133 HA ASP 17 HA ASP 17 8.332 -3.266 10.001 134 HB2 ASP 17 1HB ASP 17 7.827 -0.727 9.458 135 HB3 ASP 17 2HB ASP 17 6.295 -1.035 10.249 136 H TRP 18 H TRP 18 4.935 -2.637 9.105 137 HA TRP 18 HA TRP 18 3.788 -4.242 11.239 138 HB2 TRP 18 1HB TRP 18 2.240 -2.817 10.245 139 HB3 TRP 18 2HB TRP 18 2.655 -3.305 8.613 140 HD1 TRP 18 HD TRP 18 0.551 -4.530 11.610 141 HE1 TRP 18 1HE TRP 18 -1.299 -6.084 10.735 142 HE3 TRP 18 3HE TRP 18 2.289 -5.210 6.854 143 HZ2 TRP 18 2HZ TRP 18 -2.073 -7.194 8.188 144 HZ3 TRP 18 3HZ TRP 18 1.030 -6.658 5.256 145 HH2 TRP 18 HH TRP 18 -1.248 -7.414 5.843 146 H ALA 19 H ALA 19 4.694 -5.040 7.801 147 HA ALA 19 HA ALA 19 3.362 -7.490 8.036 148 HB1 ALA 19 1HB ALA 19 3.914 -6.537 5.844 149 HB2 ALA 19 2HB ALA 19 5.634 -6.926 6.091 150 HB3 ALA 19 3HB ALA 19 4.402 -8.235 5.981 151 H LYS 20 H LYS 20 6.731 -6.729 8.897 152 HA LYS 20 HA LYS 20 7.226 -9.559 9.604 153 HB2 LYS 20 1HB LYS 20 9.433 -8.908 10.161 154 HB3 LYS 20 2HB LYS 20 8.995 -8.152 8.643 155 HG2 LYS 20 1HG LYS 20 10.117 -6.471 9.661 156 HG3 LYS 20 2HG LYS 20 8.487 -6.009 10.071 157 HD2 LYS 20 1HD LYS 20 8.784 -6.533 12.346 158 HD3 LYS 20 2HD LYS 20 10.059 -7.705 12.033 159 HE2 LYS 20 1HE LYS 20 10.334 -4.671 11.762 160 HE3 LYS 20 2HE LYS 20 10.863 -5.640 13.138 161 HZ1 LYS 20 3HZ LYS 20 11.993 -5.753 10.417 162 HZ2 LYS 20 1HZ LYS 20 12.323 -6.861 11.605 163 HZ3 LYS 20 2HZ LYS 20 12.723 -5.288 11.800 164 H ALA 21 H ALA 21 6.142 -6.621 11.241 165 HA ALA 21 HA ALA 21 6.664 -7.461 13.918 166 HB1 ALA 21 1HB ALA 21 6.113 -5.111 13.375 167 HB2 ALA 21 2HB ALA 21 4.522 -5.609 12.756 168 HB3 ALA 21 3HB ALA 21 4.874 -5.758 14.466 169 H ARG 22 H ARG 22 3.995 -7.971 11.662 170 HA ARG 22 HA ARG 22 2.066 -8.778 13.475 171 HB2 ARG 22 1HB ARG 22 2.151 -8.472 10.741 172 HB3 ARG 22 2HB ARG 22 2.140 -10.246 10.884 173 HG2 ARG 22 1HG ARG 22 0.078 -9.816 12.455 174 HG3 ARG 22 2HG ARG 22 0.059 -8.229 11.640 175 HD2 ARG 22 1HD ARG 22 -0.406 -9.165 9.547 176 HD3 ARG 22 2HD ARG 22 0.241 -10.728 9.976 177 HE ARG 22 HE ARG 22 -2.058 -10.077 11.592 178 HH11 ARG 22 1HH1 ARG 22 -1.376 -11.058 8.279 179 HH12 ARG 22 2HH1 ARG 22 -2.573 -12.333 8.265 180 HH21 ARG 22 1HH2 ARG 22 -3.592 -11.628 11.605 181 HH22 ARG 22 2HH2 ARG 22 -3.798 -12.793 10.333 182 H THR 23 H THR 23 1.179 -10.892 13.889 183 HA THR 23 HA THR 23 2.933 -12.788 14.846 184 HB THR 23 HB THR 23 0.002 -12.860 14.157 185 HG1 THR 23 1HG THR 23 1.574 -12.830 16.519 186 HG21 THR 23 3HG2 THR 23 -0.172 -14.982 15.431 187 HG22 THR 23 1HG2 THR 23 1.612 -15.104 15.432 188 HG23 THR 23 2HG2 THR 23 0.711 -15.169 13.911 189 HA PRO 24 HA PRO 24 2.540 -15.803 11.258 190 HB2 PRO 24 1HB PRO 24 1.401 -15.060 8.854 191 HB3 PRO 24 2HB PRO 24 0.540 -15.842 10.211 192 HG2 PRO 24 1HG PRO 24 0.673 -12.914 9.447 193 HG3 PRO 24 2HG PRO 24 -0.770 -13.871 9.931 194 HD2 PRO 24 1HD PRO 24 0.535 -12.268 11.699 195 HD3 PRO 24 2HD PRO 24 -0.151 -13.843 12.186 196 H ALA 25 H ALA 25 3.348 -12.672 10.880 197 HA ALA 25 HA ALA 25 4.699 -11.331 9.640 198 HB1 ALA 25 1HB ALA 25 7.003 -11.990 9.747 199 HB2 ALA 25 2HB ALA 25 6.119 -12.348 11.267 200 HB3 ALA 25 3HB ALA 25 6.505 -13.669 10.142 201 H LEU 26 H LEU 26 4.018 -11.000 7.609 202 HA LEU 26 HA LEU 26 4.090 -13.157 5.581 203 HB2 LEU 26 1HB LEU 26 2.759 -10.403 5.491 204 HB3 LEU 26 2HB LEU 26 2.618 -11.674 4.288 205 HG LEU 26 HG LEU 26 1.460 -11.580 7.070 206 HD11 LEU 26 1HD1 LEU 26 -0.578 -11.906 5.829 207 HD12 LEU 26 2HD1 LEU 26 0.317 -12.280 4.338 208 HD13 LEU 26 3HD1 LEU 26 0.413 -10.639 5.028 209 HD21 LEU 26 3HD2 LEU 26 2.301 -13.841 7.028 210 HD22 LEU 26 1HD2 LEU 26 1.547 -14.135 5.434 211 HD23 LEU 26 2HD2 LEU 26 0.547 -13.790 6.872 212 HA PRO 27 HA PRO 27 7.132 -10.976 3.090 213 HB2 PRO 27 1HB PRO 27 6.833 -12.097 0.637 214 HB3 PRO 27 2HB PRO 27 7.368 -13.059 2.048 215 HG2 PRO 27 1HG PRO 27 4.590 -12.872 0.854 216 HG3 PRO 27 2HG PRO 27 5.467 -14.334 1.380 217 HD2 PRO 27 1HD PRO 27 3.595 -12.952 2.904 218 HD3 PRO 27 2HD PRO 27 4.872 -13.969 3.603 219 H VAL 28 H VAL 28 7.277 -9.469 1.090 220 HA VAL 28 HA VAL 28 4.663 -8.106 0.603 221 HB VAL 28 HB VAL 28 7.204 -6.611 1.274 222 HG11 VAL 28 1HG1 VAL 28 5.572 -4.791 1.754 223 HG12 VAL 28 2HG1 VAL 28 5.463 -5.356 0.088 224 HG13 VAL 28 3HG1 VAL 28 4.239 -5.867 1.265 225 HG21 VAL 28 3HG2 VAL 28 5.062 -7.561 3.215 226 HG22 VAL 28 1HG2 VAL 28 6.812 -7.820 3.306 227 HG23 VAL 28 2HG2 VAL 28 6.167 -6.202 3.551 228 H ALA 29 H ALA 29 4.379 -8.535 -1.545 229 HA ALA 29 HA ALA 29 6.661 -8.481 -3.343 230 HB1 ALA 29 1HB ALA 29 3.778 -9.066 -4.045 231 HB2 ALA 29 2HB ALA 29 5.213 -9.341 -5.028 232 HB3 ALA 29 3HB ALA 29 4.961 -10.276 -3.535 233 H TRP 30 H TRP 30 7.072 -6.226 -2.871 234 HA TRP 30 HA TRP 30 5.461 -4.050 -3.797 235 HB2 TRP 30 1HB TRP 30 8.492 -4.380 -3.710 236 HB3 TRP 30 2HB TRP 30 7.633 -2.873 -3.970 237 HD1 TRP 30 HD TRP 30 8.748 -5.207 -1.218 238 HE1 TRP 30 1HE TRP 30 8.158 -4.217 1.058 239 HE3 TRP 30 3HE TRP 30 5.697 -1.317 -2.750 240 HZ2 TRP 30 2HZ TRP 30 6.560 -2.084 2.097 241 HZ3 TRP 30 3HZ TRP 30 4.625 0.094 -1.086 242 HH2 TRP 30 HH TRP 30 4.998 -0.279 1.345 243 H GLN 31 H GLN 31 6.200 -2.690 -5.711 244 HA GLN 31 HA GLN 31 5.757 -4.053 -8.134 245 HB2 GLN 31 1HB GLN 31 7.227 -1.412 -7.843 246 HB3 GLN 31 2HB GLN 31 6.421 -2.046 -9.280 247 HG2 GLN 31 1HG GLN 31 4.257 -2.016 -7.812 248 HG3 GLN 31 2HG GLN 31 5.184 -0.972 -6.731 249 HE21 GLN 31 1HE2 GLN 31 2.768 -0.284 -8.387 250 HE22 GLN 31 2HE2 GLN 31 3.330 1.121 -9.266 251 H ASN 32 H ASN 32 6.990 -5.066 -9.515 252 HA ASN 32 HA ASN 32 8.608 -6.192 -10.431 253 HB2 ASN 32 1HB ASN 32 10.377 -3.852 -9.996 254 HB3 ASN 32 2HB ASN 32 10.574 -5.158 -11.168 255 HD21 ASN 32 1HD2 ASN 32 9.289 -2.197 -10.675 256 HD22 ASN 32 2HD2 ASN 32 8.162 -2.076 -12.036 257 H THR 33 H THR 33 8.612 -6.160 -7.178 258 HA THR 33 HA THR 33 11.360 -6.565 -6.559 259 HB THR 33 HB THR 33 9.441 -5.826 -5.015 260 HG1 THR 33 1HG THR 33 10.630 -7.148 -3.272 261 HG21 THR 33 3HG2 THR 33 8.566 -7.571 -3.549 262 HG22 THR 33 1HG2 THR 33 9.346 -8.833 -4.501 263 HG23 THR 33 2HG2 THR 33 8.027 -7.880 -5.219 264 H LYS 34 H LYS 34 11.946 -8.526 -5.210 265 HA LYS 34 HA LYS 34 11.396 -11.062 -6.573 266 HB2 LYS 34 1HB LYS 34 13.407 -11.893 -5.375 267 HB3 LYS 34 2HB LYS 34 13.644 -10.890 -6.812 268 HG2 LYS 34 1HG LYS 34 13.493 -9.307 -4.390 269 HG3 LYS 34 2HG LYS 34 14.740 -10.543 -4.238 270 HD2 LYS 34 1HD LYS 34 15.724 -8.457 -5.067 271 HD3 LYS 34 2HD LYS 34 15.824 -9.746 -6.280 272 HE2 LYS 34 1HE LYS 34 13.826 -8.801 -7.429 273 HE3 LYS 34 2HE LYS 34 13.748 -7.494 -6.243 274 HZ1 LYS 34 3HZ LYS 34 16.221 -7.868 -7.784 275 HZ2 LYS 34 1HZ LYS 34 15.567 -6.472 -7.196 276 HZ3 LYS 34 2HZ LYS 34 14.915 -7.169 -8.496 277 H PHE 35 H PHE 35 9.969 -12.338 -5.412 278 HA PHE 35 HA PHE 35 10.026 -12.213 -2.481 279 HB2 PHE 35 1HB PHE 35 7.712 -11.792 -2.323 280 HB3 PHE 35 2HB PHE 35 8.366 -10.483 -3.282 281 HD1 PHE 35 2HD PHE 35 8.135 -10.745 -5.921 282 HD2 PHE 35 1HD PHE 35 5.895 -13.081 -3.059 283 HE1 PHE 35 2HE PHE 35 6.547 -11.430 -7.698 284 HE2 PHE 35 1HE PHE 35 4.297 -13.734 -4.843 285 HZ PHE 35 HZ PHE 35 4.650 -12.954 -7.167 286 H THR 36 H THR 36 10.626 -14.160 -4.667 287 HA THR 36 HA THR 36 8.807 -16.345 -3.836 288 HB THR 36 HB THR 36 9.144 -15.898 -6.335 289 HG1 THR 36 1HG THR 36 8.202 -17.684 -6.069 290 HG21 THR 36 3HG2 THR 36 11.772 -17.346 -5.825 291 HG22 THR 36 1HG2 THR 36 11.572 -15.682 -6.365 292 HG23 THR 36 2HG2 THR 36 11.024 -17.014 -7.404 293 HA PRO 37 HA PRO 37 9.166 -18.687 -3.385 294 HB2 PRO 37 1HB PRO 37 9.236 -19.993 -0.992 295 HB3 PRO 37 2HB PRO 37 10.355 -20.382 -2.336 296 HG2 PRO 37 1HG PRO 37 10.884 -18.607 0.067 297 HG3 PRO 37 2HG PRO 37 11.906 -19.932 -0.580 298 HD2 PRO 37 1HD PRO 37 12.338 -17.301 -1.221 299 HD3 PRO 37 2HD PRO 37 12.617 -18.605 -2.411 300 HA PRO 38 HA PRO 38 6.343 -16.216 -0.818 301 HB2 PRO 38 1HB PRO 38 4.111 -17.752 -0.878 302 HB3 PRO 38 2HB PRO 38 4.612 -16.752 -2.311 303 HG2 PRO 38 1HG PRO 38 4.991 -19.695 -1.801 304 HG3 PRO 38 2HG PRO 38 4.548 -18.896 -3.338 305 HD2 PRO 38 1HD PRO 38 7.110 -19.738 -2.728 306 HD3 PRO 38 2HD PRO 38 6.779 -18.328 -3.783 307 H ALA 39 H ALA 39 4.628 -16.846 0.992 308 HA ALA 39 HA ALA 39 6.262 -18.278 2.862 309 HB1 ALA 39 1HB ALA 39 4.930 -17.093 4.558 310 HB2 ALA 39 2HB ALA 39 5.693 -15.985 3.403 311 HB3 ALA 39 3HB ALA 39 3.945 -16.343 3.262 312 H ALA 40 H ALA 40 5.644 -20.110 1.789 313 HA ALA 40 HA ALA 40 4.637 -22.252 1.760 314 HB1 ALA 40 1HB ALA 40 2.874 -21.306 4.064 315 HB2 ALA 40 2HB ALA 40 3.119 -22.965 3.535 316 HB3 ALA 40 3HB ALA 40 4.458 -22.068 4.272 317 H GLY 41 H GLY 41 3.948 -20.152 0.059 318 HA2 GLY 41 2HA GLY 41 2.478 -19.907 -1.691 319 HA3 GLY 41 1HA GLY 41 1.363 -21.048 -0.922 320 H VAL 42 H VAL 42 2.013 -18.769 1.403 321 HA VAL 42 HA VAL 42 -0.342 -17.085 0.772 322 HB VAL 42 HB VAL 42 1.469 -17.138 3.211 323 HG11 VAL 42 1HG1 VAL 42 -0.364 -16.043 4.375 324 HG12 VAL 42 2HG1 VAL 42 0.199 -15.075 3.012 325 HG13 VAL 42 3HG1 VAL 42 -1.311 -16.023 2.867 326 HG21 VAL 42 3HG2 VAL 42 -0.282 -18.427 4.373 327 HG22 VAL 42 1HG2 VAL 42 -1.200 -18.545 2.864 328 HG23 VAL 42 2HG2 VAL 42 0.371 -19.360 3.033 329 H TYR 43 H TYR 43 -0.052 -14.962 0.003 330 HA TYR 43 HA TYR 43 2.391 -13.540 0.463 331 HB2 TYR 43 1HB TYR 43 3.151 -13.265 -1.830 332 HB3 TYR 43 2HB TYR 43 3.231 -14.933 -1.356 333 HD1 TYR 43 1HD TYR 43 1.377 -16.536 -2.110 334 HD2 TYR 43 2HD TYR 43 1.930 -12.591 -3.779 335 HE1 TYR 43 1HE TYR 43 0.004 -17.175 -4.086 336 HE2 TYR 43 2HE TYR 43 0.604 -13.225 -5.754 337 HH TYR 43 HH TYR 43 -0.936 -16.455 -6.092 338 H LEU 44 H LEU 44 2.290 -11.536 -1.199 339 HA LEU 44 HA LEU 44 -0.287 -10.094 -0.800 340 HB2 LEU 44 1HB LEU 44 2.080 -10.248 0.934 341 HB3 LEU 44 2HB LEU 44 1.830 -8.605 0.412 342 HG LEU 44 HG LEU 44 -0.358 -8.522 1.428 343 HD11 LEU 44 1HD1 LEU 44 0.155 -11.408 2.212 344 HD12 LEU 44 2HD1 LEU 44 -1.150 -10.764 1.182 345 HD13 LEU 44 3HD1 LEU 44 -1.129 -10.360 2.873 346 HD21 LEU 44 3HD2 LEU 44 1.765 -9.720 3.265 347 HD22 LEU 44 1HD2 LEU 44 0.432 -8.639 3.754 348 HD23 LEU 44 2HD2 LEU 44 1.735 -8.051 2.713 349 H ARG 45 H ARG 45 -0.394 -9.326 -2.843 350 HA ARG 45 HA ARG 45 1.910 -8.105 -4.291 351 HB2 ARG 45 1HB ARG 45 -1.015 -8.465 -4.858 352 HB3 ARG 45 2HB ARG 45 -0.026 -7.399 -5.867 353 HG2 ARG 45 1HG ARG 45 1.382 -9.227 -6.520 354 HG3 ARG 45 2HG ARG 45 0.527 -10.354 -5.426 355 HD2 ARG 45 1HD ARG 45 -1.455 -10.298 -6.735 356 HD3 ARG 45 2HD ARG 45 -0.931 -8.883 -7.640 357 HE ARG 45 HE ARG 45 -0.034 -11.694 -7.994 358 HH11 ARG 45 1HH1 ARG 45 0.297 -8.324 -9.072 359 HH12 ARG 45 2HH1 ARG 45 1.122 -8.751 -10.541 360 HH21 ARG 45 1HH2 ARG 45 0.894 -12.230 -9.942 361 HH22 ARG 45 2HH2 ARG 45 1.313 -11.054 -11.153 362 H ALA 46 H ALA 46 2.489 -6.587 -2.669 363 HA ALA 46 HA ALA 46 0.603 -4.493 -1.789 364 HB1 ALA 46 1HB ALA 46 2.731 -3.627 -0.670 365 HB2 ALA 46 2HB ALA 46 2.322 -5.299 -0.218 366 HB3 ALA 46 3HB ALA 46 3.619 -4.967 -1.391 367 H TYR 47 H TYR 47 0.113 -3.741 -3.983 368 HA TYR 47 HA TYR 47 2.415 -2.755 -5.582 369 HB2 TYR 47 1HB TYR 47 0.784 -4.689 -6.271 370 HB3 TYR 47 2HB TYR 47 -0.234 -3.349 -6.777 371 HD1 TYR 47 2HD TYR 47 0.658 -1.735 -8.466 372 HD2 TYR 47 1HD TYR 47 2.779 -5.327 -7.453 373 HE1 TYR 47 2HE TYR 47 2.040 -1.481 -10.527 374 HE2 TYR 47 1HE TYR 47 4.202 -5.080 -9.453 375 HH TYR 47 HH TYR 47 4.758 -3.702 -11.318 376 H VAL 48 H VAL 48 2.646 -0.793 -4.825 377 HA VAL 48 HA VAL 48 0.677 1.338 -4.642 378 HB VAL 48 HB VAL 48 2.818 2.689 -4.323 379 HG11 VAL 48 1HG1 VAL 48 3.293 1.853 -2.107 380 HG12 VAL 48 2HG1 VAL 48 1.548 1.856 -2.390 381 HG13 VAL 48 3HG1 VAL 48 2.457 0.325 -2.437 382 HG21 VAL 48 3HG2 VAL 48 4.837 1.601 -4.046 383 HG22 VAL 48 1HG2 VAL 48 4.080 -0.015 -4.036 384 HG23 VAL 48 2HG2 VAL 48 4.146 0.916 -5.559 385 H MET 49 H MET 49 -0.097 0.871 -6.695 386 HA MET 49 HA MET 49 1.135 1.460 -9.243 387 HB2 MET 49 1HB MET 49 -1.620 1.065 -8.247 388 HB3 MET 49 2HB MET 49 -1.518 2.176 -9.607 389 HG2 MET 49 1HG MET 49 -0.802 0.574 -11.067 390 HG3 MET 49 2HG MET 49 -0.029 -0.407 -9.848 391 HE1 MET 49 3HE MET 49 -2.018 -1.123 -7.673 392 HE2 MET 49 1HE MET 49 -3.097 -2.392 -8.254 393 HE3 MET 49 2HE MET 49 -1.366 -2.544 -8.543 394 HA PRO 50 HA PRO 50 1.561 5.846 -8.858 395 HB2 PRO 50 1HB PRO 50 2.024 6.594 -11.431 396 HB3 PRO 50 2HB PRO 50 3.137 5.485 -10.575 397 HG2 PRO 50 1HG PRO 50 0.858 4.756 -12.439 398 HG3 PRO 50 2HG PRO 50 2.555 4.216 -12.535 399 HD2 PRO 50 1HD PRO 50 0.600 2.731 -11.308 400 HD3 PRO 50 2HD PRO 50 2.282 2.749 -10.695 401 H ALA 51 H ALA 51 0.669 7.924 -10.265 402 HA ALA 51 HA ALA 51 -2.200 7.897 -9.836 403 HB1 ALA 51 1HB ALA 51 -2.088 10.248 -10.389 404 HB2 ALA 51 2HB ALA 51 -0.590 9.882 -9.512 405 HB3 ALA 51 3HB ALA 51 -0.562 10.022 -11.277 406 H ALA 52 H ALA 52 -3.803 8.521 -11.414 407 HA ALA 52 HA ALA 52 -3.134 8.704 -14.208 408 HB1 ALA 52 1HB ALA 52 -4.713 6.946 -14.970 409 HB2 ALA 52 2HB ALA 52 -3.370 6.255 -14.055 410 HB3 ALA 52 3HB ALA 52 -4.959 6.434 -13.280 411 H THR 53 H THR 53 -4.279 10.427 -12.031 412 HA THR 53 HA THR 53 -7.088 10.661 -12.660 413 HB THR 53 HB THR 53 -6.261 13.083 -11.518 414 HG1 THR 53 1HG THR 53 -4.538 12.780 -10.517 415 HG21 THR 53 3HG2 THR 53 -8.238 11.760 -10.934 416 HG22 THR 53 1HG2 THR 53 -7.314 12.226 -9.505 417 HG23 THR 53 2HG2 THR 53 -7.192 10.555 -10.146 418 H ILE 54 H ILE 54 -8.069 12.365 -13.710 419 HA ILE 54 HA ILE 54 -6.746 13.554 -16.005 420 HB ILE 54 HB ILE 54 -9.467 14.309 -14.876 421 HG12 ILE 54 1HG1 ILE 54 -9.654 11.934 -14.878 422 HG13 ILE 54 2HG1 ILE 54 -10.512 12.613 -16.244 423 HG21 ILE 54 1HG2 ILE 54 -9.055 15.684 -16.772 424 HG22 ILE 54 2HG2 ILE 54 -8.283 14.356 -17.673 425 HG23 ILE 54 3HG2 ILE 54 -10.031 14.400 -17.409 426 HD11 ILE 54 3HD1 ILE 54 -9.395 10.569 -16.925 427 HD12 ILE 54 1HD1 ILE 54 -8.623 11.930 -17.753 428 HD13 ILE 54 2HD1 ILE 54 -7.827 11.169 -16.364 429 H SER 55 H SER 55 -7.597 16.122 -16.052 430 HA SER 55 HA SER 55 -6.110 17.691 -14.186 431 HB2 SER 55 1HB SER 55 -8.514 18.762 -15.578 432 HB3 SER 55 2HB SER 55 -6.903 19.436 -15.435 433 HG SER 55 HG SER 55 -7.787 18.608 -17.569 434 H ARG 56 H ARG 56 -6.655 17.527 -12.080 435 HA ARG 56 HA ARG 56 -9.253 18.548 -11.229 436 HB2 ARG 56 1HB ARG 56 -9.476 15.955 -11.365 437 HB3 ARG 56 2HB ARG 56 -8.350 15.904 -10.008 438 HG2 ARG 56 1HG ARG 56 -9.993 17.515 -8.801 439 HG3 ARG 56 2HG ARG 56 -11.110 17.232 -10.124 440 HD2 ARG 56 1HD ARG 56 -9.889 14.924 -8.568 441 HD3 ARG 56 2HD ARG 56 -11.258 15.838 -7.927 442 HE ARG 56 HE ARG 56 -11.300 14.512 -10.612 443 HH11 ARG 56 1HH1 ARG 56 -12.528 14.481 -7.324 444 HH12 ARG 56 2HH1 ARG 56 -14.134 13.997 -7.695 445 HH21 ARG 56 1HH2 ARG 56 -13.459 13.866 -11.233 446 HH22 ARG 56 2HH2 ARG 56 -14.622 13.485 -10.001 447 H ASP 57 H ASP 57 -6.699 19.631 -11.334 448 HA ASP 57 HA ASP 57 -5.476 19.308 -8.634 449 HB2 ASP 57 1HB ASP 57 -4.097 19.445 -11.334 450 HB3 ASP 57 2HB ASP 57 -3.333 19.231 -9.778 451 H ALA 58 H ALA 58 -3.795 21.084 -8.303 452 HA ALA 58 HA ALA 58 -5.513 23.444 -8.266 453 HB1 ALA 58 1HB ALA 58 -3.992 24.188 -6.484 454 HB2 ALA 58 2HB ALA 58 -4.543 22.530 -6.190 455 HB3 ALA 58 3HB ALA 58 -2.902 22.823 -6.812 456 H ALA 59 H ALA 59 -5.033 23.545 -10.673 457 HA ALA 59 HA ALA 59 -4.137 24.470 -12.513 458 HB1 ALA 59 1HB ALA 59 -4.641 26.592 -11.400 459 HB2 ALA 59 2HB ALA 59 -3.029 26.582 -10.631 460 HB3 ALA 59 3HB ALA 59 -3.183 26.722 -12.390 461 H GLY 60 H GLY 60 -2.804 22.301 -11.589 462 HA2 GLY 60 2HA GLY 60 -0.951 21.090 -12.210 463 HA3 GLY 60 1HA GLY 60 -0.114 22.575 -12.691 464 H ASP 61 H ASP 61 -0.102 24.109 -10.516 465 HA ASP 61 HA ASP 61 1.117 24.704 -8.826 466 HB2 ASP 61 1HB ASP 61 -0.192 23.864 -7.201 467 HB3 ASP 61 2HB ASP 61 -0.130 22.249 -7.846 468 H HIS 62 H HIS 62 2.173 21.400 -8.620 469 HA HIS 62 HA HIS 62 4.213 21.667 -10.554 470 HB2 HIS 62 1HB HIS 62 5.026 22.914 -8.234 471 HB3 HIS 62 2HB HIS 62 5.520 21.278 -7.869 472 HD1 HIS 62 1HD HIS 62 6.931 24.304 -9.171 473 HD2 HIS 62 2HD HIS 62 7.102 20.213 -10.228 474 HE1 HIS 62 1HE HIS 62 9.115 23.961 -10.454 475 H ARG 63 H ARG 63 2.887 20.022 -7.902 476 HA ARG 63 HA ARG 63 3.844 17.381 -8.964 477 HB2 ARG 63 1HB ARG 63 3.995 18.474 -6.213 478 HB3 ARG 63 2HB ARG 63 3.275 16.878 -6.291 479 HG2 ARG 63 1HG ARG 63 5.539 16.426 -6.012 480 HG3 ARG 63 2HG ARG 63 5.238 16.178 -7.741 481 HD2 ARG 63 1HD ARG 63 6.007 18.942 -7.331 482 HD3 ARG 63 2HD ARG 63 7.118 17.939 -6.397 483 HE ARG 63 HE ARG 63 6.635 17.103 -9.174 484 HH11 ARG 63 1HH1 ARG 63 8.970 18.614 -6.942 485 HH12 ARG 63 2HH1 ARG 63 10.138 18.909 -8.186 486 HH21 ARG 63 1HH2 ARG 63 8.128 17.655 -10.827 487 HH22 ARG 63 2HH2 ARG 63 9.636 18.367 -10.414 488 H GLN 64 H GLN 64 2.499 15.777 -9.047 489 HA GLN 64 HA GLN 64 -0.313 16.040 -8.224 490 HB2 GLN 64 1HB GLN 64 0.658 15.676 -11.090 491 HB3 GLN 64 2HB GLN 64 -0.978 15.277 -10.558 492 HG2 GLN 64 1HG GLN 64 -1.392 17.620 -9.918 493 HG3 GLN 64 2HG GLN 64 0.264 18.062 -10.349 494 HE21 GLN 64 1HE2 GLN 64 -2.758 16.667 -11.828 495 HE22 GLN 64 2HE2 GLN 64 -2.328 17.159 -13.441 496 H TYR 65 H TYR 65 1.608 14.523 -7.034 497 HA TYR 65 HA TYR 65 1.624 11.805 -8.163 498 HB2 TYR 65 1HB TYR 65 2.592 12.800 -5.457 499 HB3 TYR 65 2HB TYR 65 2.878 11.211 -6.143 500 HD1 TYR 65 2HD TYR 65 3.517 12.277 -9.046 501 HD2 TYR 65 1HD TYR 65 4.916 13.304 -5.098 502 HE1 TYR 65 2HE TYR 65 5.654 13.140 -10.009 503 HE2 TYR 65 1HE TYR 65 7.044 14.118 -6.040 504 HH TYR 65 HH TYR 65 8.211 14.644 -7.960 505 H ARG 66 H ARG 66 -0.300 10.941 -8.139 506 HA ARG 66 HA ARG 66 -1.777 10.663 -5.542 507 HB2 ARG 66 1HB ARG 66 -3.238 11.421 -8.040 508 HB3 ARG 66 2HB ARG 66 -3.877 11.270 -6.392 509 HG2 ARG 66 1HG ARG 66 -2.459 13.187 -5.712 510 HG3 ARG 66 2HG ARG 66 -1.974 13.407 -7.409 511 HD2 ARG 66 1HD ARG 66 -4.344 13.764 -8.029 512 HD3 ARG 66 2HD ARG 66 -4.783 13.653 -6.306 513 HE ARG 66 HE ARG 66 -2.669 15.573 -6.994 514 HH11 ARG 66 1HH1 ARG 66 -6.169 15.259 -6.524 515 HH12 ARG 66 2HH1 ARG 66 -6.391 16.917 -6.054 516 HH21 ARG 66 1HH2 ARG 66 -2.972 17.776 -6.599 517 HH22 ARG 66 2HH2 ARG 66 -4.470 18.379 -6.006 518 H GLY 67 H GLY 67 -1.001 8.598 -5.636 519 HA2 GLY 67 2HA GLY 67 -1.697 6.820 -7.917 520 HA3 GLY 67 1HA GLY 67 -0.551 6.425 -6.643 521 H VAL 68 H VAL 68 -1.926 4.338 -7.066 522 HA VAL 68 HA VAL 68 -4.008 4.242 -4.990 523 HB VAL 68 HB VAL 68 -5.208 4.221 -7.042 524 HG11 VAL 68 1HG1 VAL 68 -3.381 3.455 -8.611 525 HG12 VAL 68 2HG1 VAL 68 -3.696 1.796 -8.043 526 HG13 VAL 68 3HG1 VAL 68 -4.962 2.718 -8.860 527 HG21 VAL 68 3HG2 VAL 68 -6.370 2.057 -6.896 528 HG22 VAL 68 1HG2 VAL 68 -5.018 1.369 -5.986 529 HG23 VAL 68 2HG2 VAL 68 -5.988 2.669 -5.273 530 H PHE 69 H PHE 69 -3.506 2.747 -3.493 531 HA PHE 69 HA PHE 69 -1.142 0.979 -3.979 532 HB2 PHE 69 1HB PHE 69 -0.554 2.446 -2.293 533 HB3 PHE 69 2HB PHE 69 -2.115 2.421 -1.537 534 HD1 PHE 69 2HD PHE 69 0.246 -0.395 -2.523 535 HD2 PHE 69 1HD PHE 69 -2.011 1.529 0.629 536 HE1 PHE 69 2HE PHE 69 1.002 -2.096 -0.909 537 HE2 PHE 69 1HE PHE 69 -1.269 -0.209 2.209 538 HZ PHE 69 HZ PHE 69 0.236 -2.016 1.455 539 H GLN 70 H GLN 70 -1.734 -0.951 -4.389 540 HA GLN 70 HA GLN 70 -4.335 -2.040 -3.491 541 HB2 GLN 70 1HB GLN 70 -2.448 -2.536 -5.841 542 HB3 GLN 70 2HB GLN 70 -3.675 -3.686 -5.434 543 HG2 GLN 70 1HG GLN 70 -5.030 -1.176 -5.492 544 HG3 GLN 70 2HG GLN 70 -4.021 -1.143 -6.864 545 HE21 GLN 70 1HE2 GLN 70 -6.689 -2.362 -5.443 546 HE22 GLN 70 2HE2 GLN 70 -7.310 -3.554 -6.603 547 H VAL 71 H VAL 71 -4.394 -3.983 -2.419 548 HA VAL 71 HA VAL 71 -1.844 -5.367 -1.840 549 HB VAL 71 HB VAL 71 -3.929 -4.441 0.102 550 HG11 VAL 71 1HG1 VAL 71 -3.710 -6.224 1.425 551 HG12 VAL 71 2HG1 VAL 71 -2.687 -7.041 0.255 552 HG13 VAL 71 3HG1 VAL 71 -1.961 -6.005 1.496 553 HG21 VAL 71 3HG2 VAL 71 -2.028 -3.599 1.391 554 HG22 VAL 71 1HG2 VAL 71 -0.928 -4.140 0.102 555 HG23 VAL 71 2HG2 VAL 71 -2.139 -2.881 -0.215 556 H ASN 72 H ASN 72 -2.390 -6.696 -3.530 557 HA ASN 72 HA ASN 72 -4.915 -8.262 -3.396 558 HB2 ASN 72 1HB ASN 72 -2.911 -7.728 -5.470 559 HB3 ASN 72 2HB ASN 72 -3.061 -9.479 -5.188 560 HD21 ASN 72 1HD2 ASN 72 -5.827 -7.165 -4.904 561 HD22 ASN 72 2HD2 ASN 72 -6.668 -7.964 -6.223 562 H VAL 73 H VAL 73 -4.700 -8.914 -1.296 563 HA VAL 73 HA VAL 73 -2.509 -10.565 -0.372 564 HB VAL 73 HB VAL 73 -3.535 -9.240 1.274 565 HG11 VAL 73 1HG1 VAL 73 -5.650 -8.625 0.236 566 HG12 VAL 73 2HG1 VAL 73 -6.237 -10.293 0.462 567 HG13 VAL 73 3HG1 VAL 73 -5.934 -9.241 1.858 568 HG21 VAL 73 3HG2 VAL 73 -3.144 -11.431 2.245 569 HG22 VAL 73 1HG2 VAL 73 -4.675 -10.858 2.880 570 HG23 VAL 73 2HG2 VAL 73 -4.673 -12.066 1.610 571 H VAL 74 H VAL 74 -2.224 -12.687 -0.873 572 HA VAL 74 HA VAL 74 -4.538 -14.191 -1.944 573 HB VAL 74 HB VAL 74 -1.606 -14.698 -2.534 574 HG11 VAL 74 1HG1 VAL 74 -4.228 -15.501 -3.885 575 HG12 VAL 74 2HG1 VAL 74 -2.618 -15.881 -4.512 576 HG13 VAL 74 3HG1 VAL 74 -3.124 -16.564 -2.973 577 HG21 VAL 74 3HG2 VAL 74 -2.015 -13.585 -4.742 578 HG22 VAL 74 1HG2 VAL 74 -3.532 -12.936 -4.074 579 HG23 VAL 74 2HG2 VAL 74 -1.959 -12.471 -3.384 580 H MET 75 H MET 75 -5.055 -16.233 -0.878 581 HA MET 75 HA MET 75 -2.923 -17.412 0.736 582 HB2 MET 75 1HB MET 75 -4.171 -17.441 2.819 583 HB3 MET 75 2HB MET 75 -3.861 -15.802 2.315 584 HG2 MET 75 1HG MET 75 -6.456 -16.801 1.360 585 HG3 MET 75 2HG MET 75 -6.240 -16.937 3.096 586 HE1 MET 75 3HE MET 75 -7.020 -13.089 0.758 587 HE2 MET 75 1HE MET 75 -5.624 -14.069 0.295 588 HE3 MET 75 2HE MET 75 -7.247 -14.768 0.216 589 HA PRO 76 HA PRO 76 -4.838 -20.858 -1.094 590 HB2 PRO 76 1HB PRO 76 -4.238 -22.979 0.575 591 HB3 PRO 76 2HB PRO 76 -3.058 -22.156 -0.470 592 HG2 PRO 76 1HG PRO 76 -3.602 -21.708 2.471 593 HG3 PRO 76 2HG PRO 76 -2.014 -21.837 1.651 594 HD2 PRO 76 1HD PRO 76 -3.126 -19.437 2.301 595 HD3 PRO 76 2HD PRO 76 -2.165 -19.646 0.801 596 H ILE 77 H ILE 77 -6.664 -22.139 -1.144 597 HA ILE 77 HA ILE 77 -8.627 -21.801 1.038 598 HB ILE 77 HB ILE 77 -9.241 -23.101 -1.614 599 HG12 ILE 77 1HG1 ILE 77 -9.351 -20.129 -0.971 600 HG13 ILE 77 2HG1 ILE 77 -8.291 -20.905 -2.134 601 HG21 ILE 77 1HG2 ILE 77 -11.535 -22.514 -0.961 602 HG22 ILE 77 2HG2 ILE 77 -10.781 -23.364 0.374 603 HG23 ILE 77 3HG2 ILE 77 -10.956 -21.596 0.450 604 HD11 ILE 77 3HD1 ILE 77 -11.303 -20.684 -2.303 605 HD12 ILE 77 1HD1 ILE 77 -10.091 -19.931 -3.349 606 HD13 ILE 77 2HD1 ILE 77 -10.312 -21.693 -3.397 607 H GLY 78 H GLY 78 -7.953 -23.243 2.557 608 HA2 GLY 78 2HA GLY 78 -7.477 -26.101 1.904 609 HA3 GLY 78 1HA GLY 78 -7.409 -25.339 3.499 610 H ASP 79 H ASP 79 -9.540 -24.347 4.240 611 HA ASP 79 HA ASP 79 -11.843 -26.065 3.428 612 HB2 ASP 79 1HB ASP 79 -10.605 -26.806 5.553 613 HB3 ASP 79 2HB ASP 79 -11.263 -25.354 6.314 614 H GLY 80 H GLY 80 -10.942 -23.020 3.352 615 HA2 GLY 80 2HA GLY 80 -13.109 -21.942 2.369 616 HA3 GLY 80 1HA GLY 80 -13.611 -21.870 4.053 617 H SER 81 H SER 81 -10.517 -21.334 4.532 618 HA SER 81 HA SER 81 -9.193 -19.591 4.884 619 HB2 SER 81 1HB SER 81 -8.599 -20.401 2.788 620 HB3 SER 81 2HB SER 81 -9.802 -19.400 1.928 621 HG SER 81 HG SER 81 -8.527 -17.724 2.135 622 H ARG 82 H ARG 82 -10.058 -18.211 6.366 623 HA ARG 82 HA ARG 82 -11.779 -15.981 5.326 624 HB2 ARG 82 1HB ARG 82 -11.500 -16.709 8.227 625 HB3 ARG 82 2HB ARG 82 -12.771 -15.825 7.417 626 HG2 ARG 82 1HG ARG 82 -12.225 -18.803 7.386 627 HG3 ARG 82 2HG ARG 82 -13.633 -17.986 8.028 628 HD2 ARG 82 1HD ARG 82 -13.237 -17.518 5.118 629 HD3 ARG 82 2HD ARG 82 -13.389 -19.222 5.524 630 HE ARG 82 HE ARG 82 -15.470 -18.205 6.878 631 HH11 ARG 82 1HH1 ARG 82 -14.434 -17.829 3.479 632 HH12 ARG 82 2HH1 ARG 82 -16.000 -17.354 2.930 633 HH21 ARG 82 1HH2 ARG 82 -17.603 -17.937 6.061 634 HH22 ARG 82 2HH2 ARG 82 -17.850 -17.416 4.431 635 H SER 83 H SER 83 -8.550 -16.515 5.887 636 HA SER 83 HA SER 83 -7.936 -14.435 7.698 637 HB2 SER 83 1HB SER 83 -6.306 -15.865 5.572 638 HB3 SER 83 2HB SER 83 -5.587 -14.793 6.772 639 HG SER 83 HG SER 83 -5.786 -17.119 7.364 640 H ALA 84 H ALA 84 -8.902 -14.060 4.373 641 HA ALA 84 HA ALA 84 -7.713 -11.557 3.762 642 HB1 ALA 84 1HB ALA 84 -10.484 -12.671 3.111 643 HB2 ALA 84 2HB ALA 84 -9.768 -11.238 2.364 644 HB3 ALA 84 3HB ALA 84 -9.009 -12.822 2.114 645 H GLU 85 H GLU 85 -10.401 -12.366 5.979 646 HA GLU 85 HA GLU 85 -11.447 -9.668 6.099 647 HB2 GLU 85 1HB GLU 85 -11.874 -12.149 7.827 648 HB3 GLU 85 2HB GLU 85 -12.843 -10.666 7.883 649 HG2 GLU 85 1HG GLU 85 -13.641 -10.965 5.683 650 HG3 GLU 85 2HG GLU 85 -12.566 -12.287 5.321 651 H GLN 86 H GLN 86 -9.695 -11.785 8.368 652 HA GLN 86 HA GLN 86 -9.109 -9.970 10.400 653 HB2 GLN 86 1HB GLN 86 -8.307 -12.615 9.613 654 HB3 GLN 86 2HB GLN 86 -6.812 -11.738 9.808 655 HG2 GLN 86 1HG GLN 86 -8.662 -11.206 12.041 656 HG3 GLN 86 2HG GLN 86 -8.417 -12.920 11.791 657 HE21 GLN 86 1HE2 GLN 86 -6.238 -13.791 11.980 658 HE22 GLN 86 2HE2 GLN 86 -5.099 -12.951 13.018 659 H VAL 87 H VAL 87 -7.281 -10.576 7.396 660 HA VAL 87 HA VAL 87 -5.261 -8.585 7.844 661 HB VAL 87 HB VAL 87 -6.264 -10.119 5.443 662 HG11 VAL 87 1HG1 VAL 87 -4.255 -9.246 4.236 663 HG12 VAL 87 2HG1 VAL 87 -5.527 -8.057 4.464 664 HG13 VAL 87 3HG1 VAL 87 -4.074 -8.013 5.503 665 HG21 VAL 87 3HG2 VAL 87 -3.998 -11.152 5.774 666 HG22 VAL 87 1HG2 VAL 87 -3.719 -10.066 7.142 667 HG23 VAL 87 2HG2 VAL 87 -4.987 -11.294 7.243 668 H ALA 88 H ALA 88 -8.478 -8.288 6.268 669 HA ALA 88 HA ALA 88 -7.935 -5.672 5.360 670 HB1 ALA 88 1HB ALA 88 -9.799 -6.980 4.522 671 HB2 ALA 88 2HB ALA 88 -10.582 -6.995 6.112 672 HB3 ALA 88 3HB ALA 88 -10.394 -5.465 5.213 673 H ALA 89 H ALA 89 -8.962 -6.876 8.547 674 HA ALA 89 HA ALA 89 -9.451 -4.220 9.671 675 HB1 ALA 89 1HB ALA 89 -8.940 -6.881 11.093 676 HB2 ALA 89 2HB ALA 89 -9.654 -5.415 11.787 677 HB3 ALA 89 3HB ALA 89 -10.533 -6.317 10.538 678 H GLU 90 H GLU 90 -6.765 -6.545 9.645 679 HA GLU 90 HA GLU 90 -5.081 -5.274 11.511 680 HB2 GLU 90 1HB GLU 90 -4.600 -7.120 9.189 681 HB3 GLU 90 2HB GLU 90 -3.246 -6.470 10.084 682 HG2 GLU 90 1HG GLU 90 -5.555 -7.741 11.608 683 HG3 GLU 90 2HG GLU 90 -4.393 -8.757 10.787 684 H LEU 91 H LEU 91 -5.122 -5.049 8.013 685 HA LEU 91 HA LEU 91 -3.279 -2.901 7.608 686 HB2 LEU 91 1HB LEU 91 -5.686 -3.836 6.018 687 HB3 LEU 91 2HB LEU 91 -4.673 -2.500 5.502 688 HG LEU 91 HG LEU 91 -3.267 -5.079 6.153 689 HD11 LEU 91 1HD1 LEU 91 -3.691 -5.866 3.829 690 HD12 LEU 91 2HD1 LEU 91 -4.917 -4.597 3.652 691 HD13 LEU 91 3HD1 LEU 91 -5.127 -5.881 4.863 692 HD21 LEU 91 3HD2 LEU 91 -2.048 -2.984 5.478 693 HD22 LEU 91 1HD2 LEU 91 -2.907 -3.016 3.931 694 HD23 LEU 91 2HD2 LEU 91 -1.782 -4.334 4.357 695 H ASP 92 H ASP 92 -6.933 -2.595 7.673 696 HA ASP 92 HA ASP 92 -6.900 0.160 7.513 697 HB2 ASP 92 1HB ASP 92 -8.952 -1.122 7.333 698 HB3 ASP 92 2HB ASP 92 -8.847 -1.590 9.049 699 H ALA 93 H ALA 93 -6.366 -1.728 10.557 700 HA ALA 93 HA ALA 93 -6.565 0.622 12.223 701 HB1 ALA 93 1HB ALA 93 -5.407 -0.832 13.898 702 HB2 ALA 93 2HB ALA 93 -6.799 -1.634 13.127 703 HB3 ALA 93 3HB ALA 93 -5.141 -2.022 12.616 704 H LEU 94 H LEU 94 -4.093 -0.492 10.114 705 HA LEU 94 HA LEU 94 -1.908 1.010 11.442 706 HB2 LEU 94 1HB LEU 94 -1.984 -1.543 10.615 707 HB3 LEU 94 2HB LEU 94 -1.692 -0.853 9.059 708 HG LEU 94 HG LEU 94 0.243 -1.806 10.427 709 HD11 LEU 94 1HD1 LEU 94 0.654 0.935 9.229 710 HD12 LEU 94 2HD1 LEU 94 0.567 -0.591 8.329 711 HD13 LEU 94 3HD1 LEU 94 1.888 -0.326 9.470 712 HD21 LEU 94 3HD2 LEU 94 1.457 -0.372 11.915 713 HD22 LEU 94 1HD2 LEU 94 -0.193 -0.588 12.535 714 HD23 LEU 94 2HD2 LEU 94 0.273 0.933 11.733 715 H PHE 95 H PHE 95 -3.873 0.776 8.591 716 HA PHE 95 HA PHE 95 -2.789 3.241 7.417 717 HB2 PHE 95 1HB PHE 95 -3.989 0.777 6.034 718 HB3 PHE 95 2HB PHE 95 -3.969 2.315 5.285 719 HD1 PHE 95 1HD PHE 95 -1.592 -0.159 6.777 720 HD2 PHE 95 2HD PHE 95 -2.230 3.038 3.944 721 HE1 PHE 95 1HE PHE 95 0.655 -0.552 5.819 722 HE2 PHE 95 2HE PHE 95 -0.033 2.560 2.911 723 HZ PHE 95 HZ PHE 95 1.437 0.788 3.870 724 HA PRO 96 HA PRO 96 -7.160 4.049 8.816 725 HB2 PRO 96 1HB PRO 96 -6.704 6.179 10.465 726 HB3 PRO 96 2HB PRO 96 -6.615 4.485 11.042 727 HG2 PRO 96 1HG PRO 96 -4.331 6.278 10.150 728 HG3 PRO 96 2HG PRO 96 -4.445 5.290 11.647 729 HD2 PRO 96 1HD PRO 96 -3.141 4.414 9.421 730 HD3 PRO 96 2HD PRO 96 -4.067 3.300 10.480 731 H VAL 97 H VAL 97 -8.181 6.287 8.407 732 HA VAL 97 HA VAL 97 -7.619 7.185 5.810 733 HB VAL 97 HB VAL 97 -9.758 6.969 7.005 734 HG11 VAL 97 1HG1 VAL 97 -9.122 9.691 8.234 735 HG12 VAL 97 2HG1 VAL 97 -10.639 8.783 8.376 736 HG13 VAL 97 3HG1 VAL 97 -9.150 8.167 9.114 737 HG21 VAL 97 3HG2 VAL 97 -9.769 9.753 5.912 738 HG22 VAL 97 1HG2 VAL 97 -9.265 8.459 4.849 739 HG23 VAL 97 2HG2 VAL 97 -10.864 8.375 5.579 740 H ASN 98 H ASN 98 -5.517 7.785 7.851 741 HA ASN 98 HA ASN 98 -5.090 10.692 7.389 742 HB2 ASN 98 1HB ASN 98 -4.204 9.035 9.817 743 HB3 ASN 98 2HB ASN 98 -4.024 10.773 9.638 744 HD21 ASN 98 1HD2 ASN 98 -5.931 12.131 9.956 745 HD22 ASN 98 2HD2 ASN 98 -7.389 11.415 10.675 746 H LEU 99 H LEU 99 -3.343 7.717 8.173 747 HA LEU 99 HA LEU 99 -1.199 7.157 7.786 748 HB2 LEU 99 1HB LEU 99 -2.725 6.914 5.649 749 HB3 LEU 99 2HB LEU 99 -1.522 7.948 4.925 750 HG LEU 99 HG LEU 99 -0.649 5.795 4.498 751 HD11 LEU 99 1HD1 LEU 99 1.409 5.534 5.696 752 HD12 LEU 99 2HD1 LEU 99 0.797 6.361 7.130 753 HD13 LEU 99 3HD1 LEU 99 1.099 7.270 5.647 754 HD21 LEU 99 3HD2 LEU 99 -0.464 3.992 6.166 755 HD22 LEU 99 1HD2 LEU 99 -2.123 4.533 5.911 756 HD23 LEU 99 2HD2 LEU 99 -1.253 5.013 7.382 757 H VAL 100 H VAL 100 -0.477 9.042 9.129 758 HA VAL 100 HA VAL 100 0.898 11.173 7.636 759 HB VAL 100 HB VAL 100 0.012 11.940 9.615 760 HG11 VAL 100 1HG1 VAL 100 -0.489 9.947 10.877 761 HG12 VAL 100 2HG1 VAL 100 1.245 9.629 11.149 762 HG13 VAL 100 3HG1 VAL 100 0.467 11.047 11.868 763 HG21 VAL 100 3HG2 VAL 100 2.920 11.479 10.361 764 HG22 VAL 100 1HG2 VAL 100 2.374 12.659 9.153 765 HG23 VAL 100 2HG2 VAL 100 1.867 12.817 10.840 766 H MET 101 H MET 101 2.162 9.939 6.237 767 HA MET 101 HA MET 101 4.502 8.689 7.578 768 HB2 MET 101 1HB MET 101 5.157 7.609 5.610 769 HB3 MET 101 2HB MET 101 3.611 7.065 6.253 770 HG2 MET 101 1HG MET 101 2.510 8.547 4.530 771 HG3 MET 101 2HG MET 101 4.104 8.741 3.792 772 HE1 MET 101 3HE MET 101 1.062 7.398 3.508 773 HE2 MET 101 1HE MET 101 1.841 7.625 1.933 774 HE3 MET 101 2HE MET 101 1.206 6.018 2.375 775 H GLN 102 H GLN 102 5.268 10.694 8.230 776 HA GLN 102 HA GLN 102 6.016 12.726 6.234 777 HB2 GLN 102 1HB GLN 102 6.829 13.999 8.123 778 HB3 GLN 102 2HB GLN 102 5.127 13.614 8.211 779 HG2 GLN 102 1HG GLN 102 5.517 11.886 9.881 780 HG3 GLN 102 2HG GLN 102 7.262 12.142 9.814 781 HE21 GLN 102 1HE2 GLN 102 8.118 14.345 10.358 782 HE22 GLN 102 2HE2 GLN 102 7.192 15.319 11.492 783 H SER 103 H SER 103 7.230 11.529 4.939 784 HA SER 103 HA SER 103 9.551 9.994 5.856 785 HB2 SER 103 1HB SER 103 7.904 9.749 3.741 786 HB3 SER 103 2HB SER 103 9.107 10.810 3.001 787 HG SER 103 HG SER 103 9.553 8.698 2.598 788 H GLY 104 H GLY 104 11.594 10.535 4.338 789 HA2 GLY 104 2HA GLY 104 12.893 12.826 5.287 790 HA3 GLY 104 1HA GLY 104 13.360 11.878 3.865 791 H GLY 105 H GLY 105 10.438 12.923 2.914 792 HA2 GLY 105 2HA GLY 105 11.587 15.347 1.571 793 HA3 GLY 105 1HA GLY 105 10.464 14.227 0.793 794 H LEU 106 H LEU 106 8.412 13.772 2.273 795 HA LEU 106 HA LEU 106 7.367 16.247 3.443 796 HB2 LEU 106 1HB LEU 106 5.691 15.073 1.291 797 HB3 LEU 106 2HB LEU 106 5.830 16.722 1.830 798 HG LEU 106 HG LEU 106 8.114 16.690 0.471 799 HD11 LEU 106 1HD1 LEU 106 8.136 14.215 0.097 800 HD12 LEU 106 2HD1 LEU 106 7.958 15.058 -1.437 801 HD13 LEU 106 3HD1 LEU 106 6.536 14.330 -0.638 802 HD21 LEU 106 3HD2 LEU 106 6.969 17.288 -1.592 803 HD22 LEU 106 1HD2 LEU 106 6.106 17.987 -0.239 804 HD23 LEU 106 2HD2 LEU 106 5.456 16.537 -1.019 805 H ALA 107 H ALA 107 4.956 15.842 3.731 806 HA ALA 107 HA ALA 107 4.544 13.223 5.120 807 HB1 ALA 107 1HB ALA 107 4.372 15.409 6.458 808 HB2 ALA 107 2HB ALA 107 2.851 15.684 5.572 809 HB3 ALA 107 3HB ALA 107 3.038 14.246 6.579 810 H VAL 108 H VAL 108 3.700 11.795 3.764 811 HA VAL 108 HA VAL 108 1.814 12.546 1.668 812 HB VAL 108 HB VAL 108 2.183 9.732 2.677 813 HG11 VAL 108 1HG1 VAL 108 0.676 10.089 0.754 814 HG12 VAL 108 2HG1 VAL 108 1.987 10.943 -0.089 815 HG13 VAL 108 3HG1 VAL 108 2.105 9.200 0.234 816 HG21 VAL 108 3HG2 VAL 108 4.551 10.503 2.550 817 HG22 VAL 108 1HG2 VAL 108 4.177 9.322 1.298 818 HG23 VAL 108 2HG2 VAL 108 4.269 11.063 0.889 819 H ARG 109 H ARG 109 -0.453 11.435 1.660 820 HA ARG 109 HA ARG 109 -1.566 10.714 4.271 821 HB2 ARG 109 1HB ARG 109 -1.970 13.116 4.052 822 HB3 ARG 109 2HB ARG 109 -2.664 12.901 2.446 823 HG2 ARG 109 1HG ARG 109 -4.712 12.358 3.213 824 HG3 ARG 109 2HG ARG 109 -4.103 11.441 4.605 825 HD2 ARG 109 1HD ARG 109 -3.442 13.533 5.707 826 HD3 ARG 109 2HD ARG 109 -4.045 14.472 4.336 827 HE ARG 109 HE ARG 109 -6.253 13.064 5.157 828 HH11 ARG 109 1HH1 ARG 109 -3.940 15.245 6.812 829 HH12 ARG 109 2HH1 ARG 109 -5.126 15.862 7.911 830 HH21 ARG 109 1HH2 ARG 109 -7.762 13.850 6.668 831 HH22 ARG 109 2HH2 ARG 109 -7.324 15.123 7.776 832 H VAL 110 H VAL 110 -3.380 9.293 3.971 833 HA VAL 110 HA VAL 110 -3.405 7.874 1.460 834 HB VAL 110 HB VAL 110 -3.661 6.725 3.534 835 HG11 VAL 110 1HG1 VAL 110 -5.748 6.927 4.854 836 HG12 VAL 110 2HG1 VAL 110 -4.756 8.386 4.916 837 HG13 VAL 110 3HG1 VAL 110 -6.221 8.332 3.899 838 HG21 VAL 110 3HG2 VAL 110 -4.704 5.744 1.569 839 HG22 VAL 110 1HG2 VAL 110 -5.623 5.323 3.028 840 HG23 VAL 110 2HG2 VAL 110 -6.246 6.531 1.930 841 H ARG 111 H ARG 111 -5.375 10.475 2.706 842 HA ARG 111 HA ARG 111 -6.860 11.868 1.604 843 HB2 ARG 111 1HB ARG 111 -5.427 11.480 -0.389 844 HB3 ARG 111 2HB ARG 111 -6.605 10.252 -0.904 845 HG2 ARG 111 1HG ARG 111 -8.431 11.909 -0.807 846 HG3 ARG 111 2HG ARG 111 -7.297 13.096 -0.116 847 HD2 ARG 111 1HD ARG 111 -7.478 13.710 -2.293 848 HD3 ARG 111 2HD ARG 111 -5.925 12.906 -2.165 849 HE ARG 111 HE ARG 111 -6.737 11.005 -3.347 850 HH11 ARG 111 1HH1 ARG 111 -9.328 13.448 -3.085 851 HH12 ARG 111 2HH1 ARG 111 -10.011 13.054 -4.631 852 HH21 ARG 111 1HH2 ARG 111 -7.735 10.408 -5.252 853 HH22 ARG 111 2HH2 ARG 111 -9.239 11.108 -5.769 854 H THR 112 H THR 112 -7.488 8.409 0.654 855 HA THR 112 HA THR 112 -10.379 8.819 1.131 856 HB THR 112 HB THR 112 -10.572 6.634 0.037 857 HG1 THR 112 1HG THR 112 -8.741 5.604 0.459 858 HG21 THR 112 3HG2 THR 112 -8.836 8.526 -1.624 859 HG22 THR 112 1HG2 THR 112 -10.588 8.693 -1.363 860 HG23 THR 112 2HG2 THR 112 -9.947 7.287 -2.237 861 HA PRO 113 HA PRO 113 -9.968 5.768 4.573 862 HB2 PRO 113 1HB PRO 113 -12.353 4.459 4.410 863 HB3 PRO 113 2HB PRO 113 -12.256 6.141 5.015 864 HG2 PRO 113 1HG PRO 113 -12.887 5.225 2.191 865 HG3 PRO 113 2HG PRO 113 -13.836 6.352 3.217 866 HD2 PRO 113 1HD PRO 113 -12.067 7.229 1.366 867 HD3 PRO 113 2HD PRO 113 -12.267 8.081 2.918 868 H ILE 114 H ILE 114 -10.578 3.194 4.451 869 HA ILE 114 HA ILE 114 -9.152 2.040 2.145 870 HB ILE 114 HB ILE 114 -10.226 0.851 4.751 871 HG12 ILE 114 1HG1 ILE 114 -8.431 2.514 5.249 872 HG13 ILE 114 2HG1 ILE 114 -8.012 0.876 5.683 873 HG21 ILE 114 1HG2 ILE 114 -8.579 -0.952 4.315 874 HG22 ILE 114 2HG2 ILE 114 -9.936 -0.954 3.206 875 HG23 ILE 114 3HG2 ILE 114 -8.364 -0.339 2.658 876 HD11 ILE 114 3HD1 ILE 114 -6.176 2.205 4.542 877 HD12 ILE 114 1HD1 ILE 114 -6.519 0.630 3.836 878 HD13 ILE 114 2HD1 ILE 114 -7.131 2.119 3.061 879 H SER 115 H SER 115 -10.193 0.189 1.038 880 HA SER 115 HA SER 115 -12.980 -0.344 1.723 881 HB2 SER 115 1HB SER 115 -12.296 -0.300 -1.182 882 HB3 SER 115 2HB SER 115 -13.878 -0.207 -0.424 883 HG SER 115 HG SER 115 -13.398 1.866 -1.208 884 H ASN 116 H ASN 116 -13.640 -2.443 0.768 885 HA ASN 116 HA ASN 116 -11.633 -4.365 -0.071 886 HB2 ASN 116 1HB ASN 116 -11.229 -4.569 2.286 887 HB3 ASN 116 2HB ASN 116 -12.951 -4.498 2.659 888 HD21 ASN 116 1HD2 ASN 116 -14.238 -6.427 2.451 889 HD22 ASN 116 2HD2 ASN 116 -13.571 -7.919 1.781 890 H GLY 117 H GLY 117 -12.750 -6.296 -0.923 891 HA2 GLY 117 2HA GLY 117 -15.703 -6.178 -1.123 892 HA3 GLY 117 1HA GLY 117 -14.744 -6.217 -2.594 893 H GLN 118 H GLN 118 -16.256 -8.340 -2.646 894 HA GLN 118 HA GLN 118 -15.460 -10.584 -1.123 895 HB2 GLN 118 1HB GLN 118 -17.123 -9.932 -3.537 896 HB3 GLN 118 2HB GLN 118 -16.550 -11.570 -3.419 897 HG2 GLN 118 1HG GLN 118 -17.540 -11.780 -1.135 898 HG3 GLN 118 2HG GLN 118 -18.162 -10.133 -1.295 899 HE21 GLN 118 1HE2 GLN 118 -18.246 -13.337 -2.952 900 HE22 GLN 118 2HE2 GLN 118 -19.870 -13.145 -3.611 901 HA PRO 119 HA PRO 119 -11.826 -11.590 -3.409 902 HB2 PRO 119 1HB PRO 119 -11.501 -14.265 -2.878 903 HB3 PRO 119 2HB PRO 119 -11.264 -12.979 -1.663 904 HG2 PRO 119 1HG PRO 119 -13.717 -14.708 -2.116 905 HG3 PRO 119 2HG PRO 119 -12.931 -14.294 -0.558 906 HD2 PRO 119 1HD PRO 119 -15.133 -12.958 -1.496 907 HD3 PRO 119 2HD PRO 119 -13.886 -12.117 -0.566 908 H THR 120 H THR 120 -11.073 -12.268 -5.354 909 HA THR 120 HA THR 120 -12.742 -13.703 -7.262 910 HB THR 120 HB THR 120 -9.750 -13.123 -7.363 911 HG1 THR 120 1HG THR 120 -11.735 -11.359 -8.339 912 HG21 THR 120 3HG2 THR 120 -11.878 -13.352 -9.539 913 HG22 THR 120 1HG2 THR 120 -10.615 -14.554 -9.169 914 HG23 THR 120 2HG2 THR 120 -10.163 -12.956 -9.793 915 H THR 121 H THR 121 -13.045 -15.929 -6.865 916 HA THR 121 HA THR 121 -11.161 -17.474 -5.293 917 HB THR 121 HB THR 121 -13.367 -18.491 -7.121 918 HG1 THR 121 1HG THR 121 -13.660 -17.768 -4.396 919 HG21 THR 121 3HG2 THR 121 -11.879 -20.161 -6.119 920 HG22 THR 121 1HG2 THR 121 -13.502 -20.292 -5.421 921 HG23 THR 121 2HG2 THR 121 -12.185 -19.521 -4.508 922 H GLY 122 H GLY 122 -9.336 -18.484 -6.109 923 HA2 GLY 122 2HA GLY 122 -8.972 -18.757 -9.037 924 HA3 GLY 122 1HA GLY 122 -7.679 -18.690 -7.827 925 H ASP 123 H ASP 123 -7.100 -20.682 -9.002 926 HA ASP 123 HA ASP 123 -8.483 -23.072 -9.161 927 HB2 ASP 123 1HB ASP 123 -6.312 -22.634 -10.177 928 HB3 ASP 123 2HB ASP 123 -5.540 -22.628 -8.605 929 H ALA 124 H ALA 124 -6.282 -22.149 -6.518 930 HA ALA 124 HA ALA 124 -7.907 -23.463 -4.454 931 HB1 ALA 124 1HB ALA 124 -4.986 -24.192 -5.027 932 HB2 ALA 124 2HB ALA 124 -5.965 -24.790 -3.671 933 HB3 ALA 124 3HB ALA 124 -6.381 -25.250 -5.333 934 H ASP 125 H ASP 125 -6.984 -20.673 -5.301 935 HA ASP 125 HA ASP 125 -5.920 -19.804 -2.692 936 HB2 ASP 125 1HB ASP 125 -4.962 -18.790 -5.409 937 HB3 ASP 125 2HB ASP 125 -4.699 -17.961 -3.885 938 H HIS 126 H HIS 126 -6.503 -17.340 -2.525 939 HA HIS 126 HA HIS 126 -8.481 -16.459 -4.491 940 HB2 HIS 126 1HB HIS 126 -10.327 -16.299 -3.076 941 HB3 HIS 126 2HB HIS 126 -9.566 -17.831 -2.619 942 HD1 HIS 126 1HD HIS 126 -10.679 -14.673 -0.998 943 HD2 HIS 126 2HD HIS 126 -8.265 -18.050 -0.326 944 HE1 HIS 126 1HE HIS 126 -10.387 -14.844 1.528 945 H THR 127 H THR 127 -8.878 -14.167 -4.409 946 HA THR 127 HA THR 127 -7.084 -12.584 -2.640 947 HB THR 127 HB THR 127 -7.322 -11.985 -5.613 948 HG1 THR 127 1HG THR 127 -6.544 -14.001 -5.754 949 HG21 THR 127 3HG2 THR 127 -5.076 -11.060 -5.238 950 HG22 THR 127 1HG2 THR 127 -5.166 -11.494 -3.541 951 HG23 THR 127 2HG2 THR 127 -6.303 -10.300 -4.193 952 H VAL 128 H VAL 128 -8.159 -11.098 -1.623 953 HA VAL 128 HA VAL 128 -10.777 -10.121 -2.572 954 HB VAL 128 HB VAL 128 -10.430 -8.656 -0.494 955 HG11 VAL 128 1HG1 VAL 128 -12.053 -10.528 -0.691 956 HG12 VAL 128 2HG1 VAL 128 -10.827 -11.593 0.057 957 HG13 VAL 128 3HG1 VAL 128 -11.492 -10.194 0.937 958 HG21 VAL 128 3HG2 VAL 128 -8.065 -9.105 -0.162 959 HG22 VAL 128 1HG2 VAL 128 -9.050 -9.408 1.267 960 HG23 VAL 128 2HG2 VAL 128 -8.460 -10.786 0.312 961 HA PRO 129 HA PRO 129 -8.859 -6.425 -4.241 962 HB2 PRO 129 1HB PRO 129 -11.093 -5.006 -4.858 963 HB3 PRO 129 2HB PRO 129 -10.670 -6.542 -5.661 964 HG2 PRO 129 1HG PRO 129 -12.630 -6.083 -3.398 965 HG3 PRO 129 2HG PRO 129 -12.854 -7.110 -4.848 966 HD2 PRO 129 1HD PRO 129 -12.068 -8.070 -2.392 967 HD3 PRO 129 2HD PRO 129 -11.690 -8.832 -3.964 968 H ILE 130 H ILE 130 -7.759 -5.709 -2.443 969 HA ILE 130 HA ILE 130 -9.148 -3.686 -0.706 970 HB ILE 130 HB ILE 130 -6.550 -5.152 -0.105 971 HG12 ILE 130 1HG1 ILE 130 -9.354 -5.549 1.019 972 HG13 ILE 130 2HG1 ILE 130 -8.483 -6.698 0.005 973 HG21 ILE 130 1HG2 ILE 130 -6.780 -2.848 0.904 974 HG22 ILE 130 2HG2 ILE 130 -8.300 -3.376 1.668 975 HG23 ILE 130 3HG2 ILE 130 -6.757 -4.120 2.104 976 HD11 ILE 130 3HD1 ILE 130 -8.349 -7.489 2.262 977 HD12 ILE 130 1HD1 ILE 130 -6.735 -6.886 1.825 978 HD13 ILE 130 2HD1 ILE 130 -7.814 -5.928 2.869 979 H SER 131 H SER 131 -8.566 -1.569 -1.014 980 HA SER 131 HA SER 131 -5.931 -0.782 -1.543 981 HB2 SER 131 1HB SER 131 -6.302 0.317 -3.803 982 HB3 SER 131 2HB SER 131 -6.190 -1.435 -3.795 983 HG SER 131 HG SER 131 -8.676 -1.219 -3.649 984 H LEU 132 H LEU 132 -5.670 1.556 -1.815 985 HA LEU 132 HA LEU 132 -7.993 3.280 -1.369 986 HB2 LEU 132 1HB LEU 132 -6.686 4.495 0.396 987 HB3 LEU 132 2HB LEU 132 -7.409 2.977 0.856 988 HG LEU 132 HG LEU 132 -5.227 3.424 1.858 989 HD11 LEU 132 1HD1 LEU 132 -6.052 1.006 1.363 990 HD12 LEU 132 2HD1 LEU 132 -4.437 1.308 2.004 991 HD13 LEU 132 3HD1 LEU 132 -4.666 0.954 0.270 992 HD21 LEU 132 3HD2 LEU 132 -4.227 4.554 -0.183 993 HD22 LEU 132 1HD2 LEU 132 -3.986 2.934 -0.832 994 HD23 LEU 132 2HD2 LEU 132 -3.165 3.427 0.676 995 H GLY 133 H GLY 133 -7.221 5.683 -1.628 996 HA2 GLY 133 2HA GLY 133 -5.428 5.725 -4.032 997 HA3 GLY 133 1HA GLY 133 -6.997 6.502 -3.950 998 H TYR 134 H TYR 134 -3.715 6.722 -3.181 999 HA TYR 134 HA TYR 134 -3.985 8.815 -1.110 1000 HB2 TYR 134 1HB TYR 134 -1.608 8.406 -0.698 1001 HB3 TYR 134 2HB TYR 134 -2.525 6.926 -0.627 1002 HD1 TYR 134 2HD TYR 134 -2.384 5.248 -2.584 1003 HD2 TYR 134 1HD TYR 134 0.257 8.626 -2.151 1004 HE1 TYR 134 2HE TYR 134 -0.814 4.246 -4.233 1005 HE2 TYR 134 1HE TYR 134 1.858 7.576 -3.727 1006 HH TYR 134 HH TYR 134 1.037 4.669 -5.658 1007 H ASP 135 H ASP 135 -2.178 10.552 -1.162 1008 HA ASP 135 HA ASP 135 -1.634 11.750 -3.741 1009 HB2 ASP 135 1HB ASP 135 -2.894 13.710 -3.469 1010 HB3 ASP 135 2HB ASP 135 -4.036 12.424 -3.139 1011 H VAL 136 H VAL 136 -1.046 14.399 -2.571 1012 HA VAL 136 HA VAL 136 1.134 13.665 -0.786 1013 HB VAL 136 HB VAL 136 1.521 13.512 -3.447 1014 HG11 VAL 136 1HG1 VAL 136 2.082 16.436 -3.028 1015 HG12 VAL 136 2HG1 VAL 136 2.382 15.476 -4.494 1016 HG13 VAL 136 3HG1 VAL 136 0.720 15.791 -3.929 1017 HG21 VAL 136 3HG2 VAL 136 3.055 13.001 -1.742 1018 HG22 VAL 136 1HG2 VAL 136 3.800 13.769 -3.156 1019 HG23 VAL 136 2HG2 VAL 136 3.567 14.719 -1.659 1020 H GLN 137 H GLN 137 2.178 15.698 -0.073 1021 HA GLN 137 HA GLN 137 0.384 18.082 -0.006 1022 HB2 GLN 137 1HB GLN 137 2.324 16.958 2.086 1023 HB3 GLN 137 2HB GLN 137 1.769 18.633 2.080 1024 HG2 GLN 137 1HG GLN 137 -0.610 17.685 1.876 1025 HG3 GLN 137 2HG GLN 137 0.114 16.110 2.275 1026 HE21 GLN 137 1HE2 GLN 137 0.911 15.757 4.427 1027 HE22 GLN 137 2HE2 GLN 137 0.446 16.823 5.766 1028 H PHE 138 H PHE 138 1.685 20.028 0.521 1029 HA PHE 138 HA PHE 138 4.342 20.342 -0.497 1030 HB2 PHE 138 1HB PHE 138 2.035 20.443 -2.217 1031 HB3 PHE 138 2HB PHE 138 2.498 22.090 -1.895 1032 HD1 PHE 138 2HD PHE 138 4.748 19.150 -2.128 1033 HD2 PHE 138 1HD PHE 138 3.412 22.767 -4.000 1034 HE1 PHE 138 2HE PHE 138 6.463 18.847 -3.931 1035 HE2 PHE 138 1HE PHE 138 5.054 22.482 -5.801 1036 HZ PHE 138 HZ PHE 138 6.614 20.513 -5.782 1037 H TYR 139 H TYR 139 3.362 20.620 1.945 1038 HA TYR 139 HA TYR 139 2.308 23.239 2.629 1039 HB2 TYR 139 1HB TYR 139 3.030 22.664 4.979 1040 HB3 TYR 139 2HB TYR 139 1.931 21.526 4.233 1041 HD1 TYR 139 2HD TYR 139 5.660 21.984 4.865 1042 HD2 TYR 139 1HD TYR 139 2.337 19.276 4.324 1043 HE1 TYR 139 2HE TYR 139 7.136 20.090 5.366 1044 HE2 TYR 139 1HE TYR 139 3.811 17.386 4.795 1045 HH TYR 139 HH TYR 139 7.329 17.750 5.363 1046 HA PRO 140 HA PRO 140 6.174 25.553 2.708 1047 HB2 PRO 140 1HB PRO 140 5.804 27.180 4.916 1048 HB3 PRO 140 2HB PRO 140 5.062 27.491 3.309 1049 HG2 PRO 140 1HG PRO 140 3.845 26.177 5.747 1050 HG3 PRO 140 2HG PRO 140 3.117 27.400 4.657 1051 HD2 PRO 140 1HD PRO 140 2.555 24.749 4.421 1052 HD3 PRO 140 2HD PRO 140 2.708 25.789 2.979 1053 H GLU 141 H GLU 141 8.066 24.724 3.462 1054 HA GLU 141 HA GLU 141 8.124 22.918 5.765 1055 HB2 GLU 141 1HB GLU 141 10.392 23.895 3.974 1056 HB3 GLU 141 2HB GLU 141 10.486 22.610 5.184 1057 HG2 GLU 141 1HG GLU 141 8.350 21.730 3.680 1058 HG3 GLU 141 2HG GLU 141 9.294 22.575 2.449 Start of MODEL 17 1 H1 GLY 1 H GLY 1 13.358 13.656 -11.820 2 HA2 GLY 1 2HA GLY 1 11.757 12.048 -10.784 3 HA3 GLY 1 1HA GLY 1 13.190 11.225 -10.139 4 H MET 2 H MET 2 13.724 11.850 -8.120 5 HA MET 2 HA MET 2 14.001 12.966 -6.212 6 HB2 MET 2 1HB MET 2 14.135 15.229 -8.060 7 HB3 MET 2 2HB MET 2 13.208 15.682 -6.633 8 HG2 MET 2 1HG MET 2 15.559 16.174 -6.317 9 HG3 MET 2 2HG MET 2 15.043 14.921 -5.191 10 HE1 MET 2 3HE MET 2 18.082 15.375 -5.480 11 HE2 MET 2 1HE MET 2 17.411 13.994 -4.566 12 HE3 MET 2 2HE MET 2 18.694 13.733 -5.770 13 H SER 3 H SER 3 12.690 13.851 -4.425 14 HA SER 3 HA SER 3 10.893 14.116 -3.210 15 HB2 SER 3 1HB SER 3 9.262 14.557 -5.738 16 HB3 SER 3 2HB SER 3 8.775 14.908 -4.071 17 HG SER 3 HG SER 3 10.475 16.384 -3.911 18 H GLN 4 H GLN 4 9.668 12.269 -6.045 19 HA GLN 4 HA GLN 4 7.913 10.590 -4.771 20 HB2 GLN 4 1HB GLN 4 8.099 10.736 -7.177 21 HB3 GLN 4 2HB GLN 4 9.744 10.123 -7.152 22 HG2 GLN 4 1HG GLN 4 8.290 8.439 -7.974 23 HG3 GLN 4 2HG GLN 4 8.950 7.891 -6.458 24 HE21 GLN 4 1HE2 GLN 4 7.401 8.318 -4.472 25 HE22 GLN 4 2HE2 GLN 4 5.736 7.867 -4.772 26 H ASP 5 H ASP 5 11.458 9.910 -5.203 27 HA ASP 5 HA ASP 5 11.571 7.311 -4.292 28 HB2 ASP 5 1HB ASP 5 13.547 9.517 -3.572 29 HB3 ASP 5 2HB ASP 5 13.876 7.779 -3.612 30 H LEU 6 H LEU 6 11.270 10.273 -2.403 31 HA LEU 6 HA LEU 6 11.833 9.021 0.165 32 HB2 LEU 6 1HB LEU 6 10.824 11.777 -0.687 33 HB3 LEU 6 2HB LEU 6 11.112 11.326 1.001 34 HG LEU 6 HG LEU 6 13.255 11.114 -1.171 35 HD11 LEU 6 1HD1 LEU 6 12.975 13.418 0.752 36 HD12 LEU 6 2HD1 LEU 6 12.321 13.463 -0.902 37 HD13 LEU 6 3HD1 LEU 6 14.073 13.266 -0.596 38 HD21 LEU 6 3HD2 LEU 6 13.415 11.226 1.880 39 HD22 LEU 6 1HD2 LEU 6 14.800 11.196 0.774 40 HD23 LEU 6 2HD2 LEU 6 13.723 9.809 0.859 41 H ILE 7 H ILE 7 8.893 10.285 -1.496 42 HA ILE 7 HA ILE 7 7.040 9.341 0.452 43 HB ILE 7 HB ILE 7 6.732 9.676 -2.554 44 HG12 ILE 7 1HG1 ILE 7 5.239 11.599 -1.132 45 HG13 ILE 7 2HG1 ILE 7 6.735 11.506 -0.207 46 HG21 ILE 7 1HG2 ILE 7 4.544 9.248 -0.487 47 HG22 ILE 7 2HG2 ILE 7 4.294 9.731 -2.175 48 HG23 ILE 7 3HG2 ILE 7 4.972 8.147 -1.804 49 HD11 ILE 7 3HD1 ILE 7 6.698 11.891 -3.220 50 HD12 ILE 7 1HD1 ILE 7 6.654 13.228 -2.065 51 HD13 ILE 7 2HD1 ILE 7 8.033 12.148 -2.049 52 H ARG 8 H ARG 8 8.547 7.559 -2.277 53 HA ARG 8 HA ARG 8 7.158 5.081 -1.928 54 HB2 ARG 8 1HB ARG 8 8.712 5.822 -3.855 55 HB3 ARG 8 2HB ARG 8 10.059 5.463 -2.779 56 HG2 ARG 8 1HG ARG 8 9.063 3.061 -2.621 57 HG3 ARG 8 2HG ARG 8 8.075 3.539 -4.019 58 HD2 ARG 8 1HD ARG 8 10.343 4.361 -5.036 59 HD3 ARG 8 2HD ARG 8 11.098 3.431 -3.740 60 HE ARG 8 HE ARG 8 9.165 2.119 -5.592 61 HH11 ARG 8 1HH1 ARG 8 12.552 2.451 -4.507 62 HH12 ARG 8 2HH1 ARG 8 13.129 1.227 -5.599 63 HH21 ARG 8 1HH2 ARG 8 10.051 0.464 -7.067 64 HH22 ARG 8 2HH2 ARG 8 11.735 0.106 -6.950 65 H ALA 9 H ALA 9 10.295 6.241 -0.570 66 HA ALA 9 HA ALA 9 10.794 4.020 1.010 67 HB1 ALA 9 1HB ALA 9 12.411 5.817 0.405 68 HB2 ALA 9 2HB ALA 9 11.614 6.898 1.580 69 HB3 ALA 9 3HB ALA 9 12.428 5.412 2.127 70 H ALA 10 H ALA 10 8.438 6.529 1.662 71 HA ALA 10 HA ALA 10 8.337 5.986 4.543 72 HB1 ALA 10 1HB ALA 10 6.349 7.368 2.687 73 HB2 ALA 10 2HB ALA 10 6.222 7.255 4.447 74 HB3 ALA 10 3HB ALA 10 7.575 8.132 3.729 75 H PHE 11 H PHE 11 7.003 4.449 1.647 76 HA PHE 11 HA PHE 11 4.696 3.365 3.051 77 HB2 PHE 11 1HB PHE 11 5.864 2.840 0.296 78 HB3 PHE 11 2HB PHE 11 4.435 2.062 0.929 79 HD1 PHE 11 2HD PHE 11 4.759 5.743 1.778 80 HD2 PHE 11 1HD PHE 11 3.241 2.809 -1.052 81 HE1 PHE 11 2HE PHE 11 3.292 7.387 0.856 82 HE2 PHE 11 1HE PHE 11 1.667 4.544 -1.894 83 HZ PHE 11 HZ PHE 11 1.698 6.828 -0.954 84 H GLU 12 H GLU 12 7.922 2.090 2.054 85 HA GLU 12 HA GLU 12 7.506 -0.542 3.092 86 HB2 GLU 12 1HB GLU 12 10.034 -0.606 3.132 87 HB3 GLU 12 2HB GLU 12 9.259 -0.329 1.577 88 HG2 GLU 12 1HG GLU 12 9.702 2.073 1.733 89 HG3 GLU 12 2HG GLU 12 10.478 1.853 3.303 90 H LYS 13 H LYS 13 8.356 2.502 4.686 91 HA LYS 13 HA LYS 13 9.151 1.329 7.212 92 HB2 LYS 13 1HB LYS 13 8.195 4.119 6.418 93 HB3 LYS 13 2HB LYS 13 8.765 3.711 8.023 94 HG2 LYS 13 1HG LYS 13 10.621 3.022 5.767 95 HG3 LYS 13 2HG LYS 13 10.314 4.731 6.079 96 HD2 LYS 13 1HD LYS 13 11.031 4.550 8.376 97 HD3 LYS 13 2HD LYS 13 11.246 2.780 8.220 98 HE2 LYS 13 1HE LYS 13 12.928 3.058 6.526 99 HE3 LYS 13 2HE LYS 13 12.629 4.794 6.401 100 HZ1 LYS 13 3HZ LYS 13 13.538 5.099 8.576 101 HZ2 LYS 13 1HZ LYS 13 14.615 4.198 7.671 102 HZ3 LYS 13 2HZ LYS 13 13.717 3.496 8.830 103 H ARG 14 H ARG 14 6.186 1.371 5.632 104 HA ARG 14 HA ARG 14 4.801 1.234 8.228 105 HB2 ARG 14 1HB ARG 14 4.207 2.985 6.042 106 HB3 ARG 14 2HB ARG 14 2.990 1.736 6.015 107 HG2 ARG 14 1HG ARG 14 2.135 3.514 7.322 108 HG3 ARG 14 2HG ARG 14 2.503 2.234 8.466 109 HD2 ARG 14 1HD ARG 14 4.361 4.590 7.865 110 HD3 ARG 14 2HD ARG 14 3.117 4.645 9.109 111 HE ARG 14 HE ARG 14 5.627 3.093 9.159 112 HH11 ARG 14 1HH1 ARG 14 2.543 3.811 10.900 113 HH12 ARG 14 2HH1 ARG 14 3.082 3.113 12.347 114 HH21 ARG 14 1HH2 ARG 14 6.389 2.373 11.176 115 HH22 ARG 14 2HH2 ARG 14 5.333 2.433 12.552 116 H LEU 15 H LEU 15 4.245 0.110 4.858 117 HA LEU 15 HA LEU 15 2.724 -2.093 5.743 118 HB2 LEU 15 1HB LEU 15 2.658 -1.055 3.465 119 HB3 LEU 15 2HB LEU 15 4.255 -1.717 3.125 120 HG LEU 15 HG LEU 15 3.327 -4.037 3.371 121 HD11 LEU 15 1HD1 LEU 15 0.631 -2.605 3.566 122 HD12 LEU 15 2HD1 LEU 15 1.371 -3.605 4.834 123 HD13 LEU 15 3HD1 LEU 15 0.857 -4.348 3.321 124 HD21 LEU 15 3HD2 LEU 15 2.005 -2.165 1.395 125 HD22 LEU 15 1HD2 LEU 15 1.980 -3.926 1.236 126 HD23 LEU 15 2HD2 LEU 15 3.527 -3.043 1.164 127 H SER 16 H SER 16 6.222 -1.954 4.831 128 HA SER 16 HA SER 16 6.531 -4.824 5.149 129 HB2 SER 16 1HB SER 16 7.991 -3.245 3.702 130 HB3 SER 16 2HB SER 16 8.781 -2.775 5.212 131 HG SER 16 HG SER 16 9.593 -4.715 5.459 132 H ASP 17 H ASP 17 7.363 -1.919 7.008 133 HA ASP 17 HA ASP 17 8.538 -3.151 9.168 134 HB2 ASP 17 1HB ASP 17 8.357 -0.664 8.393 135 HB3 ASP 17 2HB ASP 17 6.942 -0.595 9.436 136 H TRP 18 H TRP 18 5.080 -2.777 8.586 137 HA TRP 18 HA TRP 18 4.221 -3.800 11.197 138 HB2 TRP 18 1HB TRP 18 2.626 -2.504 10.194 139 HB3 TRP 18 2HB TRP 18 2.892 -3.099 8.600 140 HD1 TRP 18 HD TRP 18 1.035 -4.003 11.837 141 HE1 TRP 18 1HE TRP 18 -0.894 -5.620 11.290 142 HE3 TRP 18 3HE TRP 18 2.198 -5.092 6.962 143 HZ2 TRP 18 2HZ TRP 18 -1.756 -7.193 9.088 144 HZ3 TRP 18 3HZ TRP 18 0.950 -6.882 5.767 145 HH2 TRP 18 HH TRP 18 -1.112 -7.921 6.884 146 H ALA 19 H ALA 19 4.493 -5.170 7.849 147 HA ALA 19 HA ALA 19 3.319 -7.619 8.576 148 HB1 ALA 19 1HB ALA 19 3.535 -7.056 6.203 149 HB2 ALA 19 2HB ALA 19 5.326 -6.947 6.350 150 HB3 ALA 19 3HB ALA 19 4.566 -8.502 6.484 151 H LYS 20 H LYS 20 6.602 -6.623 9.201 152 HA LYS 20 HA LYS 20 7.513 -9.366 9.724 153 HB2 LYS 20 1HB LYS 20 9.600 -8.198 10.497 154 HB3 LYS 20 2HB LYS 20 9.135 -7.681 8.873 155 HG2 LYS 20 1HG LYS 20 8.338 -5.560 9.666 156 HG3 LYS 20 2HG LYS 20 8.276 -6.108 11.320 157 HD2 LYS 20 1HD LYS 20 10.822 -6.334 11.193 158 HD3 LYS 20 2HD LYS 20 10.689 -5.284 9.755 159 HE2 LYS 20 1HE LYS 20 9.247 -3.720 11.165 160 HE3 LYS 20 2HE LYS 20 9.531 -4.782 12.552 161 HZ1 LYS 20 3HZ LYS 20 10.933 -2.928 12.656 162 HZ2 LYS 20 1HZ LYS 20 11.511 -3.077 11.170 163 HZ3 LYS 20 2HZ LYS 20 11.927 -4.191 12.334 164 H ALA 21 H ALA 21 5.885 -6.911 11.498 165 HA ALA 21 HA ALA 21 6.688 -7.923 14.164 166 HB1 ALA 21 1HB ALA 21 5.305 -5.335 13.284 167 HB2 ALA 21 2HB ALA 21 5.779 -5.750 14.956 168 HB3 ALA 21 3HB ALA 21 7.035 -5.498 13.719 169 H ARG 22 H ARG 22 4.588 -8.654 11.939 170 HA ARG 22 HA ARG 22 1.975 -8.620 13.139 171 HB2 ARG 22 1HB ARG 22 3.000 -8.784 10.589 172 HB3 ARG 22 2HB ARG 22 2.902 -10.497 10.973 173 HG2 ARG 22 1HG ARG 22 0.448 -9.879 11.733 174 HG3 ARG 22 2HG ARG 22 0.717 -8.444 10.740 175 HD2 ARG 22 1HD ARG 22 1.430 -11.122 9.456 176 HD3 ARG 22 2HD ARG 22 -0.206 -10.799 9.873 177 HE ARG 22 HE ARG 22 -0.514 -9.218 8.413 178 HH11 ARG 22 1HH1 ARG 22 2.967 -9.704 8.576 179 HH12 ARG 22 2HH1 ARG 22 3.273 -9.583 6.874 180 HH21 ARG 22 1HH2 ARG 22 -0.183 -9.289 6.092 181 HH22 ARG 22 2HH2 ARG 22 1.398 -9.339 5.377 182 H THR 23 H THR 23 0.840 -10.893 13.424 183 HA THR 23 HA THR 23 2.670 -12.725 14.806 184 HB THR 23 HB THR 23 -0.317 -12.911 14.339 185 HG1 THR 23 1HG THR 23 1.079 -11.396 15.909 186 HG21 THR 23 3HG2 THR 23 1.550 -14.546 16.090 187 HG22 THR 23 1HG2 THR 23 0.889 -15.094 14.549 188 HG23 THR 23 2HG2 THR 23 -0.207 -14.761 15.907 189 HA PRO 24 HA PRO 24 1.705 -15.838 11.477 190 HB2 PRO 24 1HB PRO 24 0.470 -15.083 9.078 191 HB3 PRO 24 2HB PRO 24 -0.288 -15.877 10.464 192 HG2 PRO 24 1HG PRO 24 -0.285 -12.990 9.688 193 HG3 PRO 24 2HG PRO 24 -1.604 -13.927 10.426 194 HD2 PRO 24 1HD PRO 24 -0.077 -12.247 11.880 195 HD3 PRO 24 2HD PRO 24 -0.701 -13.803 12.543 196 H ALA 25 H ALA 25 2.918 -12.986 10.887 197 HA ALA 25 HA ALA 25 4.475 -11.862 9.546 198 HB1 ALA 25 1HB ALA 25 6.588 -12.865 9.666 199 HB2 ALA 25 2HB ALA 25 5.694 -13.367 11.110 200 HB3 ALA 25 3HB ALA 25 5.895 -14.492 9.774 201 H LEU 26 H LEU 26 4.019 -11.237 7.497 202 HA LEU 26 HA LEU 26 4.050 -13.388 5.395 203 HB2 LEU 26 1HB LEU 26 2.553 -10.690 5.321 204 HB3 LEU 26 2HB LEU 26 2.655 -11.873 4.054 205 HG LEU 26 HG LEU 26 0.611 -12.087 5.084 206 HD11 LEU 26 1HD1 LEU 26 1.857 -14.151 4.225 207 HD12 LEU 26 2HD1 LEU 26 0.534 -14.534 5.343 208 HD13 LEU 26 3HD1 LEU 26 2.205 -14.547 5.948 209 HD21 LEU 26 3HD2 LEU 26 0.145 -11.563 7.087 210 HD22 LEU 26 1HD2 LEU 26 1.674 -12.248 7.727 211 HD23 LEU 26 2HD2 LEU 26 0.336 -13.281 7.330 212 HA PRO 27 HA PRO 27 7.354 -11.117 3.465 213 HB2 PRO 27 1HB PRO 27 7.291 -12.181 0.929 214 HB3 PRO 27 2HB PRO 27 7.829 -13.101 2.351 215 HG2 PRO 27 1HG PRO 27 5.077 -13.090 1.068 216 HG3 PRO 27 2HG PRO 27 6.069 -14.513 1.548 217 HD2 PRO 27 1HD PRO 27 4.083 -13.522 3.155 218 HD3 PRO 27 2HD PRO 27 5.607 -14.173 3.845 219 H VAL 28 H VAL 28 7.782 -9.713 1.476 220 HA VAL 28 HA VAL 28 5.375 -7.993 0.983 221 HB VAL 28 HB VAL 28 8.095 -7.122 2.032 222 HG11 VAL 28 1HG1 VAL 28 5.527 -5.496 1.812 223 HG12 VAL 28 2HG1 VAL 28 7.083 -4.946 2.433 224 HG13 VAL 28 3HG1 VAL 28 6.914 -5.340 0.731 225 HG21 VAL 28 3HG2 VAL 28 6.950 -8.333 3.826 226 HG22 VAL 28 1HG2 VAL 28 6.977 -6.630 4.166 227 HG23 VAL 28 2HG2 VAL 28 5.479 -7.376 3.567 228 H ALA 29 H ALA 29 5.617 -9.223 -1.167 229 HA ALA 29 HA ALA 29 7.854 -8.506 -2.866 230 HB1 ALA 29 1HB ALA 29 5.201 -9.867 -3.510 231 HB2 ALA 29 2HB ALA 29 6.583 -9.688 -4.604 232 HB3 ALA 29 3HB ALA 29 6.745 -10.669 -3.128 233 H TRP 30 H TRP 30 7.937 -6.305 -2.983 234 HA TRP 30 HA TRP 30 5.782 -4.658 -4.021 235 HB2 TRP 30 1HB TRP 30 8.804 -4.326 -4.122 236 HB3 TRP 30 2HB TRP 30 7.640 -3.095 -4.573 237 HD1 TRP 30 HD TRP 30 9.578 -4.321 -1.657 238 HE1 TRP 30 1HE TRP 30 8.952 -3.003 0.451 239 HE3 TRP 30 3HE TRP 30 5.366 -1.942 -3.364 240 HZ2 TRP 30 2HZ TRP 30 6.720 -1.443 1.389 241 HZ3 TRP 30 3HZ TRP 30 4.053 -0.496 -1.831 242 HH2 TRP 30 HH TRP 30 4.686 -0.281 0.554 243 H GLN 31 H GLN 31 5.533 -3.943 -6.157 244 HA GLN 31 HA GLN 31 6.033 -5.488 -8.447 245 HB2 GLN 31 1HB GLN 31 5.791 -3.304 -9.657 246 HB3 GLN 31 2HB GLN 31 4.478 -3.687 -8.554 247 HG2 GLN 31 1HG GLN 31 4.754 -1.853 -7.350 248 HG3 GLN 31 2HG GLN 31 6.453 -2.131 -7.088 249 HE21 GLN 31 1HE2 GLN 31 5.133 -1.501 -10.353 250 HE22 GLN 31 2HE2 GLN 31 5.595 0.132 -10.443 251 H ASN 32 H ASN 32 7.530 -5.339 -10.111 252 HA ASN 32 HA ASN 32 9.400 -5.361 -11.194 253 HB2 ASN 32 1HB ASN 32 10.346 -2.967 -9.569 254 HB3 ASN 32 2HB ASN 32 11.096 -3.637 -11.006 255 HD21 ASN 32 1HD2 ASN 32 8.207 -1.987 -9.817 256 HD22 ASN 32 2HD2 ASN 32 7.607 -1.466 -11.373 257 H THR 33 H THR 33 9.842 -4.965 -7.793 258 HA THR 33 HA THR 33 12.473 -5.725 -7.400 259 HB THR 33 HB THR 33 10.049 -5.931 -5.548 260 HG1 THR 33 1HG THR 33 10.138 -3.876 -6.365 261 HG21 THR 33 3HG2 THR 33 11.693 -5.340 -3.756 262 HG22 THR 33 1HG2 THR 33 13.006 -5.590 -4.928 263 HG23 THR 33 2HG2 THR 33 11.956 -6.942 -4.450 264 H LYS 34 H LYS 34 13.394 -7.619 -6.493 265 HA LYS 34 HA LYS 34 12.727 -10.103 -7.675 266 HB2 LYS 34 1HB LYS 34 14.932 -9.014 -6.387 267 HB3 LYS 34 2HB LYS 34 14.307 -10.074 -5.136 268 HG2 LYS 34 1HG LYS 34 15.802 -11.434 -6.209 269 HG3 LYS 34 2HG LYS 34 14.313 -11.921 -6.999 270 HD2 LYS 34 1HD LYS 34 16.353 -9.932 -8.129 271 HD3 LYS 34 2HD LYS 34 16.295 -11.654 -8.500 272 HE2 LYS 34 1HE LYS 34 13.919 -11.303 -9.354 273 HE3 LYS 34 2HE LYS 34 14.208 -9.559 -9.231 274 HZ1 LYS 34 3HZ LYS 34 16.047 -9.828 -10.805 275 HZ2 LYS 34 1HZ LYS 34 14.666 -10.447 -11.449 276 HZ3 LYS 34 2HZ LYS 34 15.783 -11.467 -10.839 277 H PHE 35 H PHE 35 11.613 -11.943 -6.832 278 HA PHE 35 HA PHE 35 10.369 -11.769 -4.191 279 HB2 PHE 35 1HB PHE 35 8.117 -12.197 -5.217 280 HB3 PHE 35 2HB PHE 35 8.750 -10.582 -5.389 281 HD1 PHE 35 1HD PHE 35 9.272 -13.714 -7.555 282 HD2 PHE 35 2HD PHE 35 7.794 -9.673 -7.264 283 HE1 PHE 35 1HE PHE 35 8.812 -13.726 -9.941 284 HE2 PHE 35 2HE PHE 35 7.278 -9.718 -9.709 285 HZ PHE 35 HZ PHE 35 7.780 -11.739 -11.050 286 H THR 36 H THR 36 8.942 -13.798 -3.910 287 HA THR 36 HA THR 36 8.730 -15.898 -3.648 288 HB THR 36 HB THR 36 9.095 -15.911 -6.328 289 HG1 THR 36 1HG THR 36 7.949 -17.658 -6.125 290 HG21 THR 36 3HG2 THR 36 11.049 -18.026 -5.323 291 HG22 THR 36 1HG2 THR 36 11.536 -16.566 -6.199 292 HG23 THR 36 2HG2 THR 36 10.512 -17.768 -6.998 293 HA PRO 37 HA PRO 37 9.409 -18.540 -3.371 294 HB2 PRO 37 1HB PRO 37 9.522 -19.750 -0.941 295 HB3 PRO 37 2HB PRO 37 10.733 -20.019 -2.232 296 HG2 PRO 37 1HG PRO 37 10.907 -18.121 0.123 297 HG3 PRO 37 2HG PRO 37 12.134 -19.306 -0.431 298 HD2 PRO 37 1HD PRO 37 12.265 -16.678 -1.130 299 HD3 PRO 37 2HD PRO 37 12.729 -17.963 -2.281 300 HA PRO 38 HA PRO 38 6.033 -16.523 -1.024 301 HB2 PRO 38 1HB PRO 38 4.188 -18.510 -0.798 302 HB3 PRO 38 2HB PRO 38 4.469 -17.661 -2.364 303 HG2 PRO 38 1HG PRO 38 5.495 -20.318 -1.436 304 HG3 PRO 38 2HG PRO 38 4.860 -19.897 -3.053 305 HD2 PRO 38 1HD PRO 38 7.565 -20.020 -2.487 306 HD3 PRO 38 2HD PRO 38 6.882 -18.902 -3.705 307 H ALA 39 H ALA 39 4.628 -17.246 1.039 308 HA ALA 39 HA ALA 39 6.414 -18.622 2.917 309 HB1 ALA 39 1HB ALA 39 4.432 -16.343 3.341 310 HB2 ALA 39 2HB ALA 39 5.209 -17.261 4.635 311 HB3 ALA 39 3HB ALA 39 6.210 -16.299 3.537 312 H ALA 40 H ALA 40 5.595 -20.466 2.023 313 HA ALA 40 HA ALA 40 4.346 -22.404 2.070 314 HB1 ALA 40 1HB ALA 40 2.905 -22.852 3.977 315 HB2 ALA 40 2HB ALA 40 4.392 -22.054 4.533 316 HB3 ALA 40 3HB ALA 40 2.875 -21.145 4.422 317 H GLY 41 H GLY 41 3.735 -20.773 0.110 318 HA2 GLY 41 2HA GLY 41 2.224 -20.535 -1.550 319 HA3 GLY 41 1HA GLY 41 1.015 -21.400 -0.599 320 H VAL 42 H VAL 42 1.937 -18.999 1.403 321 HA VAL 42 HA VAL 42 -0.165 -17.121 0.435 322 HB VAL 42 HB VAL 42 0.966 -17.686 3.229 323 HG11 VAL 42 1HG1 VAL 42 -0.789 -16.242 4.115 324 HG12 VAL 42 2HG1 VAL 42 0.246 -15.323 3.009 325 HG13 VAL 42 3HG1 VAL 42 -1.342 -15.889 2.466 326 HG21 VAL 42 3HG2 VAL 42 -1.866 -18.201 2.208 327 HG22 VAL 42 1HG2 VAL 42 -0.616 -19.468 2.358 328 HG23 VAL 42 2HG2 VAL 42 -1.199 -18.625 3.790 329 H TYR 43 H TYR 43 0.374 -14.967 0.037 330 HA TYR 43 HA TYR 43 2.709 -13.750 1.124 331 HB2 TYR 43 1HB TYR 43 3.951 -13.364 -0.968 332 HB3 TYR 43 2HB TYR 43 3.928 -15.043 -0.542 333 HD1 TYR 43 2HD TYR 43 2.360 -16.664 -1.824 334 HD2 TYR 43 1HD TYR 43 3.088 -12.560 -3.024 335 HE1 TYR 43 2HE TYR 43 1.638 -17.189 -4.128 336 HE2 TYR 43 1HE TYR 43 2.284 -13.119 -5.312 337 HH TYR 43 HH TYR 43 1.361 -16.372 -6.352 338 H LEU 44 H LEU 44 3.033 -11.556 -0.308 339 HA LEU 44 HA LEU 44 0.341 -10.359 -0.764 340 HB2 LEU 44 1HB LEU 44 2.667 -9.127 0.780 341 HB3 LEU 44 2HB LEU 44 1.256 -8.242 0.237 342 HG LEU 44 HG LEU 44 1.271 -10.466 2.299 343 HD11 LEU 44 1HD1 LEU 44 0.858 -7.459 2.504 344 HD12 LEU 44 2HD1 LEU 44 2.146 -8.425 3.249 345 HD13 LEU 44 3HD1 LEU 44 0.446 -8.580 3.797 346 HD21 LEU 44 3HD2 LEU 44 -1.037 -8.756 1.273 347 HD22 LEU 44 1HD2 LEU 44 -1.120 -9.888 2.641 348 HD23 LEU 44 2HD2 LEU 44 -0.842 -10.501 1.015 349 H ARG 45 H ARG 45 0.222 -9.271 -2.679 350 HA ARG 45 HA ARG 45 2.814 -8.534 -4.014 351 HB2 ARG 45 1HB ARG 45 0.321 -9.807 -5.077 352 HB3 ARG 45 2HB ARG 45 0.988 -8.523 -6.076 353 HG2 ARG 45 1HG ARG 45 3.255 -9.643 -5.948 354 HG3 ARG 45 2HG ARG 45 2.504 -10.943 -5.025 355 HD2 ARG 45 1HD ARG 45 2.583 -11.784 -7.205 356 HD3 ARG 45 2HD ARG 45 0.909 -11.218 -7.081 357 HE ARG 45 HE ARG 45 2.529 -9.103 -8.092 358 HH11 ARG 45 1HH1 ARG 45 1.456 -12.301 -9.208 359 HH12 ARG 45 2HH1 ARG 45 1.507 -11.887 -10.884 360 HH21 ARG 45 1HH2 ARG 45 2.791 -8.610 -10.191 361 HH22 ARG 45 2HH2 ARG 45 2.327 -9.678 -11.485 362 H ALA 46 H ALA 46 3.221 -6.483 -3.691 363 HA ALA 46 HA ALA 46 1.020 -4.536 -3.275 364 HB1 ALA 46 1HB ALA 46 4.003 -4.542 -2.637 365 HB2 ALA 46 2HB ALA 46 2.936 -3.167 -2.358 366 HB3 ALA 46 3HB ALA 46 2.655 -4.695 -1.494 367 H TYR 47 H TYR 47 0.569 -2.963 -4.792 368 HA TYR 47 HA TYR 47 2.542 -2.451 -6.951 369 HB2 TYR 47 1HB TYR 47 0.648 -3.992 -7.540 370 HB3 TYR 47 2HB TYR 47 -0.442 -2.635 -7.385 371 HD1 TYR 47 1HD TYR 47 0.021 -0.616 -8.814 372 HD2 TYR 47 2HD TYR 47 1.993 -4.326 -9.532 373 HE1 TYR 47 1HE TYR 47 0.790 0.221 -11.097 374 HE2 TYR 47 2HE TYR 47 2.684 -3.568 -11.782 375 HH TYR 47 HH TYR 47 2.523 -1.871 -13.387 376 H VAL 48 H VAL 48 3.068 -0.480 -7.019 377 HA VAL 48 HA VAL 48 1.621 1.753 -5.796 378 HB VAL 48 HB VAL 48 4.373 1.442 -7.092 379 HG11 VAL 48 1HG1 VAL 48 5.030 3.519 -6.289 380 HG12 VAL 48 2HG1 VAL 48 3.447 3.842 -6.988 381 HG13 VAL 48 3HG1 VAL 48 3.640 3.714 -5.230 382 HG21 VAL 48 3HG2 VAL 48 5.268 1.597 -4.737 383 HG22 VAL 48 1HG2 VAL 48 3.611 1.409 -4.137 384 HG23 VAL 48 2HG2 VAL 48 4.388 0.113 -5.067 385 H MET 49 H MET 49 0.068 2.636 -7.180 386 HA MET 49 HA MET 49 0.699 2.885 -10.115 387 HB2 MET 49 1HB MET 49 -1.846 2.705 -8.512 388 HB3 MET 49 2HB MET 49 -1.842 3.597 -10.037 389 HG2 MET 49 1HG MET 49 -1.300 1.732 -11.325 390 HG3 MET 49 2HG MET 49 -0.873 0.800 -9.905 391 HE1 MET 49 3HE MET 49 -2.651 0.132 -7.966 392 HE2 MET 49 1HE MET 49 -3.926 -0.888 -8.659 393 HE3 MET 49 2HE MET 49 -2.245 -1.127 -9.154 394 HA PRO 50 HA PRO 50 1.213 7.102 -8.188 395 HB2 PRO 50 1HB PRO 50 3.407 7.958 -9.512 396 HB3 PRO 50 2HB PRO 50 3.549 6.781 -8.166 397 HG2 PRO 50 1HG PRO 50 3.453 6.211 -11.141 398 HG3 PRO 50 2HG PRO 50 4.648 5.601 -9.948 399 HD2 PRO 50 1HD PRO 50 2.451 4.132 -10.731 400 HD3 PRO 50 2HD PRO 50 3.117 4.058 -9.080 401 H ALA 51 H ALA 51 0.692 9.175 -9.225 402 HA ALA 51 HA ALA 51 -0.702 8.970 -11.772 403 HB1 ALA 51 1HB ALA 51 0.236 11.507 -10.363 404 HB2 ALA 51 2HB ALA 51 -1.030 11.347 -11.592 405 HB3 ALA 51 3HB ALA 51 -1.264 10.675 -9.970 406 H ALA 52 H ALA 52 0.157 9.222 -13.734 407 HA ALA 52 HA ALA 52 2.895 9.164 -14.306 408 HB1 ALA 52 1HB ALA 52 0.498 9.844 -16.077 409 HB2 ALA 52 2HB ALA 52 2.126 9.409 -16.635 410 HB3 ALA 52 3HB ALA 52 1.145 8.222 -15.757 411 H THR 53 H THR 53 3.794 10.811 -13.314 412 HA THR 53 HA THR 53 3.129 13.573 -13.415 413 HB THR 53 HB THR 53 4.632 12.552 -11.761 414 HG1 THR 53 1HG THR 53 6.342 14.242 -12.043 415 HG21 THR 53 3HG2 THR 53 6.983 12.143 -12.229 416 HG22 THR 53 1HG2 THR 53 6.747 12.519 -13.947 417 HG23 THR 53 2HG2 THR 53 5.987 11.084 -13.233 418 H ILE 54 H ILE 54 4.000 15.375 -14.677 419 HA ILE 54 HA ILE 54 4.140 14.691 -17.444 420 HB ILE 54 HB ILE 54 4.673 17.404 -16.215 421 HG12 ILE 54 1HG1 ILE 54 2.159 17.754 -16.708 422 HG13 ILE 54 2HG1 ILE 54 2.014 16.003 -16.685 423 HG21 ILE 54 1HG2 ILE 54 5.107 17.173 -18.651 424 HG22 ILE 54 2HG2 ILE 54 3.438 16.605 -18.879 425 HG23 ILE 54 3HG2 ILE 54 3.766 18.258 -18.317 426 HD11 ILE 54 3HD1 ILE 54 2.381 15.998 -14.294 427 HD12 ILE 54 1HD1 ILE 54 3.169 17.598 -14.344 428 HD13 ILE 54 2HD1 ILE 54 1.425 17.444 -14.584 429 H SER 55 H SER 55 5.843 14.514 -18.655 430 HA SER 55 HA SER 55 8.462 14.232 -17.607 431 HB2 SER 55 1HB SER 55 7.300 14.294 -20.424 432 HB3 SER 55 2HB SER 55 8.937 13.848 -20.009 433 HG SER 55 HG SER 55 6.504 12.605 -19.251 434 H ARG 56 H ARG 56 7.111 16.901 -18.178 435 HA ARG 56 HA ARG 56 9.621 18.381 -18.250 436 HB2 ARG 56 1HB ARG 56 9.116 20.045 -19.918 437 HB3 ARG 56 2HB ARG 56 9.198 18.417 -20.546 438 HG2 ARG 56 1HG ARG 56 7.410 19.177 -21.696 439 HG3 ARG 56 2HG ARG 56 6.603 18.410 -20.325 440 HD2 ARG 56 1HD ARG 56 6.045 20.506 -19.353 441 HD3 ARG 56 2HD ARG 56 7.280 21.372 -20.298 442 HE ARG 56 HE ARG 56 5.395 20.253 -22.094 443 HH11 ARG 56 1HH1 ARG 56 5.583 22.914 -19.690 444 HH12 ARG 56 2HH1 ARG 56 4.507 23.919 -20.619 445 HH21 ARG 56 1HH2 ARG 56 3.986 21.560 -23.192 446 HH22 ARG 56 2HH2 ARG 56 3.660 23.182 -22.693 447 H ASP 57 H ASP 57 7.493 17.797 -16.288 448 HA ASP 57 HA ASP 57 6.360 18.680 -14.571 449 HB2 ASP 57 1HB ASP 57 8.402 20.807 -15.003 450 HB3 ASP 57 2HB ASP 57 7.114 21.156 -13.906 451 H ALA 58 H ALA 58 5.157 20.712 -13.778 452 HA ALA 58 HA ALA 58 3.712 22.229 -15.730 453 HB1 ALA 58 1HB ALA 58 2.234 19.879 -14.480 454 HB2 ALA 58 2HB ALA 58 1.500 21.181 -15.445 455 HB3 ALA 58 3HB ALA 58 2.656 20.066 -16.200 456 H ALA 59 H ALA 59 4.858 23.512 -14.020 457 HA ALA 59 HA ALA 59 4.722 25.028 -12.332 458 HB1 ALA 59 1HB ALA 59 3.185 25.857 -13.997 459 HB2 ALA 59 2HB ALA 59 1.851 24.898 -13.318 460 HB3 ALA 59 3HB ALA 59 2.541 26.258 -12.409 461 H GLY 60 H GLY 60 2.470 25.684 -10.617 462 HA2 GLY 60 2HA GLY 60 2.155 23.307 -8.850 463 HA3 GLY 60 1HA GLY 60 2.639 24.876 -8.181 464 H ASP 61 H ASP 61 0.545 25.168 -10.870 465 HA ASP 61 HA ASP 61 -1.605 26.061 -9.069 466 HB2 ASP 61 1HB ASP 61 -1.784 27.893 -10.448 467 HB3 ASP 61 2HB ASP 61 -0.041 27.533 -10.552 468 H HIS 62 H HIS 62 -0.953 23.954 -11.741 469 HA HIS 62 HA HIS 62 -3.875 23.462 -12.116 470 HB2 HIS 62 1HB HIS 62 -2.185 24.689 -13.878 471 HB3 HIS 62 2HB HIS 62 -1.964 23.018 -14.370 472 HD1 HIS 62 1HD HIS 62 -4.365 25.920 -14.608 473 HD2 HIS 62 2HD HIS 62 -4.349 21.734 -15.160 474 HE1 HIS 62 1HE HIS 62 -6.391 25.389 -16.042 475 H ARG 63 H ARG 63 -1.098 21.930 -10.985 476 HA ARG 63 HA ARG 63 -2.221 19.318 -11.301 477 HB2 ARG 63 1HB ARG 63 -0.698 20.121 -13.462 478 HB3 ARG 63 2HB ARG 63 0.521 19.300 -12.519 479 HG2 ARG 63 1HG ARG 63 -2.204 18.137 -13.146 480 HG3 ARG 63 2HG ARG 63 -0.840 17.979 -14.272 481 HD2 ARG 63 1HD ARG 63 0.394 16.901 -12.268 482 HD3 ARG 63 2HD ARG 63 -1.223 16.797 -11.518 483 HE ARG 63 HE ARG 63 -1.653 15.745 -13.962 484 HH11 ARG 63 1HH1 ARG 63 0.451 14.921 -11.261 485 HH12 ARG 63 2HH1 ARG 63 0.941 13.363 -11.850 486 HH21 ARG 63 1HH2 ARG 63 -1.068 13.749 -14.819 487 HH22 ARG 63 2HH2 ARG 63 0.098 12.711 -14.087 488 H GLN 64 H GLN 64 -1.346 17.852 -9.992 489 HA GLN 64 HA GLN 64 1.149 18.366 -8.682 490 HB2 GLN 64 1HB GLN 64 -1.476 18.016 -7.187 491 HB3 GLN 64 2HB GLN 64 0.023 17.567 -6.422 492 HG2 GLN 64 1HG GLN 64 0.920 19.793 -6.531 493 HG3 GLN 64 2HG GLN 64 -0.420 20.360 -7.517 494 HE21 GLN 64 1HE2 GLN 64 0.507 21.387 -4.855 495 HE22 GLN 64 2HE2 GLN 64 -0.913 21.263 -3.833 496 H TYR 65 H TYR 65 1.616 16.343 -7.141 497 HA TYR 65 HA TYR 65 1.562 13.876 -8.656 498 HB2 TYR 65 1HB TYR 65 2.614 14.875 -6.037 499 HB3 TYR 65 2HB TYR 65 2.087 13.202 -6.045 500 HD1 TYR 65 2HD TYR 65 3.966 15.318 -8.575 501 HD2 TYR 65 1HD TYR 65 3.809 11.700 -6.203 502 HE1 TYR 65 2HE TYR 65 6.029 14.532 -9.625 503 HE2 TYR 65 1HE TYR 65 5.841 10.888 -7.301 504 HH TYR 65 HH TYR 65 7.918 12.857 -9.320 505 H ARG 66 H ARG 66 0.592 11.889 -7.687 506 HA ARG 66 HA ARG 66 -1.521 11.917 -5.796 507 HB2 ARG 66 1HB ARG 66 -2.285 12.823 -8.367 508 HB3 ARG 66 2HB ARG 66 -2.791 11.161 -8.381 509 HG2 ARG 66 1HG ARG 66 -3.483 13.049 -6.104 510 HG3 ARG 66 2HG ARG 66 -4.417 13.013 -7.617 511 HD2 ARG 66 1HD ARG 66 -4.613 10.474 -7.271 512 HD3 ARG 66 2HD ARG 66 -4.110 10.776 -5.605 513 HE ARG 66 HE ARG 66 -6.153 12.546 -5.913 514 HH11 ARG 66 1HH1 ARG 66 -5.774 9.037 -6.019 515 HH12 ARG 66 2HH1 ARG 66 -7.466 8.698 -5.991 516 HH21 ARG 66 1HH2 ARG 66 -8.467 12.113 -5.919 517 HH22 ARG 66 2HH2 ARG 66 -9.004 10.482 -6.125 518 H GLY 67 H GLY 67 -2.604 9.574 -5.847 519 HA2 GLY 67 2HA GLY 67 -1.772 7.775 -7.883 520 HA3 GLY 67 1HA GLY 67 -0.844 7.487 -6.404 521 H VAL 68 H VAL 68 -2.064 5.422 -6.972 522 HA VAL 68 HA VAL 68 -3.872 5.155 -4.732 523 HB VAL 68 HB VAL 68 -5.416 4.979 -6.576 524 HG11 VAL 68 1HG1 VAL 68 -3.866 2.678 -7.769 525 HG12 VAL 68 2HG1 VAL 68 -5.297 3.491 -8.415 526 HG13 VAL 68 3HG1 VAL 68 -3.760 4.354 -8.388 527 HG21 VAL 68 3HG2 VAL 68 -6.304 2.673 -6.381 528 HG22 VAL 68 1HG2 VAL 68 -4.851 2.167 -5.507 529 HG23 VAL 68 2HG2 VAL 68 -5.952 3.398 -4.829 530 H PHE 69 H PHE 69 -3.458 3.100 -3.702 531 HA PHE 69 HA PHE 69 -0.976 1.704 -4.526 532 HB2 PHE 69 1HB PHE 69 -0.551 3.055 -2.464 533 HB3 PHE 69 2HB PHE 69 -1.973 2.342 -1.715 534 HD1 PHE 69 2HD PHE 69 0.989 0.965 -3.650 535 HD2 PHE 69 1HD PHE 69 -1.471 0.726 -0.097 536 HE1 PHE 69 2HE PHE 69 2.188 -1.056 -2.956 537 HE2 PHE 69 1HE PHE 69 -0.221 -1.285 0.613 538 HZ PHE 69 HZ PHE 69 1.611 -2.180 -0.813 539 H GLN 70 H GLN 70 -1.174 -0.586 -4.295 540 HA GLN 70 HA GLN 70 -3.864 -1.600 -3.600 541 HB2 GLN 70 1HB GLN 70 -3.635 -1.277 -6.105 542 HB3 GLN 70 2HB GLN 70 -2.256 -2.362 -6.092 543 HG2 GLN 70 1HG GLN 70 -3.544 -4.253 -5.568 544 HG3 GLN 70 2HG GLN 70 -4.833 -3.302 -4.835 545 HE21 GLN 70 1HE2 GLN 70 -6.625 -2.873 -5.994 546 HE22 GLN 70 2HE2 GLN 70 -6.797 -3.210 -7.689 547 H VAL 71 H VAL 71 -3.796 -3.765 -2.748 548 HA VAL 71 HA VAL 71 -1.277 -5.231 -3.038 549 HB VAL 71 HB VAL 71 -2.788 -5.132 -0.415 550 HG11 VAL 71 1HG1 VAL 71 -0.156 -6.479 -1.226 551 HG12 VAL 71 2HG1 VAL 71 -0.666 -6.258 0.461 552 HG13 VAL 71 3HG1 VAL 71 -1.633 -7.260 -0.587 553 HG21 VAL 71 3HG2 VAL 71 -1.606 -3.006 -0.693 554 HG22 VAL 71 1HG2 VAL 71 -0.823 -3.975 0.540 555 HG23 VAL 71 2HG2 VAL 71 -0.102 -3.868 -1.086 556 H ASN 72 H ASN 72 -1.726 -7.627 -2.800 557 HA ASN 72 HA ASN 72 -4.515 -8.391 -2.520 558 HB2 ASN 72 1HB ASN 72 -2.759 -9.019 -4.874 559 HB3 ASN 72 2HB ASN 72 -3.586 -10.392 -4.182 560 HD21 ASN 72 1HD2 ASN 72 -4.083 -8.410 -6.706 561 HD22 ASN 72 2HD2 ASN 72 -5.747 -7.957 -6.431 562 H VAL 73 H VAL 73 -4.780 -10.294 -1.469 563 HA VAL 73 HA VAL 73 -2.599 -11.382 0.196 564 HB VAL 73 HB VAL 73 -5.582 -11.038 0.818 565 HG11 VAL 73 1HG1 VAL 73 -5.108 -11.630 3.092 566 HG12 VAL 73 2HG1 VAL 73 -4.630 -12.943 2.031 567 HG13 VAL 73 3HG1 VAL 73 -3.387 -11.854 2.731 568 HG21 VAL 73 3HG2 VAL 73 -4.886 -9.364 2.485 569 HG22 VAL 73 1HG2 VAL 73 -3.256 -9.376 1.812 570 HG23 VAL 73 2HG2 VAL 73 -4.622 -8.828 0.823 571 H VAL 74 H VAL 74 -2.243 -12.803 -1.689 572 HA VAL 74 HA VAL 74 -4.379 -14.651 -2.457 573 HB VAL 74 HB VAL 74 -2.764 -14.041 -4.128 574 HG11 VAL 74 1HG1 VAL 74 -0.830 -13.413 -2.805 575 HG12 VAL 74 2HG1 VAL 74 -0.533 -15.129 -2.407 576 HG13 VAL 74 3HG1 VAL 74 -0.444 -14.551 -4.084 577 HG21 VAL 74 3HG2 VAL 74 -2.370 -16.914 -3.225 578 HG22 VAL 74 1HG2 VAL 74 -3.706 -16.274 -4.215 579 HG23 VAL 74 2HG2 VAL 74 -2.040 -16.276 -4.833 580 H MET 75 H MET 75 -4.917 -16.499 -1.370 581 HA MET 75 HA MET 75 -2.953 -17.780 0.403 582 HB2 MET 75 1HB MET 75 -5.777 -17.174 1.326 583 HB3 MET 75 2HB MET 75 -4.549 -17.972 2.269 584 HG2 MET 75 1HG MET 75 -3.506 -15.898 2.717 585 HG3 MET 75 2HG MET 75 -4.317 -15.099 1.360 586 HE1 MET 75 3HE MET 75 -7.490 -15.851 1.663 587 HE2 MET 75 1HE MET 75 -7.930 -14.423 2.579 588 HE3 MET 75 2HE MET 75 -6.783 -14.262 1.237 589 HA PRO 76 HA PRO 76 -5.025 -21.094 -1.717 590 HB2 PRO 76 1HB PRO 76 -4.118 -23.330 -0.439 591 HB3 PRO 76 2HB PRO 76 -3.035 -22.262 -1.387 592 HG2 PRO 76 1HG PRO 76 -3.503 -22.245 1.613 593 HG3 PRO 76 2HG PRO 76 -1.934 -22.247 0.741 594 HD2 PRO 76 1HD PRO 76 -3.129 -19.963 1.677 595 HD3 PRO 76 2HD PRO 76 -2.136 -19.970 0.186 596 H ILE 77 H ILE 77 -6.585 -22.922 -1.367 597 HA ILE 77 HA ILE 77 -8.490 -22.254 0.808 598 HB ILE 77 HB ILE 77 -8.936 -23.830 -1.731 599 HG12 ILE 77 1HG1 ILE 77 -9.542 -20.909 -1.115 600 HG13 ILE 77 2HG1 ILE 77 -8.315 -21.444 -2.196 601 HG21 ILE 77 1HG2 ILE 77 -10.961 -22.524 0.163 602 HG22 ILE 77 2HG2 ILE 77 -11.301 -23.584 -1.235 603 HG23 ILE 77 3HG2 ILE 77 -10.548 -24.245 0.202 604 HD11 ILE 77 3HD1 ILE 77 -10.177 -20.679 -3.465 605 HD12 ILE 77 1HD1 ILE 77 -10.062 -22.445 -3.678 606 HD13 ILE 77 2HD1 ILE 77 -11.293 -21.734 -2.602 607 H GLY 78 H GLY 78 -7.233 -23.367 2.437 608 HA2 GLY 78 2HA GLY 78 -7.060 -26.340 2.261 609 HA3 GLY 78 1HA GLY 78 -6.068 -25.258 3.237 610 H ASP 79 H ASP 79 -9.581 -25.011 3.012 611 HA ASP 79 HA ASP 79 -11.068 -24.434 4.545 612 HB2 ASP 79 1HB ASP 79 -11.453 -26.785 4.733 613 HB3 ASP 79 2HB ASP 79 -10.129 -26.936 5.889 614 H GLY 80 H GLY 80 -9.688 -22.576 4.794 615 HA2 GLY 80 2HA GLY 80 -9.274 -21.753 7.443 616 HA3 GLY 80 1HA GLY 80 -7.740 -22.446 6.911 617 H SER 81 H SER 81 -9.790 -20.792 4.548 618 HA SER 81 HA SER 81 -7.621 -18.830 4.205 619 HB2 SER 81 1HB SER 81 -9.113 -20.439 2.462 620 HB3 SER 81 2HB SER 81 -9.780 -18.814 2.227 621 HG SER 81 HG SER 81 -7.232 -19.840 1.724 622 H ARG 82 H ARG 82 -10.169 -18.571 6.214 623 HA ARG 82 HA ARG 82 -11.477 -16.168 5.100 624 HB2 ARG 82 1HB ARG 82 -11.758 -17.498 7.825 625 HB3 ARG 82 2HB ARG 82 -12.641 -16.082 7.294 626 HG2 ARG 82 1HG ARG 82 -14.093 -17.859 7.040 627 HG3 ARG 82 2HG ARG 82 -13.611 -17.421 5.402 628 HD2 ARG 82 1HD ARG 82 -12.277 -19.401 5.162 629 HD3 ARG 82 2HD ARG 82 -12.266 -19.705 6.909 630 HE ARG 82 HE ARG 82 -14.397 -20.191 4.957 631 HH11 ARG 82 1HH1 ARG 82 -13.479 -20.265 8.426 632 HH12 ARG 82 2HH1 ARG 82 -14.765 -21.304 8.874 633 HH21 ARG 82 1HH2 ARG 82 -16.178 -21.502 5.633 634 HH22 ARG 82 2HH2 ARG 82 -16.120 -22.243 7.195 635 H SER 83 H SER 83 -8.469 -16.641 6.474 636 HA SER 83 HA SER 83 -8.057 -14.543 8.230 637 HB2 SER 83 1HB SER 83 -6.253 -15.770 6.104 638 HB3 SER 83 2HB SER 83 -5.702 -14.791 7.497 639 HG SER 83 HG SER 83 -6.325 -16.291 8.870 640 H ALA 84 H ALA 84 -8.796 -14.243 4.836 641 HA ALA 84 HA ALA 84 -7.691 -11.813 4.063 642 HB1 ALA 84 1HB ALA 84 -10.226 -11.523 3.127 643 HB2 ALA 84 2HB ALA 84 -9.071 -12.632 2.406 644 HB3 ALA 84 3HB ALA 84 -10.282 -13.249 3.544 645 H GLU 85 H GLU 85 -10.528 -12.243 6.344 646 HA GLU 85 HA GLU 85 -11.140 -9.426 6.401 647 HB2 GLU 85 1HB GLU 85 -11.729 -11.645 8.409 648 HB3 GLU 85 2HB GLU 85 -12.432 -10.033 8.378 649 HG2 GLU 85 1HG GLU 85 -13.350 -10.565 6.065 650 HG3 GLU 85 2HG GLU 85 -12.731 -12.199 6.276 651 H GLN 86 H GLN 86 -9.512 -11.640 8.687 652 HA GLN 86 HA GLN 86 -8.680 -9.871 10.578 653 HB2 GLN 86 1HB GLN 86 -7.958 -12.564 9.716 654 HB3 GLN 86 2HB GLN 86 -6.489 -11.711 10.107 655 HG2 GLN 86 1HG GLN 86 -8.531 -11.202 12.159 656 HG3 GLN 86 2HG GLN 86 -8.312 -12.914 11.898 657 HE21 GLN 86 1HE2 GLN 86 -6.661 -9.915 12.884 658 HE22 GLN 86 2HE2 GLN 86 -5.294 -10.690 13.628 659 H VAL 87 H VAL 87 -6.848 -10.731 7.646 660 HA VAL 87 HA VAL 87 -4.694 -8.926 8.116 661 HB VAL 87 HB VAL 87 -5.812 -10.263 5.602 662 HG11 VAL 87 1HG1 VAL 87 -4.527 -8.449 4.745 663 HG12 VAL 87 2HG1 VAL 87 -3.216 -8.717 5.921 664 HG13 VAL 87 3HG1 VAL 87 -3.516 -9.883 4.604 665 HG21 VAL 87 3HG2 VAL 87 -4.871 -11.767 7.446 666 HG22 VAL 87 1HG2 VAL 87 -4.099 -11.914 5.865 667 HG23 VAL 87 2HG2 VAL 87 -3.302 -11.000 7.156 668 H ALA 88 H ALA 88 -7.729 -8.444 6.203 669 HA ALA 88 HA ALA 88 -6.976 -5.854 5.295 670 HB1 ALA 88 1HB ALA 88 -9.371 -5.549 4.847 671 HB2 ALA 88 2HB ALA 88 -8.825 -7.153 4.320 672 HB3 ALA 88 3HB ALA 88 -9.762 -6.978 5.830 673 H ALA 89 H ALA 89 -8.330 -6.971 8.360 674 HA ALA 89 HA ALA 89 -9.041 -4.287 9.282 675 HB1 ALA 89 1HB ALA 89 -9.600 -5.503 11.388 676 HB2 ALA 89 2HB ALA 89 -10.401 -6.169 9.952 677 HB3 ALA 89 3HB ALA 89 -8.999 -7.005 10.642 678 H GLU 90 H GLU 90 -6.327 -6.584 9.821 679 HA GLU 90 HA GLU 90 -5.045 -5.059 11.906 680 HB2 GLU 90 1HB GLU 90 -3.924 -6.924 9.766 681 HB3 GLU 90 2HB GLU 90 -2.952 -6.194 11.040 682 HG2 GLU 90 1HG GLU 90 -4.999 -7.399 12.481 683 HG3 GLU 90 2HG GLU 90 -4.781 -8.522 11.139 684 H LEU 91 H LEU 91 -4.741 -5.173 8.443 685 HA LEU 91 HA LEU 91 -3.027 -3.054 7.880 686 HB2 LEU 91 1HB LEU 91 -5.250 -4.239 6.322 687 HB3 LEU 91 2HB LEU 91 -4.238 -2.969 5.689 688 HG LEU 91 HG LEU 91 -3.010 -5.504 6.790 689 HD11 LEU 91 1HD1 LEU 91 -4.589 -6.201 5.080 690 HD12 LEU 91 2HD1 LEU 91 -2.940 -6.351 4.475 691 HD13 LEU 91 3HD1 LEU 91 -3.963 -4.979 3.966 692 HD21 LEU 91 3HD2 LEU 91 -1.169 -4.899 5.230 693 HD22 LEU 91 1HD2 LEU 91 -1.447 -3.650 6.444 694 HD23 LEU 91 2HD2 LEU 91 -2.051 -3.430 4.773 695 H ASP 92 H ASP 92 -6.677 -2.908 8.091 696 HA ASP 92 HA ASP 92 -6.960 -0.143 7.675 697 HB2 ASP 92 1HB ASP 92 -8.769 -1.777 7.544 698 HB3 ASP 92 2HB ASP 92 -8.598 -2.135 9.257 699 H ALA 93 H ALA 93 -6.448 -1.941 10.731 700 HA ALA 93 HA ALA 93 -6.740 0.337 12.421 701 HB1 ALA 93 1HB ALA 93 -5.748 -1.164 14.137 702 HB2 ALA 93 2HB ALA 93 -7.069 -1.925 13.230 703 HB3 ALA 93 3HB ALA 93 -5.392 -2.353 12.861 704 H LEU 94 H LEU 94 -4.146 -0.573 10.303 705 HA LEU 94 HA LEU 94 -2.171 1.068 11.771 706 HB2 LEU 94 1HB LEU 94 -1.341 -1.009 10.808 707 HB3 LEU 94 2HB LEU 94 -1.997 -0.545 9.198 708 HG LEU 94 HG LEU 94 -0.335 1.328 9.081 709 HD11 LEU 94 1HD1 LEU 94 1.616 1.256 10.619 710 HD12 LEU 94 2HD1 LEU 94 0.806 0.013 11.586 711 HD13 LEU 94 3HD1 LEU 94 0.131 1.653 11.493 712 HD21 LEU 94 3HD2 LEU 94 1.603 -0.100 8.618 713 HD22 LEU 94 1HD2 LEU 94 0.114 -0.890 8.077 714 HD23 LEU 94 2HD2 LEU 94 0.861 -1.404 9.567 715 H PHE 95 H PHE 95 -4.228 1.049 8.887 716 HA PHE 95 HA PHE 95 -2.999 3.550 7.885 717 HB2 PHE 95 1HB PHE 95 -4.390 1.250 6.500 718 HB3 PHE 95 2HB PHE 95 -3.872 2.713 5.688 719 HD1 PHE 95 2HD PHE 95 -1.201 3.305 6.359 720 HD2 PHE 95 1HD PHE 95 -3.007 -0.607 6.078 721 HE1 PHE 95 2HE PHE 95 0.956 2.342 5.777 722 HE2 PHE 95 1HE PHE 95 -0.808 -1.564 5.471 723 HZ PHE 95 HZ PHE 95 1.181 -0.097 5.286 724 HA PRO 96 HA PRO 96 -7.384 4.663 9.069 725 HB2 PRO 96 1HB PRO 96 -6.878 7.024 10.371 726 HB3 PRO 96 2HB PRO 96 -6.665 5.441 11.172 727 HG2 PRO 96 1HG PRO 96 -4.535 7.120 9.791 728 HG3 PRO 96 2HG PRO 96 -4.499 6.438 11.447 729 HD2 PRO 96 1HD PRO 96 -3.343 5.147 9.361 730 HD3 PRO 96 2HD PRO 96 -4.233 4.234 10.634 731 H VAL 97 H VAL 97 -8.502 6.768 8.486 732 HA VAL 97 HA VAL 97 -8.048 7.563 5.806 733 HB VAL 97 HB VAL 97 -10.168 7.449 7.261 734 HG11 VAL 97 1HG1 VAL 97 -10.950 9.431 8.365 735 HG12 VAL 97 2HG1 VAL 97 -9.405 8.956 9.085 736 HG13 VAL 97 3HG1 VAL 97 -9.474 10.332 7.949 737 HG21 VAL 97 3HG2 VAL 97 -10.266 8.163 4.973 738 HG22 VAL 97 1HG2 VAL 97 -11.404 9.080 5.959 739 HG23 VAL 97 2HG2 VAL 97 -9.884 9.838 5.424 740 H ASN 98 H ASN 98 -5.948 8.312 7.969 741 HA ASN 98 HA ASN 98 -5.478 11.147 7.147 742 HB2 ASN 98 1HB ASN 98 -4.682 9.651 9.678 743 HB3 ASN 98 2HB ASN 98 -3.761 11.027 9.101 744 HD21 ASN 98 1HD2 ASN 98 -7.220 10.159 9.655 745 HD22 ASN 98 2HD2 ASN 98 -7.636 11.686 10.376 746 H LEU 99 H LEU 99 -3.752 8.061 7.935 747 HA LEU 99 HA LEU 99 -1.879 7.114 7.119 748 HB2 LEU 99 1HB LEU 99 -3.659 7.203 5.251 749 HB3 LEU 99 2HB LEU 99 -2.567 8.350 4.476 750 HG LEU 99 HG LEU 99 -0.905 6.225 5.004 751 HD11 LEU 99 1HD1 LEU 99 -2.084 4.188 4.325 752 HD12 LEU 99 2HD1 LEU 99 -3.616 5.077 4.231 753 HD13 LEU 99 3HD1 LEU 99 -2.799 4.886 5.793 754 HD21 LEU 99 3HD2 LEU 99 -1.145 7.489 2.822 755 HD22 LEU 99 1HD2 LEU 99 -2.477 6.388 2.409 756 HD23 LEU 99 2HD2 LEU 99 -0.877 5.742 2.686 757 H VAL 100 H VAL 100 -1.322 9.422 8.450 758 HA VAL 100 HA VAL 100 0.176 11.329 6.816 759 HB VAL 100 HB VAL 100 -0.585 11.149 9.739 760 HG11 VAL 100 1HG1 VAL 100 1.658 12.120 9.824 761 HG12 VAL 100 2HG1 VAL 100 1.280 13.220 8.474 762 HG13 VAL 100 3HG1 VAL 100 0.458 13.392 10.042 763 HG21 VAL 100 3HG2 VAL 100 -1.851 13.141 9.240 764 HG22 VAL 100 1HG2 VAL 100 -1.072 13.326 7.654 765 HG23 VAL 100 2HG2 VAL 100 -2.192 11.998 7.928 766 H MET 101 H MET 101 1.920 10.454 6.012 767 HA MET 101 HA MET 101 3.892 9.063 7.784 768 HB2 MET 101 1HB MET 101 3.336 8.738 4.811 769 HB3 MET 101 2HB MET 101 4.585 7.898 5.745 770 HG2 MET 101 1HG MET 101 2.914 6.796 7.094 771 HG3 MET 101 2HG MET 101 1.610 7.654 6.288 772 HE1 MET 101 3HE MET 101 2.386 7.549 3.133 773 HE2 MET 101 1HE MET 101 1.357 6.146 2.798 774 HE3 MET 101 2HE MET 101 0.822 7.383 3.954 775 H GLN 102 H GLN 102 5.062 10.986 8.342 776 HA GLN 102 HA GLN 102 6.130 12.736 6.256 777 HB2 GLN 102 1HB GLN 102 7.760 13.385 8.009 778 HB3 GLN 102 2HB GLN 102 6.073 13.738 8.361 779 HG2 GLN 102 1HG GLN 102 5.973 12.252 10.132 780 HG3 GLN 102 2HG GLN 102 7.268 11.211 9.527 781 HE21 GLN 102 1HE2 GLN 102 9.194 11.416 10.652 782 HE22 GLN 102 2HE2 GLN 102 9.719 12.947 11.354 783 H SER 103 H SER 103 7.574 12.059 4.751 784 HA SER 103 HA SER 103 9.437 9.846 5.401 785 HB2 SER 103 1HB SER 103 8.274 10.058 3.147 786 HB3 SER 103 2HB SER 103 9.308 11.470 2.831 787 HG SER 103 HG SER 103 10.006 9.094 2.330 788 H GLY 104 H GLY 104 11.652 10.701 4.071 789 HA2 GLY 104 2HA GLY 104 12.898 12.935 5.572 790 HA3 GLY 104 1HA GLY 104 13.668 11.873 4.361 791 H GLY 105 H GLY 105 10.727 12.756 3.131 792 HA2 GLY 105 2HA GLY 105 11.713 15.239 1.802 793 HA3 GLY 105 1HA GLY 105 10.488 14.131 1.118 794 H LEU 106 H LEU 106 8.448 14.238 1.846 795 HA LEU 106 HA LEU 106 7.693 16.135 3.969 796 HB2 LEU 106 1HB LEU 106 5.985 16.895 2.287 797 HB3 LEU 106 2HB LEU 106 7.628 17.329 1.940 798 HG LEU 106 HG LEU 106 6.324 16.726 -0.002 799 HD11 LEU 106 1HD1 LEU 106 7.857 15.680 -1.319 800 HD12 LEU 106 2HD1 LEU 106 8.519 14.698 -0.010 801 HD13 LEU 106 3HD1 LEU 106 8.802 16.455 -0.049 802 HD21 LEU 106 3HD2 LEU 106 5.638 14.548 -0.621 803 HD22 LEU 106 1HD2 LEU 106 4.980 14.882 0.967 804 HD23 LEU 106 2HD2 LEU 106 6.387 13.810 0.815 805 H ALA 107 H ALA 107 5.107 15.953 4.028 806 HA ALA 107 HA ALA 107 4.591 13.180 4.818 807 HB1 ALA 107 1HB ALA 107 2.700 14.098 6.027 808 HB2 ALA 107 2HB ALA 107 4.153 15.055 6.362 809 HB3 ALA 107 3HB ALA 107 2.926 15.684 5.237 810 H VAL 108 H VAL 108 2.537 12.201 4.423 811 HA VAL 108 HA VAL 108 1.503 12.579 1.658 812 HB VAL 108 HB VAL 108 1.734 9.919 3.153 813 HG11 VAL 108 1HG1 VAL 108 1.559 10.598 0.166 814 HG12 VAL 108 2HG1 VAL 108 1.612 8.964 0.853 815 HG13 VAL 108 3HG1 VAL 108 0.209 9.984 1.151 816 HG21 VAL 108 3HG2 VAL 108 3.782 10.967 1.140 817 HG22 VAL 108 1HG2 VAL 108 4.080 10.737 2.866 818 HG23 VAL 108 2HG2 VAL 108 3.743 9.335 1.870 819 H ARG 109 H ARG 109 -0.881 11.809 1.491 820 HA ARG 109 HA ARG 109 -2.171 11.165 4.031 821 HB2 ARG 109 1HB ARG 109 -2.973 13.533 2.303 822 HB3 ARG 109 2HB ARG 109 -4.235 12.585 3.101 823 HG2 ARG 109 1HG ARG 109 -3.226 12.945 5.292 824 HG3 ARG 109 2HG ARG 109 -1.889 13.799 4.529 825 HD2 ARG 109 1HD ARG 109 -3.491 15.528 3.698 826 HD3 ARG 109 2HD ARG 109 -4.782 14.711 4.619 827 HE ARG 109 HE ARG 109 -2.664 15.071 6.385 828 HH11 ARG 109 1HH1 ARG 109 -5.126 17.126 4.851 829 HH12 ARG 109 2HH1 ARG 109 -4.607 18.557 5.685 830 HH21 ARG 109 1HH2 ARG 109 -2.235 16.887 7.700 831 HH22 ARG 109 2HH2 ARG 109 -3.068 18.373 7.401 832 H VAL 110 H VAL 110 -3.814 9.676 3.752 833 HA VAL 110 HA VAL 110 -4.066 8.396 1.153 834 HB VAL 110 HB VAL 110 -4.222 7.152 3.229 835 HG11 VAL 110 1HG1 VAL 110 -5.333 8.820 4.637 836 HG12 VAL 110 2HG1 VAL 110 -6.837 8.582 3.736 837 HG13 VAL 110 3HG1 VAL 110 -6.145 7.251 4.676 838 HG21 VAL 110 3HG2 VAL 110 -6.726 6.956 1.586 839 HG22 VAL 110 1HG2 VAL 110 -5.200 6.092 1.392 840 HG23 VAL 110 2HG2 VAL 110 -6.206 5.772 2.805 841 H ARG 111 H ARG 111 -5.913 10.741 2.927 842 HA ARG 111 HA ARG 111 -7.689 12.056 2.492 843 HB2 ARG 111 1HB ARG 111 -7.518 11.109 -0.388 844 HB3 ARG 111 2HB ARG 111 -8.568 12.391 0.195 845 HG2 ARG 111 1HG ARG 111 -5.513 12.443 0.327 846 HG3 ARG 111 2HG ARG 111 -6.479 13.164 -0.957 847 HD2 ARG 111 1HD ARG 111 -7.552 14.684 0.564 848 HD3 ARG 111 2HD ARG 111 -6.759 13.952 1.975 849 HE ARG 111 HE ARG 111 -4.649 14.558 0.379 850 HH11 ARG 111 1HH1 ARG 111 -7.242 16.781 1.452 851 HH12 ARG 111 2HH1 ARG 111 -6.106 18.085 1.670 852 HH21 ARG 111 1HH2 ARG 111 -3.472 16.330 0.224 853 HH22 ARG 111 2HH2 ARG 111 -3.956 17.877 0.923 854 H THR 112 H THR 112 -8.043 8.852 0.813 855 HA THR 112 HA THR 112 -10.876 8.743 1.491 856 HB THR 112 HB THR 112 -10.635 6.642 0.081 857 HG1 THR 112 1HG THR 112 -8.452 6.233 0.378 858 HG21 THR 112 3HG2 THR 112 -11.315 8.803 -0.894 859 HG22 THR 112 1HG2 THR 112 -10.299 7.865 -1.995 860 HG23 THR 112 2HG2 THR 112 -9.609 9.259 -1.132 861 HA PRO 113 HA PRO 113 -10.126 5.511 4.617 862 HB2 PRO 113 1HB PRO 113 -12.343 3.894 4.313 863 HB3 PRO 113 2HB PRO 113 -12.361 5.461 5.165 864 HG2 PRO 113 1HG PRO 113 -13.280 4.831 2.371 865 HG3 PRO 113 2HG PRO 113 -14.008 5.937 3.574 866 HD2 PRO 113 1HD PRO 113 -12.386 6.727 1.455 867 HD3 PRO 113 2HD PRO 113 -12.603 7.666 2.959 868 H ILE 114 H ILE 114 -9.885 3.151 4.660 869 HA ILE 114 HA ILE 114 -8.645 1.714 2.589 870 HB ILE 114 HB ILE 114 -10.468 0.864 4.884 871 HG12 ILE 114 1HG1 ILE 114 -8.607 1.922 5.864 872 HG13 ILE 114 2HG1 ILE 114 -8.295 0.208 5.995 873 HG21 ILE 114 1HG2 ILE 114 -8.657 -0.990 3.302 874 HG22 ILE 114 2HG2 ILE 114 -9.464 -1.376 4.850 875 HG23 ILE 114 3HG2 ILE 114 -10.428 -1.043 3.434 876 HD11 ILE 114 3HD1 ILE 114 -6.244 1.213 5.323 877 HD12 ILE 114 1HD1 ILE 114 -6.871 0.406 3.870 878 HD13 ILE 114 2HD1 ILE 114 -7.024 2.162 4.058 879 H SER 115 H SER 115 -9.354 0.349 0.965 880 HA SER 115 HA SER 115 -12.282 -0.171 0.806 881 HB2 SER 115 1HB SER 115 -11.168 1.045 -1.263 882 HB3 SER 115 2HB SER 115 -10.466 -0.585 -1.517 883 HG SER 115 HG SER 115 -12.216 -0.743 -2.603 884 H ASN 116 H ASN 116 -12.673 -2.367 -0.043 885 HA ASN 116 HA ASN 116 -11.001 -4.603 0.500 886 HB2 ASN 116 1HB ASN 116 -11.292 -4.355 2.787 887 HB3 ASN 116 2HB ASN 116 -12.566 -3.173 2.610 888 HD21 ASN 116 1HD2 ASN 116 -12.075 -6.627 2.043 889 HD22 ASN 116 2HD2 ASN 116 -13.641 -7.140 2.665 890 H GLY 117 H GLY 117 -12.326 -6.489 -0.401 891 HA2 GLY 117 2HA GLY 117 -15.188 -6.110 -0.550 892 HA3 GLY 117 1HA GLY 117 -14.425 -6.142 -2.141 893 H GLN 118 H GLN 118 -16.069 -8.000 -2.095 894 HA GLN 118 HA GLN 118 -15.608 -10.374 -0.681 895 HB2 GLN 118 1HB GLN 118 -17.323 -9.376 -2.845 896 HB3 GLN 118 2HB GLN 118 -16.888 -11.026 -3.149 897 HG2 GLN 118 1HG GLN 118 -17.887 -10.271 -0.407 898 HG3 GLN 118 2HG GLN 118 -19.041 -10.316 -1.741 899 HE21 GLN 118 1HE2 GLN 118 -19.189 -11.953 0.560 900 HE22 GLN 118 2HE2 GLN 118 -19.141 -13.600 0.044 901 HA PRO 119 HA PRO 119 -12.205 -12.109 -3.004 902 HB2 PRO 119 1HB PRO 119 -12.745 -14.844 -2.537 903 HB3 PRO 119 2HB PRO 119 -11.773 -13.780 -1.492 904 HG2 PRO 119 1HG PRO 119 -14.483 -14.851 -1.112 905 HG3 PRO 119 2HG PRO 119 -13.397 -14.109 0.109 906 HD2 PRO 119 1HD PRO 119 -15.678 -12.956 -1.197 907 HD3 PRO 119 2HD PRO 119 -14.570 -12.128 -0.076 908 H THR 120 H THR 120 -11.891 -12.904 -5.180 909 HA THR 120 HA THR 120 -14.480 -13.413 -6.584 910 HB THR 120 HB THR 120 -13.219 -12.796 -8.548 911 HG1 THR 120 1HG THR 120 -11.124 -12.897 -8.651 912 HG21 THR 120 3HG2 THR 120 -12.073 -11.238 -6.209 913 HG22 THR 120 1HG2 THR 120 -13.755 -11.048 -6.730 914 HG23 THR 120 2HG2 THR 120 -12.423 -10.590 -7.834 915 H THR 121 H THR 121 -12.096 -14.965 -5.416 916 HA THR 121 HA THR 121 -11.465 -17.258 -5.062 917 HB THR 121 HB THR 121 -13.856 -18.069 -6.767 918 HG1 THR 121 1HG THR 121 -14.621 -16.920 -5.080 919 HG21 THR 121 3HG2 THR 121 -12.086 -19.565 -4.773 920 HG22 THR 121 1HG2 THR 121 -12.542 -20.048 -6.423 921 HG23 THR 121 2HG2 THR 121 -13.736 -20.089 -5.139 922 H GLY 122 H GLY 122 -10.798 -19.283 -6.601 923 HA2 GLY 122 2HA GLY 122 -9.826 -18.664 -9.176 924 HA3 GLY 122 1HA GLY 122 -8.610 -18.344 -7.951 925 H ASP 123 H ASP 123 -7.500 -20.155 -9.040 926 HA ASP 123 HA ASP 123 -8.703 -22.611 -9.619 927 HB2 ASP 123 1HB ASP 123 -6.560 -21.546 -10.494 928 HB3 ASP 123 2HB ASP 123 -5.757 -22.174 -9.077 929 H ALA 124 H ALA 124 -6.669 -21.730 -6.812 930 HA ALA 124 HA ALA 124 -8.010 -23.679 -5.046 931 HB1 ALA 124 1HB ALA 124 -5.771 -24.632 -4.411 932 HB2 ALA 124 2HB ALA 124 -6.073 -24.927 -6.141 933 HB3 ALA 124 3HB ALA 124 -4.991 -23.616 -5.639 934 H ASP 125 H ASP 125 -7.775 -20.699 -5.518 935 HA ASP 125 HA ASP 125 -6.665 -19.853 -2.939 936 HB2 ASP 125 1HB ASP 125 -5.607 -18.211 -5.118 937 HB3 ASP 125 2HB ASP 125 -4.782 -18.899 -3.763 938 H HIS 126 H HIS 126 -7.855 -18.034 -2.308 939 HA HIS 126 HA HIS 126 -9.498 -16.695 -4.388 940 HB2 HIS 126 1HB HIS 126 -9.711 -16.114 -1.444 941 HB3 HIS 126 2HB HIS 126 -10.805 -15.718 -2.735 942 HD1 HIS 126 1HD HIS 126 -12.720 -17.671 -3.345 943 HD2 HIS 126 2HD HIS 126 -10.034 -18.372 -0.138 944 HE1 HIS 126 1HE HIS 126 -13.657 -19.565 -2.020 945 H THR 127 H THR 127 -9.481 -14.320 -4.128 946 HA THR 127 HA THR 127 -7.358 -13.029 -2.583 947 HB THR 127 HB THR 127 -7.693 -11.843 -5.233 948 HG1 THR 127 1HG THR 127 -7.786 -14.090 -5.870 949 HG21 THR 127 3HG2 THR 127 -5.219 -11.808 -5.235 950 HG22 THR 127 1HG2 THR 127 -5.176 -13.010 -3.926 951 HG23 THR 127 2HG2 THR 127 -5.800 -11.389 -3.610 952 H VAL 128 H VAL 128 -8.304 -11.477 -1.526 953 HA VAL 128 HA VAL 128 -10.936 -10.412 -2.420 954 HB VAL 128 HB VAL 128 -10.803 -9.330 -0.186 955 HG11 VAL 128 1HG1 VAL 128 -11.411 -11.355 1.075 956 HG12 VAL 128 2HG1 VAL 128 -12.090 -11.362 -0.549 957 HG13 VAL 128 3HG1 VAL 128 -10.651 -12.357 -0.168 958 HG21 VAL 128 3HG2 VAL 128 -9.401 -10.145 1.579 959 HG22 VAL 128 1HG2 VAL 128 -8.501 -11.193 0.483 960 HG23 VAL 128 2HG2 VAL 128 -8.403 -9.409 0.340 961 HA PRO 129 HA PRO 129 -8.729 -6.918 -4.089 962 HB2 PRO 129 1HB PRO 129 -10.807 -5.311 -4.711 963 HB3 PRO 129 2HB PRO 129 -10.524 -6.885 -5.508 964 HG2 PRO 129 1HG PRO 129 -12.462 -6.319 -3.265 965 HG3 PRO 129 2HG PRO 129 -12.749 -7.225 -4.794 966 HD2 PRO 129 1HD PRO 129 -12.155 -8.478 -2.478 967 HD3 PRO 129 2HD PRO 129 -11.578 -9.068 -4.058 968 H ILE 130 H ILE 130 -7.537 -5.355 -3.039 969 HA ILE 130 HA ILE 130 -8.769 -3.656 -0.943 970 HB ILE 130 HB ILE 130 -6.221 -5.296 -0.601 971 HG12 ILE 130 1HG1 ILE 130 -8.903 -5.441 0.864 972 HG13 ILE 130 2HG1 ILE 130 -8.279 -6.652 -0.256 973 HG21 ILE 130 1HG2 ILE 130 -6.000 -3.067 0.408 974 HG22 ILE 130 2HG2 ILE 130 -7.508 -3.319 1.327 975 HG23 ILE 130 3HG2 ILE 130 -6.062 -4.294 1.645 976 HD11 ILE 130 3HD1 ILE 130 -7.140 -6.016 2.484 977 HD12 ILE 130 1HD1 ILE 130 -8.016 -7.446 1.950 978 HD13 ILE 130 2HD1 ILE 130 -6.395 -7.120 1.294 979 H SER 131 H SER 131 -8.190 -1.565 -1.302 980 HA SER 131 HA SER 131 -5.553 -0.796 -2.016 981 HB2 SER 131 1HB SER 131 -6.317 0.455 -4.164 982 HB3 SER 131 2HB SER 131 -6.048 -1.279 -4.304 983 HG SER 131 HG SER 131 -7.991 -0.371 -5.278 984 H LEU 132 H LEU 132 -5.353 1.603 -2.236 985 HA LEU 132 HA LEU 132 -7.598 3.217 -1.267 986 HB2 LEU 132 1HB LEU 132 -6.081 4.327 0.410 987 HB3 LEU 132 2HB LEU 132 -6.843 2.797 0.833 988 HG LEU 132 HG LEU 132 -4.478 1.766 0.156 989 HD11 LEU 132 1HD1 LEU 132 -3.662 4.595 0.959 990 HD12 LEU 132 2HD1 LEU 132 -3.446 3.897 -0.658 991 HD13 LEU 132 3HD1 LEU 132 -2.597 3.193 0.732 992 HD21 LEU 132 3HD2 LEU 132 -3.796 2.055 2.516 993 HD22 LEU 132 1HD2 LEU 132 -5.520 1.685 2.337 994 HD23 LEU 132 2HD2 LEU 132 -5.015 3.345 2.704 995 H GLY 133 H GLY 133 -7.342 5.464 -1.732 996 HA2 GLY 133 2HA GLY 133 -5.501 6.137 -3.894 997 HA3 GLY 133 1HA GLY 133 -6.661 7.185 -3.070 998 H TYR 134 H TYR 134 -4.142 8.247 -3.534 999 HA TYR 134 HA TYR 134 -3.997 9.281 -0.968 1000 HB2 TYR 134 1HB TYR 134 -1.631 9.098 -0.419 1001 HB3 TYR 134 2HB TYR 134 -2.348 7.512 -0.445 1002 HD1 TYR 134 2HD TYR 134 -1.981 6.035 -2.501 1003 HD2 TYR 134 1HD TYR 134 0.184 9.708 -1.789 1004 HE1 TYR 134 2HE TYR 134 -0.164 5.252 -3.962 1005 HE2 TYR 134 1HE TYR 134 2.012 8.944 -3.287 1006 HH TYR 134 HH TYR 134 1.774 5.937 -5.140 1007 H ASP 135 H ASP 135 -2.609 11.259 -0.942 1008 HA ASP 135 HA ASP 135 -1.781 12.226 -3.608 1009 HB2 ASP 135 1HB ASP 135 -2.883 14.188 -3.509 1010 HB3 ASP 135 2HB ASP 135 -4.095 13.133 -2.814 1011 H VAL 136 H VAL 136 -0.441 14.433 -3.108 1012 HA VAL 136 HA VAL 136 1.519 13.745 -0.996 1013 HB VAL 136 HB VAL 136 2.092 13.894 -3.962 1014 HG11 VAL 136 1HG1 VAL 136 4.380 13.156 -3.360 1015 HG12 VAL 136 2HG1 VAL 136 3.953 14.719 -2.679 1016 HG13 VAL 136 3HG1 VAL 136 3.926 13.290 -1.638 1017 HG21 VAL 136 3HG2 VAL 136 2.156 11.433 -2.168 1018 HG22 VAL 136 1HG2 VAL 136 1.062 11.700 -3.540 1019 HG23 VAL 136 2HG2 VAL 136 2.787 11.491 -3.830 1020 H GLN 137 H GLN 137 2.205 15.616 -0.117 1021 HA GLN 137 HA GLN 137 1.816 18.132 -1.632 1022 HB2 GLN 137 1HB GLN 137 0.923 19.237 0.230 1023 HB3 GLN 137 2HB GLN 137 -0.067 17.810 -0.107 1024 HG2 GLN 137 1HG GLN 137 1.140 16.603 1.764 1025 HG3 GLN 137 2HG GLN 137 1.980 18.124 2.122 1026 HE21 GLN 137 1HE2 GLN 137 0.089 16.605 3.993 1027 HE22 GLN 137 2HE2 GLN 137 -1.023 17.928 4.346 1028 H PHE 138 H PHE 138 3.398 19.702 -1.303 1029 HA PHE 138 HA PHE 138 5.936 18.862 -0.304 1030 HB2 PHE 138 1HB PHE 138 4.721 21.379 -1.380 1031 HB3 PHE 138 2HB PHE 138 6.220 21.529 -0.462 1032 HD1 PHE 138 2HD PHE 138 4.773 19.329 -3.165 1033 HD2 PHE 138 1HD PHE 138 8.261 21.278 -1.574 1034 HE1 PHE 138 2HE PHE 138 6.173 18.260 -4.918 1035 HE2 PHE 138 1HE PHE 138 9.659 20.235 -3.329 1036 HZ PHE 138 HZ PHE 138 8.615 18.664 -4.981 1037 H TYR 139 H TYR 139 3.243 20.074 1.314 1038 HA TYR 139 HA TYR 139 2.612 20.862 3.204 1039 HB2 TYR 139 1HB TYR 139 4.371 18.891 3.842 1040 HB3 TYR 139 2HB TYR 139 5.165 20.256 4.559 1041 HD1 TYR 139 1HD TYR 139 2.240 18.040 4.517 1042 HD2 TYR 139 2HD TYR 139 4.057 21.353 6.592 1043 HE1 TYR 139 1HE TYR 139 0.601 17.765 6.357 1044 HE2 TYR 139 2HE TYR 139 2.456 21.072 8.443 1045 HH TYR 139 HH TYR 139 0.580 19.976 9.184 1046 HA PRO 140 HA PRO 140 4.141 24.971 2.954 1047 HB2 PRO 140 1HB PRO 140 2.954 26.211 5.124 1048 HB3 PRO 140 2HB PRO 140 2.054 25.681 3.673 1049 HG2 PRO 140 1HG PRO 140 2.450 24.168 6.282 1050 HG3 PRO 140 2HG PRO 140 0.906 24.513 5.439 1051 HD2 PRO 140 1HD PRO 140 2.077 22.157 5.060 1052 HD3 PRO 140 2HD PRO 140 1.468 23.045 3.646 1053 H GLU 141 H GLU 141 5.520 26.472 3.774 1054 HA GLU 141 HA GLU 141 7.444 27.164 4.569 1055 HB2 GLU 141 1HB GLU 141 5.738 27.774 6.431 1056 HB3 GLU 141 2HB GLU 141 6.549 26.545 7.398 1057 HG2 GLU 141 1HG GLU 141 8.733 27.733 6.965 1058 HG3 GLU 141 2HG GLU 141 7.882 28.923 6.007 Start of MODEL 18 1 H1 GLY 1 H GLY 1 16.919 11.843 -8.167 2 HA2 GLY 1 2HA GLY 1 15.858 9.989 -6.926 3 HA3 GLY 1 1HA GLY 1 17.274 10.003 -5.862 4 H MET 2 H MET 2 14.180 11.413 -6.518 5 HA MET 2 HA MET 2 14.461 13.231 -4.255 6 HB2 MET 2 1HB MET 2 13.649 15.174 -5.603 7 HB3 MET 2 2HB MET 2 15.298 14.703 -5.972 8 HG2 MET 2 1HG MET 2 13.087 13.584 -7.697 9 HG3 MET 2 2HG MET 2 13.522 15.271 -7.868 10 HE1 MET 2 3HE MET 2 14.426 15.464 -10.191 11 HE2 MET 2 1HE MET 2 15.324 14.162 -10.999 12 HE3 MET 2 2HE MET 2 13.675 13.868 -10.397 13 H SER 3 H SER 3 12.427 14.225 -3.765 14 HA SER 3 HA SER 3 10.316 14.006 -3.136 15 HB2 SER 3 1HB SER 3 9.948 14.315 -6.112 16 HB3 SER 3 2HB SER 3 8.850 14.863 -4.828 17 HG SER 3 HG SER 3 10.629 16.145 -4.022 18 H GLN 4 H GLN 4 9.761 12.075 -6.132 19 HA GLN 4 HA GLN 4 7.863 10.348 -4.892 20 HB2 GLN 4 1HB GLN 4 9.561 10.201 -7.401 21 HB3 GLN 4 2HB GLN 4 8.610 8.812 -6.913 22 HG2 GLN 4 1HG GLN 4 7.306 11.530 -7.264 23 HG3 GLN 4 2HG GLN 4 7.614 10.460 -8.616 24 HE21 GLN 4 1HE2 GLN 4 6.175 9.849 -5.230 25 HE22 GLN 4 2HE2 GLN 4 4.966 8.797 -5.932 26 H ASP 5 H ASP 5 11.352 10.204 -5.225 27 HA ASP 5 HA ASP 5 12.052 7.639 -4.395 28 HB2 ASP 5 1HB ASP 5 13.439 9.511 -5.322 29 HB3 ASP 5 2HB ASP 5 13.329 10.364 -3.803 30 H LEU 6 H LEU 6 11.864 10.521 -2.410 31 HA LEU 6 HA LEU 6 12.129 9.324 0.146 32 HB2 LEU 6 1HB LEU 6 10.563 11.863 -0.501 33 HB3 LEU 6 2HB LEU 6 11.421 11.530 0.981 34 HG LEU 6 HG LEU 6 12.807 11.925 -1.719 35 HD11 LEU 6 1HD1 LEU 6 12.438 14.038 0.374 36 HD12 LEU 6 2HD1 LEU 6 11.288 13.851 -0.971 37 HD13 LEU 6 3HD1 LEU 6 13.005 14.224 -1.286 38 HD21 LEU 6 3HD2 LEU 6 13.776 12.037 1.176 39 HD22 LEU 6 1HD2 LEU 6 14.741 12.417 -0.248 40 HD23 LEU 6 2HD2 LEU 6 14.152 10.773 -0.018 41 H ILE 7 H ILE 7 9.279 10.589 -1.523 42 HA ILE 7 HA ILE 7 7.261 9.862 0.152 43 HB ILE 7 HB ILE 7 7.433 10.034 -2.835 44 HG12 ILE 7 1HG1 ILE 7 5.637 11.655 -1.064 45 HG13 ILE 7 2HG1 ILE 7 7.368 11.993 -1.001 46 HG21 ILE 7 1HG2 ILE 7 4.844 9.443 -1.351 47 HG22 ILE 7 2HG2 ILE 7 4.995 9.903 -3.068 48 HG23 ILE 7 3HG2 ILE 7 5.656 8.372 -2.513 49 HD11 ILE 7 3HD1 ILE 7 5.754 12.088 -3.569 50 HD12 ILE 7 1HD1 ILE 7 5.970 13.475 -2.478 51 HD13 ILE 7 2HD1 ILE 7 7.373 12.772 -3.251 52 H ARG 8 H ARG 8 8.800 7.579 -2.222 53 HA ARG 8 HA ARG 8 6.935 5.484 -1.726 54 HB2 ARG 8 1HB ARG 8 8.853 5.795 -3.575 55 HB3 ARG 8 2HB ARG 8 9.809 4.854 -2.453 56 HG2 ARG 8 1HG ARG 8 8.158 3.032 -2.473 57 HG3 ARG 8 2HG ARG 8 7.045 4.001 -3.462 58 HD2 ARG 8 1HD ARG 8 9.778 2.985 -4.325 59 HD3 ARG 8 2HD ARG 8 8.217 2.322 -4.801 60 HE ARG 8 HE ARG 8 8.183 5.051 -5.476 61 HH11 ARG 8 1HH1 ARG 8 9.889 2.096 -6.525 62 HH12 ARG 8 2HH1 ARG 8 10.371 2.770 -8.056 63 HH21 ARG 8 1HH2 ARG 8 8.510 5.775 -7.637 64 HH22 ARG 8 2HH2 ARG 8 9.376 4.794 -8.750 65 H ALA 9 H ALA 9 10.070 6.239 -0.269 66 HA ALA 9 HA ALA 9 10.658 4.138 1.324 67 HB1 ALA 9 1HB ALA 9 11.913 5.680 2.607 68 HB2 ALA 9 2HB ALA 9 11.706 6.555 1.066 69 HB3 ALA 9 3HB ALA 9 10.707 6.949 2.482 70 H ALA 10 H ALA 10 8.289 6.687 2.122 71 HA ALA 10 HA ALA 10 7.803 5.854 4.779 72 HB1 ALA 10 1HB ALA 10 5.805 7.199 2.939 73 HB2 ALA 10 2HB ALA 10 5.884 7.296 4.702 74 HB3 ALA 10 3HB ALA 10 7.157 8.050 3.731 75 H PHE 11 H PHE 11 6.423 4.705 1.722 76 HA PHE 11 HA PHE 11 4.061 3.445 2.871 77 HB2 PHE 11 1HB PHE 11 5.469 3.096 0.182 78 HB3 PHE 11 2HB PHE 11 4.019 2.270 0.669 79 HD1 PHE 11 2HD PHE 11 4.931 5.997 0.817 80 HD2 PHE 11 1HD PHE 11 2.259 2.924 -0.641 81 HE1 PHE 11 2HE PHE 11 3.603 7.692 -0.288 82 HE2 PHE 11 1HE PHE 11 0.885 4.678 -1.720 83 HZ PHE 11 HZ PHE 11 1.542 7.061 -1.559 84 H GLU 12 H GLU 12 7.371 2.478 1.908 85 HA GLU 12 HA GLU 12 7.168 -0.297 2.569 86 HB2 GLU 12 1HB GLU 12 9.592 1.532 2.430 87 HB3 GLU 12 2HB GLU 12 9.601 -0.241 2.442 88 HG2 GLU 12 1HG GLU 12 8.441 -0.325 0.306 89 HG3 GLU 12 2HG GLU 12 8.194 1.419 0.289 90 H LYS 13 H LYS 13 8.134 2.567 4.409 91 HA LYS 13 HA LYS 13 8.751 1.275 6.927 92 HB2 LYS 13 1HB LYS 13 9.776 3.346 6.205 93 HB3 LYS 13 2HB LYS 13 8.204 4.148 6.118 94 HG2 LYS 13 1HG LYS 13 7.927 4.164 8.455 95 HG3 LYS 13 2HG LYS 13 9.166 2.911 8.708 96 HD2 LYS 13 1HD LYS 13 10.932 4.409 8.190 97 HD3 LYS 13 2HD LYS 13 9.799 5.657 7.593 98 HE2 LYS 13 1HE LYS 13 8.765 5.820 9.836 99 HE3 LYS 13 2HE LYS 13 9.900 4.620 10.456 100 HZ1 LYS 13 3HZ LYS 13 10.541 6.862 10.965 101 HZ2 LYS 13 1HZ LYS 13 10.668 7.264 9.378 102 HZ3 LYS 13 2HZ LYS 13 11.687 6.149 10.041 103 H ARG 14 H ARG 14 5.865 1.490 5.264 104 HA ARG 14 HA ARG 14 4.548 1.111 7.851 105 HB2 ARG 14 1HB ARG 14 3.381 2.265 5.340 106 HB3 ARG 14 2HB ARG 14 2.355 1.321 6.431 107 HG2 ARG 14 1HG ARG 14 4.031 3.648 7.414 108 HG3 ARG 14 2HG ARG 14 2.368 3.828 6.836 109 HD2 ARG 14 1HD ARG 14 1.504 2.371 8.537 110 HD3 ARG 14 2HD ARG 14 3.113 1.917 9.096 111 HE ARG 14 HE ARG 14 1.586 4.298 9.662 112 HH11 ARG 14 1HH1 ARG 14 4.953 3.003 9.611 113 HH12 ARG 14 2HH1 ARG 14 5.511 4.123 10.799 114 HH21 ARG 14 1HH2 ARG 14 2.369 5.662 11.352 115 HH22 ARG 14 2HH2 ARG 14 4.041 5.692 11.765 116 H LEU 15 H LEU 15 4.198 -0.114 4.472 117 HA LEU 15 HA LEU 15 2.806 -2.381 5.363 118 HB2 LEU 15 1HB LEU 15 2.926 -1.291 3.008 119 HB3 LEU 15 2HB LEU 15 4.445 -2.172 2.836 120 HG LEU 15 HG LEU 15 3.269 -4.318 3.115 121 HD11 LEU 15 1HD1 LEU 15 1.262 -3.613 4.380 122 HD12 LEU 15 2HD1 LEU 15 0.807 -4.407 2.880 123 HD13 LEU 15 3HD1 LEU 15 0.723 -2.640 2.989 124 HD21 LEU 15 3HD2 LEU 15 2.321 -2.389 0.947 125 HD22 LEU 15 1HD2 LEU 15 2.128 -4.166 0.853 126 HD23 LEU 15 2HD2 LEU 15 3.739 -3.413 0.878 127 H SER 16 H SER 16 6.342 -2.175 4.334 128 HA SER 16 HA SER 16 6.814 -4.947 4.802 129 HB2 SER 16 1HB SER 16 8.773 -2.621 4.739 130 HB3 SER 16 2HB SER 16 9.109 -4.336 4.504 131 HG SER 16 HG SER 16 9.022 -3.575 2.544 132 H ASP 17 H ASP 17 7.166 -1.987 6.697 133 HA ASP 17 HA ASP 17 8.459 -2.988 9.012 134 HB2 ASP 17 1HB ASP 17 7.112 -0.553 8.115 135 HB3 ASP 17 2HB ASP 17 6.657 -0.919 9.766 136 H TRP 18 H TRP 18 5.037 -2.789 8.116 137 HA TRP 18 HA TRP 18 3.912 -3.732 10.603 138 HB2 TRP 18 1HB TRP 18 2.531 -2.448 9.176 139 HB3 TRP 18 2HB TRP 18 2.905 -3.376 7.754 140 HD1 TRP 18 HD TRP 18 0.846 -3.703 10.996 141 HE1 TRP 18 1HE TRP 18 -0.982 -5.421 10.658 142 HE3 TRP 18 3HE TRP 18 2.206 -5.404 6.356 143 HZ2 TRP 18 2HZ TRP 18 -1.661 -7.508 8.685 144 HZ3 TRP 18 3HZ TRP 18 1.044 -7.410 5.364 145 HH2 TRP 18 HH TRP 18 -1.069 -8.226 6.429 146 H ALA 19 H ALA 19 4.355 -5.324 7.378 147 HA ALA 19 HA ALA 19 3.204 -7.744 8.227 148 HB1 ALA 19 1HB ALA 19 4.194 -8.734 6.211 149 HB2 ALA 19 2HB ALA 19 3.682 -7.095 5.835 150 HB3 ALA 19 3HB ALA 19 5.402 -7.446 6.124 151 H LYS 20 H LYS 20 6.653 -6.671 8.602 152 HA LYS 20 HA LYS 20 7.476 -9.288 9.572 153 HB2 LYS 20 1HB LYS 20 9.582 -8.232 10.128 154 HB3 LYS 20 2HB LYS 20 9.055 -7.846 8.504 155 HG2 LYS 20 1HG LYS 20 9.873 -5.831 9.198 156 HG3 LYS 20 2HG LYS 20 8.173 -5.610 9.484 157 HD2 LYS 20 1HD LYS 20 8.409 -5.596 11.795 158 HD3 LYS 20 2HD LYS 20 9.890 -6.544 11.772 159 HE2 LYS 20 1HE LYS 20 9.687 -3.693 10.680 160 HE3 LYS 20 2HE LYS 20 10.058 -4.046 12.367 161 HZ1 LYS 20 3HZ LYS 20 11.744 -4.904 10.072 162 HZ2 LYS 20 1HZ LYS 20 11.973 -5.297 11.646 163 HZ3 LYS 20 2HZ LYS 20 12.082 -3.741 11.192 164 H ALA 21 H ALA 21 6.098 -6.464 11.123 165 HA ALA 21 HA ALA 21 6.738 -7.354 13.836 166 HB1 ALA 21 1HB ALA 21 4.827 -5.202 12.797 167 HB2 ALA 21 2HB ALA 21 5.307 -5.440 14.491 168 HB3 ALA 21 3HB ALA 21 6.512 -4.949 13.297 169 H ARG 22 H ARG 22 4.005 -7.616 11.587 170 HA ARG 22 HA ARG 22 1.930 -8.434 13.164 171 HB2 ARG 22 1HB ARG 22 2.262 -7.917 10.582 172 HB3 ARG 22 2HB ARG 22 2.690 -9.638 10.548 173 HG2 ARG 22 1HG ARG 22 0.200 -9.543 11.809 174 HG3 ARG 22 2HG ARG 22 0.088 -8.341 10.525 175 HD2 ARG 22 1HD ARG 22 1.244 -11.111 9.980 176 HD3 ARG 22 2HD ARG 22 -0.463 -10.901 10.052 177 HE ARG 22 HE ARG 22 -0.592 -9.893 8.138 178 HH11 ARG 22 1HH1 ARG 22 2.850 -10.045 8.938 179 HH12 ARG 22 2HH1 ARG 22 3.387 -9.849 7.324 180 HH21 ARG 22 1HH2 ARG 22 0.147 -9.771 5.946 181 HH22 ARG 22 2HH2 ARG 22 1.812 -9.679 5.566 182 H THR 23 H THR 23 0.945 -10.634 13.076 183 HA THR 23 HA THR 23 2.558 -12.333 14.642 184 HB THR 23 HB THR 23 -0.250 -12.740 13.588 185 HG1 THR 23 1HG THR 23 0.975 -11.648 15.863 186 HG21 THR 23 3HG2 THR 23 0.748 -14.905 14.191 187 HG22 THR 23 1HG2 THR 23 -0.461 -14.418 15.388 188 HG23 THR 23 2HG2 THR 23 1.285 -14.253 15.746 189 HA PRO 24 HA PRO 24 2.776 -15.882 11.566 190 HB2 PRO 24 1HB PRO 24 1.837 -15.595 8.983 191 HB3 PRO 24 2HB PRO 24 0.910 -16.298 10.331 192 HG2 PRO 24 1HG PRO 24 0.857 -13.461 9.247 193 HG3 PRO 24 2HG PRO 24 -0.540 -14.510 9.640 194 HD2 PRO 24 1HD PRO 24 0.286 -12.652 11.401 195 HD3 PRO 24 2HD PRO 24 -0.174 -14.289 11.968 196 H ALA 25 H ALA 25 3.293 -12.763 10.847 197 HA ALA 25 HA ALA 25 4.628 -11.437 9.554 198 HB1 ALA 25 1HB ALA 25 6.362 -13.414 10.927 199 HB2 ALA 25 2HB ALA 25 7.073 -12.080 9.961 200 HB3 ALA 25 3HB ALA 25 6.008 -11.732 11.334 201 H LEU 26 H LEU 26 4.065 -11.464 7.617 202 HA LEU 26 HA LEU 26 4.731 -13.567 5.650 203 HB2 LEU 26 1HB LEU 26 2.880 -11.135 5.304 204 HB3 LEU 26 2HB LEU 26 2.956 -12.582 4.295 205 HG LEU 26 HG LEU 26 2.000 -12.517 7.192 206 HD11 LEU 26 1HD1 LEU 26 0.696 -11.805 4.853 207 HD12 LEU 26 2HD1 LEU 26 -0.035 -12.178 6.410 208 HD13 LEU 26 3HD1 LEU 26 0.106 -13.441 5.167 209 HD21 LEU 26 3HD2 LEU 26 2.127 -14.901 5.315 210 HD22 LEU 26 1HD2 LEU 26 1.270 -14.820 6.867 211 HD23 LEU 26 2HD2 LEU 26 3.025 -14.687 6.833 212 HA PRO 27 HA PRO 27 7.443 -10.779 3.411 213 HB2 PRO 27 1HB PRO 27 7.465 -11.825 0.918 214 HB3 PRO 27 2HB PRO 27 8.146 -12.701 2.317 215 HG2 PRO 27 1HG PRO 27 5.404 -13.040 1.049 216 HG3 PRO 27 2HG PRO 27 6.562 -14.317 1.475 217 HD2 PRO 27 1HD PRO 27 4.490 -13.592 3.104 218 HD3 PRO 27 2HD PRO 27 6.061 -14.128 3.761 219 H VAL 28 H VAL 28 7.510 -9.134 1.670 220 HA VAL 28 HA VAL 28 4.828 -8.192 0.793 221 HB VAL 28 HB VAL 28 7.092 -6.569 2.019 222 HG11 VAL 28 1HG1 VAL 28 5.457 -4.776 2.116 223 HG12 VAL 28 2HG1 VAL 28 5.603 -5.321 0.441 224 HG13 VAL 28 3HG1 VAL 28 4.207 -5.848 1.430 225 HG21 VAL 28 3HG2 VAL 28 6.201 -7.887 3.815 226 HG22 VAL 28 1HG2 VAL 28 5.409 -6.307 3.929 227 HG23 VAL 28 2HG2 VAL 28 4.531 -7.676 3.229 228 H ALA 29 H ALA 29 4.924 -8.564 -1.413 229 HA ALA 29 HA ALA 29 7.471 -8.179 -2.824 230 HB1 ALA 29 1HB ALA 29 4.776 -9.207 -3.803 231 HB2 ALA 29 2HB ALA 29 6.277 -9.143 -4.754 232 HB3 ALA 29 3HB ALA 29 6.171 -10.194 -3.324 233 H TRP 30 H TRP 30 7.769 -5.896 -2.932 234 HA TRP 30 HA TRP 30 5.731 -4.099 -3.972 235 HB2 TRP 30 1HB TRP 30 8.721 -3.802 -3.548 236 HB3 TRP 30 2HB TRP 30 7.675 -2.523 -4.074 237 HD1 TRP 30 HD TRP 30 8.754 -4.221 -0.910 238 HE1 TRP 30 1HE TRP 30 7.628 -3.099 1.099 239 HE3 TRP 30 3HE TRP 30 5.318 -1.371 -3.406 240 HZ2 TRP 30 2HZ TRP 30 5.567 -1.100 1.531 241 HZ3 TRP 30 3HZ TRP 30 3.719 0.062 -2.142 242 HH2 TRP 30 HH TRP 30 3.813 0.150 0.330 243 H GLN 31 H GLN 31 6.749 -2.595 -5.985 244 HA GLN 31 HA GLN 31 5.818 -4.116 -8.119 245 HB2 GLN 31 1HB GLN 31 7.457 -1.554 -8.176 246 HB3 GLN 31 2HB GLN 31 6.735 -2.314 -9.581 247 HG2 GLN 31 1HG GLN 31 4.456 -2.069 -8.370 248 HG3 GLN 31 2HG GLN 31 5.326 -0.967 -7.274 249 HE21 GLN 31 1HE2 GLN 31 4.343 -1.537 -10.639 250 HE22 GLN 31 2HE2 GLN 31 4.871 -0.036 -11.333 251 H ASN 32 H ASN 32 9.171 -2.986 -7.675 252 HA ASN 32 HA ASN 32 9.994 -4.825 -9.853 253 HB2 ASN 32 1HB ASN 32 11.243 -2.236 -8.939 254 HB3 ASN 32 2HB ASN 32 11.939 -3.340 -10.121 255 HD21 ASN 32 1HD2 ASN 32 9.729 -0.785 -9.748 256 HD22 ASN 32 2HD2 ASN 32 9.014 -0.860 -11.339 257 H THR 33 H THR 33 9.517 -5.823 -7.245 258 HA THR 33 HA THR 33 12.212 -6.539 -6.242 259 HB THR 33 HB THR 33 9.671 -6.101 -4.624 260 HG1 THR 33 1HG THR 33 11.778 -4.301 -5.220 261 HG21 THR 33 3HG2 THR 33 11.296 -7.437 -3.405 262 HG22 THR 33 1HG2 THR 33 11.252 -5.810 -2.719 263 HG23 THR 33 2HG2 THR 33 12.592 -6.279 -3.788 264 H LYS 34 H LYS 34 12.161 -8.729 -5.177 265 HA LYS 34 HA LYS 34 9.891 -10.459 -6.039 266 HB2 LYS 34 1HB LYS 34 12.886 -10.851 -6.149 267 HB3 LYS 34 2HB LYS 34 11.893 -12.237 -5.758 268 HG2 LYS 34 1HG LYS 34 10.818 -10.764 -8.088 269 HG3 LYS 34 2HG LYS 34 12.489 -11.290 -8.313 270 HD2 LYS 34 1HD LYS 34 11.018 -13.009 -9.117 271 HD3 LYS 34 2HD LYS 34 11.882 -13.592 -7.716 272 HE2 LYS 34 1HE LYS 34 9.919 -13.304 -6.300 273 HE3 LYS 34 2HE LYS 34 9.015 -12.563 -7.643 274 HZ1 LYS 34 3HZ LYS 34 10.123 -15.279 -7.843 275 HZ2 LYS 34 1HZ LYS 34 8.915 -14.604 -8.760 276 HZ3 LYS 34 2HZ LYS 34 8.674 -15.003 -7.171 277 H PHE 35 H PHE 35 9.368 -12.119 -4.572 278 HA PHE 35 HA PHE 35 10.768 -12.414 -2.088 279 HB2 PHE 35 1HB PHE 35 8.215 -10.855 -2.139 280 HB3 PHE 35 2HB PHE 35 8.237 -12.189 -1.024 281 HD1 PHE 35 2HD PHE 35 10.273 -12.449 0.573 282 HD2 PHE 35 1HD PHE 35 9.375 -8.827 -1.580 283 HE1 PHE 35 2HE PHE 35 11.796 -11.190 2.057 284 HE2 PHE 35 1HE PHE 35 10.845 -7.551 -0.048 285 HZ PHE 35 HZ PHE 35 12.122 -8.738 1.726 286 H THR 36 H THR 36 11.089 -14.487 -2.576 287 HA THR 36 HA THR 36 8.895 -16.406 -2.730 288 HB THR 36 HB THR 36 11.029 -15.833 -4.844 289 HG1 THR 36 1HG THR 36 8.481 -15.206 -4.513 290 HG21 THR 36 3HG2 THR 36 9.146 -18.209 -4.738 291 HG22 THR 36 1HG2 THR 36 10.920 -18.268 -4.596 292 HG23 THR 36 2HG2 THR 36 10.172 -17.758 -6.114 293 HA PRO 37 HA PRO 37 9.033 -18.925 -2.675 294 HB2 PRO 37 1HB PRO 37 8.843 -20.529 -0.452 295 HB3 PRO 37 2HB PRO 37 9.969 -20.851 -1.800 296 HG2 PRO 37 1HG PRO 37 10.554 -19.410 0.806 297 HG3 PRO 37 2HG PRO 37 11.482 -20.754 0.067 298 HD2 PRO 37 1HD PRO 37 12.273 -18.213 -0.286 299 HD3 PRO 37 2HD PRO 37 12.320 -19.373 -1.656 300 HA PRO 38 HA PRO 38 6.071 -16.562 -0.276 301 HB2 PRO 38 1HB PRO 38 3.902 -18.246 -0.125 302 HB3 PRO 38 2HB PRO 38 4.365 -17.370 -1.626 303 HG2 PRO 38 1HG PRO 38 4.977 -20.233 -0.845 304 HG3 PRO 38 2HG PRO 38 4.394 -19.622 -2.421 305 HD2 PRO 38 1HD PRO 38 7.019 -20.159 -1.961 306 HD3 PRO 38 2HD PRO 38 6.534 -18.782 -2.980 307 H ALA 39 H ALA 39 4.416 -16.948 1.625 308 HA ALA 39 HA ALA 39 5.685 -18.366 3.825 309 HB1 ALA 39 1HB ALA 39 3.213 -16.577 3.713 310 HB2 ALA 39 2HB ALA 39 3.831 -17.369 5.170 311 HB3 ALA 39 3HB ALA 39 4.809 -16.133 4.359 312 H ALA 40 H ALA 40 5.454 -20.194 2.444 313 HA ALA 40 HA ALA 40 4.660 -22.277 1.994 314 HB1 ALA 40 1HB ALA 40 4.395 -22.393 4.446 315 HB2 ALA 40 2HB ALA 40 2.729 -21.772 4.298 316 HB3 ALA 40 3HB ALA 40 3.153 -23.358 3.618 317 H GLY 41 H GLY 41 3.241 -19.856 0.869 318 HA2 GLY 41 2HA GLY 41 1.999 -20.226 -1.237 319 HA3 GLY 41 1HA GLY 41 0.855 -21.240 -0.335 320 H VAL 42 H VAL 42 1.489 -18.921 1.794 321 HA VAL 42 HA VAL 42 -0.597 -17.013 0.876 322 HB VAL 42 HB VAL 42 0.849 -17.419 3.542 323 HG11 VAL 42 1HG1 VAL 42 -0.690 -15.716 4.472 324 HG12 VAL 42 2HG1 VAL 42 0.444 -15.030 3.317 325 HG13 VAL 42 3HG1 VAL 42 -1.236 -15.338 2.824 326 HG21 VAL 42 3HG2 VAL 42 -2.095 -17.696 2.878 327 HG22 VAL 42 1HG2 VAL 42 -0.969 -19.075 2.964 328 HG23 VAL 42 2HG2 VAL 42 -1.303 -18.103 4.405 329 H TYR 43 H TYR 43 -0.060 -14.865 0.461 330 HA TYR 43 HA TYR 43 2.458 -13.707 1.060 331 HB2 TYR 43 1HB TYR 43 3.296 -13.439 -1.281 332 HB3 TYR 43 2HB TYR 43 3.421 -15.060 -0.688 333 HD1 TYR 43 2HD TYR 43 1.836 -16.862 -1.509 334 HD2 TYR 43 1HD TYR 43 1.871 -12.883 -3.161 335 HE1 TYR 43 2HE TYR 43 0.656 -17.690 -3.475 336 HE2 TYR 43 1HE TYR 43 0.600 -13.743 -5.146 337 HH TYR 43 HH TYR 43 -0.223 -17.153 -5.556 338 H LEU 44 H LEU 44 2.617 -11.711 -0.685 339 HA LEU 44 HA LEU 44 0.026 -10.289 -0.575 340 HB2 LEU 44 1HB LEU 44 1.629 -10.260 1.593 341 HB3 LEU 44 2HB LEU 44 2.586 -9.161 0.632 342 HG LEU 44 HG LEU 44 0.684 -7.611 0.469 343 HD11 LEU 44 1HD1 LEU 44 -0.768 -9.774 2.075 344 HD12 LEU 44 2HD1 LEU 44 -1.283 -9.024 0.553 345 HD13 LEU 44 3HD1 LEU 44 -1.314 -8.091 2.037 346 HD21 LEU 44 3HD2 LEU 44 0.638 -7.004 2.896 347 HD22 LEU 44 1HD2 LEU 44 2.268 -7.443 2.349 348 HD23 LEU 44 2HD2 LEU 44 1.304 -8.609 3.287 349 H ARG 45 H ARG 45 -0.144 -8.996 -2.409 350 HA ARG 45 HA ARG 45 2.370 -8.429 -3.948 351 HB2 ARG 45 1HB ARG 45 -0.331 -9.427 -4.895 352 HB3 ARG 45 2HB ARG 45 0.798 -8.595 -5.969 353 HG2 ARG 45 1HG ARG 45 2.561 -10.265 -5.467 354 HG3 ARG 45 2HG ARG 45 1.479 -11.062 -4.335 355 HD2 ARG 45 1HD ARG 45 1.516 -12.355 -6.309 356 HD3 ARG 45 2HD ARG 45 -0.076 -11.596 -6.222 357 HE ARG 45 HE ARG 45 0.713 -9.988 -7.912 358 HH11 ARG 45 1HH1 ARG 45 2.596 -13.069 -7.718 359 HH12 ARG 45 2HH1 ARG 45 3.493 -12.710 -9.129 360 HH21 ARG 45 1HH2 ARG 45 1.639 -9.771 -9.928 361 HH22 ARG 45 2HH2 ARG 45 2.851 -10.873 -10.485 362 H ALA 46 H ALA 46 2.685 -6.442 -3.128 363 HA ALA 46 HA ALA 46 0.662 -4.357 -2.972 364 HB1 ALA 46 1HB ALA 46 2.549 -4.090 -1.532 365 HB2 ALA 46 2HB ALA 46 3.709 -4.506 -2.816 366 HB3 ALA 46 3HB ALA 46 2.884 -2.967 -2.859 367 H TYR 47 H TYR 47 0.244 -2.707 -4.568 368 HA TYR 47 HA TYR 47 2.230 -2.359 -6.685 369 HB2 TYR 47 1HB TYR 47 0.184 -3.727 -7.527 370 HB3 TYR 47 2HB TYR 47 -0.723 -2.234 -7.325 371 HD1 TYR 47 1HD TYR 47 0.028 -0.216 -8.549 372 HD2 TYR 47 2HD TYR 47 1.719 -4.081 -9.306 373 HE1 TYR 47 1HE TYR 47 0.948 0.632 -10.719 374 HE2 TYR 47 2HE TYR 47 2.621 -3.292 -11.480 375 HH TYR 47 HH TYR 47 2.101 0.100 -12.620 376 H VAL 48 H VAL 48 2.506 0.013 -7.067 377 HA VAL 48 HA VAL 48 0.527 1.695 -5.805 378 HB VAL 48 HB VAL 48 2.559 1.233 -4.324 379 HG11 VAL 48 1HG1 VAL 48 4.600 2.372 -4.725 380 HG12 VAL 48 2HG1 VAL 48 4.258 1.315 -6.129 381 HG13 VAL 48 3HG1 VAL 48 3.962 3.067 -6.238 382 HG21 VAL 48 3HG2 VAL 48 1.011 3.103 -4.095 383 HG22 VAL 48 1HG2 VAL 48 2.675 3.592 -3.679 384 HG23 VAL 48 2HG2 VAL 48 1.973 4.029 -5.266 385 H MET 49 H MET 49 -0.301 2.783 -7.338 386 HA MET 49 HA MET 49 1.035 3.160 -9.960 387 HB2 MET 49 1HB MET 49 -1.763 3.772 -8.930 388 HB3 MET 49 2HB MET 49 -1.226 4.158 -10.563 389 HG2 MET 49 1HG MET 49 -1.019 1.868 -11.173 390 HG3 MET 49 2HG MET 49 -0.955 1.356 -9.505 391 HE1 MET 49 3HE MET 49 -4.010 -0.577 -9.434 392 HE2 MET 49 1HE MET 49 -2.345 -0.704 -10.027 393 HE3 MET 49 2HE MET 49 -2.666 -0.004 -8.431 394 HA PRO 50 HA PRO 50 1.887 7.412 -8.514 395 HB2 PRO 50 1HB PRO 50 2.592 8.570 -10.903 396 HB3 PRO 50 2HB PRO 50 3.649 7.425 -10.037 397 HG2 PRO 50 1HG PRO 50 1.693 6.804 -12.286 398 HG3 PRO 50 2HG PRO 50 3.442 6.380 -12.190 399 HD2 PRO 50 1HD PRO 50 1.563 4.579 -11.428 400 HD3 PRO 50 2HD PRO 50 3.044 4.779 -10.479 401 H ALA 51 H ALA 51 1.188 9.680 -9.482 402 HA ALA 51 HA ALA 51 -1.633 9.903 -9.422 403 HB1 ALA 51 1HB ALA 51 -0.012 11.715 -8.867 404 HB2 ALA 51 2HB ALA 51 0.476 11.805 -10.571 405 HB3 ALA 51 3HB ALA 51 -1.178 12.250 -10.100 406 H ALA 52 H ALA 52 -3.163 10.288 -11.018 407 HA ALA 52 HA ALA 52 -2.335 10.462 -13.841 408 HB1 ALA 52 1HB ALA 52 -4.483 8.565 -12.808 409 HB2 ALA 52 2HB ALA 52 -4.122 8.916 -14.512 410 HB3 ALA 52 3HB ALA 52 -2.917 8.093 -13.507 411 H THR 53 H THR 53 -2.743 12.687 -12.489 412 HA THR 53 HA THR 53 -5.213 13.569 -13.699 413 HB THR 53 HB THR 53 -5.695 13.154 -11.247 414 HG1 THR 53 1HG THR 53 -6.231 15.827 -11.696 415 HG21 THR 53 3HG2 THR 53 -5.128 14.821 -9.600 416 HG22 THR 53 1HG2 THR 53 -4.137 15.720 -10.762 417 HG23 THR 53 2HG2 THR 53 -3.637 14.099 -10.232 418 H ILE 54 H ILE 54 -4.719 15.248 -14.963 419 HA ILE 54 HA ILE 54 -2.475 17.027 -14.417 420 HB ILE 54 HB ILE 54 -2.918 15.644 -17.113 421 HG12 ILE 54 1HG1 ILE 54 -0.899 15.074 -14.948 422 HG13 ILE 54 2HG1 ILE 54 -2.049 13.946 -15.657 423 HG21 ILE 54 1HG2 ILE 54 -0.806 16.751 -17.762 424 HG22 ILE 54 2HG2 ILE 54 -2.015 17.917 -17.282 425 HG23 ILE 54 3HG2 ILE 54 -0.705 17.495 -16.152 426 HD11 ILE 54 3HD1 ILE 54 -0.826 14.157 -17.862 427 HD12 ILE 54 1HD1 ILE 54 0.468 14.998 -16.970 428 HD13 ILE 54 2HD1 ILE 54 0.037 13.334 -16.550 429 H SER 55 H SER 55 -3.096 19.053 -15.139 430 HA SER 55 HA SER 55 -4.299 20.783 -15.773 431 HB2 SER 55 1HB SER 55 -3.969 19.122 -17.821 432 HB3 SER 55 2HB SER 55 -5.713 19.057 -17.778 433 HG SER 55 HG SER 55 -5.697 21.388 -17.999 434 H ARG 56 H ARG 56 -5.658 18.533 -14.241 435 HA ARG 56 HA ARG 56 -8.312 19.804 -13.798 436 HB2 ARG 56 1HB ARG 56 -7.587 16.885 -14.053 437 HB3 ARG 56 2HB ARG 56 -8.966 17.469 -13.175 438 HG2 ARG 56 1HG ARG 56 -9.460 18.767 -15.490 439 HG3 ARG 56 2HG ARG 56 -8.467 17.439 -16.130 440 HD2 ARG 56 1HD ARG 56 -10.566 16.426 -16.192 441 HD3 ARG 56 2HD ARG 56 -10.035 15.958 -14.579 442 HE ARG 56 HE ARG 56 -11.432 18.500 -14.558 443 HH11 ARG 56 1HH1 ARG 56 -11.806 14.992 -14.271 444 HH12 ARG 56 2HH1 ARG 56 -13.331 15.088 -13.470 445 HH21 ARG 56 1HH2 ARG 56 -13.666 18.604 -13.966 446 HH22 ARG 56 2HH2 ARG 56 -14.501 17.157 -13.444 447 H ASP 57 H ASP 57 -7.155 21.002 -12.236 448 HA ASP 57 HA ASP 57 -6.589 19.679 -9.676 449 HB2 ASP 57 1HB ASP 57 -4.708 21.765 -10.816 450 HB3 ASP 57 2HB ASP 57 -4.433 20.641 -9.489 451 H ALA 58 H ALA 58 -6.605 21.571 -7.959 452 HA ALA 58 HA ALA 58 -7.983 23.998 -8.933 453 HB1 ALA 58 1HB ALA 58 -9.285 22.146 -6.899 454 HB2 ALA 58 2HB ALA 58 -9.962 23.640 -7.571 455 HB3 ALA 58 3HB ALA 58 -9.750 22.230 -8.619 456 H ALA 59 H ALA 59 -5.438 23.413 -7.390 457 HA ALA 59 HA ALA 59 -5.911 24.908 -4.872 458 HB1 ALA 59 1HB ALA 59 -3.329 23.821 -6.097 459 HB2 ALA 59 2HB ALA 59 -3.500 24.580 -4.498 460 HB3 ALA 59 3HB ALA 59 -4.276 23.016 -4.829 461 H GLY 60 H GLY 60 -4.591 27.000 -4.660 462 HA2 GLY 60 2HA GLY 60 -4.506 28.552 -7.134 463 HA3 GLY 60 1HA GLY 60 -4.113 29.105 -5.492 464 H ASP 61 H ASP 61 -2.789 26.358 -7.514 465 HA ASP 61 HA ASP 61 -0.089 27.279 -7.518 466 HB2 ASP 61 1HB ASP 61 -0.375 26.663 -5.130 467 HB3 ASP 61 2HB ASP 61 -1.114 25.134 -5.605 468 H HIS 62 H HIS 62 1.002 25.828 -8.798 469 HA HIS 62 HA HIS 62 -0.522 24.441 -10.840 470 HB2 HIS 62 1HB HIS 62 2.325 25.217 -10.372 471 HB3 HIS 62 2HB HIS 62 2.137 23.714 -11.233 472 HD1 HIS 62 1HD HIS 62 1.027 27.387 -11.643 473 HD2 HIS 62 2HD HIS 62 1.527 23.765 -13.723 474 HE1 HIS 62 1HE HIS 62 0.589 27.903 -14.141 475 H ARG 63 H ARG 63 -0.242 22.256 -11.517 476 HA ARG 63 HA ARG 63 0.115 20.077 -11.459 477 HB2 ARG 63 1HB ARG 63 2.505 21.131 -10.643 478 HB3 ARG 63 2HB ARG 63 2.135 20.135 -9.246 479 HG2 ARG 63 1HG ARG 63 1.716 18.246 -11.067 480 HG3 ARG 63 2HG ARG 63 2.611 19.325 -12.132 481 HD2 ARG 63 1HD ARG 63 3.593 18.174 -9.489 482 HD3 ARG 63 2HD ARG 63 4.042 17.590 -11.103 483 HE ARG 63 HE ARG 63 4.743 20.283 -11.084 484 HH11 ARG 63 1HH1 ARG 63 5.719 17.393 -9.311 485 HH12 ARG 63 2HH1 ARG 63 7.204 18.074 -8.715 486 HH21 ARG 63 1HH2 ARG 63 6.667 21.127 -10.514 487 HH22 ARG 63 2HH2 ARG 63 7.809 20.299 -9.471 488 H GLN 64 H GLN 64 0.458 18.098 -9.718 489 HA GLN 64 HA GLN 64 -0.743 18.533 -7.153 490 HB2 GLN 64 1HB GLN 64 -2.330 17.398 -9.325 491 HB3 GLN 64 2HB GLN 64 -1.973 16.114 -8.209 492 HG2 GLN 64 1HG GLN 64 -3.210 18.779 -7.402 493 HG3 GLN 64 2HG GLN 64 -4.135 17.332 -7.797 494 HE21 GLN 64 1HE2 GLN 64 -4.651 15.955 -6.012 495 HE22 GLN 64 2HE2 GLN 64 -3.673 15.933 -4.542 496 H TYR 65 H TYR 65 -0.463 16.337 -5.961 497 HA TYR 65 HA TYR 65 1.148 14.373 -7.452 498 HB2 TYR 65 1HB TYR 65 1.464 15.217 -4.598 499 HB3 TYR 65 2HB TYR 65 1.418 13.494 -4.898 500 HD1 TYR 65 2HD TYR 65 3.144 16.594 -6.158 501 HD2 TYR 65 1HD TYR 65 3.369 12.339 -5.454 502 HE1 TYR 65 2HE TYR 65 5.510 16.609 -6.828 503 HE2 TYR 65 1HE TYR 65 5.747 12.368 -6.050 504 HH TYR 65 HH TYR 65 7.474 15.395 -6.964 505 H ARG 66 H ARG 66 0.368 12.109 -6.573 506 HA ARG 66 HA ARG 66 -2.122 11.744 -5.355 507 HB2 ARG 66 1HB ARG 66 -2.286 12.625 -8.136 508 HB3 ARG 66 2HB ARG 66 -2.906 11.013 -7.966 509 HG2 ARG 66 1HG ARG 66 -3.879 13.083 -6.007 510 HG3 ARG 66 2HG ARG 66 -4.352 13.202 -7.663 511 HD2 ARG 66 1HD ARG 66 -4.982 10.637 -7.410 512 HD3 ARG 66 2HD ARG 66 -5.019 11.031 -5.681 513 HE ARG 66 HE ARG 66 -6.495 13.013 -7.035 514 HH11 ARG 66 1HH1 ARG 66 -6.758 9.462 -6.476 515 HH12 ARG 66 2HH1 ARG 66 -8.455 9.451 -6.693 516 HH21 ARG 66 1HH2 ARG 66 -8.862 12.833 -7.531 517 HH22 ARG 66 2HH2 ARG 66 -9.597 11.304 -7.226 518 H GLY 67 H GLY 67 -2.907 9.413 -5.937 519 HA2 GLY 67 2HA GLY 67 -2.003 7.929 -7.933 520 HA3 GLY 67 1HA GLY 67 -0.799 7.558 -6.689 521 H VAL 68 H VAL 68 -1.893 5.317 -6.950 522 HA VAL 68 HA VAL 68 -3.739 5.097 -4.702 523 HB VAL 68 HB VAL 68 -5.341 5.016 -6.445 524 HG11 VAL 68 1HG1 VAL 68 -3.630 2.984 -7.887 525 HG12 VAL 68 2HG1 VAL 68 -5.262 3.483 -8.369 526 HG13 VAL 68 3HG1 VAL 68 -3.948 4.653 -8.425 527 HG21 VAL 68 3HG2 VAL 68 -4.710 2.113 -5.734 528 HG22 VAL 68 1HG2 VAL 68 -5.684 3.251 -4.775 529 HG23 VAL 68 2HG2 VAL 68 -6.238 2.737 -6.346 530 H PHE 69 H PHE 69 -3.261 3.388 -3.439 531 HA PHE 69 HA PHE 69 -0.959 1.650 -4.204 532 HB2 PHE 69 1HB PHE 69 -0.570 2.955 -2.151 533 HB3 PHE 69 2HB PHE 69 -2.125 2.440 -1.500 534 HD1 PHE 69 1HD PHE 69 1.005 0.964 -2.941 535 HD2 PHE 69 2HD PHE 69 -2.155 0.563 -0.070 536 HE1 PHE 69 1HE PHE 69 1.895 -1.227 -2.287 537 HE2 PHE 69 2HE PHE 69 -1.265 -1.648 0.600 538 HZ PHE 69 HZ PHE 69 0.726 -2.587 -0.553 539 H GLN 70 H GLN 70 -1.410 -0.636 -3.953 540 HA GLN 70 HA GLN 70 -4.171 -1.515 -3.397 541 HB2 GLN 70 1HB GLN 70 -3.982 -1.027 -5.841 542 HB3 GLN 70 2HB GLN 70 -2.561 -2.070 -5.935 543 HG2 GLN 70 1HG GLN 70 -3.870 -4.039 -5.399 544 HG3 GLN 70 2HG GLN 70 -5.261 -3.043 -4.977 545 HE21 GLN 70 1HE2 GLN 70 -6.709 -3.876 -6.397 546 HE22 GLN 70 2HE2 GLN 70 -6.635 -3.522 -8.101 547 H VAL 71 H VAL 71 -4.158 -3.601 -2.449 548 HA VAL 71 HA VAL 71 -1.661 -5.154 -2.611 549 HB VAL 71 HB VAL 71 -1.337 -3.646 -0.783 550 HG11 VAL 71 1HG1 VAL 71 -3.678 -3.344 0.030 551 HG12 VAL 71 2HG1 VAL 71 -3.589 -4.923 0.790 552 HG13 VAL 71 3HG1 VAL 71 -2.493 -3.641 1.304 553 HG21 VAL 71 3HG2 VAL 71 -0.604 -5.256 0.881 554 HG22 VAL 71 1HG2 VAL 71 -1.602 -6.505 0.114 555 HG23 VAL 71 2HG2 VAL 71 -0.241 -5.786 -0.776 556 H ASN 72 H ASN 72 -2.706 -6.680 -3.865 557 HA ASN 72 HA ASN 72 -4.970 -8.189 -2.832 558 HB2 ASN 72 1HB ASN 72 -3.135 -8.409 -5.173 559 HB3 ASN 72 2HB ASN 72 -3.562 -9.945 -4.450 560 HD21 ASN 72 1HD2 ASN 72 -4.720 -7.736 -6.790 561 HD22 ASN 72 2HD2 ASN 72 -6.353 -8.394 -6.728 562 H VAL 73 H VAL 73 -4.946 -9.340 -1.102 563 HA VAL 73 HA VAL 73 -2.567 -10.755 -0.098 564 HB VAL 73 HB VAL 73 -3.788 -9.900 1.678 565 HG11 VAL 73 1HG1 VAL 73 -5.892 -9.182 0.639 566 HG12 VAL 73 2HG1 VAL 73 -6.385 -10.875 0.416 567 HG13 VAL 73 3HG1 VAL 73 -6.238 -10.177 2.046 568 HG21 VAL 73 3HG2 VAL 73 -3.323 -12.396 1.806 569 HG22 VAL 73 1HG2 VAL 73 -4.608 -11.814 2.883 570 HG23 VAL 73 2HG2 VAL 73 -5.009 -12.673 1.396 571 H VAL 74 H VAL 74 -2.150 -12.757 -0.777 572 HA VAL 74 HA VAL 74 -4.372 -14.327 -1.986 573 HB VAL 74 HB VAL 74 -1.418 -14.943 -2.344 574 HG11 VAL 74 1HG1 VAL 74 -3.999 -15.779 -3.764 575 HG12 VAL 74 2HG1 VAL 74 -2.370 -16.237 -4.296 576 HG13 VAL 74 3HG1 VAL 74 -2.967 -16.799 -2.741 577 HG21 VAL 74 3HG2 VAL 74 -1.743 -13.987 -4.683 578 HG22 VAL 74 1HG2 VAL 74 -3.179 -13.165 -4.066 579 HG23 VAL 74 2HG2 VAL 74 -1.588 -12.795 -3.383 580 H MET 75 H MET 75 -4.958 -16.156 -0.899 581 HA MET 75 HA MET 75 -3.039 -17.412 0.851 582 HB2 MET 75 1HB MET 75 -4.531 -17.750 2.728 583 HB3 MET 75 2HB MET 75 -4.283 -16.041 2.450 584 HG2 MET 75 1HG MET 75 -6.652 -17.005 1.025 585 HG3 MET 75 2HG MET 75 -6.694 -17.461 2.717 586 HE1 MET 75 3HE MET 75 -7.885 -14.989 0.322 587 HE2 MET 75 1HE MET 75 -7.448 -13.367 0.902 588 HE3 MET 75 2HE MET 75 -6.200 -14.435 0.242 589 HA PRO 76 HA PRO 76 -4.756 -20.851 -1.363 590 HB2 PRO 76 1HB PRO 76 -3.998 -22.980 0.206 591 HB3 PRO 76 2HB PRO 76 -2.853 -21.998 -0.762 592 HG2 PRO 76 1HG PRO 76 -3.519 -21.765 2.178 593 HG3 PRO 76 2HG PRO 76 -1.905 -21.793 1.411 594 HD2 PRO 76 1HD PRO 76 -3.196 -19.487 2.126 595 HD3 PRO 76 2HD PRO 76 -2.118 -19.566 0.690 596 H ILE 77 H ILE 77 -6.142 -22.915 -0.864 597 HA ILE 77 HA ILE 77 -8.348 -22.134 0.987 598 HB ILE 77 HB ILE 77 -8.582 -23.797 -1.545 599 HG12 ILE 77 1HG1 ILE 77 -9.143 -20.870 -0.963 600 HG13 ILE 77 2HG1 ILE 77 -7.977 -21.495 -2.098 601 HG21 ILE 77 1HG2 ILE 77 -10.729 -22.537 0.246 602 HG22 ILE 77 2HG2 ILE 77 -10.993 -23.569 -1.174 603 HG23 ILE 77 3HG2 ILE 77 -10.283 -24.256 0.272 604 HD11 ILE 77 3HD1 ILE 77 -10.988 -21.654 -2.396 605 HD12 ILE 77 1HD1 ILE 77 -9.847 -20.676 -3.306 606 HD13 ILE 77 2HD1 ILE 77 -9.811 -22.435 -3.487 607 H GLY 78 H GLY 78 -7.618 -23.149 2.816 608 HA2 GLY 78 2HA GLY 78 -8.427 -25.936 3.012 609 HA3 GLY 78 1HA GLY 78 -6.687 -25.679 3.252 610 H ASP 79 H ASP 79 -6.058 -25.057 5.253 611 HA ASP 79 HA ASP 79 -8.063 -24.858 7.312 612 HB2 ASP 79 1HB ASP 79 -6.133 -26.312 7.527 613 HB3 ASP 79 2HB ASP 79 -5.044 -24.938 7.426 614 H GLY 80 H GLY 80 -7.213 -22.424 5.430 615 HA2 GLY 80 2HA GLY 80 -8.243 -20.505 7.377 616 HA3 GLY 80 1HA GLY 80 -6.537 -20.236 7.013 617 H SER 81 H SER 81 -9.629 -20.900 5.113 618 HA SER 81 HA SER 81 -8.518 -19.380 2.887 619 HB2 SER 81 1HB SER 81 -10.923 -19.671 2.074 620 HB3 SER 81 2HB SER 81 -9.837 -21.075 2.092 621 HG SER 81 HG SER 81 -12.211 -20.875 3.086 622 H ARG 82 H ARG 82 -10.613 -18.584 5.626 623 HA ARG 82 HA ARG 82 -11.450 -16.074 4.254 624 HB2 ARG 82 1HB ARG 82 -12.880 -15.913 6.499 625 HB3 ARG 82 2HB ARG 82 -13.436 -16.545 4.986 626 HG2 ARG 82 1HG ARG 82 -12.306 -18.389 7.126 627 HG3 ARG 82 2HG ARG 82 -13.952 -17.785 7.152 628 HD2 ARG 82 1HD ARG 82 -13.947 -18.637 4.601 629 HD3 ARG 82 2HD ARG 82 -12.691 -19.712 5.207 630 HE ARG 82 HE ARG 82 -15.434 -19.403 6.366 631 HH11 ARG 82 1HH1 ARG 82 -12.762 -21.633 5.538 632 HH12 ARG 82 2HH1 ARG 82 -13.729 -23.057 5.782 633 HH21 ARG 82 1HH2 ARG 82 -16.640 -21.295 6.698 634 HH22 ARG 82 2HH2 ARG 82 -16.021 -22.852 6.305 635 H SER 83 H SER 83 -8.785 -16.882 5.593 636 HA SER 83 HA SER 83 -8.225 -15.004 7.626 637 HB2 SER 83 1HB SER 83 -6.499 -16.121 5.382 638 HB3 SER 83 2HB SER 83 -5.864 -15.283 6.812 639 HG SER 83 HG SER 83 -6.073 -17.681 6.826 640 H ALA 84 H ALA 84 -8.954 -14.380 4.294 641 HA ALA 84 HA ALA 84 -7.942 -11.859 3.740 642 HB1 ALA 84 1HB ALA 84 -10.721 -13.050 3.311 643 HB2 ALA 84 2HB ALA 84 -10.185 -11.539 2.573 644 HB3 ALA 84 3HB ALA 84 -9.363 -13.061 2.168 645 H GLU 85 H GLU 85 -10.553 -12.691 6.101 646 HA GLU 85 HA GLU 85 -11.403 -9.972 6.487 647 HB2 GLU 85 1HB GLU 85 -11.718 -12.478 8.211 648 HB3 GLU 85 2HB GLU 85 -12.478 -10.907 8.494 649 HG2 GLU 85 1HG GLU 85 -13.330 -11.140 6.030 650 HG3 GLU 85 2HG GLU 85 -12.909 -12.831 6.188 651 H GLN 86 H GLN 86 -9.363 -12.190 8.516 652 HA GLN 86 HA GLN 86 -8.476 -10.499 10.423 653 HB2 GLN 86 1HB GLN 86 -7.980 -13.068 9.497 654 HB3 GLN 86 2HB GLN 86 -6.433 -12.326 9.167 655 HG2 GLN 86 1HG GLN 86 -7.689 -11.950 11.900 656 HG3 GLN 86 2HG GLN 86 -7.077 -13.522 11.418 657 HE21 GLN 86 1HE2 GLN 86 -6.160 -10.271 12.425 658 HE22 GLN 86 2HE2 GLN 86 -4.434 -10.610 12.487 659 H VAL 87 H VAL 87 -6.880 -11.058 7.270 660 HA VAL 87 HA VAL 87 -4.804 -9.206 7.563 661 HB VAL 87 HB VAL 87 -6.220 -10.337 5.094 662 HG11 VAL 87 1HG1 VAL 87 -3.610 -8.811 5.305 663 HG12 VAL 87 2HG1 VAL 87 -3.933 -9.930 3.963 664 HG13 VAL 87 3HG1 VAL 87 -4.987 -8.539 4.208 665 HG21 VAL 87 3HG2 VAL 87 -4.988 -11.931 6.837 666 HG22 VAL 87 1HG2 VAL 87 -4.818 -12.152 5.101 667 HG23 VAL 87 2HG2 VAL 87 -3.540 -11.337 6.024 668 H ALA 88 H ALA 88 -7.943 -8.641 5.774 669 HA ALA 88 HA ALA 88 -7.166 -5.969 5.133 670 HB1 ALA 88 1HB ALA 88 -9.017 -7.180 3.987 671 HB2 ALA 88 2HB ALA 88 -10.002 -7.027 5.472 672 HB3 ALA 88 3HB ALA 88 -9.488 -5.585 4.569 673 H ALA 89 H ALA 89 -8.481 -7.393 8.095 674 HA ALA 89 HA ALA 89 -9.280 -4.813 9.187 675 HB1 ALA 89 1HB ALA 89 -8.965 -7.556 10.471 676 HB2 ALA 89 2HB ALA 89 -9.455 -6.103 11.365 677 HB3 ALA 89 3HB ALA 89 -10.466 -6.715 10.056 678 H GLU 90 H GLU 90 -6.390 -6.896 9.348 679 HA GLU 90 HA GLU 90 -5.016 -5.406 11.409 680 HB2 GLU 90 1HB GLU 90 -3.931 -7.116 9.108 681 HB3 GLU 90 2HB GLU 90 -2.966 -6.414 10.417 682 HG2 GLU 90 1HG GLU 90 -4.652 -7.739 11.959 683 HG3 GLU 90 2HG GLU 90 -4.918 -8.691 10.506 684 H LEU 91 H LEU 91 -4.756 -5.429 7.867 685 HA LEU 91 HA LEU 91 -2.905 -3.361 7.583 686 HB2 LEU 91 1HB LEU 91 -5.107 -4.414 5.805 687 HB3 LEU 91 2HB LEU 91 -4.017 -3.141 5.258 688 HG LEU 91 HG LEU 91 -2.904 -5.749 6.351 689 HD11 LEU 91 1HD1 LEU 91 -4.497 -6.368 4.631 690 HD12 LEU 91 2HD1 LEU 91 -2.845 -6.623 4.054 691 HD13 LEU 91 3HD1 LEU 91 -3.777 -5.204 3.491 692 HD21 LEU 91 3HD2 LEU 91 -1.018 -5.166 4.840 693 HD22 LEU 91 1HD2 LEU 91 -1.309 -3.898 6.039 694 HD23 LEU 91 2HD2 LEU 91 -1.863 -3.678 4.356 695 H ASP 92 H ASP 92 -6.497 -3.179 7.768 696 HA ASP 92 HA ASP 92 -6.879 -0.502 7.142 697 HB2 ASP 92 1HB ASP 92 -8.733 -2.031 7.372 698 HB3 ASP 92 2HB ASP 92 -8.380 -2.287 9.081 699 H ALA 93 H ALA 93 -6.153 -1.874 10.370 700 HA ALA 93 HA ALA 93 -6.373 0.675 11.735 701 HB1 ALA 93 1HB ALA 93 -5.267 -0.528 13.608 702 HB2 ALA 93 2HB ALA 93 -6.642 -1.429 12.954 703 HB3 ALA 93 3HB ALA 93 -4.974 -1.919 12.541 704 H LEU 94 H LEU 94 -3.823 -0.953 9.979 705 HA LEU 94 HA LEU 94 -1.695 0.729 11.049 706 HB2 LEU 94 1HB LEU 94 -1.506 -1.673 10.381 707 HB3 LEU 94 2HB LEU 94 -1.744 -1.235 8.704 708 HG LEU 94 HG LEU 94 0.567 -1.705 9.675 709 HD11 LEU 94 1HD1 LEU 94 1.732 -0.228 8.116 710 HD12 LEU 94 2HD1 LEU 94 0.191 0.618 7.807 711 HD13 LEU 94 3HD1 LEU 94 0.363 -1.110 7.437 712 HD21 LEU 94 3HD2 LEU 94 1.893 0.083 10.555 713 HD22 LEU 94 1HD2 LEU 94 0.476 -0.152 11.576 714 HD23 LEU 94 2HD2 LEU 94 0.551 1.223 10.453 715 H PHE 95 H PHE 95 -3.906 0.787 8.332 716 HA PHE 95 HA PHE 95 -2.518 3.171 7.202 717 HB2 PHE 95 1HB PHE 95 -3.968 0.866 5.880 718 HB3 PHE 95 2HB PHE 95 -3.577 2.339 5.026 719 HD1 PHE 95 1HD PHE 95 -0.974 3.146 5.274 720 HD2 PHE 95 2HD PHE 95 -2.411 -0.910 5.734 721 HE1 PHE 95 1HE PHE 95 1.161 2.283 4.427 722 HE2 PHE 95 2HE PHE 95 -0.250 -1.756 4.930 723 HZ PHE 95 HZ PHE 95 1.551 -0.156 4.253 724 HA PRO 96 HA PRO 96 -6.925 4.217 8.385 725 HB2 PRO 96 1HB PRO 96 -6.598 6.012 10.405 726 HB3 PRO 96 2HB PRO 96 -6.460 4.258 10.696 727 HG2 PRO 96 1HG PRO 96 -4.207 6.207 10.166 728 HG3 PRO 96 2HG PRO 96 -4.360 5.038 11.518 729 HD2 PRO 96 1HD PRO 96 -2.956 4.440 9.262 730 HD3 PRO 96 2HD PRO 96 -3.945 3.207 10.134 731 H VAL 97 H VAL 97 -7.967 6.412 8.326 732 HA VAL 97 HA VAL 97 -7.373 7.475 5.854 733 HB VAL 97 HB VAL 97 -9.553 7.183 7.010 734 HG11 VAL 97 1HG1 VAL 97 -8.900 9.876 8.284 735 HG12 VAL 97 2HG1 VAL 97 -10.458 9.045 8.347 736 HG13 VAL 97 3HG1 VAL 97 -9.044 8.325 9.128 737 HG21 VAL 97 3HG2 VAL 97 -9.259 8.457 4.831 738 HG22 VAL 97 1HG2 VAL 97 -10.721 8.768 5.741 739 HG23 VAL 97 2HG2 VAL 97 -9.385 9.948 5.791 740 H ASN 98 H ASN 98 -5.572 8.320 8.414 741 HA ASN 98 HA ASN 98 -5.045 11.121 7.477 742 HB2 ASN 98 1HB ASN 98 -4.252 9.610 10.019 743 HB3 ASN 98 2HB ASN 98 -3.560 11.160 9.548 744 HD21 ASN 98 1HD2 ASN 98 -6.349 9.651 11.037 745 HD22 ASN 98 2HD2 ASN 98 -7.406 11.049 10.998 746 H LEU 99 H LEU 99 -3.690 7.894 7.636 747 HA LEU 99 HA LEU 99 -1.673 7.014 7.148 748 HB2 LEU 99 1HB LEU 99 -3.233 7.730 5.081 749 HB3 LEU 99 2HB LEU 99 -1.732 8.453 4.522 750 HG LEU 99 HG LEU 99 -0.733 6.113 5.048 751 HD11 LEU 99 1HD1 LEU 99 -3.749 5.575 5.104 752 HD12 LEU 99 2HD1 LEU 99 -2.554 5.164 6.344 753 HD13 LEU 99 3HD1 LEU 99 -2.597 4.310 4.776 754 HD21 LEU 99 3HD2 LEU 99 -1.085 5.197 2.962 755 HD22 LEU 99 1HD2 LEU 99 -1.292 6.942 2.662 756 HD23 LEU 99 2HD2 LEU 99 -2.679 5.832 2.776 757 H VAL 100 H VAL 100 -0.583 8.312 8.861 758 HA VAL 100 HA VAL 100 1.063 10.589 8.213 759 HB VAL 100 HB VAL 100 1.872 10.053 10.567 760 HG11 VAL 100 1HG1 VAL 100 -0.234 10.705 11.663 761 HG12 VAL 100 2HG1 VAL 100 0.040 11.643 10.193 762 HG13 VAL 100 3HG1 VAL 100 -1.149 10.323 10.188 763 HG21 VAL 100 3HG2 VAL 100 1.274 7.558 10.212 764 HG22 VAL 100 1HG2 VAL 100 0.914 8.290 11.804 765 HG23 VAL 100 2HG2 VAL 100 -0.376 8.042 10.619 766 H MET 101 H MET 101 1.583 8.872 6.434 767 HA MET 101 HA MET 101 4.056 7.392 6.717 768 HB2 MET 101 1HB MET 101 1.907 7.787 4.792 769 HB3 MET 101 2HB MET 101 3.452 8.028 3.975 770 HG2 MET 101 1HG MET 101 4.011 5.965 4.046 771 HG3 MET 101 2HG MET 101 3.401 5.660 5.709 772 HE1 MET 101 3HE MET 101 2.415 6.301 2.136 773 HE2 MET 101 1HE MET 101 0.864 5.469 1.903 774 HE3 MET 101 2HE MET 101 0.941 6.929 2.912 775 H GLN 102 H GLN 102 5.052 9.217 7.912 776 HA GLN 102 HA GLN 102 6.070 11.537 6.509 777 HB2 GLN 102 1HB GLN 102 7.729 11.636 8.330 778 HB3 GLN 102 2HB GLN 102 6.090 11.610 8.896 779 HG2 GLN 102 1HG GLN 102 6.964 8.863 8.865 780 HG3 GLN 102 2HG GLN 102 8.318 9.789 9.461 781 HE21 GLN 102 1HE2 GLN 102 8.218 9.064 11.628 782 HE22 GLN 102 2HE2 GLN 102 6.824 9.259 12.649 783 H SER 103 H SER 103 8.197 11.893 5.757 784 HA SER 103 HA SER 103 9.959 9.664 5.170 785 HB2 SER 103 1HB SER 103 9.505 10.793 2.604 786 HB3 SER 103 2HB SER 103 9.138 9.152 3.161 787 HG SER 103 HG SER 103 7.429 11.405 3.385 788 H GLY 104 H GLY 104 11.807 10.506 3.710 789 HA2 GLY 104 2HA GLY 104 13.045 12.700 5.006 790 HA3 GLY 104 1HA GLY 104 13.568 11.872 3.530 791 H GLY 105 H GLY 105 10.468 13.272 3.185 792 HA2 GLY 105 2HA GLY 105 11.549 15.694 1.851 793 HA3 GLY 105 1HA GLY 105 10.322 14.634 1.085 794 H LEU 106 H LEU 106 8.522 14.003 2.664 795 HA LEU 106 HA LEU 106 7.531 15.817 4.586 796 HB2 LEU 106 1HB LEU 106 5.515 16.467 2.960 797 HB3 LEU 106 2HB LEU 106 6.958 17.439 3.120 798 HG LEU 106 HG LEU 106 7.877 16.568 1.027 799 HD11 LEU 106 1HD1 LEU 106 6.393 15.190 -0.472 800 HD12 LEU 106 2HD1 LEU 106 5.369 14.858 0.946 801 HD13 LEU 106 3HD1 LEU 106 7.062 14.340 0.903 802 HD21 LEU 106 3HD2 LEU 106 6.427 18.552 1.041 803 HD22 LEU 106 1HD2 LEU 106 5.036 17.524 0.650 804 HD23 LEU 106 2HD2 LEU 106 6.406 17.663 -0.483 805 H ALA 107 H ALA 107 4.884 15.235 4.588 806 HA ALA 107 HA ALA 107 4.889 12.272 4.742 807 HB1 ALA 107 1HB ALA 107 3.172 14.309 6.211 808 HB2 ALA 107 2HB ALA 107 3.100 12.546 6.403 809 HB3 ALA 107 3HB ALA 107 4.556 13.434 6.904 810 H VAL 108 H VAL 108 3.469 11.163 3.436 811 HA VAL 108 HA VAL 108 1.897 12.632 1.470 812 HB VAL 108 HB VAL 108 3.234 10.337 1.386 813 HG11 VAL 108 1HG1 VAL 108 1.821 9.380 3.224 814 HG12 VAL 108 2HG1 VAL 108 0.582 9.101 1.983 815 HG13 VAL 108 3HG1 VAL 108 2.222 8.404 1.788 816 HG21 VAL 108 3HG2 VAL 108 2.073 9.550 -0.511 817 HG22 VAL 108 1HG2 VAL 108 0.571 10.364 -0.044 818 HG23 VAL 108 2HG2 VAL 108 1.978 11.322 -0.551 819 H ARG 109 H ARG 109 -0.626 11.929 1.266 820 HA ARG 109 HA ARG 109 -1.757 11.116 3.848 821 HB2 ARG 109 1HB ARG 109 -1.846 13.449 4.141 822 HB3 ARG 109 2HB ARG 109 -2.436 13.749 2.494 823 HG2 ARG 109 1HG ARG 109 -4.623 12.857 3.087 824 HG3 ARG 109 2HG ARG 109 -3.988 12.208 4.611 825 HD2 ARG 109 1HD ARG 109 -5.165 14.152 5.219 826 HD3 ARG 109 2HD ARG 109 -3.460 14.570 5.320 827 HE ARG 109 HE ARG 109 -4.344 15.324 2.739 828 HH11 ARG 109 1HH1 ARG 109 -4.605 16.418 6.132 829 HH12 ARG 109 2HH1 ARG 109 -5.572 17.781 5.763 830 HH21 ARG 109 1HH2 ARG 109 -5.469 17.343 2.251 831 HH22 ARG 109 2HH2 ARG 109 -6.069 18.315 3.546 832 H VAL 110 H VAL 110 -3.368 9.694 3.551 833 HA VAL 110 HA VAL 110 -3.844 8.598 1.019 834 HB VAL 110 HB VAL 110 -3.833 7.471 3.142 835 HG11 VAL 110 1HG1 VAL 110 -6.568 8.628 3.672 836 HG12 VAL 110 2HG1 VAL 110 -5.658 7.446 4.647 837 HG13 VAL 110 3HG1 VAL 110 -5.063 9.104 4.491 838 HG21 VAL 110 3HG2 VAL 110 -5.735 5.919 2.754 839 HG22 VAL 110 1HG2 VAL 110 -6.345 7.041 1.511 840 HG23 VAL 110 2HG2 VAL 110 -4.770 6.292 1.326 841 H ARG 111 H ARG 111 -5.736 10.987 2.803 842 HA ARG 111 HA ARG 111 -7.483 12.289 2.316 843 HB2 ARG 111 1HB ARG 111 -6.297 11.878 -0.339 844 HB3 ARG 111 2HB ARG 111 -8.050 12.068 -0.463 845 HG2 ARG 111 1HG ARG 111 -6.286 13.931 1.148 846 HG3 ARG 111 2HG ARG 111 -6.587 14.177 -0.560 847 HD2 ARG 111 1HD ARG 111 -9.048 13.789 1.068 848 HD3 ARG 111 2HD ARG 111 -8.138 15.264 1.395 849 HE ARG 111 HE ARG 111 -8.205 15.304 -1.299 850 HH11 ARG 111 1HH1 ARG 111 -10.726 15.314 1.199 851 HH12 ARG 111 2HH1 ARG 111 -11.932 15.937 0.113 852 HH21 ARG 111 1HH2 ARG 111 -9.789 16.280 -2.609 853 HH22 ARG 111 2HH2 ARG 111 -11.408 16.520 -1.985 854 H THR 112 H THR 112 -7.794 8.978 0.858 855 HA THR 112 HA THR 112 -10.663 9.120 1.588 856 HB THR 112 HB THR 112 -10.826 7.300 -0.068 857 HG1 THR 112 1HG THR 112 -9.107 6.445 -0.747 858 HG21 THR 112 3HG2 THR 112 -11.301 9.627 -0.774 859 HG22 THR 112 1HG2 THR 112 -10.576 8.693 -2.092 860 HG23 THR 112 2HG2 THR 112 -9.591 9.869 -1.197 861 HA PRO 113 HA PRO 113 -9.810 5.882 4.469 862 HB2 PRO 113 1HB PRO 113 -12.136 4.458 4.612 863 HB3 PRO 113 2HB PRO 113 -11.987 6.157 5.164 864 HG2 PRO 113 1HG PRO 113 -13.066 5.165 2.519 865 HG3 PRO 113 2HG PRO 113 -13.765 6.371 3.659 866 HD2 PRO 113 1HD PRO 113 -12.284 7.070 1.461 867 HD3 PRO 113 2HD PRO 113 -12.292 8.035 2.973 868 H ILE 114 H ILE 114 -9.937 3.475 4.763 869 HA ILE 114 HA ILE 114 -8.822 1.850 2.660 870 HB ILE 114 HB ILE 114 -10.096 1.436 5.395 871 HG12 ILE 114 1HG1 ILE 114 -7.725 2.410 5.055 872 HG13 ILE 114 2HG1 ILE 114 -7.957 1.156 6.245 873 HG21 ILE 114 1HG2 ILE 114 -10.701 -0.600 4.313 874 HG22 ILE 114 2HG2 ILE 114 -9.078 -0.795 3.612 875 HG23 ILE 114 3HG2 ILE 114 -9.335 -0.938 5.362 876 HD11 ILE 114 3HD1 ILE 114 -7.023 0.516 3.426 877 HD12 ILE 114 1HD1 ILE 114 -5.900 0.984 4.713 878 HD13 ILE 114 2HD1 ILE 114 -6.880 -0.479 4.879 879 H SER 115 H SER 115 -9.878 0.231 1.449 880 HA SER 115 HA SER 115 -12.780 -0.107 1.721 881 HB2 SER 115 1HB SER 115 -11.864 1.592 -0.246 882 HB3 SER 115 2HB SER 115 -11.712 0.014 -1.036 883 HG SER 115 HG SER 115 -13.720 1.282 -1.259 884 H ASN 116 H ASN 116 -13.384 -2.222 0.483 885 HA ASN 116 HA ASN 116 -11.245 -3.965 -0.331 886 HB2 ASN 116 1HB ASN 116 -11.659 -5.664 1.294 887 HB3 ASN 116 2HB ASN 116 -11.428 -4.198 2.215 888 HD21 ASN 116 1HD2 ASN 116 -13.406 -6.813 1.810 889 HD22 ASN 116 2HD2 ASN 116 -14.781 -6.259 2.775 890 H GLY 117 H GLY 117 -12.463 -6.204 -0.879 891 HA2 GLY 117 2HA GLY 117 -15.352 -5.905 -1.328 892 HA3 GLY 117 1HA GLY 117 -14.372 -6.187 -2.776 893 H GLN 118 H GLN 118 -16.006 -8.157 -2.611 894 HA GLN 118 HA GLN 118 -15.365 -10.256 -0.789 895 HB2 GLN 118 1HB GLN 118 -17.059 -9.782 -3.264 896 HB3 GLN 118 2HB GLN 118 -16.591 -11.424 -2.905 897 HG2 GLN 118 1HG GLN 118 -17.415 -10.791 -0.427 898 HG3 GLN 118 2HG GLN 118 -18.360 -9.596 -1.328 899 HE21 GLN 118 1HE2 GLN 118 -18.394 -12.706 -0.122 900 HE22 GLN 118 2HE2 GLN 118 -19.625 -13.403 -1.143 901 HA PRO 119 HA PRO 119 -11.994 -12.002 -2.998 902 HB2 PRO 119 1HB PRO 119 -12.208 -14.718 -2.456 903 HB3 PRO 119 2HB PRO 119 -11.578 -13.503 -1.314 904 HG2 PRO 119 1HG PRO 119 -14.271 -14.811 -1.373 905 HG3 PRO 119 2HG PRO 119 -13.317 -14.180 0.012 906 HD2 PRO 119 1HD PRO 119 -15.491 -12.889 -1.227 907 HD3 PRO 119 2HD PRO 119 -14.307 -12.133 -0.131 908 H THR 120 H THR 120 -11.489 -12.972 -5.018 909 HA THR 120 HA THR 120 -13.847 -13.833 -6.566 910 HB THR 120 HB THR 120 -12.321 -11.880 -7.117 911 HG1 THR 120 1HG THR 120 -12.376 -12.368 -9.345 912 HG21 THR 120 3HG2 THR 120 -10.175 -13.048 -6.771 913 HG22 THR 120 1HG2 THR 120 -10.314 -12.307 -8.380 914 HG23 THR 120 2HG2 THR 120 -10.523 -14.057 -8.191 915 H THR 121 H THR 121 -11.821 -15.352 -4.784 916 HA THR 121 HA THR 121 -10.810 -17.449 -4.637 917 HB THR 121 HB THR 121 -12.736 -18.474 -6.715 918 HG1 THR 121 1HG THR 121 -14.348 -18.235 -5.510 919 HG21 THR 121 3HG2 THR 121 -11.398 -20.249 -5.790 920 HG22 THR 121 1HG2 THR 121 -12.956 -20.351 -4.995 921 HG23 THR 121 2HG2 THR 121 -11.583 -19.616 -4.155 922 H GLY 122 H GLY 122 -10.129 -19.416 -6.550 923 HA2 GLY 122 2HA GLY 122 -8.919 -18.412 -8.927 924 HA3 GLY 122 1HA GLY 122 -7.749 -18.618 -7.593 925 H ASP 123 H ASP 123 -6.809 -20.341 -8.805 926 HA ASP 123 HA ASP 123 -8.147 -22.741 -9.600 927 HB2 ASP 123 1HB ASP 123 -5.960 -22.066 -10.406 928 HB3 ASP 123 2HB ASP 123 -5.274 -22.255 -8.787 929 H ALA 124 H ALA 124 -6.191 -21.914 -6.740 930 HA ALA 124 HA ALA 124 -7.869 -23.481 -4.945 931 HB1 ALA 124 1HB ALA 124 -6.036 -24.896 -4.168 932 HB2 ALA 124 2HB ALA 124 -6.240 -25.136 -5.908 933 HB3 ALA 124 3HB ALA 124 -4.904 -24.122 -5.305 934 H ASP 125 H ASP 125 -7.437 -20.674 -5.272 935 HA ASP 125 HA ASP 125 -6.057 -19.905 -2.776 936 HB2 ASP 125 1HB ASP 125 -5.706 -18.507 -5.454 937 HB3 ASP 125 2HB ASP 125 -5.099 -17.941 -3.922 938 H HIS 126 H HIS 126 -6.828 -17.709 -2.152 939 HA HIS 126 HA HIS 126 -9.055 -16.624 -3.798 940 HB2 HIS 126 1HB HIS 126 -8.980 -16.412 -0.778 941 HB3 HIS 126 2HB HIS 126 -10.178 -15.679 -1.823 942 HD1 HIS 126 1HD HIS 126 -12.055 -17.586 -2.890 943 HD2 HIS 126 2HD HIS 126 -9.425 -18.629 0.235 944 HE1 HIS 126 1HE HIS 126 -13.053 -19.620 -1.763 945 H THR 127 H THR 127 -9.158 -14.393 -3.929 946 HA THR 127 HA THR 127 -7.203 -12.640 -2.582 947 HB THR 127 HB THR 127 -7.438 -11.525 -5.044 948 HG1 THR 127 1HG THR 127 -7.004 -13.517 -6.458 949 HG21 THR 127 3HG2 THR 127 -5.328 -11.977 -3.917 950 HG22 THR 127 1HG2 THR 127 -5.226 -12.509 -5.600 951 HG23 THR 127 2HG2 THR 127 -5.451 -13.702 -4.279 952 H VAL 128 H VAL 128 -8.283 -11.286 -1.456 953 HA VAL 128 HA VAL 128 -10.942 -10.284 -2.370 954 HB VAL 128 HB VAL 128 -10.613 -8.870 -0.267 955 HG11 VAL 128 1HG1 VAL 128 -11.719 -10.469 1.147 956 HG12 VAL 128 2HG1 VAL 128 -12.308 -10.602 -0.503 957 HG13 VAL 128 3HG1 VAL 128 -11.154 -11.814 0.128 958 HG21 VAL 128 3HG2 VAL 128 -8.750 -11.045 0.657 959 HG22 VAL 128 1HG2 VAL 128 -8.305 -9.353 0.290 960 HG23 VAL 128 2HG2 VAL 128 -9.423 -9.699 1.605 961 HA PRO 129 HA PRO 129 -8.488 -6.885 -4.140 962 HB2 PRO 129 1HB PRO 129 -10.515 -5.254 -4.877 963 HB3 PRO 129 2HB PRO 129 -10.242 -6.838 -5.667 964 HG2 PRO 129 1HG PRO 129 -12.213 -6.184 -3.481 965 HG3 PRO 129 2HG PRO 129 -12.512 -7.113 -4.969 966 HD2 PRO 129 1HD PRO 129 -11.988 -8.277 -2.571 967 HD3 PRO 129 2HD PRO 129 -11.512 -9.001 -4.142 968 H ILE 130 H ILE 130 -7.580 -5.052 -3.204 969 HA ILE 130 HA ILE 130 -8.948 -3.513 -1.117 970 HB ILE 130 HB ILE 130 -6.306 -4.963 -0.618 971 HG12 ILE 130 1HG1 ILE 130 -8.986 -5.288 0.798 972 HG13 ILE 130 2HG1 ILE 130 -8.234 -6.452 -0.283 973 HG21 ILE 130 1HG2 ILE 130 -6.401 -3.872 1.643 974 HG22 ILE 130 2HG2 ILE 130 -6.182 -2.728 0.321 975 HG23 ILE 130 3HG2 ILE 130 -7.777 -2.917 1.077 976 HD11 ILE 130 3HD1 ILE 130 -6.318 -6.664 1.295 977 HD12 ILE 130 1HD1 ILE 130 -7.263 -5.721 2.478 978 HD13 ILE 130 2HD1 ILE 130 -7.874 -7.271 1.881 979 H SER 131 H SER 131 -8.454 -1.393 -1.597 980 HA SER 131 HA SER 131 -5.822 -0.625 -2.364 981 HB2 SER 131 1HB SER 131 -6.492 0.677 -4.409 982 HB3 SER 131 2HB SER 131 -6.314 -1.056 -4.592 983 HG SER 131 HG SER 131 -8.317 -1.259 -5.070 984 H LEU 132 H LEU 132 -5.550 1.751 -2.405 985 HA LEU 132 HA LEU 132 -7.735 3.407 -1.424 986 HB2 LEU 132 1HB LEU 132 -6.263 4.396 0.376 987 HB3 LEU 132 2HB LEU 132 -7.030 2.853 0.695 988 HG LEU 132 HG LEU 132 -4.583 1.967 -0.158 989 HD11 LEU 132 1HD1 LEU 132 -2.765 3.287 0.574 990 HD12 LEU 132 2HD1 LEU 132 -3.808 4.423 1.402 991 HD13 LEU 132 3HD1 LEU 132 -3.750 4.445 -0.360 992 HD21 LEU 132 3HD2 LEU 132 -5.379 2.904 2.613 993 HD22 LEU 132 1HD2 LEU 132 -4.060 1.769 2.258 994 HD23 LEU 132 2HD2 LEU 132 -5.739 1.336 1.861 995 H GLY 133 H GLY 133 -7.365 5.646 -1.839 996 HA2 GLY 133 2HA GLY 133 -5.407 6.153 -3.983 997 HA3 GLY 133 1HA GLY 133 -6.695 7.215 -3.417 998 H TYR 134 H TYR 134 -4.207 8.375 -3.684 999 HA TYR 134 HA TYR 134 -3.991 9.419 -1.015 1000 HB2 TYR 134 1HB TYR 134 -1.572 9.107 -0.728 1001 HB3 TYR 134 2HB TYR 134 -2.402 7.590 -0.732 1002 HD1 TYR 134 1HD TYR 134 -0.178 9.801 -2.730 1003 HD2 TYR 134 2HD TYR 134 -2.025 5.907 -2.417 1004 HE1 TYR 134 1HE TYR 134 1.306 8.961 -4.541 1005 HE2 TYR 134 2HE TYR 134 -0.485 5.049 -4.200 1006 HH TYR 134 HH TYR 134 0.848 6.011 -6.183 1007 H ASP 135 H ASP 135 -2.450 11.366 -1.077 1008 HA ASP 135 HA ASP 135 -1.325 12.186 -3.553 1009 HB2 ASP 135 1HB ASP 135 -2.166 14.290 -3.865 1010 HB3 ASP 135 2HB ASP 135 -3.536 13.179 -3.897 1011 H VAL 136 H VAL 136 -0.438 14.796 -2.651 1012 HA VAL 136 HA VAL 136 0.974 14.072 -0.132 1013 HB VAL 136 HB VAL 136 1.804 15.749 -2.522 1014 HG11 VAL 136 1HG1 VAL 136 3.222 15.411 0.148 1015 HG12 VAL 136 2HG1 VAL 136 4.074 15.838 -1.343 1016 HG13 VAL 136 3HG1 VAL 136 2.836 16.924 -0.726 1017 HG21 VAL 136 3HG2 VAL 136 3.550 14.078 -2.790 1018 HG22 VAL 136 1HG2 VAL 136 3.076 13.269 -1.282 1019 HG23 VAL 136 2HG2 VAL 136 1.997 13.241 -2.698 1020 H GLN 137 H GLN 137 1.638 16.214 1.069 1021 HA GLN 137 HA GLN 137 -0.216 18.387 0.863 1022 HB2 GLN 137 1HB GLN 137 -0.864 18.372 3.144 1023 HB3 GLN 137 2HB GLN 137 -1.199 16.733 2.555 1024 HG2 GLN 137 1HG GLN 137 1.309 16.339 3.479 1025 HG3 GLN 137 2HG GLN 137 0.867 17.692 4.516 1026 HE21 GLN 137 1HE2 GLN 137 1.247 14.582 4.716 1027 HE22 GLN 137 2HE2 GLN 137 -0.068 14.075 5.755 1028 H PHE 138 H PHE 138 0.795 20.197 2.411 1029 HA PHE 138 HA PHE 138 3.698 19.755 2.853 1030 HB2 PHE 138 1HB PHE 138 2.370 22.221 1.656 1031 HB3 PHE 138 2HB PHE 138 4.001 22.176 2.289 1032 HD1 PHE 138 2HD PHE 138 1.791 20.895 -0.420 1033 HD2 PHE 138 1HD PHE 138 5.835 21.281 1.017 1034 HE1 PHE 138 2HE PHE 138 2.651 20.344 -2.681 1035 HE2 PHE 138 1HE PHE 138 6.691 20.717 -1.243 1036 HZ PHE 138 HZ PHE 138 5.104 20.306 -3.108 1037 H TYR 139 H TYR 139 4.476 21.001 4.621 1038 HA TYR 139 HA TYR 139 2.498 22.226 6.446 1039 HB2 TYR 139 1HB TYR 139 3.865 21.292 8.309 1040 HB3 TYR 139 2HB TYR 139 2.809 20.170 7.473 1041 HD1 TYR 139 1HD TYR 139 3.749 18.487 5.862 1042 HD2 TYR 139 2HD TYR 139 6.250 20.893 8.415 1043 HE1 TYR 139 1HE TYR 139 5.661 16.985 5.412 1044 HE2 TYR 139 2HE TYR 139 8.143 19.371 8.025 1045 HH TYR 139 HH TYR 139 8.872 17.406 6.936 1046 HA PRO 140 HA PRO 140 5.922 25.166 5.585 1047 HB2 PRO 140 1HB PRO 140 4.439 27.332 4.904 1048 HB3 PRO 140 2HB PRO 140 4.710 26.000 3.736 1049 HG2 PRO 140 1HG PRO 140 2.319 26.410 5.564 1050 HG3 PRO 140 2HG PRO 140 2.309 26.135 3.795 1051 HD2 PRO 140 1HD PRO 140 1.979 24.116 5.613 1052 HD3 PRO 140 2HD PRO 140 2.821 23.856 4.048 1053 H GLU 141 H GLU 141 5.584 27.651 6.618 1054 HA GLU 141 HA GLU 141 3.887 27.556 8.978 1055 HB2 GLU 141 1HB GLU 141 6.598 28.959 9.000 1056 HB3 GLU 141 2HB GLU 141 5.326 29.075 10.202 1057 HG2 GLU 141 1HG GLU 141 5.564 26.618 10.654 1058 HG3 GLU 141 2HG GLU 141 6.919 26.567 9.504 Start of MODEL 19 1 H1 GLY 1 H GLY 1 18.189 12.286 -6.593 2 HA2 GLY 1 2HA GLY 1 16.315 13.486 -7.578 3 HA3 GLY 1 1HA GLY 1 15.323 12.030 -7.318 4 H MET 2 H MET 2 14.151 14.108 -6.179 5 HA MET 2 HA MET 2 14.714 13.755 -3.310 6 HB2 MET 2 1HB MET 2 13.962 16.469 -4.435 7 HB3 MET 2 2HB MET 2 14.432 16.034 -2.792 8 HG2 MET 2 1HG MET 2 16.254 17.169 -3.606 9 HG3 MET 2 2HG MET 2 16.749 15.487 -3.729 10 HE1 MET 2 3HE MET 2 16.880 18.806 -5.352 11 HE2 MET 2 1HE MET 2 18.308 17.781 -5.105 12 HE3 MET 2 2HE MET 2 17.841 18.261 -6.749 13 H SER 3 H SER 3 12.609 14.977 -2.270 14 HA SER 3 HA SER 3 10.517 14.516 -1.667 15 HB2 SER 3 1HB SER 3 10.150 15.437 -4.529 16 HB3 SER 3 2HB SER 3 8.811 15.183 -3.407 17 HG SER 3 HG SER 3 9.429 17.290 -3.375 18 H GLN 4 H GLN 4 9.944 13.207 -5.019 19 HA GLN 4 HA GLN 4 8.256 11.266 -3.895 20 HB2 GLN 4 1HB GLN 4 8.356 12.213 -6.263 21 HB3 GLN 4 2HB GLN 4 9.502 10.933 -6.641 22 HG2 GLN 4 1HG GLN 4 6.715 10.501 -5.445 23 HG3 GLN 4 2HG GLN 4 7.008 10.608 -7.174 24 HE21 GLN 4 1HE2 GLN 4 6.507 8.323 -4.802 25 HE22 GLN 4 2HE2 GLN 4 7.407 7.023 -5.549 26 H ASP 5 H ASP 5 11.716 11.147 -4.474 27 HA ASP 5 HA ASP 5 12.440 8.459 -4.114 28 HB2 ASP 5 1HB ASP 5 13.537 11.129 -3.212 29 HB3 ASP 5 2HB ASP 5 14.165 9.676 -2.449 30 H LEU 6 H LEU 6 11.761 10.889 -1.634 31 HA LEU 6 HA LEU 6 11.828 9.033 0.562 32 HB2 LEU 6 1HB LEU 6 10.698 11.855 0.612 33 HB3 LEU 6 2HB LEU 6 11.412 10.911 1.904 34 HG LEU 6 HG LEU 6 13.014 12.413 1.607 35 HD11 LEU 6 1HD1 LEU 6 13.982 10.229 1.528 36 HD12 LEU 6 2HD1 LEU 6 14.966 11.452 0.687 37 HD13 LEU 6 3HD1 LEU 6 14.016 10.276 -0.241 38 HD21 LEU 6 3HD2 LEU 6 11.845 13.439 -0.315 39 HD22 LEU 6 1HD2 LEU 6 12.820 12.401 -1.376 40 HD23 LEU 6 2HD2 LEU 6 13.630 13.568 -0.299 41 H ILE 7 H ILE 7 9.269 10.580 -1.372 42 HA ILE 7 HA ILE 7 7.056 10.069 0.280 43 HB ILE 7 HB ILE 7 7.136 9.994 -2.764 44 HG12 ILE 7 1HG1 ILE 7 7.795 12.174 -1.947 45 HG13 ILE 7 2HG1 ILE 7 6.156 12.279 -2.576 46 HG21 ILE 7 1HG2 ILE 7 4.694 10.452 -2.677 47 HG22 ILE 7 2HG2 ILE 7 5.124 8.839 -2.118 48 HG23 ILE 7 3HG2 ILE 7 4.711 10.092 -0.941 49 HD11 ILE 7 3HD1 ILE 7 7.302 12.535 0.152 50 HD12 ILE 7 1HD1 ILE 7 6.010 13.452 -0.664 51 HD13 ILE 7 2HD1 ILE 7 5.634 11.877 0.051 52 H ARG 8 H ARG 8 8.498 7.999 -2.316 53 HA ARG 8 HA ARG 8 6.621 5.865 -1.915 54 HB2 ARG 8 1HB ARG 8 7.509 5.019 -3.791 55 HB3 ARG 8 2HB ARG 8 8.386 6.550 -3.784 56 HG2 ARG 8 1HG ARG 8 10.037 5.300 -4.275 57 HG3 ARG 8 2HG ARG 8 10.208 5.428 -2.519 58 HD2 ARG 8 1HD ARG 8 8.691 3.120 -3.761 59 HD3 ARG 8 2HD ARG 8 10.427 3.142 -3.978 60 HE ARG 8 HE ARG 8 8.967 2.507 -1.576 61 HH11 ARG 8 1HH1 ARG 8 12.119 3.692 -2.776 62 HH12 ARG 8 2HH1 ARG 8 13.028 2.766 -1.614 63 HH21 ARG 8 1HH2 ARG 8 10.186 1.292 -0.098 64 HH22 ARG 8 2HH2 ARG 8 11.903 1.404 -0.030 65 H ALA 9 H ALA 9 9.744 6.612 -0.556 66 HA ALA 9 HA ALA 9 10.209 4.134 0.720 67 HB1 ALA 9 1HB ALA 9 11.182 6.918 1.421 68 HB2 ALA 9 2HB ALA 9 11.984 5.360 1.792 69 HB3 ALA 9 3HB ALA 9 11.805 5.916 0.094 70 H ALA 10 H ALA 10 8.095 6.852 1.649 71 HA ALA 10 HA ALA 10 7.767 6.219 4.391 72 HB1 ALA 10 1HB ALA 10 5.623 7.243 2.496 73 HB2 ALA 10 2HB ALA 10 5.667 7.393 4.259 74 HB3 ALA 10 3HB ALA 10 6.862 8.262 3.271 75 H PHE 11 H PHE 11 6.492 4.651 1.450 76 HA PHE 11 HA PHE 11 4.293 3.306 2.689 77 HB2 PHE 11 1HB PHE 11 5.829 2.782 0.103 78 HB3 PHE 11 2HB PHE 11 4.544 1.767 0.654 79 HD1 PHE 11 2HD PHE 11 4.665 5.582 0.689 80 HD2 PHE 11 1HD PHE 11 2.836 1.976 -0.864 81 HE1 PHE 11 2HE PHE 11 2.873 6.911 -0.306 82 HE2 PHE 11 1HE PHE 11 1.029 3.334 -1.849 83 HZ PHE 11 HZ PHE 11 1.015 5.804 -1.530 84 H GLU 12 H GLU 12 7.667 2.137 1.857 85 HA GLU 12 HA GLU 12 7.190 -0.369 3.174 86 HB2 GLU 12 1HB GLU 12 8.651 -0.128 1.236 87 HB3 GLU 12 2HB GLU 12 9.719 0.965 2.148 88 HG2 GLU 12 1HG GLU 12 10.609 -0.713 3.387 89 HG3 GLU 12 2HG GLU 12 9.145 -1.695 3.385 90 H LYS 13 H LYS 13 8.176 2.772 4.279 91 HA LYS 13 HA LYS 13 9.472 1.983 6.724 92 HB2 LYS 13 1HB LYS 13 9.840 4.151 5.664 93 HB3 LYS 13 2HB LYS 13 8.134 4.583 5.872 94 HG2 LYS 13 1HG LYS 13 8.322 4.779 8.198 95 HG3 LYS 13 2HG LYS 13 9.801 3.799 8.242 96 HD2 LYS 13 1HD LYS 13 11.039 5.653 7.146 97 HD3 LYS 13 2HD LYS 13 9.548 6.650 7.159 98 HE2 LYS 13 1HE LYS 13 9.408 6.356 9.635 99 HE3 LYS 13 2HE LYS 13 10.874 5.387 9.595 100 HZ1 LYS 13 3HZ LYS 13 10.644 8.281 9.076 101 HZ2 LYS 13 1HZ LYS 13 12.021 7.431 8.753 102 HZ3 LYS 13 2HZ LYS 13 11.424 7.541 10.286 103 H ARG 14 H ARG 14 6.296 1.676 5.602 104 HA ARG 14 HA ARG 14 5.403 1.254 8.375 105 HB2 ARG 14 1HB ARG 14 4.362 3.253 7.092 106 HB3 ARG 14 2HB ARG 14 3.439 2.029 6.202 107 HG2 ARG 14 1HG ARG 14 2.531 1.158 8.310 108 HG3 ARG 14 2HG ARG 14 3.586 2.214 9.248 109 HD2 ARG 14 1HD ARG 14 2.419 4.202 8.184 110 HD3 ARG 14 2HD ARG 14 1.289 3.060 7.446 111 HE ARG 14 HE ARG 14 0.210 2.838 9.439 112 HH11 ARG 14 1HH1 ARG 14 3.394 4.289 10.133 113 HH12 ARG 14 2HH1 ARG 14 2.835 4.998 11.613 114 HH21 ARG 14 1HH2 ARG 14 -0.291 3.348 11.674 115 HH22 ARG 14 2HH2 ARG 14 0.882 4.129 12.642 116 H LEU 15 H LEU 15 4.669 0.120 5.003 117 HA LEU 15 HA LEU 15 3.099 -2.014 5.888 118 HB2 LEU 15 1HB LEU 15 3.609 -1.012 3.459 119 HB3 LEU 15 2HB LEU 15 4.729 -2.360 3.367 120 HG LEU 15 HG LEU 15 1.724 -2.515 3.885 121 HD11 LEU 15 1HD1 LEU 15 1.606 -3.477 1.642 122 HD12 LEU 15 2HD1 LEU 15 3.375 -3.337 1.455 123 HD13 LEU 15 3HD1 LEU 15 2.370 -1.883 1.604 124 HD21 LEU 15 3HD2 LEU 15 2.000 -4.989 3.470 125 HD22 LEU 15 1HD2 LEU 15 2.631 -4.416 5.000 126 HD23 LEU 15 2HD2 LEU 15 3.755 -4.770 3.670 127 H SER 16 H SER 16 6.618 -2.163 5.019 128 HA SER 16 HA SER 16 6.879 -4.951 5.647 129 HB2 SER 16 1HB SER 16 8.400 -3.522 4.205 130 HB3 SER 16 2HB SER 16 8.983 -2.788 5.725 131 HG SER 16 HG SER 16 9.629 -5.186 4.522 132 H ASP 17 H ASP 17 7.166 -1.963 7.522 133 HA ASP 17 HA ASP 17 8.372 -3.004 9.871 134 HB2 ASP 17 1HB ASP 17 8.121 -0.567 9.351 135 HB3 ASP 17 2HB ASP 17 6.385 -0.695 9.625 136 H TRP 18 H TRP 18 5.006 -2.860 8.871 137 HA TRP 18 HA TRP 18 4.005 -4.105 11.354 138 HB2 TRP 18 1HB TRP 18 2.439 -2.750 10.282 139 HB3 TRP 18 2HB TRP 18 2.833 -3.372 8.677 140 HD1 TRP 18 HD TRP 18 0.581 -4.116 11.670 141 HE1 TRP 18 1HE TRP 18 -1.103 -5.936 11.047 142 HE3 TRP 18 3HE TRP 18 2.399 -5.314 7.056 143 HZ2 TRP 18 2HZ TRP 18 -1.706 -7.572 8.683 144 HZ3 TRP 18 3HZ TRP 18 1.261 -7.001 5.628 145 HH2 TRP 18 HH TRP 18 -0.834 -8.085 6.435 146 H ALA 19 H ALA 19 4.667 -5.149 7.983 147 HA ALA 19 HA ALA 19 3.490 -7.676 8.213 148 HB1 ALA 19 1HB ALA 19 4.143 -6.592 6.060 149 HB2 ALA 19 2HB ALA 19 5.859 -6.882 6.456 150 HB3 ALA 19 3HB ALA 19 4.758 -8.243 6.191 151 H LYS 20 H LYS 20 6.892 -6.737 8.924 152 HA LYS 20 HA LYS 20 7.704 -9.447 9.593 153 HB2 LYS 20 1HB LYS 20 9.700 -8.533 10.361 154 HB3 LYS 20 2HB LYS 20 9.240 -7.563 8.958 155 HG2 LYS 20 1HG LYS 20 8.327 -5.823 10.593 156 HG3 LYS 20 2HG LYS 20 8.996 -6.788 11.899 157 HD2 LYS 20 1HD LYS 20 10.745 -5.418 11.654 158 HD3 LYS 20 2HD LYS 20 11.229 -6.622 10.466 159 HE2 LYS 20 1HE LYS 20 11.026 -5.184 8.743 160 HE3 LYS 20 2HE LYS 20 9.432 -4.642 9.278 161 HZ1 LYS 20 3HZ LYS 20 10.898 -2.793 9.403 162 HZ2 LYS 20 1HZ LYS 20 12.042 -3.651 10.209 163 HZ3 LYS 20 2HZ LYS 20 10.644 -3.287 10.966 164 H ALA 21 H ALA 21 6.226 -6.771 11.390 165 HA ALA 21 HA ALA 21 6.789 -7.917 13.983 166 HB1 ALA 21 1HB ALA 21 6.798 -5.483 13.627 167 HB2 ALA 21 2HB ALA 21 5.100 -5.526 13.075 168 HB3 ALA 21 3HB ALA 21 5.504 -5.894 14.756 169 H ARG 22 H ARG 22 4.266 -8.393 11.675 170 HA ARG 22 HA ARG 22 2.170 -9.023 13.509 171 HB2 ARG 22 1HB ARG 22 2.327 -8.644 10.763 172 HB3 ARG 22 2HB ARG 22 2.379 -10.412 10.852 173 HG2 ARG 22 1HG ARG 22 0.320 -10.070 12.488 174 HG3 ARG 22 2HG ARG 22 0.214 -8.494 11.700 175 HD2 ARG 22 1HD ARG 22 -0.275 -9.475 9.577 176 HD3 ARG 22 2HD ARG 22 0.423 -11.027 10.055 177 HE ARG 22 HE ARG 22 -1.856 -10.203 11.680 178 HH11 ARG 22 1HH1 ARG 22 -1.013 -12.056 8.718 179 HH12 ARG 22 2HH1 ARG 22 -2.519 -12.948 8.798 180 HH21 ARG 22 1HH2 ARG 22 -3.641 -11.631 11.776 181 HH22 ARG 22 2HH2 ARG 22 -4.014 -12.640 10.400 182 H THR 23 H THR 23 1.316 -11.169 13.794 183 HA THR 23 HA THR 23 2.822 -13.106 14.881 184 HB THR 23 HB THR 23 0.178 -13.277 13.407 185 HG1 THR 23 1HG THR 23 0.712 -12.943 16.152 186 HG21 THR 23 3HG2 THR 23 1.135 -15.532 13.662 187 HG22 THR 23 1HG2 THR 23 -0.289 -15.285 14.674 188 HG23 THR 23 2HG2 THR 23 1.344 -15.237 15.398 189 HA PRO 24 HA PRO 24 3.267 -16.147 11.382 190 HB2 PRO 24 1HB PRO 24 2.394 -15.753 8.813 191 HB3 PRO 24 2HB PRO 24 1.322 -16.347 10.124 192 HG2 PRO 24 1HG PRO 24 1.667 -13.493 9.123 193 HG3 PRO 24 2HG PRO 24 0.136 -14.398 9.348 194 HD2 PRO 24 1HD PRO 24 0.994 -12.739 11.278 195 HD3 PRO 24 2HD PRO 24 0.323 -14.354 11.676 196 H ALA 25 H ALA 25 3.780 -12.966 10.786 197 HA ALA 25 HA ALA 25 5.124 -11.554 9.662 198 HB1 ALA 25 1HB ALA 25 7.405 -12.108 9.175 199 HB2 ALA 25 2HB ALA 25 6.913 -12.760 10.767 200 HB3 ALA 25 3HB ALA 25 7.068 -13.835 9.364 201 H LEU 26 H LEU 26 4.432 -10.770 7.725 202 HA LEU 26 HA LEU 26 4.000 -12.736 5.559 203 HB2 LEU 26 1HB LEU 26 3.091 -9.848 5.740 204 HB3 LEU 26 2HB LEU 26 2.830 -10.908 4.372 205 HG LEU 26 HG LEU 26 0.837 -10.981 5.456 206 HD11 LEU 26 1HD1 LEU 26 1.651 -13.347 5.080 207 HD12 LEU 26 2HD1 LEU 26 0.480 -13.226 6.382 208 HD13 LEU 26 3HD1 LEU 26 2.194 -13.389 6.763 209 HD21 LEU 26 3HD2 LEU 26 1.534 -9.806 7.479 210 HD22 LEU 26 1HD2 LEU 26 2.043 -11.368 8.164 211 HD23 LEU 26 2HD2 LEU 26 0.325 -11.071 7.712 212 HA PRO 27 HA PRO 27 7.431 -10.987 3.175 213 HB2 PRO 27 1HB PRO 27 6.777 -11.979 0.713 214 HB3 PRO 27 2HB PRO 27 7.431 -13.008 2.020 215 HG2 PRO 27 1HG PRO 27 4.540 -12.688 1.207 216 HG3 PRO 27 2HG PRO 27 5.438 -14.199 1.548 217 HD2 PRO 27 1HD PRO 27 3.829 -12.917 3.395 218 HD3 PRO 27 2HD PRO 27 5.294 -13.843 3.866 219 H VAL 28 H VAL 28 7.644 -9.238 1.502 220 HA VAL 28 HA VAL 28 5.089 -7.832 0.895 221 HB VAL 28 HB VAL 28 7.471 -6.451 2.160 222 HG11 VAL 28 1HG1 VAL 28 5.950 -4.518 2.273 223 HG12 VAL 28 2HG1 VAL 28 6.112 -5.049 0.593 224 HG13 VAL 28 3HG1 VAL 28 4.654 -5.467 1.502 225 HG21 VAL 28 3HG2 VAL 28 6.373 -7.783 3.884 226 HG22 VAL 28 1HG2 VAL 28 5.894 -6.092 4.083 227 HG23 VAL 28 2HG2 VAL 28 4.774 -7.248 3.339 228 H ALA 29 H ALA 29 5.135 -8.273 -1.193 229 HA ALA 29 HA ALA 29 7.497 -7.944 -2.904 230 HB1 ALA 29 1HB ALA 29 4.591 -8.760 -3.382 231 HB2 ALA 29 2HB ALA 29 5.840 -8.704 -4.630 232 HB3 ALA 29 3HB ALA 29 5.975 -9.862 -3.280 233 H TRP 30 H TRP 30 7.871 -5.869 -3.706 234 HA TRP 30 HA TRP 30 5.570 -4.034 -4.187 235 HB2 TRP 30 1HB TRP 30 8.520 -3.370 -4.085 236 HB3 TRP 30 2HB TRP 30 7.192 -2.265 -4.220 237 HD1 TRP 30 HD TRP 30 9.061 -4.331 -1.590 238 HE1 TRP 30 1HE TRP 30 8.501 -3.361 0.673 239 HE3 TRP 30 3HE TRP 30 5.123 -1.526 -3.005 240 HZ2 TRP 30 2HZ TRP 30 6.347 -1.768 1.821 241 HZ3 TRP 30 3HZ TRP 30 3.743 -0.317 -1.319 242 HH2 TRP 30 HH TRP 30 4.336 -0.437 1.114 243 H GLN 31 H GLN 31 6.428 -2.541 -6.133 244 HA GLN 31 HA GLN 31 6.058 -3.721 -8.566 245 HB2 GLN 31 1HB GLN 31 7.808 -1.367 -7.829 246 HB3 GLN 31 2HB GLN 31 7.329 -1.780 -9.483 247 HG2 GLN 31 1HG GLN 31 4.926 -1.429 -8.802 248 HG3 GLN 31 2HG GLN 31 5.507 -0.818 -7.244 249 HE21 GLN 31 1HE2 GLN 31 4.021 0.778 -9.222 250 HE22 GLN 31 2HE2 GLN 31 5.078 2.036 -9.790 251 H ASN 32 H ASN 32 9.351 -2.896 -7.274 252 HA ASN 32 HA ASN 32 10.544 -4.271 -9.643 253 HB2 ASN 32 1HB ASN 32 11.430 -1.703 -8.316 254 HB3 ASN 32 2HB ASN 32 12.296 -2.556 -9.586 255 HD21 ASN 32 1HD2 ASN 32 9.759 -0.366 -8.907 256 HD22 ASN 32 2HD2 ASN 32 9.100 -0.191 -10.516 257 H THR 33 H THR 33 10.104 -5.782 -7.604 258 HA THR 33 HA THR 33 12.510 -5.905 -5.821 259 HB THR 33 HB THR 33 9.574 -6.087 -5.013 260 HG1 THR 33 1HG THR 33 10.613 -3.907 -4.062 261 HG21 THR 33 3HG2 THR 33 10.317 -5.617 -2.753 262 HG22 THR 33 1HG2 THR 33 12.002 -5.443 -3.289 263 HG23 THR 33 2HG2 THR 33 11.183 -7.026 -3.310 264 H LYS 34 H LYS 34 12.583 -7.995 -4.519 265 HA LYS 34 HA LYS 34 11.834 -10.356 -6.114 266 HB2 LYS 34 1HB LYS 34 13.172 -9.894 -3.429 267 HB3 LYS 34 2HB LYS 34 12.535 -11.474 -3.865 268 HG2 LYS 34 1HG LYS 34 14.889 -11.376 -4.304 269 HG3 LYS 34 2HG LYS 34 14.005 -11.637 -5.794 270 HD2 LYS 34 1HD LYS 34 14.852 -8.829 -4.999 271 HD3 LYS 34 2HD LYS 34 16.040 -9.935 -5.647 272 HE2 LYS 34 1HE LYS 34 13.457 -9.227 -7.098 273 HE3 LYS 34 2HE LYS 34 14.999 -8.418 -7.362 274 HZ1 LYS 34 3HZ LYS 34 14.547 -11.306 -7.789 275 HZ2 LYS 34 1HZ LYS 34 15.919 -10.455 -8.162 276 HZ3 LYS 34 2HZ LYS 34 14.547 -10.153 -8.960 277 H PHE 35 H PHE 35 10.342 -11.950 -5.241 278 HA PHE 35 HA PHE 35 8.299 -11.071 -3.376 279 HB2 PHE 35 1HB PHE 35 6.539 -11.266 -5.175 280 HB3 PHE 35 2HB PHE 35 7.584 -9.867 -5.293 281 HD1 PHE 35 2HD PHE 35 7.216 -13.353 -6.771 282 HD2 PHE 35 1HD PHE 35 8.467 -9.258 -7.305 283 HE1 PHE 35 2HE PHE 35 7.595 -13.785 -9.169 284 HE2 PHE 35 1HE PHE 35 8.825 -9.701 -9.725 285 HZ PHE 35 HZ PHE 35 8.391 -11.956 -10.654 286 H THR 36 H THR 36 10.190 -13.357 -3.837 287 HA THR 36 HA THR 36 8.270 -15.465 -3.308 288 HB THR 36 HB THR 36 8.721 -14.999 -5.933 289 HG1 THR 36 1HG THR 36 7.188 -16.365 -5.413 290 HG21 THR 36 3HG2 THR 36 10.638 -17.282 -5.411 291 HG22 THR 36 1HG2 THR 36 11.132 -15.610 -5.803 292 HG23 THR 36 2HG2 THR 36 10.177 -16.532 -6.957 293 HA PRO 37 HA PRO 37 8.793 -18.113 -3.406 294 HB2 PRO 37 1HB PRO 37 8.848 -19.722 -1.207 295 HB3 PRO 37 2HB PRO 37 10.051 -19.850 -2.518 296 HG2 PRO 37 1HG PRO 37 10.316 -18.360 0.111 297 HG3 PRO 37 2HG PRO 37 11.469 -19.519 -0.624 298 HD2 PRO 37 1HD PRO 37 11.754 -16.813 -0.912 299 HD3 PRO 37 2HD PRO 37 12.166 -17.924 -2.254 300 HA PRO 38 HA PRO 38 5.631 -16.268 -0.687 301 HB2 PRO 38 1HB PRO 38 3.782 -18.310 -0.599 302 HB3 PRO 38 2HB PRO 38 3.890 -17.091 -1.919 303 HG2 PRO 38 1HG PRO 38 4.815 -19.928 -1.923 304 HG3 PRO 38 2HG PRO 38 4.187 -18.944 -3.273 305 HD2 PRO 38 1HD PRO 38 6.883 -19.491 -2.816 306 HD3 PRO 38 2HD PRO 38 6.287 -18.072 -3.730 307 H ALA 39 H ALA 39 4.223 -17.188 1.286 308 HA ALA 39 HA ALA 39 6.111 -18.536 3.053 309 HB1 ALA 39 1HB ALA 39 4.962 -17.141 4.837 310 HB2 ALA 39 2HB ALA 39 5.827 -16.162 3.629 311 HB3 ALA 39 3HB ALA 39 4.056 -16.329 3.547 312 H ALA 40 H ALA 40 5.287 -20.396 2.212 313 HA ALA 40 HA ALA 40 4.070 -22.307 2.167 314 HB1 ALA 40 1HB ALA 40 2.566 -21.291 4.603 315 HB2 ALA 40 2HB ALA 40 2.710 -22.967 4.018 316 HB3 ALA 40 3HB ALA 40 4.130 -22.119 4.663 317 H GLY 41 H GLY 41 3.539 -20.597 0.368 318 HA2 GLY 41 2HA GLY 41 2.086 -20.153 -1.310 319 HA3 GLY 41 1HA GLY 41 0.814 -21.054 -0.473 320 H VAL 42 H VAL 42 1.649 -18.861 1.745 321 HA VAL 42 HA VAL 42 -0.398 -16.895 0.895 322 HB VAL 42 HB VAL 42 1.160 -17.187 3.518 323 HG11 VAL 42 1HG1 VAL 42 -1.265 -15.467 2.906 324 HG12 VAL 42 2HG1 VAL 42 -0.542 -15.724 4.511 325 HG13 VAL 42 3HG1 VAL 42 0.389 -14.905 3.270 326 HG21 VAL 42 3HG2 VAL 42 -0.449 -19.093 3.092 327 HG22 VAL 42 1HG2 VAL 42 -0.888 -18.107 4.484 328 HG23 VAL 42 2HG2 VAL 42 -1.752 -17.881 2.957 329 H TYR 43 H TYR 43 0.146 -14.965 -0.046 330 HA TYR 43 HA TYR 43 2.558 -13.600 0.774 331 HB2 TYR 43 1HB TYR 43 3.598 -13.377 -1.395 332 HB3 TYR 43 2HB TYR 43 3.556 -15.039 -0.905 333 HD1 TYR 43 2HD TYR 43 1.529 -16.489 -1.899 334 HD2 TYR 43 1HD TYR 43 2.855 -12.712 -3.514 335 HE1 TYR 43 2HE TYR 43 0.531 -17.069 -4.111 336 HE2 TYR 43 1HE TYR 43 1.820 -13.270 -5.693 337 HH TYR 43 HH TYR 43 0.057 -16.300 -6.306 338 H LEU 44 H LEU 44 2.741 -11.477 -0.737 339 HA LEU 44 HA LEU 44 -0.007 -10.427 -1.131 340 HB2 LEU 44 1HB LEU 44 2.371 -9.241 0.307 341 HB3 LEU 44 2HB LEU 44 1.167 -8.193 -0.436 342 HG LEU 44 HG LEU 44 0.292 -10.309 1.520 343 HD11 LEU 44 1HD1 LEU 44 0.393 -8.619 3.317 344 HD12 LEU 44 2HD1 LEU 44 1.185 -7.476 2.206 345 HD13 LEU 44 3HD1 LEU 44 2.013 -8.968 2.690 346 HD21 LEU 44 3HD2 LEU 44 -1.399 -9.202 0.109 347 HD22 LEU 44 1HD2 LEU 44 -0.892 -7.642 0.795 348 HD23 LEU 44 2HD2 LEU 44 -1.607 -8.885 1.842 349 H ARG 45 H ARG 45 0.040 -8.590 -2.541 350 HA ARG 45 HA ARG 45 2.399 -8.129 -4.190 351 HB2 ARG 45 1HB ARG 45 -0.405 -8.788 -5.197 352 HB3 ARG 45 2HB ARG 45 0.543 -7.543 -6.021 353 HG2 ARG 45 1HG ARG 45 2.343 -9.112 -6.464 354 HG3 ARG 45 2HG ARG 45 1.532 -10.394 -5.568 355 HD2 ARG 45 1HD ARG 45 0.010 -10.814 -7.242 356 HD3 ARG 45 2HD ARG 45 -0.071 -9.139 -7.777 357 HE ARG 45 HE ARG 45 1.716 -11.236 -8.734 358 HH11 ARG 45 1HH1 ARG 45 0.864 -7.752 -8.902 359 HH12 ARG 45 2HH1 ARG 45 1.979 -7.476 -10.201 360 HH21 ARG 45 1HH2 ARG 45 3.292 -10.691 -10.433 361 HH22 ARG 45 2HH2 ARG 45 3.340 -9.062 -10.988 362 H ALA 46 H ALA 46 2.649 -5.872 -4.271 363 HA ALA 46 HA ALA 46 0.543 -4.152 -3.104 364 HB1 ALA 46 1HB ALA 46 3.363 -4.404 -1.962 365 HB2 ALA 46 2HB ALA 46 2.229 -3.127 -1.570 366 HB3 ALA 46 3HB ALA 46 1.824 -4.793 -1.132 367 H TYR 47 H TYR 47 0.325 -3.423 -5.221 368 HA TYR 47 HA TYR 47 2.780 -2.341 -6.521 369 HB2 TYR 47 1HB TYR 47 1.317 -4.227 -7.528 370 HB3 TYR 47 2HB TYR 47 0.199 -2.935 -7.941 371 HD1 TYR 47 1HD TYR 47 1.137 -0.963 -9.298 372 HD2 TYR 47 2HD TYR 47 3.287 -4.659 -8.841 373 HE1 TYR 47 1HE TYR 47 2.437 -0.427 -11.330 374 HE2 TYR 47 2HE TYR 47 4.622 -4.133 -10.851 375 HH TYR 47 HH TYR 47 3.759 -1.473 -12.994 376 H VAL 48 H VAL 48 2.970 -0.272 -6.012 377 HA VAL 48 HA VAL 48 0.673 1.571 -5.849 378 HB VAL 48 HB VAL 48 2.352 2.088 -4.296 379 HG11 VAL 48 1HG1 VAL 48 4.236 0.838 -4.917 380 HG12 VAL 48 2HG1 VAL 48 4.427 1.727 -6.466 381 HG13 VAL 48 3HG1 VAL 48 4.734 2.515 -4.899 382 HG21 VAL 48 3HG2 VAL 48 1.465 4.014 -5.508 383 HG22 VAL 48 1HG2 VAL 48 3.114 4.277 -4.889 384 HG23 VAL 48 2HG2 VAL 48 2.862 3.951 -6.614 385 H MET 49 H MET 49 0.310 3.158 -7.490 386 HA MET 49 HA MET 49 1.529 2.580 -10.131 387 HB2 MET 49 1HB MET 49 -1.254 2.217 -9.197 388 HB3 MET 49 2HB MET 49 -1.152 3.234 -10.639 389 HG2 MET 49 1HG MET 49 -0.152 1.547 -11.913 390 HG3 MET 49 2HG MET 49 0.341 0.614 -10.511 391 HE1 MET 49 3HE MET 49 -0.865 -1.372 -9.602 392 HE2 MET 49 1HE MET 49 -1.832 -0.184 -8.693 393 HE3 MET 49 2HE MET 49 -2.598 -1.560 -9.544 394 HA PRO 50 HA PRO 50 1.999 6.915 -10.227 395 HB2 PRO 50 1HB PRO 50 1.935 7.538 -12.871 396 HB3 PRO 50 2HB PRO 50 3.192 6.464 -12.183 397 HG2 PRO 50 1HG PRO 50 0.606 5.648 -13.561 398 HG3 PRO 50 2HG PRO 50 2.264 5.075 -13.921 399 HD2 PRO 50 1HD PRO 50 0.591 3.684 -12.316 400 HD3 PRO 50 2HD PRO 50 2.341 3.763 -11.966 401 H ALA 51 H ALA 51 1.023 9.015 -11.093 402 HA ALA 51 HA ALA 51 -1.872 9.072 -10.697 403 HB1 ALA 51 1HB ALA 51 -0.615 10.945 -9.832 404 HB2 ALA 51 2HB ALA 51 0.181 11.207 -11.403 405 HB3 ALA 51 3HB ALA 51 -1.549 11.527 -11.202 406 H ALA 52 H ALA 52 -2.962 8.108 -12.338 407 HA ALA 52 HA ALA 52 -2.444 8.606 -15.159 408 HB1 ALA 52 1HB ALA 52 -3.438 6.496 -14.319 409 HB2 ALA 52 2HB ALA 52 -4.883 7.391 -13.795 410 HB3 ALA 52 3HB ALA 52 -4.453 7.308 -15.516 411 H THR 53 H THR 53 -2.730 11.088 -13.592 412 HA THR 53 HA THR 53 -5.161 12.271 -14.840 413 HB THR 53 HB THR 53 -4.822 14.004 -12.903 414 HG1 THR 53 1HG THR 53 -3.109 13.352 -11.839 415 HG21 THR 53 3HG2 THR 53 -6.004 11.227 -12.497 416 HG22 THR 53 1HG2 THR 53 -6.824 12.665 -13.116 417 HG23 THR 53 2HG2 THR 53 -6.291 12.610 -11.421 418 H ILE 54 H ILE 54 -4.640 14.898 -14.985 419 HA ILE 54 HA ILE 54 -2.843 14.794 -17.212 420 HB ILE 54 HB ILE 54 -4.060 17.155 -15.807 421 HG12 ILE 54 1HG1 ILE 54 -5.099 16.060 -18.423 422 HG13 ILE 54 2HG1 ILE 54 -5.661 15.349 -16.909 423 HG21 ILE 54 1HG2 ILE 54 -3.742 18.326 -18.059 424 HG22 ILE 54 2HG2 ILE 54 -2.295 18.031 -17.115 425 HG23 ILE 54 3HG2 ILE 54 -2.680 16.967 -18.492 426 HD11 ILE 54 3HD1 ILE 54 -5.960 18.280 -17.667 427 HD12 ILE 54 1HD1 ILE 54 -7.220 17.042 -17.704 428 HD13 ILE 54 2HD1 ILE 54 -6.511 17.533 -16.154 429 H SER 55 H SER 55 -0.829 15.523 -17.408 430 HA SER 55 HA SER 55 0.589 16.892 -15.205 431 HB2 SER 55 1HB SER 55 0.940 14.166 -15.923 432 HB3 SER 55 2HB SER 55 2.303 15.009 -16.652 433 HG SER 55 HG SER 55 2.697 14.334 -14.472 434 H ARG 56 H ARG 56 -0.553 17.442 -17.961 435 HA ARG 56 HA ARG 56 1.802 18.815 -19.175 436 HB2 ARG 56 1HB ARG 56 -0.955 18.229 -20.366 437 HB3 ARG 56 2HB ARG 56 0.345 19.049 -21.215 438 HG2 ARG 56 1HG ARG 56 0.442 16.155 -20.275 439 HG3 ARG 56 2HG ARG 56 0.066 16.718 -21.894 440 HD2 ARG 56 1HD ARG 56 2.471 18.000 -21.458 441 HD3 ARG 56 2HD ARG 56 2.703 16.515 -20.513 442 HE ARG 56 HE ARG 56 1.605 16.235 -23.216 443 HH11 ARG 56 1HH1 ARG 56 4.718 16.453 -21.494 444 HH12 ARG 56 2HH1 ARG 56 5.559 15.502 -22.663 445 HH21 ARG 56 1HH2 ARG 56 2.739 15.070 -24.778 446 HH22 ARG 56 2HH2 ARG 56 4.423 14.706 -24.548 447 H ASP 57 H ASP 57 -0.164 19.547 -16.895 448 HA ASP 57 HA ASP 57 -1.044 22.224 -17.838 449 HB2 ASP 57 1HB ASP 57 -2.128 20.184 -15.876 450 HB3 ASP 57 2HB ASP 57 -2.246 21.887 -15.486 451 H ALA 58 H ALA 58 0.137 23.815 -16.960 452 HA ALA 58 HA ALA 58 1.545 25.024 -15.755 453 HB1 ALA 58 1HB ALA 58 0.981 25.175 -13.393 454 HB2 ALA 58 2HB ALA 58 -0.495 24.885 -14.334 455 HB3 ALA 58 3HB ALA 58 0.271 23.560 -13.426 456 H ALA 59 H ALA 59 2.343 22.103 -16.027 457 HA ALA 59 HA ALA 59 4.043 20.701 -15.868 458 HB1 ALA 59 1HB ALA 59 5.379 22.526 -16.842 459 HB2 ALA 59 2HB ALA 59 5.793 23.089 -15.205 460 HB3 ALA 59 3HB ALA 59 6.337 21.496 -15.763 461 H GLY 60 H GLY 60 5.739 19.702 -14.552 462 HA2 GLY 60 2HA GLY 60 5.826 20.287 -11.744 463 HA3 GLY 60 1HA GLY 60 4.930 18.795 -12.126 464 H ASP 61 H ASP 61 6.155 17.000 -13.025 465 HA ASP 61 HA ASP 61 7.710 15.547 -13.130 466 HB2 ASP 61 1HB ASP 61 8.258 16.702 -15.108 467 HB3 ASP 61 2HB ASP 61 9.056 17.935 -14.213 468 H HIS 62 H HIS 62 7.430 17.566 -10.803 469 HA HIS 62 HA HIS 62 9.135 15.988 -9.175 470 HB2 HIS 62 1HB HIS 62 10.135 18.492 -9.899 471 HB3 HIS 62 2HB HIS 62 9.372 18.870 -8.366 472 HD1 HIS 62 1HD HIS 62 12.633 17.968 -9.636 473 HD2 HIS 62 2HD HIS 62 10.243 16.865 -6.339 474 HE1 HIS 62 1HE HIS 62 14.193 16.841 -7.947 475 H ARG 63 H ARG 63 6.092 16.836 -9.613 476 HA ARG 63 HA ARG 63 5.361 17.177 -6.825 477 HB2 ARG 63 1HB ARG 63 4.360 19.412 -7.011 478 HB3 ARG 63 2HB ARG 63 6.077 19.456 -7.366 479 HG2 ARG 63 1HG ARG 63 5.343 19.257 -9.855 480 HG3 ARG 63 2HG ARG 63 3.753 19.771 -9.306 481 HD2 ARG 63 1HD ARG 63 6.295 21.331 -8.663 482 HD3 ARG 63 2HD ARG 63 5.448 21.561 -10.179 483 HE ARG 63 HE ARG 63 4.582 22.382 -7.500 484 HH11 ARG 63 1HH1 ARG 63 3.809 22.399 -11.110 485 HH12 ARG 63 2HH1 ARG 63 2.682 23.673 -10.831 486 HH21 ARG 63 1HH2 ARG 63 2.836 23.895 -7.385 487 HH22 ARG 63 2HH2 ARG 63 2.159 24.504 -8.867 488 H GLN 64 H GLN 64 2.787 17.958 -6.953 489 HA GLN 64 HA GLN 64 0.721 17.465 -7.345 490 HB2 GLN 64 1HB GLN 64 -0.123 17.548 -9.450 491 HB3 GLN 64 2HB GLN 64 1.077 18.812 -9.127 492 HG2 GLN 64 1HG GLN 64 2.486 18.034 -10.845 493 HG3 GLN 64 2HG GLN 64 1.942 16.364 -10.643 494 HE21 GLN 64 1HE2 GLN 64 0.799 15.555 -12.211 495 HE22 GLN 64 2HE2 GLN 64 -0.200 16.428 -13.349 496 H TYR 65 H TYR 65 2.135 15.400 -6.564 497 HA TYR 65 HA TYR 65 1.383 13.036 -7.993 498 HB2 TYR 65 1HB TYR 65 2.317 13.400 -5.104 499 HB3 TYR 65 2HB TYR 65 2.154 11.832 -5.830 500 HD1 TYR 65 2HD TYR 65 3.236 12.202 -8.591 501 HD2 TYR 65 1HD TYR 65 4.650 13.819 -4.839 502 HE1 TYR 65 2HE TYR 65 5.436 12.548 -9.586 503 HE2 TYR 65 1HE TYR 65 6.888 14.144 -5.820 504 HH TYR 65 HH TYR 65 7.764 12.751 -8.882 505 H ARG 66 H ARG 66 -0.056 11.489 -7.625 506 HA ARG 66 HA ARG 66 -1.997 11.062 -5.694 507 HB2 ARG 66 1HB ARG 66 -4.127 11.743 -6.916 508 HB3 ARG 66 2HB ARG 66 -3.261 12.996 -6.019 509 HG2 ARG 66 1HG ARG 66 -2.217 13.800 -7.914 510 HG3 ARG 66 2HG ARG 66 -2.801 12.514 -8.960 511 HD2 ARG 66 1HD ARG 66 -4.206 14.396 -9.459 512 HD3 ARG 66 2HD ARG 66 -5.191 13.280 -8.510 513 HE ARG 66 HE ARG 66 -3.871 15.166 -6.820 514 HH11 ARG 66 1HH1 ARG 66 -6.527 15.204 -9.250 515 HH12 ARG 66 2HH1 ARG 66 -7.036 16.790 -8.764 516 HH21 ARG 66 1HH2 ARG 66 -4.877 17.015 -5.992 517 HH22 ARG 66 2HH2 ARG 66 -6.154 17.789 -6.876 518 H GLY 67 H GLY 67 -0.979 9.399 -6.302 519 HA2 GLY 67 2HA GLY 67 -1.744 7.804 -8.723 520 HA3 GLY 67 1HA GLY 67 -0.524 7.319 -7.551 521 H VAL 68 H VAL 68 -1.795 5.229 -7.843 522 HA VAL 68 HA VAL 68 -3.784 5.041 -5.666 523 HB VAL 68 HB VAL 68 -4.922 4.807 -7.857 524 HG11 VAL 68 1HG1 VAL 68 -3.256 2.305 -8.266 525 HG12 VAL 68 2HG1 VAL 68 -4.579 2.873 -9.284 526 HG13 VAL 68 3HG1 VAL 68 -3.099 3.825 -9.198 527 HG21 VAL 68 3HG2 VAL 68 -5.859 3.623 -5.910 528 HG22 VAL 68 1HG2 VAL 68 -6.131 2.747 -7.415 529 HG23 VAL 68 2HG2 VAL 68 -4.901 2.173 -6.313 530 H PHE 69 H PHE 69 -3.709 2.807 -4.712 531 HA PHE 69 HA PHE 69 -1.177 1.349 -5.054 532 HB2 PHE 69 1HB PHE 69 -0.935 2.890 -3.114 533 HB3 PHE 69 2HB PHE 69 -2.445 2.280 -2.452 534 HD1 PHE 69 2HD PHE 69 0.711 0.677 -3.812 535 HD2 PHE 69 1HD PHE 69 -2.123 0.927 -0.569 536 HE1 PHE 69 2HE PHE 69 1.984 -1.016 -2.569 537 HE2 PHE 69 1HE PHE 69 -0.815 -0.724 0.691 538 HZ PHE 69 HZ PHE 69 1.223 -1.712 -0.288 539 H GLN 70 H GLN 70 -1.548 -0.861 -4.958 540 HA GLN 70 HA GLN 70 -4.361 -1.786 -4.727 541 HB2 GLN 70 1HB GLN 70 -2.380 -1.726 -7.013 542 HB3 GLN 70 2HB GLN 70 -3.411 -3.097 -6.922 543 HG2 GLN 70 1HG GLN 70 -4.411 -0.214 -6.996 544 HG3 GLN 70 2HG GLN 70 -4.285 -1.250 -8.396 545 HE21 GLN 70 1HE2 GLN 70 -5.307 -3.734 -6.816 546 HE22 GLN 70 2HE2 GLN 70 -7.022 -3.343 -6.646 547 H VAL 71 H VAL 71 -4.359 -3.472 -3.268 548 HA VAL 71 HA VAL 71 -1.895 -5.089 -3.022 549 HB VAL 71 HB VAL 71 -3.721 -4.176 -0.778 550 HG11 VAL 71 1HG1 VAL 71 -2.817 -6.427 -0.262 551 HG12 VAL 71 2HG1 VAL 71 -1.176 -5.874 -0.659 552 HG13 VAL 71 3HG1 VAL 71 -2.041 -5.212 0.739 553 HG21 VAL 71 3HG2 VAL 71 -2.259 -2.357 -1.523 554 HG22 VAL 71 1HG2 VAL 71 -1.697 -2.976 0.027 555 HG23 VAL 71 2HG2 VAL 71 -0.842 -3.428 -1.459 556 H ASN 72 H ASN 72 -2.165 -7.288 -2.718 557 HA ASN 72 HA ASN 72 -4.927 -8.424 -2.853 558 HB2 ASN 72 1HB ASN 72 -2.822 -8.561 -4.982 559 HB3 ASN 72 2HB ASN 72 -3.560 -10.079 -4.543 560 HD21 ASN 72 1HD2 ASN 72 -5.450 -6.980 -4.456 561 HD22 ASN 72 2HD2 ASN 72 -6.428 -7.453 -5.834 562 H VAL 73 H VAL 73 -4.858 -9.213 -0.833 563 HA VAL 73 HA VAL 73 -2.719 -10.965 0.136 564 HB VAL 73 HB VAL 73 -3.813 -9.683 1.794 565 HG11 VAL 73 1HG1 VAL 73 -5.935 -9.098 0.679 566 HG12 VAL 73 2HG1 VAL 73 -6.511 -10.755 0.986 567 HG13 VAL 73 3HG1 VAL 73 -6.159 -9.662 2.328 568 HG21 VAL 73 3HG2 VAL 73 -3.348 -11.772 2.733 569 HG22 VAL 73 1HG2 VAL 73 -5.024 -11.521 3.189 570 HG23 VAL 73 2HG2 VAL 73 -4.629 -12.592 1.846 571 H VAL 74 H VAL 74 -2.461 -12.696 -1.128 572 HA VAL 74 HA VAL 74 -4.780 -14.405 -1.932 573 HB VAL 74 HB VAL 74 -3.425 -13.880 -3.772 574 HG11 VAL 74 1HG1 VAL 74 -0.934 -14.734 -2.293 575 HG12 VAL 74 2HG1 VAL 74 -1.072 -14.211 -3.990 576 HG13 VAL 74 3HG1 VAL 74 -1.376 -13.058 -2.705 577 HG21 VAL 74 3HG2 VAL 74 -2.613 -16.654 -2.818 578 HG22 VAL 74 1HG2 VAL 74 -4.153 -16.205 -3.605 579 HG23 VAL 74 2HG2 VAL 74 -2.619 -16.058 -4.482 580 H MET 75 H MET 75 -5.190 -16.281 -0.699 581 HA MET 75 HA MET 75 -2.940 -17.351 0.868 582 HB2 MET 75 1HB MET 75 -5.675 -16.970 2.151 583 HB3 MET 75 2HB MET 75 -4.235 -17.551 2.914 584 HG2 MET 75 1HG MET 75 -3.529 -15.473 3.393 585 HG3 MET 75 2HG MET 75 -3.958 -14.799 1.849 586 HE1 MET 75 3HE MET 75 -6.852 -15.378 1.296 587 HE2 MET 75 1HE MET 75 -7.735 -14.026 2.033 588 HE3 MET 75 2HE MET 75 -6.252 -13.738 1.116 589 HA PRO 76 HA PRO 76 -4.748 -20.934 -0.934 590 HB2 PRO 76 1HB PRO 76 -4.043 -23.020 0.702 591 HB3 PRO 76 2HB PRO 76 -2.847 -22.078 -0.241 592 HG2 PRO 76 1HG PRO 76 -3.616 -21.702 2.652 593 HG3 PRO 76 2HG PRO 76 -1.972 -21.812 1.946 594 HD2 PRO 76 1HD PRO 76 -3.162 -19.429 2.470 595 HD3 PRO 76 2HD PRO 76 -2.095 -19.637 1.043 596 H ILE 77 H ILE 77 -6.333 -22.813 -0.547 597 HA ILE 77 HA ILE 77 -8.418 -21.949 1.389 598 HB ILE 77 HB ILE 77 -8.747 -23.539 -1.147 599 HG12 ILE 77 1HG1 ILE 77 -9.547 -20.637 -0.623 600 HG13 ILE 77 2HG1 ILE 77 -8.091 -21.104 -1.485 601 HG21 ILE 77 1HG2 ILE 77 -10.498 -22.881 1.173 602 HG22 ILE 77 2HG2 ILE 77 -11.251 -22.578 -0.411 603 HG23 ILE 77 3HG2 ILE 77 -10.603 -24.170 -0.027 604 HD11 ILE 77 3HD1 ILE 77 -10.938 -21.500 -2.365 605 HD12 ILE 77 1HD1 ILE 77 -9.585 -20.728 -3.198 606 HD13 ILE 77 2HD1 ILE 77 -9.615 -22.484 -3.044 607 H GLY 78 H GLY 78 -6.835 -23.116 2.921 608 HA2 GLY 78 2HA GLY 78 -6.945 -26.091 2.672 609 HA3 GLY 78 1HA GLY 78 -5.701 -25.107 3.417 610 H ASP 79 H ASP 79 -6.841 -23.549 5.258 611 HA ASP 79 HA ASP 79 -8.648 -25.306 6.885 612 HB2 ASP 79 1HB ASP 79 -6.407 -25.352 7.852 613 HB3 ASP 79 2HB ASP 79 -6.422 -23.586 7.988 614 H GLY 80 H GLY 80 -10.094 -23.995 5.390 615 HA2 GLY 80 2HA GLY 80 -11.953 -22.646 5.486 616 HA3 GLY 80 1HA GLY 80 -11.477 -22.137 7.106 617 H SER 81 H SER 81 -11.510 -21.301 3.731 618 HA SER 81 HA SER 81 -9.433 -19.427 3.683 619 HB2 SER 81 1HB SER 81 -10.777 -18.831 1.503 620 HB3 SER 81 2HB SER 81 -9.836 -20.308 1.688 621 HG SER 81 HG SER 81 -12.640 -19.981 1.858 622 H ARG 82 H ARG 82 -10.555 -18.482 5.915 623 HA ARG 82 HA ARG 82 -12.272 -16.135 5.173 624 HB2 ARG 82 1HB ARG 82 -12.059 -17.624 7.800 625 HB3 ARG 82 2HB ARG 82 -12.959 -16.147 7.538 626 HG2 ARG 82 1HG ARG 82 -14.551 -17.845 7.531 627 HG3 ARG 82 2HG ARG 82 -14.406 -17.286 5.865 628 HD2 ARG 82 1HD ARG 82 -13.122 -19.262 5.270 629 HD3 ARG 82 2HD ARG 82 -12.997 -19.756 6.967 630 HE ARG 82 HE ARG 82 -15.565 -19.604 5.428 631 HH11 ARG 82 1HH1 ARG 82 -13.751 -21.428 7.871 632 HH12 ARG 82 2HH1 ARG 82 -14.305 -22.981 7.303 633 HH21 ARG 82 1HH2 ARG 82 -16.654 -21.506 5.075 634 HH22 ARG 82 2HH2 ARG 82 -16.262 -22.970 5.930 635 H SER 83 H SER 83 -9.063 -16.732 5.658 636 HA SER 83 HA SER 83 -8.402 -14.855 7.698 637 HB2 SER 83 1HB SER 83 -6.733 -16.022 5.445 638 HB3 SER 83 2HB SER 83 -6.098 -15.148 6.818 639 HG SER 83 HG SER 83 -7.317 -17.670 6.726 640 H ALA 84 H ALA 84 -9.406 -14.234 4.478 641 HA ALA 84 HA ALA 84 -8.024 -11.946 3.694 642 HB1 ALA 84 1HB ALA 84 -11.013 -12.572 3.430 643 HB2 ALA 84 2HB ALA 84 -10.122 -11.393 2.455 644 HB3 ALA 84 3HB ALA 84 -9.747 -13.109 2.318 645 H GLU 85 H GLU 85 -10.772 -12.230 6.041 646 HA GLU 85 HA GLU 85 -11.068 -9.406 6.391 647 HB2 GLU 85 1HB GLU 85 -11.934 -11.824 8.056 648 HB3 GLU 85 2HB GLU 85 -12.360 -10.149 8.427 649 HG2 GLU 85 1HG GLU 85 -13.125 -10.022 5.939 650 HG3 GLU 85 2HG GLU 85 -13.131 -11.776 6.012 651 H GLN 86 H GLN 86 -9.355 -11.899 8.249 652 HA GLN 86 HA GLN 86 -8.366 -10.329 10.344 653 HB2 GLN 86 1HB GLN 86 -7.636 -12.883 9.053 654 HB3 GLN 86 2HB GLN 86 -6.223 -12.052 9.683 655 HG2 GLN 86 1HG GLN 86 -8.681 -12.409 11.391 656 HG3 GLN 86 2HG GLN 86 -7.531 -13.711 11.176 657 HE21 GLN 86 1HE2 GLN 86 -6.650 -10.123 11.552 658 HE22 GLN 86 2HE2 GLN 86 -5.788 -10.454 13.017 659 H VAL 87 H VAL 87 -6.937 -10.780 7.089 660 HA VAL 87 HA VAL 87 -4.710 -9.002 7.675 661 HB VAL 87 HB VAL 87 -5.760 -10.290 5.116 662 HG11 VAL 87 1HG1 VAL 87 -3.397 -9.777 4.231 663 HG12 VAL 87 2HG1 VAL 87 -4.532 -8.434 4.306 664 HG13 VAL 87 3HG1 VAL 87 -3.264 -8.603 5.553 665 HG21 VAL 87 3HG2 VAL 87 -4.828 -11.842 6.840 666 HG22 VAL 87 1HG2 VAL 87 -3.874 -11.782 5.360 667 HG23 VAL 87 2HG2 VAL 87 -3.305 -10.907 6.821 668 H ALA 88 H ALA 88 -7.819 -8.561 5.897 669 HA ALA 88 HA ALA 88 -7.230 -5.923 5.045 670 HB1 ALA 88 1HB ALA 88 -9.165 -7.151 4.195 671 HB2 ALA 88 2HB ALA 88 -9.890 -7.199 5.827 672 HB3 ALA 88 3HB ALA 88 -9.696 -5.653 4.979 673 H ALA 89 H ALA 89 -8.395 -7.179 8.143 674 HA ALA 89 HA ALA 89 -9.109 -4.634 9.308 675 HB1 ALA 89 1HB ALA 89 -10.159 -6.688 10.060 676 HB2 ALA 89 2HB ALA 89 -8.582 -7.394 10.511 677 HB3 ALA 89 3HB ALA 89 -9.229 -6.019 11.410 678 H GLU 90 H GLU 90 -6.356 -6.882 9.776 679 HA GLU 90 HA GLU 90 -4.790 -5.404 11.599 680 HB2 GLU 90 1HB GLU 90 -4.250 -7.403 9.391 681 HB3 GLU 90 2HB GLU 90 -2.915 -6.597 10.148 682 HG2 GLU 90 1HG GLU 90 -4.848 -7.715 12.115 683 HG3 GLU 90 2HG GLU 90 -4.150 -8.907 11.034 684 H LEU 91 H LEU 91 -4.757 -5.378 8.025 685 HA LEU 91 HA LEU 91 -2.776 -3.328 7.808 686 HB2 LEU 91 1HB LEU 91 -4.784 -4.549 5.899 687 HB3 LEU 91 2HB LEU 91 -3.720 -3.252 5.405 688 HG LEU 91 HG LEU 91 -2.565 -5.761 6.594 689 HD11 LEU 91 1HD1 LEU 91 -3.105 -5.159 3.658 690 HD12 LEU 91 2HD1 LEU 91 -3.955 -6.347 4.669 691 HD13 LEU 91 3HD1 LEU 91 -2.233 -6.573 4.312 692 HD21 LEU 91 3HD2 LEU 91 -1.473 -3.525 4.805 693 HD22 LEU 91 1HD2 LEU 91 -0.573 -4.984 5.248 694 HD23 LEU 91 2HD2 LEU 91 -1.032 -3.838 6.504 695 H ASP 92 H ASP 92 -6.421 -3.179 7.763 696 HA ASP 92 HA ASP 92 -6.594 -0.424 7.155 697 HB2 ASP 92 1HB ASP 92 -8.574 -1.777 7.043 698 HB3 ASP 92 2HB ASP 92 -8.407 -2.297 8.715 699 H ALA 93 H ALA 93 -6.152 -2.068 10.287 700 HA ALA 93 HA ALA 93 -6.301 0.303 11.897 701 HB1 ALA 93 1HB ALA 93 -6.466 -1.957 12.863 702 HB2 ALA 93 2HB ALA 93 -4.791 -2.307 12.374 703 HB3 ALA 93 3HB ALA 93 -5.120 -1.056 13.589 704 H LEU 94 H LEU 94 -3.659 -1.236 10.071 705 HA LEU 94 HA LEU 94 -1.660 0.564 11.081 706 HB2 LEU 94 1HB LEU 94 -1.189 -1.727 10.047 707 HB3 LEU 94 2HB LEU 94 -1.535 -1.008 8.481 708 HG LEU 94 HG LEU 94 0.286 0.726 9.007 709 HD11 LEU 94 1HD1 LEU 94 0.415 0.500 11.442 710 HD12 LEU 94 2HD1 LEU 94 1.967 0.085 10.721 711 HD13 LEU 94 3HD1 LEU 94 0.867 -1.200 11.278 712 HD21 LEU 94 3HD2 LEU 94 1.057 -0.737 7.489 713 HD22 LEU 94 1HD2 LEU 94 0.760 -2.166 8.491 714 HD23 LEU 94 2HD2 LEU 94 2.168 -1.095 8.770 715 H PHE 95 H PHE 95 -3.791 0.594 8.219 716 HA PHE 95 HA PHE 95 -2.641 3.215 7.371 717 HB2 PHE 95 1HB PHE 95 -3.857 0.980 5.724 718 HB3 PHE 95 2HB PHE 95 -3.357 2.529 5.100 719 HD1 PHE 95 2HD PHE 95 -1.008 3.079 4.778 720 HD2 PHE 95 1HD PHE 95 -2.106 -0.797 6.266 721 HE1 PHE 95 2HE PHE 95 1.224 2.226 4.176 722 HE2 PHE 95 1HE PHE 95 0.054 -1.685 5.533 723 HZ PHE 95 HZ PHE 95 1.757 -0.165 4.513 724 HA PRO 96 HA PRO 96 -7.153 3.856 8.412 725 HB2 PRO 96 1HB PRO 96 -6.969 5.752 10.341 726 HB3 PRO 96 2HB PRO 96 -6.677 4.018 10.695 727 HG2 PRO 96 1HG PRO 96 -4.597 6.157 10.097 728 HG3 PRO 96 2HG PRO 96 -4.656 5.032 11.497 729 HD2 PRO 96 1HD PRO 96 -3.200 4.456 9.266 730 HD3 PRO 96 2HD PRO 96 -4.107 3.184 10.160 731 H VAL 97 H VAL 97 -8.337 5.951 8.233 732 HA VAL 97 HA VAL 97 -7.965 7.205 5.815 733 HB VAL 97 HB VAL 97 -9.991 6.723 7.243 734 HG11 VAL 97 1HG1 VAL 97 -9.265 7.945 9.304 735 HG12 VAL 97 2HG1 VAL 97 -9.491 9.475 8.435 736 HG13 VAL 97 3HG1 VAL 97 -10.875 8.407 8.730 737 HG21 VAL 97 3HG2 VAL 97 -10.087 7.965 5.080 738 HG22 VAL 97 1HG2 VAL 97 -11.401 8.333 6.211 739 HG23 VAL 97 2HG2 VAL 97 -10.066 9.480 5.995 740 H ASN 98 H ASN 98 -5.825 7.921 7.966 741 HA ASN 98 HA ASN 98 -5.521 10.797 7.100 742 HB2 ASN 98 1HB ASN 98 -4.418 9.582 9.692 743 HB3 ASN 98 2HB ASN 98 -4.249 11.242 9.130 744 HD21 ASN 98 1HD2 ASN 98 -6.255 9.044 10.904 745 HD22 ASN 98 2HD2 ASN 98 -7.660 10.080 11.082 746 H LEU 99 H LEU 99 -3.897 7.639 7.843 747 HA LEU 99 HA LEU 99 -1.805 7.038 7.963 748 HB2 LEU 99 1HB LEU 99 -2.330 7.851 5.176 749 HB3 LEU 99 2HB LEU 99 -0.644 7.779 5.579 750 HG LEU 99 HG LEU 99 -2.513 5.528 6.214 751 HD11 LEU 99 1HD1 LEU 99 -0.766 5.022 3.892 752 HD12 LEU 99 2HD1 LEU 99 -1.910 6.297 3.577 753 HD13 LEU 99 3HD1 LEU 99 -2.497 4.713 4.101 754 HD21 LEU 99 3HD2 LEU 99 -0.193 5.710 7.336 755 HD22 LEU 99 1HD2 LEU 99 0.458 5.205 5.780 756 HD23 LEU 99 2HD2 LEU 99 -0.689 4.178 6.675 757 H VAL 100 H VAL 100 -1.075 8.329 9.681 758 HA VAL 100 HA VAL 100 0.336 10.831 9.010 759 HB VAL 100 HB VAL 100 0.383 9.428 11.692 760 HG11 VAL 100 1HG1 VAL 100 2.095 11.175 11.146 761 HG12 VAL 100 2HG1 VAL 100 0.806 12.304 10.754 762 HG13 VAL 100 3HG1 VAL 100 0.973 11.724 12.428 763 HG21 VAL 100 3HG2 VAL 100 -1.619 11.480 10.663 764 HG22 VAL 100 1HG2 VAL 100 -1.984 9.837 11.241 765 HG23 VAL 100 2HG2 VAL 100 -1.391 11.050 12.378 766 H MET 101 H MET 101 1.519 9.659 7.351 767 HA MET 101 HA MET 101 3.940 8.365 8.427 768 HB2 MET 101 1HB MET 101 4.363 7.441 6.177 769 HB3 MET 101 2HB MET 101 3.302 6.578 7.268 770 HG2 MET 101 1HG MET 101 1.347 7.223 6.098 771 HG3 MET 101 2HG MET 101 2.211 8.557 5.294 772 HE1 MET 101 3HE MET 101 0.388 6.868 3.787 773 HE2 MET 101 1HE MET 101 1.352 8.273 3.441 774 HE3 MET 101 2HE MET 101 1.355 6.888 2.289 775 H GLN 102 H GLN 102 5.753 9.487 8.145 776 HA GLN 102 HA GLN 102 5.593 11.985 6.549 777 HB2 GLN 102 1HB GLN 102 7.411 11.251 8.867 778 HB3 GLN 102 2HB GLN 102 7.434 12.761 7.940 779 HG2 GLN 102 1HG GLN 102 5.039 13.156 8.638 780 HG3 GLN 102 2HG GLN 102 5.137 11.743 9.684 781 HE21 GLN 102 1HE2 GLN 102 4.650 13.217 11.524 782 HE22 GLN 102 2HE2 GLN 102 5.927 14.281 12.105 783 H SER 103 H SER 103 8.159 12.488 5.923 784 HA SER 103 HA SER 103 9.486 10.045 5.039 785 HB2 SER 103 1HB SER 103 9.584 10.860 2.679 786 HB3 SER 103 2HB SER 103 7.995 10.368 3.150 787 HG SER 103 HG SER 103 7.648 12.666 3.644 788 H GLY 104 H GLY 104 11.622 10.851 3.841 789 HA2 GLY 104 2HA GLY 104 12.988 12.878 5.337 790 HA3 GLY 104 1HA GLY 104 13.466 12.217 3.756 791 H GLY 105 H GLY 105 10.782 13.059 2.432 792 HA2 GLY 105 2HA GLY 105 11.931 15.593 1.605 793 HA3 GLY 105 1HA GLY 105 10.543 14.724 0.903 794 H LEU 106 H LEU 106 8.806 14.413 2.864 795 HA LEU 106 HA LEU 106 8.213 16.736 4.396 796 HB2 LEU 106 1HB LEU 106 5.955 16.869 2.746 797 HB3 LEU 106 2HB LEU 106 7.193 18.054 2.846 798 HG LEU 106 HG LEU 106 8.389 17.140 0.906 799 HD11 LEU 106 1HD1 LEU 106 7.782 14.715 0.876 800 HD12 LEU 106 2HD1 LEU 106 7.306 15.506 -0.600 801 HD13 LEU 106 3HD1 LEU 106 6.077 15.180 0.650 802 HD21 LEU 106 3HD2 LEU 106 6.713 18.895 0.681 803 HD22 LEU 106 1HD2 LEU 106 5.462 17.669 0.391 804 HD23 LEU 106 2HD2 LEU 106 6.830 17.873 -0.753 805 H ALA 107 H ALA 107 5.730 14.852 2.624 806 HA ALA 107 HA ALA 107 5.594 12.565 4.371 807 HB1 ALA 107 1HB ALA 107 4.949 14.159 6.103 808 HB2 ALA 107 2HB ALA 107 3.910 15.029 4.984 809 HB3 ALA 107 3HB ALA 107 3.457 13.406 5.548 810 H VAL 108 H VAL 108 3.187 11.693 4.237 811 HA VAL 108 HA VAL 108 1.818 12.388 1.785 812 HB VAL 108 HB VAL 108 3.388 10.931 0.875 813 HG11 VAL 108 1HG1 VAL 108 4.584 9.855 2.447 814 HG12 VAL 108 2HG1 VAL 108 3.185 9.316 3.359 815 HG13 VAL 108 3HG1 VAL 108 3.635 8.495 1.833 816 HG21 VAL 108 3HG2 VAL 108 2.193 9.124 -0.068 817 HG22 VAL 108 1HG2 VAL 108 1.014 9.095 1.246 818 HG23 VAL 108 2HG2 VAL 108 1.082 10.474 0.117 819 H ARG 109 H ARG 109 -0.334 10.830 1.714 820 HA ARG 109 HA ARG 109 -1.353 10.417 4.440 821 HB2 ARG 109 1HB ARG 109 -2.361 12.416 2.378 822 HB3 ARG 109 2HB ARG 109 -3.445 11.728 3.582 823 HG2 ARG 109 1HG ARG 109 -2.168 12.635 5.411 824 HG3 ARG 109 2HG ARG 109 -0.933 13.217 4.313 825 HD2 ARG 109 1HD ARG 109 -3.823 14.169 4.481 826 HD3 ARG 109 2HD ARG 109 -2.407 15.049 5.054 827 HE ARG 109 HE ARG 109 -1.970 14.510 2.325 828 HH11 ARG 109 1HH1 ARG 109 -3.933 16.751 4.303 829 HH12 ARG 109 2HH1 ARG 109 -4.099 17.915 3.038 830 HH21 ARG 109 1HH2 ARG 109 -2.308 15.885 0.643 831 HH22 ARG 109 2HH2 ARG 109 -3.255 17.315 0.809 832 H VAL 110 H VAL 110 -3.778 9.590 3.970 833 HA VAL 110 HA VAL 110 -3.589 7.642 1.709 834 HB VAL 110 HB VAL 110 -3.929 6.901 4.092 835 HG11 VAL 110 1HG1 VAL 110 -6.712 7.984 3.716 836 HG12 VAL 110 2HG1 VAL 110 -6.107 6.934 5.000 837 HG13 VAL 110 3HG1 VAL 110 -5.465 8.582 4.836 838 HG21 VAL 110 3HG2 VAL 110 -5.894 6.012 1.986 839 HG22 VAL 110 1HG2 VAL 110 -4.279 5.357 2.331 840 HG23 VAL 110 2HG2 VAL 110 -5.572 5.158 3.513 841 H ARG 111 H ARG 111 -5.464 10.406 2.813 842 HA ARG 111 HA ARG 111 -7.039 11.685 1.903 843 HB2 ARG 111 1HB ARG 111 -5.714 11.122 -0.328 844 HB3 ARG 111 2HB ARG 111 -7.233 10.334 -0.710 845 HG2 ARG 111 1HG ARG 111 -8.185 12.685 0.407 846 HG3 ARG 111 2HG ARG 111 -6.663 13.259 -0.249 847 HD2 ARG 111 1HD ARG 111 -8.622 11.605 -1.812 848 HD3 ARG 111 2HD ARG 111 -8.875 13.343 -1.631 849 HE ARG 111 HE ARG 111 -6.917 12.051 -3.371 850 HH11 ARG 111 1HH1 ARG 111 -7.378 14.975 -1.453 851 HH12 ARG 111 2HH1 ARG 111 -6.634 16.060 -2.544 852 HH21 ARG 111 1HH2 ARG 111 -5.741 13.311 -4.705 853 HH22 ARG 111 2HH2 ARG 111 -5.372 14.993 -4.322 854 H THR 112 H THR 112 -7.567 8.253 1.287 855 HA THR 112 HA THR 112 -10.474 8.716 1.880 856 HB THR 112 HB THR 112 -10.811 6.883 0.115 857 HG1 THR 112 1HG THR 112 -8.072 7.505 -0.270 858 HG21 THR 112 3HG2 THR 112 -9.613 9.479 -0.952 859 HG22 THR 112 1HG2 THR 112 -11.195 9.407 -0.157 860 HG23 THR 112 2HG2 THR 112 -10.925 8.494 -1.642 861 HA PRO 113 HA PRO 113 -10.173 5.308 4.695 862 HB2 PRO 113 1HB PRO 113 -12.599 4.062 4.513 863 HB3 PRO 113 2HB PRO 113 -12.407 5.690 5.242 864 HG2 PRO 113 1HG PRO 113 -13.246 5.009 2.402 865 HG3 PRO 113 2HG PRO 113 -14.033 6.138 3.551 866 HD2 PRO 113 1HD PRO 113 -12.317 7.015 1.643 867 HD3 PRO 113 2HD PRO 113 -12.349 7.760 3.272 868 H ILE 114 H ILE 114 -10.123 2.890 4.728 869 HA ILE 114 HA ILE 114 -8.791 1.851 2.422 870 HB ILE 114 HB ILE 114 -9.882 0.753 5.012 871 HG12 ILE 114 1HG1 ILE 114 -7.819 2.183 4.973 872 HG13 ILE 114 2HG1 ILE 114 -7.628 0.598 5.691 873 HG21 ILE 114 1HG2 ILE 114 -8.541 -0.985 2.916 874 HG22 ILE 114 2HG2 ILE 114 -8.819 -1.412 4.634 875 HG23 ILE 114 3HG2 ILE 114 -10.180 -1.146 3.574 876 HD11 ILE 114 3HD1 ILE 114 -6.533 -0.207 3.637 877 HD12 ILE 114 1HD1 ILE 114 -6.743 1.394 2.897 878 HD13 ILE 114 2HD1 ILE 114 -5.700 1.204 4.313 879 H SER 115 H SER 115 -9.555 0.736 0.623 880 HA SER 115 HA SER 115 -12.489 0.264 0.536 881 HB2 SER 115 1HB SER 115 -10.378 1.114 -1.339 882 HB3 SER 115 2HB SER 115 -11.142 -0.408 -1.805 883 HG SER 115 HG SER 115 -12.804 1.685 -0.958 884 H ASN 116 H ASN 116 -13.170 -1.807 0.204 885 HA ASN 116 HA ASN 116 -11.391 -4.079 -0.132 886 HB2 ASN 116 1HB ASN 116 -12.766 -3.321 2.427 887 HB3 ASN 116 2HB ASN 116 -12.972 -5.003 1.930 888 HD21 ASN 116 1HD2 ASN 116 -10.571 -5.734 0.792 889 HD22 ASN 116 2HD2 ASN 116 -9.311 -5.431 1.966 890 H GLY 117 H GLY 117 -12.675 -5.920 -0.950 891 HA2 GLY 117 2HA GLY 117 -15.558 -5.529 -1.386 892 HA3 GLY 117 1HA GLY 117 -14.493 -5.537 -2.805 893 H GLN 118 H GLN 118 -16.080 -7.475 -3.173 894 HA GLN 118 HA GLN 118 -15.682 -9.885 -1.630 895 HB2 GLN 118 1HB GLN 118 -17.336 -8.953 -3.935 896 HB3 GLN 118 2HB GLN 118 -16.749 -10.586 -4.115 897 HG2 GLN 118 1HG GLN 118 -18.833 -10.798 -3.085 898 HG3 GLN 118 2HG GLN 118 -17.635 -11.152 -1.849 899 HE21 GLN 118 1HE2 GLN 118 -18.393 -10.414 0.091 900 HE22 GLN 118 2HE2 GLN 118 -19.461 -9.036 0.328 901 HA PRO 119 HA PRO 119 -12.124 -11.287 -3.973 902 HB2 PRO 119 1HB PRO 119 -12.031 -13.947 -3.358 903 HB3 PRO 119 2HB PRO 119 -11.762 -12.680 -2.136 904 HG2 PRO 119 1HG PRO 119 -14.332 -14.176 -2.730 905 HG3 PRO 119 2HG PRO 119 -13.548 -13.907 -1.136 906 HD2 PRO 119 1HD PRO 119 -15.587 -12.330 -2.109 907 HD3 PRO 119 2HD PRO 119 -14.304 -11.682 -1.048 908 H THR 120 H THR 120 -11.540 -13.233 -5.490 909 HA THR 120 HA THR 120 -13.739 -13.884 -7.385 910 HB THR 120 HB THR 120 -12.537 -11.788 -7.967 911 HG1 THR 120 1HG THR 120 -13.482 -13.028 -9.594 912 HG21 THR 120 3HG2 THR 120 -10.253 -11.841 -8.768 913 HG22 THR 120 1HG2 THR 120 -10.150 -13.585 -8.470 914 HG23 THR 120 2HG2 THR 120 -10.320 -12.477 -7.112 915 H THR 121 H THR 121 -12.265 -15.289 -5.324 916 HA THR 121 HA THR 121 -10.255 -16.900 -5.877 917 HB THR 121 HB THR 121 -11.262 -16.778 -3.732 918 HG1 THR 121 1HG THR 121 -9.885 -18.653 -4.261 919 HG21 THR 121 3HG2 THR 121 -13.092 -18.217 -3.120 920 HG22 THR 121 1HG2 THR 121 -13.221 -18.756 -4.834 921 HG23 THR 121 2HG2 THR 121 -13.611 -17.072 -4.385 922 H GLY 122 H GLY 122 -9.741 -18.906 -6.558 923 HA2 GLY 122 2HA GLY 122 -11.243 -19.792 -9.004 924 HA3 GLY 122 1HA GLY 122 -9.529 -20.003 -8.685 925 H ASP 123 H ASP 123 -8.845 -21.487 -7.176 926 HA ASP 123 HA ASP 123 -10.678 -23.804 -6.798 927 HB2 ASP 123 1HB ASP 123 -9.647 -24.023 -8.919 928 HB3 ASP 123 2HB ASP 123 -8.128 -23.380 -8.348 929 H ALA 124 H ALA 124 -7.530 -22.299 -6.031 930 HA ALA 124 HA ALA 124 -7.361 -24.031 -3.601 931 HB1 ALA 124 1HB ALA 124 -5.047 -24.542 -4.175 932 HB2 ALA 124 2HB ALA 124 -6.126 -25.026 -5.504 933 HB3 ALA 124 3HB ALA 124 -5.180 -23.554 -5.657 934 H ASP 125 H ASP 125 -7.426 -20.888 -4.726 935 HA ASP 125 HA ASP 125 -6.011 -19.771 -2.467 936 HB2 ASP 125 1HB ASP 125 -5.211 -18.053 -4.269 937 HB3 ASP 125 2HB ASP 125 -4.247 -19.432 -3.951 938 H HIS 126 H HIS 126 -6.770 -17.738 -1.942 939 HA HIS 126 HA HIS 126 -9.023 -16.646 -3.536 940 HB2 HIS 126 1HB HIS 126 -10.429 -16.467 -1.598 941 HB3 HIS 126 2HB HIS 126 -9.825 -18.114 -1.730 942 HD1 HIS 126 1HD HIS 126 -10.068 -15.391 0.779 943 HD2 HIS 126 2HD HIS 126 -7.962 -18.929 -0.015 944 HE1 HIS 126 1HE HIS 126 -9.092 -16.171 3.020 945 H THR 127 H THR 127 -9.014 -14.529 -3.823 946 HA THR 127 HA THR 127 -7.126 -12.825 -2.318 947 HB THR 127 HB THR 127 -7.425 -12.683 -5.332 948 HG1 THR 127 1HG THR 127 -6.808 -14.779 -5.184 949 HG21 THR 127 3HG2 THR 127 -5.133 -11.840 -5.191 950 HG22 THR 127 1HG2 THR 127 -5.102 -12.141 -3.447 951 HG23 THR 127 2HG2 THR 127 -6.211 -10.922 -4.110 952 H VAL 128 H VAL 128 -8.291 -11.366 -1.347 953 HA VAL 128 HA VAL 128 -10.732 -10.239 -2.573 954 HB VAL 128 HB VAL 128 -10.520 -8.803 -0.445 955 HG11 VAL 128 1HG1 VAL 128 -12.231 -10.503 -0.836 956 HG12 VAL 128 2HG1 VAL 128 -11.186 -11.723 -0.101 957 HG13 VAL 128 3HG1 VAL 128 -11.772 -10.346 0.869 958 HG21 VAL 128 3HG2 VAL 128 -9.362 -9.572 1.439 959 HG22 VAL 128 1HG2 VAL 128 -8.761 -11.011 0.581 960 HG23 VAL 128 2HG2 VAL 128 -8.212 -9.381 0.115 961 HA PRO 129 HA PRO 129 -8.311 -6.825 -4.168 962 HB2 PRO 129 1HB PRO 129 -10.334 -5.096 -4.764 963 HB3 PRO 129 2HB PRO 129 -10.106 -6.627 -5.664 964 HG2 PRO 129 1HG PRO 129 -12.098 -6.056 -3.464 965 HG3 PRO 129 2HG PRO 129 -12.325 -6.994 -4.973 966 HD2 PRO 129 1HD PRO 129 -11.770 -8.059 -2.471 967 HD3 PRO 129 2HD PRO 129 -11.492 -8.871 -4.033 968 H ILE 130 H ILE 130 -7.210 -5.215 -2.991 969 HA ILE 130 HA ILE 130 -8.768 -3.551 -1.157 970 HB ILE 130 HB ILE 130 -5.929 -4.217 -0.408 971 HG12 ILE 130 1HG1 ILE 130 -8.284 -6.010 0.187 972 HG13 ILE 130 2HG1 ILE 130 -6.699 -6.395 -0.452 973 HG21 ILE 130 1HG2 ILE 130 -6.596 -3.439 1.777 974 HG22 ILE 130 2HG2 ILE 130 -7.204 -2.285 0.598 975 HG23 ILE 130 3HG2 ILE 130 -8.311 -3.457 1.335 976 HD11 ILE 130 3HD1 ILE 130 -7.376 -5.596 2.407 977 HD12 ILE 130 1HD1 ILE 130 -6.918 -7.200 1.837 978 HD13 ILE 130 2HD1 ILE 130 -5.718 -5.886 1.803 979 H SER 131 H SER 131 -8.128 -1.431 -1.404 980 HA SER 131 HA SER 131 -5.703 -0.690 -2.688 981 HB2 SER 131 1HB SER 131 -6.718 0.417 -4.719 982 HB3 SER 131 2HB SER 131 -6.627 -1.332 -4.727 983 HG SER 131 HG SER 131 -8.789 0.344 -4.737 984 H LEU 132 H LEU 132 -5.672 1.724 -3.151 985 HA LEU 132 HA LEU 132 -7.576 3.394 -1.821 986 HB2 LEU 132 1HB LEU 132 -5.990 4.295 -0.113 987 HB3 LEU 132 2HB LEU 132 -6.645 2.702 0.159 988 HG LEU 132 HG LEU 132 -4.299 1.942 -0.966 989 HD11 LEU 132 1HD1 LEU 132 -3.648 4.576 0.414 990 HD12 LEU 132 2HD1 LEU 132 -3.423 4.218 -1.299 991 HD13 LEU 132 3HD1 LEU 132 -2.470 3.349 -0.077 992 HD21 LEU 132 3HD2 LEU 132 -3.551 1.518 1.319 993 HD22 LEU 132 1HD2 LEU 132 -5.295 1.232 1.152 994 HD23 LEU 132 2HD2 LEU 132 -4.734 2.714 1.933 995 H GLY 133 H GLY 133 -7.117 5.649 -2.124 996 HA2 GLY 133 2HA GLY 133 -5.240 6.120 -4.410 997 HA3 GLY 133 1HA GLY 133 -6.923 6.632 -4.389 998 H TYR 134 H TYR 134 -3.788 7.679 -3.835 999 HA TYR 134 HA TYR 134 -4.385 9.357 -1.450 1000 HB2 TYR 134 1HB TYR 134 -2.224 8.904 -0.691 1001 HB3 TYR 134 2HB TYR 134 -3.047 7.377 -0.933 1002 HD1 TYR 134 1HD TYR 134 -2.445 5.979 -3.062 1003 HD2 TYR 134 2HD TYR 134 -0.144 9.388 -1.698 1004 HE1 TYR 134 1HE TYR 134 -0.539 5.260 -4.453 1005 HE2 TYR 134 2HE TYR 134 1.739 8.692 -3.094 1006 HH TYR 134 HH TYR 134 1.697 5.682 -5.029 1007 H ASP 135 H ASP 135 -2.074 10.797 -1.451 1008 HA ASP 135 HA ASP 135 -1.239 11.825 -4.048 1009 HB2 ASP 135 1HB ASP 135 -1.926 14.147 -3.581 1010 HB3 ASP 135 2HB ASP 135 -3.258 13.103 -3.885 1011 H VAL 136 H VAL 136 -1.048 13.650 -1.067 1012 HA VAL 136 HA VAL 136 1.609 12.904 -0.177 1013 HB VAL 136 HB VAL 136 1.458 13.965 -2.759 1014 HG11 VAL 136 1HG1 VAL 136 1.605 16.440 -1.081 1015 HG12 VAL 136 2HG1 VAL 136 1.719 16.280 -2.844 1016 HG13 VAL 136 3HG1 VAL 136 0.187 15.910 -1.991 1017 HG21 VAL 136 3HG2 VAL 136 3.685 14.569 -2.524 1018 HG22 VAL 136 1HG2 VAL 136 3.550 14.512 -0.731 1019 HG23 VAL 136 2HG2 VAL 136 3.275 13.036 -1.736 1020 H GLN 137 H GLN 137 2.542 14.959 0.967 1021 HA GLN 137 HA GLN 137 0.397 16.667 1.774 1022 HB2 GLN 137 1HB GLN 137 -0.042 15.135 3.393 1023 HB3 GLN 137 2HB GLN 137 1.619 14.538 3.538 1024 HG2 GLN 137 1HG GLN 137 2.336 16.393 4.614 1025 HG3 GLN 137 2HG GLN 137 0.865 17.308 4.192 1026 HE21 GLN 137 1HE2 GLN 137 2.093 14.897 6.627 1027 HE22 GLN 137 2HE2 GLN 137 0.599 14.930 7.508 1028 H PHE 138 H PHE 138 1.185 18.626 2.481 1029 HA PHE 138 HA PHE 138 4.107 19.199 2.215 1030 HB2 PHE 138 1HB PHE 138 1.676 20.913 1.557 1031 HB3 PHE 138 2HB PHE 138 3.354 21.373 1.337 1032 HD1 PHE 138 2HD PHE 138 0.721 18.985 0.110 1033 HD2 PHE 138 1HD PHE 138 4.533 20.847 -0.595 1034 HE1 PHE 138 2HE PHE 138 0.501 18.497 -2.315 1035 HE2 PHE 138 1HE PHE 138 4.243 20.511 -3.054 1036 HZ PHE 138 HZ PHE 138 2.260 19.264 -3.913 1037 H TYR 139 H TYR 139 1.519 19.128 4.336 1038 HA TYR 139 HA TYR 139 1.099 19.628 6.348 1039 HB2 TYR 139 1HB TYR 139 3.801 19.285 6.143 1040 HB3 TYR 139 2HB TYR 139 3.734 20.878 6.832 1041 HD1 TYR 139 1HD TYR 139 2.865 17.334 7.152 1042 HD2 TYR 139 2HD TYR 139 2.978 21.107 9.252 1043 HE1 TYR 139 1HE TYR 139 2.417 16.152 9.270 1044 HE2 TYR 139 2HE TYR 139 2.548 19.944 11.382 1045 HH TYR 139 HH TYR 139 3.075 16.686 11.655 1046 HA PRO 140 HA PRO 140 0.277 24.077 7.000 1047 HB2 PRO 140 1HB PRO 140 -0.547 24.085 9.582 1048 HB3 PRO 140 2HB PRO 140 -1.524 23.352 8.281 1049 HG2 PRO 140 1HG PRO 140 0.451 21.900 10.087 1050 HG3 PRO 140 2HG PRO 140 -1.287 21.534 9.879 1051 HD2 PRO 140 1HD PRO 140 0.492 20.215 8.378 1052 HD3 PRO 140 2HD PRO 140 -0.958 20.873 7.598 1053 H GLU 141 H GLU 141 2.701 23.696 6.643 1054 HA GLU 141 HA GLU 141 4.782 24.194 6.855 1055 HB2 GLU 141 1HB GLU 141 5.352 26.379 7.587 1056 HB3 GLU 141 2HB GLU 141 3.801 26.388 6.790 1057 HG2 GLU 141 1HG GLU 141 2.689 26.512 9.038 1058 HG3 GLU 141 2HG GLU 141 4.302 26.594 9.795 Start of MODEL 20 1 H1 GLY 1 H GLY 1 16.400 13.891 -9.942 2 HA2 GLY 1 2HA GLY 1 15.660 11.169 -9.067 3 HA3 GLY 1 1HA GLY 1 17.205 11.995 -8.744 4 H MET 2 H MET 2 16.931 11.678 -6.400 5 HA MET 2 HA MET 2 16.074 12.035 -4.364 6 HB2 MET 2 1HB MET 2 16.856 14.387 -5.262 7 HB3 MET 2 2HB MET 2 15.131 14.757 -5.266 8 HG2 MET 2 1HG MET 2 15.590 15.445 -3.176 9 HG3 MET 2 2HG MET 2 15.334 13.769 -2.752 10 HE1 MET 2 3HE MET 2 17.096 12.076 -2.063 11 HE2 MET 2 1HE MET 2 18.080 12.213 -3.547 12 HE3 MET 2 2HE MET 2 18.837 12.396 -1.958 13 H SER 3 H SER 3 13.784 13.528 -3.447 14 HA SER 3 HA SER 3 11.675 13.232 -2.936 15 HB2 SER 3 1HB SER 3 11.997 14.339 -5.465 16 HB3 SER 3 2HB SER 3 10.637 13.230 -5.658 17 HG SER 3 HG SER 3 10.981 15.408 -3.883 18 H GLN 4 H GLN 4 11.245 11.164 -5.901 19 HA GLN 4 HA GLN 4 9.397 9.609 -4.490 20 HB2 GLN 4 1HB GLN 4 10.305 9.800 -7.161 21 HB3 GLN 4 2HB GLN 4 10.614 8.127 -6.721 22 HG2 GLN 4 1HG GLN 4 7.942 8.896 -5.789 23 HG3 GLN 4 2HG GLN 4 8.141 9.372 -7.446 24 HE21 GLN 4 1HE2 GLN 4 7.825 6.628 -5.275 25 HE22 GLN 4 2HE2 GLN 4 7.657 5.443 -6.583 26 H ASP 5 H ASP 5 12.823 9.266 -4.710 27 HA ASP 5 HA ASP 5 13.439 6.740 -3.685 28 HB2 ASP 5 1HB ASP 5 14.884 8.738 -4.480 29 HB3 ASP 5 2HB ASP 5 14.696 9.414 -2.879 30 H LEU 6 H LEU 6 12.581 9.723 -2.014 31 HA LEU 6 HA LEU 6 12.683 8.729 0.702 32 HB2 LEU 6 1HB LEU 6 11.284 11.224 -0.302 33 HB3 LEU 6 2HB LEU 6 11.967 10.960 1.284 34 HG LEU 6 HG LEU 6 13.742 11.082 -1.200 35 HD11 LEU 6 1HD1 LEU 6 13.923 13.353 -1.134 36 HD12 LEU 6 2HD1 LEU 6 13.299 13.493 0.490 37 HD13 LEU 6 3HD1 LEU 6 12.179 13.120 -0.854 38 HD21 LEU 6 3HD2 LEU 6 14.732 10.150 0.861 39 HD22 LEU 6 1HD2 LEU 6 14.254 11.599 1.764 40 HD23 LEU 6 2HD2 LEU 6 15.443 11.724 0.451 41 H ILE 7 H ILE 7 10.210 9.385 -1.764 42 HA ILE 7 HA ILE 7 7.887 9.248 -0.191 43 HB ILE 7 HB ILE 7 8.288 8.362 -3.071 44 HG12 ILE 7 1HG1 ILE 7 8.695 10.745 -2.762 45 HG13 ILE 7 2HG1 ILE 7 7.169 10.503 -3.609 46 HG21 ILE 7 1HG2 ILE 7 6.308 7.208 -2.355 47 HG22 ILE 7 2HG2 ILE 7 5.654 8.675 -1.605 48 HG23 ILE 7 3HG2 ILE 7 5.841 8.577 -3.364 49 HD11 ILE 7 3HD1 ILE 7 6.501 12.039 -2.118 50 HD12 ILE 7 1HD1 ILE 7 6.301 10.701 -1.011 51 HD13 ILE 7 2HD1 ILE 7 7.834 11.636 -0.961 52 H ARG 8 H ARG 8 9.447 6.592 -2.143 53 HA ARG 8 HA ARG 8 7.745 4.559 -0.999 54 HB2 ARG 8 1HB ARG 8 10.289 4.496 -2.663 55 HB3 ARG 8 2HB ARG 8 9.548 3.029 -1.998 56 HG2 ARG 8 1HG ARG 8 7.421 3.559 -3.111 57 HG3 ARG 8 2HG ARG 8 8.178 4.940 -3.921 58 HD2 ARG 8 1HD ARG 8 9.449 2.181 -4.097 59 HD3 ARG 8 2HD ARG 8 8.025 2.548 -5.071 60 HE ARG 8 HE ARG 8 9.155 3.946 -6.399 61 HH11 ARG 8 1HH1 ARG 8 11.426 2.829 -3.831 62 HH12 ARG 8 2HH1 ARG 8 12.814 3.464 -4.613 63 HH21 ARG 8 1HH2 ARG 8 11.117 4.415 -7.573 64 HH22 ARG 8 2HH2 ARG 8 12.623 4.220 -6.785 65 H ALA 9 H ALA 9 10.963 5.783 -0.065 66 HA ALA 9 HA ALA 9 11.601 3.789 1.810 67 HB1 ALA 9 1HB ALA 9 12.940 5.484 2.955 68 HB2 ALA 9 2HB ALA 9 13.112 5.692 1.199 69 HB3 ALA 9 3HB ALA 9 12.071 6.788 2.134 70 H ALA 10 H ALA 10 9.158 6.361 2.054 71 HA ALA 10 HA ALA 10 8.680 5.988 4.876 72 HB1 ALA 10 1HB ALA 10 8.062 7.944 3.168 73 HB2 ALA 10 2HB ALA 10 6.557 7.019 2.998 74 HB3 ALA 10 3HB ALA 10 7.093 7.610 4.598 75 H PHE 11 H PHE 11 7.616 4.300 1.964 76 HA PHE 11 HA PHE 11 5.151 3.283 3.079 77 HB2 PHE 11 1HB PHE 11 6.759 2.453 0.628 78 HB3 PHE 11 2HB PHE 11 5.288 1.671 1.137 79 HD1 PHE 11 2HD PHE 11 5.832 5.441 1.116 80 HD2 PHE 11 1HD PHE 11 3.883 2.004 -0.649 81 HE1 PHE 11 2HE PHE 11 4.609 6.910 -0.378 82 HE2 PHE 11 1HE PHE 11 2.545 3.501 -2.038 83 HZ PHE 11 HZ PHE 11 3.003 5.986 -2.013 84 H GLU 12 H GLU 12 8.455 1.891 2.595 85 HA GLU 12 HA GLU 12 7.812 -0.656 3.787 86 HB2 GLU 12 1HB GLU 12 10.348 -0.805 4.012 87 HB3 GLU 12 2HB GLU 12 9.701 -0.654 2.378 88 HG2 GLU 12 1HG GLU 12 10.271 1.649 2.249 89 HG3 GLU 12 2HG GLU 12 10.692 1.724 3.972 90 H LYS 13 H LYS 13 8.518 2.530 5.091 91 HA LYS 13 HA LYS 13 9.168 1.611 7.755 92 HB2 LYS 13 1HB LYS 13 9.776 3.827 6.647 93 HB3 LYS 13 2HB LYS 13 8.151 4.371 7.077 94 HG2 LYS 13 1HG LYS 13 8.578 4.044 9.434 95 HG3 LYS 13 2HG LYS 13 10.014 3.079 9.115 96 HD2 LYS 13 1HD LYS 13 10.882 5.258 7.931 97 HD3 LYS 13 2HD LYS 13 9.653 6.071 8.912 98 HE2 LYS 13 1HE LYS 13 11.620 6.169 10.244 99 HE3 LYS 13 2HE LYS 13 10.712 4.802 10.920 100 HZ1 LYS 13 3HZ LYS 13 12.810 3.902 10.649 101 HZ2 LYS 13 1HZ LYS 13 13.166 4.777 9.314 102 HZ3 LYS 13 2HZ LYS 13 12.172 3.475 9.209 103 H ARG 14 H ARG 14 6.281 1.581 5.923 104 HA ARG 14 HA ARG 14 4.711 1.477 8.423 105 HB2 ARG 14 1HB ARG 14 4.109 3.414 6.960 106 HB3 ARG 14 2HB ARG 14 3.654 2.288 5.688 107 HG2 ARG 14 1HG ARG 14 1.652 2.955 6.837 108 HG3 ARG 14 2HG ARG 14 1.957 1.270 7.217 109 HD2 ARG 14 1HD ARG 14 1.206 2.422 9.202 110 HD3 ARG 14 2HD ARG 14 2.887 1.937 9.439 111 HE ARG 14 HE ARG 14 2.813 4.597 8.392 112 HH11 ARG 14 1HH1 ARG 14 2.335 2.874 11.469 113 HH12 ARG 14 2HH1 ARG 14 1.891 4.307 12.335 114 HH21 ARG 14 1HH2 ARG 14 2.784 6.437 9.603 115 HH22 ARG 14 2HH2 ARG 14 2.284 6.432 11.278 116 H LEU 15 H LEU 15 4.309 0.207 5.022 117 HA LEU 15 HA LEU 15 2.696 -1.909 5.911 118 HB2 LEU 15 1HB LEU 15 2.859 -1.110 3.534 119 HB3 LEU 15 2HB LEU 15 4.457 -1.843 3.413 120 HG LEU 15 HG LEU 15 3.482 -4.071 3.831 121 HD11 LEU 15 1HD1 LEU 15 1.473 -3.539 5.156 122 HD12 LEU 15 2HD1 LEU 15 1.004 -4.405 3.699 123 HD13 LEU 15 3HD1 LEU 15 0.778 -2.649 3.790 124 HD21 LEU 15 3HD2 LEU 15 3.712 -3.175 1.506 125 HD22 LEU 15 1HD2 LEU 15 2.030 -2.630 1.575 126 HD23 LEU 15 2HD2 LEU 15 2.406 -4.358 1.672 127 H SER 16 H SER 16 6.230 -1.890 5.216 128 HA SER 16 HA SER 16 6.463 -4.710 5.819 129 HB2 SER 16 1HB SER 16 7.957 -3.146 4.320 130 HB3 SER 16 2HB SER 16 8.768 -2.789 5.859 131 HG SER 16 HG SER 16 9.408 -4.846 6.011 132 H ASP 17 H ASP 17 6.781 -1.692 7.690 133 HA ASP 17 HA ASP 17 8.034 -2.787 10.028 134 HB2 ASP 17 1HB ASP 17 7.754 -0.328 9.475 135 HB3 ASP 17 2HB ASP 17 6.040 -0.465 9.860 136 H TRP 18 H TRP 18 4.728 -2.591 8.910 137 HA TRP 18 HA TRP 18 3.510 -3.673 11.343 138 HB2 TRP 18 1HB TRP 18 2.184 -2.233 10.062 139 HB3 TRP 18 2HB TRP 18 2.593 -2.953 8.540 140 HD1 TRP 18 HD TRP 18 0.294 -3.546 11.548 141 HE1 TRP 18 1HE TRP 18 -1.578 -5.057 10.939 142 HE3 TRP 18 3HE TRP 18 1.982 -4.965 6.930 143 HZ2 TRP 18 2HZ TRP 18 -2.107 -7.028 8.798 144 HZ3 TRP 18 3HZ TRP 18 0.933 -6.898 5.761 145 HH2 TRP 18 HH TRP 18 -1.189 -7.908 6.708 146 H ALA 19 H ALA 19 4.071 -4.938 8.017 147 HA ALA 19 HA ALA 19 2.902 -7.443 8.563 148 HB1 ALA 19 1HB ALA 19 5.020 -6.586 6.503 149 HB2 ALA 19 2HB ALA 19 4.239 -8.170 6.480 150 HB3 ALA 19 3HB ALA 19 3.267 -6.719 6.248 151 H LYS 20 H LYS 20 6.323 -6.410 9.075 152 HA LYS 20 HA LYS 20 7.164 -9.071 9.720 153 HB2 LYS 20 1HB LYS 20 9.186 -7.966 10.611 154 HB3 LYS 20 2HB LYS 20 8.729 -7.291 9.060 155 HG2 LYS 20 1HG LYS 20 9.148 -5.312 10.114 156 HG3 LYS 20 2HG LYS 20 7.477 -5.491 10.563 157 HD2 LYS 20 1HD LYS 20 8.425 -4.770 12.498 158 HD3 LYS 20 2HD LYS 20 8.395 -6.496 12.803 159 HE2 LYS 20 1HE LYS 20 10.799 -4.968 11.722 160 HE3 LYS 20 2HE LYS 20 10.510 -5.294 13.433 161 HZ1 LYS 20 3HZ LYS 20 10.472 -7.682 12.864 162 HZ2 LYS 20 1HZ LYS 20 11.928 -6.936 12.655 163 HZ3 LYS 20 2HZ LYS 20 11.016 -7.285 11.332 164 H ALA 21 H ALA 21 5.760 -6.447 11.665 165 HA ALA 21 HA ALA 21 6.317 -7.665 14.242 166 HB1 ALA 21 1HB ALA 21 4.436 -5.411 13.356 167 HB2 ALA 21 2HB ALA 21 4.854 -5.813 15.039 168 HB3 ALA 21 3HB ALA 21 6.107 -5.217 13.932 169 H ARG 22 H ARG 22 3.983 -8.112 11.759 170 HA ARG 22 HA ARG 22 1.692 -8.851 13.121 171 HB2 ARG 22 1HB ARG 22 2.409 -8.598 10.521 172 HB3 ARG 22 2HB ARG 22 2.658 -10.354 10.730 173 HG2 ARG 22 1HG ARG 22 0.222 -10.373 11.588 174 HG3 ARG 22 2HG ARG 22 0.103 -8.774 10.854 175 HD2 ARG 22 1HD ARG 22 1.265 -11.122 9.235 176 HD3 ARG 22 2HD ARG 22 -0.409 -10.967 9.510 177 HE ARG 22 HE ARG 22 -0.613 -9.165 8.244 178 HH11 ARG 22 1HH1 ARG 22 2.847 -9.572 8.581 179 HH12 ARG 22 2HH1 ARG 22 3.239 -9.591 6.905 180 HH21 ARG 22 1HH2 ARG 22 -0.160 -9.231 5.896 181 HH22 ARG 22 2HH2 ARG 22 1.462 -9.259 5.309 182 H THR 23 H THR 23 0.829 -10.871 13.339 183 HA THR 23 HA THR 23 2.162 -12.790 14.835 184 HB THR 23 HB THR 23 -0.507 -12.708 13.380 185 HG1 THR 23 1HG THR 23 0.320 -11.991 15.965 186 HG21 THR 23 3HG2 THR 23 0.330 -14.481 15.669 187 HG22 THR 23 1HG2 THR 23 0.168 -15.000 13.970 188 HG23 THR 23 2HG2 THR 23 -1.265 -14.417 14.850 189 HA PRO 24 HA PRO 24 2.517 -15.980 11.397 190 HB2 PRO 24 1HB PRO 24 1.533 -15.633 8.866 191 HB3 PRO 24 2HB PRO 24 0.579 -16.321 10.235 192 HG2 PRO 24 1HG PRO 24 0.653 -13.458 9.245 193 HG3 PRO 24 2HG PRO 24 -0.796 -14.466 9.557 194 HD2 PRO 24 1HD PRO 24 0.112 -12.693 11.362 195 HD3 PRO 24 2HD PRO 24 -0.460 -14.313 11.877 196 H ALA 25 H ALA 25 2.863 -12.801 10.815 197 HA ALA 25 HA ALA 25 4.403 -11.373 9.762 198 HB1 ALA 25 1HB ALA 25 5.730 -12.306 11.527 199 HB2 ALA 25 2HB ALA 25 6.274 -13.613 10.449 200 HB3 ALA 25 3HB ALA 25 6.702 -11.916 10.085 201 H LEU 26 H LEU 26 3.680 -11.261 7.789 202 HA LEU 26 HA LEU 26 4.277 -13.267 5.682 203 HB2 LEU 26 1HB LEU 26 2.633 -10.663 5.345 204 HB3 LEU 26 2HB LEU 26 2.957 -11.838 4.143 205 HG LEU 26 HG LEU 26 0.769 -12.183 4.829 206 HD11 LEU 26 1HD1 LEU 26 2.424 -14.480 5.964 207 HD12 LEU 26 2HD1 LEU 26 2.167 -14.206 4.223 208 HD13 LEU 26 3HD1 LEU 26 0.805 -14.597 5.287 209 HD21 LEU 26 3HD2 LEU 26 0.114 -11.535 6.780 210 HD22 LEU 26 1HD2 LEU 26 1.590 -12.220 7.582 211 HD23 LEU 26 2HD2 LEU 26 0.236 -13.250 7.070 212 HA PRO 27 HA PRO 27 7.352 -10.508 3.795 213 HB2 PRO 27 1HB PRO 27 7.362 -11.473 1.240 214 HB3 PRO 27 2HB PRO 27 8.104 -12.352 2.609 215 HG2 PRO 27 1HG PRO 27 5.349 -12.768 1.404 216 HG3 PRO 27 2HG PRO 27 6.593 -14.013 1.762 217 HD2 PRO 27 1HD PRO 27 4.551 -13.475 3.487 218 HD3 PRO 27 2HD PRO 27 6.187 -13.899 4.076 219 H VAL 28 H VAL 28 7.342 -9.037 1.830 220 HA VAL 28 HA VAL 28 4.706 -8.102 0.911 221 HB VAL 28 HB VAL 28 7.085 -6.453 1.911 222 HG11 VAL 28 1HG1 VAL 28 4.486 -5.491 0.645 223 HG12 VAL 28 2HG1 VAL 28 5.653 -4.464 1.509 224 HG13 VAL 28 3HG1 VAL 28 6.141 -5.254 0.025 225 HG21 VAL 28 3HG2 VAL 28 5.703 -7.294 3.776 226 HG22 VAL 28 1HG2 VAL 28 5.472 -5.562 3.582 227 HG23 VAL 28 2HG2 VAL 28 4.234 -6.688 2.985 228 H ALA 29 H ALA 29 5.185 -6.813 -1.275 229 HA ALA 29 HA ALA 29 7.750 -7.312 -2.400 230 HB1 ALA 29 1HB ALA 29 6.694 -9.375 -3.211 231 HB2 ALA 29 2HB ALA 29 5.288 -8.462 -3.799 232 HB3 ALA 29 3HB ALA 29 6.868 -8.238 -4.562 233 H TRP 30 H TRP 30 8.157 -5.779 -4.108 234 HA TRP 30 HA TRP 30 6.111 -3.624 -4.442 235 HB2 TRP 30 1HB TRP 30 9.096 -3.285 -4.061 236 HB3 TRP 30 2HB TRP 30 7.907 -2.024 -4.184 237 HD1 TRP 30 HD TRP 30 9.810 -3.908 -1.680 238 HE1 TRP 30 1HE TRP 30 9.091 -3.249 0.668 239 HE3 TRP 30 3HE TRP 30 5.451 -1.568 -2.845 240 HZ2 TRP 30 2HZ TRP 30 6.982 -1.650 1.886 241 HZ3 TRP 30 3HZ TRP 30 4.046 -0.524 -1.078 242 HH2 TRP 30 HH TRP 30 4.802 -0.563 1.297 243 H GLN 31 H GLN 31 6.824 -2.080 -6.323 244 HA GLN 31 HA GLN 31 7.227 -3.219 -8.807 245 HB2 GLN 31 1HB GLN 31 7.944 -0.540 -7.622 246 HB3 GLN 31 2HB GLN 31 8.111 -0.886 -9.357 247 HG2 GLN 31 1HG GLN 31 5.754 -1.086 -9.637 248 HG3 GLN 31 2HG GLN 31 5.462 -1.181 -7.911 249 HE21 GLN 31 1HE2 GLN 31 5.692 0.965 -10.570 250 HE22 GLN 31 2HE2 GLN 31 5.713 2.467 -9.643 251 H ASN 32 H ASN 32 8.984 -3.907 -9.922 252 HA ASN 32 HA ASN 32 11.029 -4.578 -10.478 253 HB2 ASN 32 1HB ASN 32 11.693 -1.700 -9.848 254 HB3 ASN 32 2HB ASN 32 12.752 -2.801 -10.717 255 HD21 ASN 32 1HD2 ASN 32 9.970 -0.746 -11.072 256 HD22 ASN 32 2HD2 ASN 32 9.683 -1.079 -12.754 257 H THR 33 H THR 33 10.361 -5.018 -7.628 258 HA THR 33 HA THR 33 13.095 -5.265 -6.497 259 HB THR 33 HB THR 33 10.510 -5.345 -4.946 260 HG1 THR 33 1HG THR 33 12.034 -3.129 -5.775 261 HG21 THR 33 3HG2 THR 33 11.912 -4.796 -3.030 262 HG22 THR 33 1HG2 THR 33 13.342 -4.640 -4.066 263 HG23 THR 33 2HG2 THR 33 12.583 -6.227 -3.826 264 H LYS 34 H LYS 34 13.783 -7.228 -6.028 265 HA LYS 34 HA LYS 34 12.637 -9.520 -7.121 266 HB2 LYS 34 1HB LYS 34 14.259 -10.815 -5.650 267 HB3 LYS 34 2HB LYS 34 14.874 -9.715 -6.872 268 HG2 LYS 34 1HG LYS 34 16.113 -8.716 -5.348 269 HG3 LYS 34 2HG LYS 34 14.641 -8.091 -4.637 270 HD2 LYS 34 1HD LYS 34 15.881 -10.740 -3.807 271 HD3 LYS 34 2HD LYS 34 16.258 -9.178 -3.056 272 HE2 LYS 34 1HE LYS 34 13.769 -8.863 -2.652 273 HE3 LYS 34 2HE LYS 34 13.550 -10.554 -3.131 274 HZ1 LYS 34 3HZ LYS 34 13.722 -10.320 -0.784 275 HZ2 LYS 34 1HZ LYS 34 15.217 -9.615 -0.883 276 HZ3 LYS 34 2HZ LYS 34 15.004 -11.194 -1.340 277 H PHE 35 H PHE 35 11.453 -11.301 -6.232 278 HA PHE 35 HA PHE 35 10.414 -11.105 -3.528 279 HB2 PHE 35 1HB PHE 35 8.073 -11.249 -4.365 280 HB3 PHE 35 2HB PHE 35 8.841 -9.703 -4.614 281 HD1 PHE 35 2HD PHE 35 8.487 -12.944 -6.605 282 HD2 PHE 35 1HD PHE 35 8.215 -8.635 -6.597 283 HE1 PHE 35 2HE PHE 35 7.859 -12.990 -8.970 284 HE2 PHE 35 1HE PHE 35 7.468 -8.707 -8.956 285 HZ PHE 35 HZ PHE 35 7.302 -10.881 -10.154 286 H THR 36 H THR 36 8.717 -13.094 -3.399 287 HA THR 36 HA THR 36 8.441 -15.232 -3.316 288 HB THR 36 HB THR 36 8.986 -14.876 -6.039 289 HG1 THR 36 1HG THR 36 7.156 -15.778 -5.366 290 HG21 THR 36 3HG2 THR 36 10.321 -17.477 -5.273 291 HG22 THR 36 1HG2 THR 36 11.175 -16.015 -5.814 292 HG23 THR 36 2HG2 THR 36 10.018 -16.807 -6.884 293 HA PRO 37 HA PRO 37 8.898 -17.730 -3.525 294 HB2 PRO 37 1HB PRO 37 9.176 -19.640 -1.665 295 HB3 PRO 37 2HB PRO 37 10.264 -19.528 -3.076 296 HG2 PRO 37 1HG PRO 37 10.767 -18.572 -0.255 297 HG3 PRO 37 2HG PRO 37 11.876 -19.465 -1.352 298 HD2 PRO 37 1HD PRO 37 11.899 -16.707 -0.994 299 HD3 PRO 37 2HD PRO 37 12.475 -17.526 -2.468 300 HA PRO 38 HA PRO 38 6.069 -16.009 -0.544 301 HB2 PRO 38 1HB PRO 38 3.942 -17.714 -0.611 302 HB3 PRO 38 2HB PRO 38 4.403 -16.656 -1.994 303 HG2 PRO 38 1HG PRO 38 5.026 -19.586 -1.608 304 HG3 PRO 38 2HG PRO 38 4.394 -18.755 -3.061 305 HD2 PRO 38 1HD PRO 38 7.058 -19.323 -2.715 306 HD3 PRO 38 2HD PRO 38 6.499 -17.874 -3.594 307 H ALA 39 H ALA 39 4.467 -16.880 1.309 308 HA ALA 39 HA ALA 39 5.920 -18.633 3.130 309 HB1 ALA 39 1HB ALA 39 5.308 -16.432 4.094 310 HB2 ALA 39 2HB ALA 39 3.609 -16.697 3.641 311 HB3 ALA 39 3HB ALA 39 4.381 -17.742 4.848 312 H ALA 40 H ALA 40 5.417 -20.240 1.629 313 HA ALA 40 HA ALA 40 4.433 -22.218 1.105 314 HB1 ALA 40 1HB ALA 40 2.272 -21.635 3.164 315 HB2 ALA 40 2HB ALA 40 2.831 -23.211 2.590 316 HB3 ALA 40 3HB ALA 40 3.890 -22.199 3.604 317 H GLY 41 H GLY 41 3.379 -19.591 0.039 318 HA2 GLY 41 2HA GLY 41 2.113 -19.467 -2.053 319 HA3 GLY 41 1HA GLY 41 0.928 -20.604 -1.388 320 H VAL 42 H VAL 42 1.662 -18.661 1.157 321 HA VAL 42 HA VAL 42 -0.397 -16.630 0.552 322 HB VAL 42 HB VAL 42 1.029 -17.212 3.197 323 HG11 VAL 42 1HG1 VAL 42 -0.802 -15.907 4.186 324 HG12 VAL 42 2HG1 VAL 42 0.084 -14.919 3.016 325 HG13 VAL 42 3HG1 VAL 42 -1.488 -15.604 2.583 326 HG21 VAL 42 3HG2 VAL 42 -1.164 -18.255 3.856 327 HG22 VAL 42 1HG2 VAL 42 -1.699 -18.086 2.190 328 HG23 VAL 42 2HG2 VAL 42 -0.344 -19.173 2.594 329 H TYR 43 H TYR 43 0.283 -14.595 -0.062 330 HA TYR 43 HA TYR 43 2.695 -13.427 0.955 331 HB2 TYR 43 1HB TYR 43 3.817 -13.059 -1.221 332 HB3 TYR 43 2HB TYR 43 3.828 -14.726 -0.736 333 HD1 TYR 43 2HD TYR 43 2.020 -16.322 -1.818 334 HD2 TYR 43 1HD TYR 43 3.030 -12.431 -3.385 335 HE1 TYR 43 2HE TYR 43 1.184 -17.019 -4.017 336 HE2 TYR 43 1HE TYR 43 2.130 -13.135 -5.603 337 HH TYR 43 HH TYR 43 0.689 -16.327 -6.198 338 H LEU 44 H LEU 44 3.007 -11.218 0.066 339 HA LEU 44 HA LEU 44 0.426 -9.960 -0.768 340 HB2 LEU 44 1HB LEU 44 2.538 -9.216 1.215 341 HB3 LEU 44 2HB LEU 44 1.991 -7.915 0.185 342 HG LEU 44 HG LEU 44 -0.236 -8.016 0.960 343 HD11 LEU 44 1HD1 LEU 44 0.481 -10.596 2.420 344 HD12 LEU 44 2HD1 LEU 44 -0.695 -10.375 1.102 345 HD13 LEU 44 3HD1 LEU 44 -1.012 -9.652 2.671 346 HD21 LEU 44 3HD2 LEU 44 1.678 -8.437 3.300 347 HD22 LEU 44 1HD2 LEU 44 0.088 -7.613 3.377 348 HD23 LEU 44 2HD2 LEU 44 1.404 -6.906 2.437 349 H ARG 45 H ARG 45 0.510 -8.513 -2.427 350 HA ARG 45 HA ARG 45 3.123 -7.892 -3.695 351 HB2 ARG 45 1HB ARG 45 1.044 -9.553 -4.800 352 HB3 ARG 45 2HB ARG 45 0.839 -8.019 -5.565 353 HG2 ARG 45 1HG ARG 45 2.669 -8.218 -6.856 354 HG3 ARG 45 2HG ARG 45 3.686 -8.768 -5.536 355 HD2 ARG 45 1HD ARG 45 3.716 -10.472 -7.096 356 HD3 ARG 45 2HD ARG 45 2.633 -11.043 -5.815 357 HE ARG 45 HE ARG 45 1.049 -9.779 -7.813 358 HH11 ARG 45 1HH1 ARG 45 3.290 -12.574 -7.597 359 HH12 ARG 45 2HH1 ARG 45 2.355 -13.589 -8.593 360 HH21 ARG 45 1HH2 ARG 45 0.030 -11.088 -9.579 361 HH22 ARG 45 2HH2 ARG 45 0.655 -12.668 -9.856 362 H ALA 46 H ALA 46 3.324 -5.644 -3.406 363 HA ALA 46 HA ALA 46 0.812 -4.095 -3.043 364 HB1 ALA 46 1HB ALA 46 2.009 -4.391 -0.915 365 HB2 ALA 46 2HB ALA 46 3.515 -3.795 -1.652 366 HB3 ALA 46 3HB ALA 46 2.128 -2.709 -1.463 367 H TYR 47 H TYR 47 0.638 -3.398 -5.187 368 HA TYR 47 HA TYR 47 3.019 -2.293 -6.528 369 HB2 TYR 47 1HB TYR 47 1.511 -3.855 -7.681 370 HB3 TYR 47 2HB TYR 47 0.196 -2.698 -7.516 371 HD1 TYR 47 2HD TYR 47 3.203 -0.841 -8.352 372 HD2 TYR 47 1HD TYR 47 0.271 -3.557 -10.023 373 HE1 TYR 47 2HE TYR 47 3.573 0.114 -10.549 374 HE2 TYR 47 1HE TYR 47 0.739 -2.657 -12.269 375 HH TYR 47 HH TYR 47 1.964 -1.078 -13.520 376 H VAL 48 H VAL 48 3.492 -0.248 -6.213 377 HA VAL 48 HA VAL 48 1.547 1.724 -5.271 378 HB VAL 48 HB VAL 48 4.549 1.760 -5.786 379 HG11 VAL 48 1HG1 VAL 48 2.828 3.974 -4.619 380 HG12 VAL 48 2HG1 VAL 48 4.603 3.945 -4.654 381 HG13 VAL 48 3HG1 VAL 48 3.700 4.027 -6.171 382 HG21 VAL 48 3HG2 VAL 48 2.868 1.695 -3.246 383 HG22 VAL 48 1HG2 VAL 48 3.958 0.440 -3.828 384 HG23 VAL 48 2HG2 VAL 48 4.633 1.969 -3.284 385 H MET 49 H MET 49 0.348 2.855 -6.699 386 HA MET 49 HA MET 49 1.141 2.950 -9.529 387 HB2 MET 49 1HB MET 49 -1.273 2.117 -8.223 388 HB3 MET 49 2HB MET 49 -1.611 3.485 -9.287 389 HG2 MET 49 1HG MET 49 -0.979 2.371 -11.193 390 HG3 MET 49 2HG MET 49 0.140 1.295 -10.357 391 HE1 MET 49 3HE MET 49 -1.774 -1.571 -9.022 392 HE2 MET 49 1HE MET 49 -0.262 -0.632 -9.178 393 HE3 MET 49 2HE MET 49 -1.498 -0.114 -8.035 394 HA PRO 50 HA PRO 50 1.535 7.346 -8.176 395 HB2 PRO 50 1HB PRO 50 3.044 8.123 -10.331 396 HB3 PRO 50 2HB PRO 50 3.707 7.411 -8.827 397 HG2 PRO 50 1HG PRO 50 3.099 6.036 -11.442 398 HG3 PRO 50 2HG PRO 50 4.565 5.900 -10.414 399 HD2 PRO 50 1HD PRO 50 2.595 4.059 -10.346 400 HD3 PRO 50 2HD PRO 50 3.473 4.516 -8.859 401 H ALA 51 H ALA 51 0.670 9.210 -9.162 402 HA ALA 51 HA ALA 51 -1.624 9.000 -10.856 403 HB1 ALA 51 1HB ALA 51 -1.762 11.327 -10.522 404 HB2 ALA 51 2HB ALA 51 -0.795 10.853 -9.116 405 HB3 ALA 51 3HB ALA 51 -0.008 11.555 -10.520 406 H ALA 52 H ALA 52 -1.549 8.696 -13.077 407 HA ALA 52 HA ALA 52 0.641 9.907 -14.619 408 HB1 ALA 52 1HB ALA 52 -0.003 6.939 -14.774 409 HB2 ALA 52 2HB ALA 52 1.090 7.849 -15.855 410 HB3 ALA 52 3HB ALA 52 1.499 7.656 -14.137 411 H THR 53 H THR 53 -1.386 11.225 -14.765 412 HA THR 53 HA THR 53 -3.382 10.438 -16.718 413 HB THR 53 HB THR 53 -3.621 12.234 -14.950 414 HG1 THR 53 1HG THR 53 -5.070 12.209 -16.647 415 HG21 THR 53 3HG2 THR 53 -1.325 13.308 -15.394 416 HG22 THR 53 1HG2 THR 53 -2.692 14.409 -15.219 417 HG23 THR 53 2HG2 THR 53 -2.062 14.028 -16.827 418 H ILE 54 H ILE 54 -3.242 12.553 -18.419 419 HA ILE 54 HA ILE 54 -1.859 11.768 -20.669 420 HB ILE 54 HB ILE 54 -2.674 14.518 -19.718 421 HG12 ILE 54 1HG1 ILE 54 -4.152 12.679 -21.662 422 HG13 ILE 54 2HG1 ILE 54 -4.450 12.637 -19.931 423 HG21 ILE 54 1HG2 ILE 54 -1.807 13.640 -22.486 424 HG22 ILE 54 2HG2 ILE 54 -2.703 15.140 -22.152 425 HG23 ILE 54 3HG2 ILE 54 -1.106 14.923 -21.471 426 HD11 ILE 54 3HD1 ILE 54 -6.113 13.995 -20.866 427 HD12 ILE 54 1HD1 ILE 54 -5.027 15.029 -19.927 428 HD13 ILE 54 2HD1 ILE 54 -4.925 15.022 -21.710 429 H SER 55 H SER 55 -0.060 12.146 -21.511 430 HA SER 55 HA SER 55 2.096 13.834 -20.376 431 HB2 SER 55 1HB SER 55 1.917 10.892 -20.616 432 HB3 SER 55 2HB SER 55 3.350 11.543 -21.371 433 HG SER 55 HG SER 55 2.778 11.309 -18.708 434 H ARG 56 H ARG 56 0.168 13.801 -22.716 435 HA ARG 56 HA ARG 56 2.084 13.982 -24.982 436 HB2 ARG 56 1HB ARG 56 -0.935 14.438 -24.776 437 HB3 ARG 56 2HB ARG 56 -0.060 14.838 -26.239 438 HG2 ARG 56 1HG ARG 56 -0.201 12.037 -25.065 439 HG3 ARG 56 2HG ARG 56 -1.216 12.688 -26.358 440 HD2 ARG 56 1HD ARG 56 0.289 11.849 -27.761 441 HD3 ARG 56 2HD ARG 56 1.252 13.280 -27.378 442 HE ARG 56 HE ARG 56 1.946 11.450 -25.426 443 HH11 ARG 56 1HH1 ARG 56 2.145 11.528 -28.944 444 HH12 ARG 56 2HH1 ARG 56 3.219 10.174 -29.092 445 HH21 ARG 56 1HH2 ARG 56 3.470 9.818 -25.536 446 HH22 ARG 56 2HH2 ARG 56 3.911 9.044 -27.025 447 H ASP 57 H ASP 57 1.516 15.794 -22.519 448 HA ASP 57 HA ASP 57 2.753 18.148 -23.594 449 HB2 ASP 57 1HB ASP 57 0.715 19.120 -22.072 450 HB3 ASP 57 2HB ASP 57 0.835 19.345 -23.819 451 H ALA 58 H ALA 58 3.912 18.984 -21.935 452 HA ALA 58 HA ALA 58 4.945 19.292 -20.009 453 HB1 ALA 58 1HB ALA 58 3.145 20.917 -20.161 454 HB2 ALA 58 2HB ALA 58 2.062 19.850 -19.245 455 HB3 ALA 58 3HB ALA 58 3.489 20.549 -18.468 456 H ALA 59 H ALA 59 3.901 16.451 -20.092 457 HA ALA 59 HA ALA 59 4.416 14.546 -18.988 458 HB1 ALA 59 1HB ALA 59 5.750 14.382 -17.168 459 HB2 ALA 59 2HB ALA 59 6.205 16.023 -17.639 460 HB3 ALA 59 3HB ALA 59 5.041 15.766 -16.323 461 H GLY 60 H GLY 60 3.676 13.356 -16.830 462 HA2 GLY 60 2HA GLY 60 0.788 14.000 -16.465 463 HA3 GLY 60 1HA GLY 60 1.501 12.387 -16.445 464 H ASP 61 H ASP 61 3.040 15.200 -14.901 465 HA ASP 61 HA ASP 61 2.254 14.699 -12.240 466 HB2 ASP 61 1HB ASP 61 3.982 13.490 -11.521 467 HB3 ASP 61 2HB ASP 61 4.406 13.134 -13.163 468 H HIS 62 H HIS 62 2.877 16.555 -11.105 469 HA HIS 62 HA HIS 62 4.641 18.519 -12.254 470 HB2 HIS 62 1HB HIS 62 2.596 19.157 -13.488 471 HB3 HIS 62 2HB HIS 62 1.685 19.210 -11.979 472 HD1 HIS 62 1HD HIS 62 4.631 21.168 -13.587 473 HD2 HIS 62 2HD HIS 62 1.429 21.534 -10.893 474 HE1 HIS 62 1HE HIS 62 4.509 23.636 -12.967 475 H ARG 63 H ARG 63 2.289 17.953 -9.867 476 HA ARG 63 HA ARG 63 3.913 18.584 -7.627 477 HB2 ARG 63 1HB ARG 63 2.810 20.836 -8.970 478 HB3 ARG 63 2HB ARG 63 1.764 20.654 -7.603 479 HG2 ARG 63 1HG ARG 63 3.375 21.838 -6.493 480 HG3 ARG 63 2HG ARG 63 4.039 20.211 -6.330 481 HD2 ARG 63 1HD ARG 63 5.718 20.549 -7.883 482 HD3 ARG 63 2HD ARG 63 4.854 21.848 -8.725 483 HE ARG 63 HE ARG 63 5.223 23.173 -6.572 484 HH11 ARG 63 1HH1 ARG 63 7.683 21.102 -8.162 485 HH12 ARG 63 2HH1 ARG 63 8.994 21.943 -7.409 486 HH21 ARG 63 1HH2 ARG 63 6.948 24.293 -5.766 487 HH22 ARG 63 2HH2 ARG 63 8.586 23.758 -5.933 488 H GLN 64 H GLN 64 1.646 16.825 -8.538 489 HA GLN 64 HA GLN 64 0.765 16.265 -5.812 490 HB2 GLN 64 1HB GLN 64 -1.227 16.909 -8.029 491 HB3 GLN 64 2HB GLN 64 -1.596 15.757 -6.755 492 HG2 GLN 64 1HG GLN 64 -0.986 17.613 -5.077 493 HG3 GLN 64 2HG GLN 64 -1.036 18.701 -6.464 494 HE21 GLN 64 1HE2 GLN 64 -2.886 17.528 -3.924 495 HE22 GLN 64 2HE2 GLN 64 -4.462 17.876 -4.567 496 H TYR 65 H TYR 65 0.643 14.122 -5.504 497 HA TYR 65 HA TYR 65 0.776 12.182 -7.767 498 HB2 TYR 65 1HB TYR 65 2.024 12.141 -5.013 499 HB3 TYR 65 2HB TYR 65 1.858 10.714 -5.873 500 HD1 TYR 65 2HD TYR 65 2.596 13.102 -8.405 501 HD2 TYR 65 1HD TYR 65 4.438 10.967 -5.127 502 HE1 TYR 65 2HE TYR 65 4.813 13.554 -9.348 503 HE2 TYR 65 1HE TYR 65 6.656 11.333 -6.147 504 HH TYR 65 HH TYR 65 7.581 11.937 -8.675 505 H ARG 66 H ARG 66 -1.381 12.068 -7.932 506 HA ARG 66 HA ARG 66 -2.977 11.039 -5.599 507 HB2 ARG 66 1HB ARG 66 -3.909 12.497 -8.065 508 HB3 ARG 66 2HB ARG 66 -4.989 11.825 -6.851 509 HG2 ARG 66 1HG ARG 66 -4.456 13.437 -5.236 510 HG3 ARG 66 2HG ARG 66 -2.884 13.795 -5.942 511 HD2 ARG 66 1HD ARG 66 -4.238 15.668 -6.333 512 HD3 ARG 66 2HD ARG 66 -3.992 14.873 -7.896 513 HE ARG 66 HE ARG 66 -6.337 13.821 -7.262 514 HH11 ARG 66 1HH1 ARG 66 -5.270 17.239 -7.226 515 HH12 ARG 66 2HH1 ARG 66 -6.864 17.831 -7.521 516 HH21 ARG 66 1HH2 ARG 66 -8.357 14.624 -7.542 517 HH22 ARG 66 2HH2 ARG 66 -8.722 16.324 -7.602 518 H GLY 67 H GLY 67 -2.863 8.956 -5.810 519 HA2 GLY 67 2HA GLY 67 -2.995 7.592 -8.487 520 HA3 GLY 67 1HA GLY 67 -1.678 7.293 -7.373 521 H VAL 68 H VAL 68 -2.404 4.976 -7.372 522 HA VAL 68 HA VAL 68 -4.296 4.622 -5.142 523 HB VAL 68 HB VAL 68 -5.551 4.134 -7.219 524 HG11 VAL 68 1HG1 VAL 68 -3.524 1.907 -7.669 525 HG12 VAL 68 2HG1 VAL 68 -5.047 2.122 -8.550 526 HG13 VAL 68 3HG1 VAL 68 -3.785 3.337 -8.686 527 HG21 VAL 68 3HG2 VAL 68 -5.056 1.679 -5.495 528 HG22 VAL 68 1HG2 VAL 68 -6.246 2.979 -5.216 529 HG23 VAL 68 2HG2 VAL 68 -6.399 1.915 -6.605 530 H PHE 69 H PHE 69 -3.767 2.691 -3.861 531 HA PHE 69 HA PHE 69 -1.193 1.370 -4.619 532 HB2 PHE 69 1HB PHE 69 -2.234 1.615 -1.794 533 HB3 PHE 69 2HB PHE 69 -0.754 0.818 -2.315 534 HD1 PHE 69 1HD PHE 69 0.197 2.967 -4.210 535 HD2 PHE 69 2HD PHE 69 -1.399 3.105 -0.257 536 HE1 PHE 69 1HE PHE 69 1.196 5.266 -3.879 537 HE2 PHE 69 2HE PHE 69 -0.458 5.410 0.090 538 HZ PHE 69 HZ PHE 69 0.783 6.494 -1.748 539 H GLN 70 H GLN 70 -1.428 -0.589 -5.088 540 HA GLN 70 HA GLN 70 -4.107 -1.939 -4.665 541 HB2 GLN 70 1HB GLN 70 -2.203 -1.906 -6.977 542 HB3 GLN 70 2HB GLN 70 -3.442 -3.097 -6.908 543 HG2 GLN 70 1HG GLN 70 -4.070 -0.120 -6.788 544 HG3 GLN 70 2HG GLN 70 -3.937 -0.988 -8.302 545 HE21 GLN 70 1HE2 GLN 70 -5.360 -3.485 -7.075 546 HE22 GLN 70 2HE2 GLN 70 -7.025 -2.974 -7.175 547 H VAL 71 H VAL 71 -3.790 -3.326 -2.990 548 HA VAL 71 HA VAL 71 -1.436 -5.097 -3.128 549 HB VAL 71 HB VAL 71 -3.148 -4.546 -0.686 550 HG11 VAL 71 1HG1 VAL 71 -0.482 -5.988 -1.114 551 HG12 VAL 71 2HG1 VAL 71 -1.038 -5.456 0.475 552 HG13 VAL 71 3HG1 VAL 71 -1.975 -6.646 -0.401 553 HG21 VAL 71 3HG2 VAL 71 -0.433 -3.324 -1.373 554 HG22 VAL 71 1HG2 VAL 71 -1.970 -2.453 -1.305 555 HG23 VAL 71 2HG2 VAL 71 -1.308 -3.147 0.161 556 H ASN 72 H ASN 72 -1.919 -7.406 -2.605 557 HA ASN 72 HA ASN 72 -4.704 -8.158 -2.445 558 HB2 ASN 72 1HB ASN 72 -3.080 -8.749 -4.821 559 HB3 ASN 72 2HB ASN 72 -3.460 -10.224 -3.950 560 HD21 ASN 72 1HD2 ASN 72 -4.817 -7.669 -5.962 561 HD22 ASN 72 2HD2 ASN 72 -6.482 -8.144 -5.728 562 H VAL 73 H VAL 73 -4.866 -10.231 -1.419 563 HA VAL 73 HA VAL 73 -2.513 -11.068 0.201 564 HB VAL 73 HB VAL 73 -5.400 -10.825 1.144 565 HG11 VAL 73 1HG1 VAL 73 -2.926 -11.405 2.805 566 HG12 VAL 73 2HG1 VAL 73 -4.631 -11.390 3.330 567 HG13 VAL 73 3HG1 VAL 73 -4.059 -12.644 2.236 568 HG21 VAL 73 3HG2 VAL 73 -3.065 -9.011 1.825 569 HG22 VAL 73 1HG2 VAL 73 -4.545 -8.574 0.943 570 HG23 VAL 73 2HG2 VAL 73 -4.650 -9.051 2.638 571 H VAL 74 H VAL 74 -2.277 -12.571 -1.606 572 HA VAL 74 HA VAL 74 -4.482 -14.394 -2.246 573 HB VAL 74 HB VAL 74 -3.016 -14.009 -4.007 574 HG11 VAL 74 1HG1 VAL 74 -0.642 -14.383 -4.031 575 HG12 VAL 74 2HG1 VAL 74 -1.042 -13.111 -2.901 576 HG13 VAL 74 3HG1 VAL 74 -0.634 -14.744 -2.291 577 HG21 VAL 74 3HG2 VAL 74 -3.738 -16.328 -3.815 578 HG22 VAL 74 1HG2 VAL 74 -2.130 -16.237 -4.550 579 HG23 VAL 74 2HG2 VAL 74 -2.284 -16.737 -2.866 580 H MET 75 H MET 75 -5.032 -16.204 -1.127 581 HA MET 75 HA MET 75 -3.069 -17.518 0.499 582 HB2 MET 75 1HB MET 75 -4.845 -17.630 2.461 583 HB3 MET 75 2HB MET 75 -3.601 -16.421 2.353 584 HG2 MET 75 1HG MET 75 -5.302 -15.195 3.057 585 HG3 MET 75 2HG MET 75 -5.290 -14.827 1.366 586 HE1 MET 75 3HE MET 75 -8.827 -15.115 0.427 587 HE2 MET 75 1HE MET 75 -7.345 -14.147 0.466 588 HE3 MET 75 2HE MET 75 -7.338 -15.737 -0.336 589 HA PRO 76 HA PRO 76 -4.981 -20.837 -1.414 590 HB2 PRO 76 1HB PRO 76 -4.184 -22.991 0.040 591 HB3 PRO 76 2HB PRO 76 -3.000 -21.907 -0.753 592 HG2 PRO 76 1HG PRO 76 -3.959 -21.794 2.134 593 HG3 PRO 76 2HG PRO 76 -2.269 -21.845 1.545 594 HD2 PRO 76 1HD PRO 76 -3.458 -19.504 2.134 595 HD3 PRO 76 2HD PRO 76 -2.377 -19.641 0.706 596 H ILE 77 H ILE 77 -6.639 -22.537 -1.341 597 HA ILE 77 HA ILE 77 -8.648 -22.060 0.755 598 HB ILE 77 HB ILE 77 -8.916 -23.736 -1.748 599 HG12 ILE 77 1HG1 ILE 77 -9.956 -20.977 -1.046 600 HG13 ILE 77 2HG1 ILE 77 -8.573 -21.215 -2.095 601 HG21 ILE 77 1HG2 ILE 77 -11.346 -23.595 -1.111 602 HG22 ILE 77 2HG2 ILE 77 -10.408 -24.383 0.153 603 HG23 ILE 77 3HG2 ILE 77 -10.897 -22.697 0.367 604 HD11 ILE 77 3HD1 ILE 77 -10.037 -22.383 -3.737 605 HD12 ILE 77 1HD1 ILE 77 -11.437 -21.971 -2.711 606 HD13 ILE 77 2HD1 ILE 77 -10.468 -20.680 -3.428 607 H GLY 78 H GLY 78 -7.717 -22.991 2.545 608 HA2 GLY 78 2HA GLY 78 -8.617 -25.308 3.437 609 HA3 GLY 78 1HA GLY 78 -7.132 -25.870 2.629 610 H ASP 79 H ASP 79 -5.158 -25.258 3.380 611 HA ASP 79 HA ASP 79 -4.924 -25.023 6.181 612 HB2 ASP 79 1HB ASP 79 -3.341 -25.940 4.138 613 HB3 ASP 79 2HB ASP 79 -2.500 -24.455 4.526 614 H GLY 80 H GLY 80 -5.584 -22.616 4.199 615 HA2 GLY 80 2HA GLY 80 -4.707 -20.455 5.998 616 HA3 GLY 80 1HA GLY 80 -4.066 -20.400 4.360 617 H SER 81 H SER 81 -7.443 -21.714 4.670 618 HA SER 81 HA SER 81 -8.264 -19.672 2.868 619 HB2 SER 81 1HB SER 81 -10.587 -20.628 3.449 620 HB3 SER 81 2HB SER 81 -9.436 -21.633 2.605 621 HG SER 81 HG SER 81 -9.318 -21.938 5.369 622 H ARG 82 H ARG 82 -9.940 -18.222 3.162 623 HA ARG 82 HA ARG 82 -10.718 -16.291 3.951 624 HB2 ARG 82 1HB ARG 82 -12.430 -16.585 5.590 625 HB3 ARG 82 2HB ARG 82 -12.431 -17.873 4.426 626 HG2 ARG 82 1HG ARG 82 -11.056 -18.270 7.103 627 HG3 ARG 82 2HG ARG 82 -12.815 -18.302 6.973 628 HD2 ARG 82 1HD ARG 82 -12.302 -20.015 4.992 629 HD3 ARG 82 2HD ARG 82 -10.814 -20.300 5.908 630 HE ARG 82 HE ARG 82 -12.906 -20.345 7.765 631 HH11 ARG 82 1HH1 ARG 82 -11.727 -22.346 5.047 632 HH12 ARG 82 2HH1 ARG 82 -12.899 -23.599 5.319 633 HH21 ARG 82 1HH2 ARG 82 -14.346 -22.142 8.177 634 HH22 ARG 82 2HH2 ARG 82 -14.310 -23.510 7.108 635 H SER 83 H SER 83 -7.934 -16.805 5.000 636 HA SER 83 HA SER 83 -7.737 -15.293 7.426 637 HB2 SER 83 1HB SER 83 -6.031 -16.822 6.358 638 HB3 SER 83 2HB SER 83 -5.759 -15.573 5.139 639 HG SER 83 HG SER 83 -5.236 -15.541 7.925 640 H ALA 84 H ALA 84 -8.306 -14.426 4.063 641 HA ALA 84 HA ALA 84 -7.355 -11.908 3.726 642 HB1 ALA 84 1HB ALA 84 -10.020 -13.125 2.870 643 HB2 ALA 84 2HB ALA 84 -9.497 -11.530 2.328 644 HB3 ALA 84 3HB ALA 84 -8.510 -12.954 1.941 645 H GLU 85 H GLU 85 -10.465 -12.612 5.499 646 HA GLU 85 HA GLU 85 -11.055 -9.831 5.931 647 HB2 GLU 85 1HB GLU 85 -11.885 -12.435 7.239 648 HB3 GLU 85 2HB GLU 85 -12.339 -10.873 7.951 649 HG2 GLU 85 1HG GLU 85 -13.259 -10.201 5.745 650 HG3 GLU 85 2HG GLU 85 -13.076 -11.860 5.178 651 H GLN 86 H GLN 86 -9.700 -12.271 8.237 652 HA GLN 86 HA GLN 86 -9.088 -10.630 10.287 653 HB2 GLN 86 1HB GLN 86 -8.672 -13.254 9.585 654 HB3 GLN 86 2HB GLN 86 -7.007 -12.695 9.521 655 HG2 GLN 86 1HG GLN 86 -8.684 -11.923 11.905 656 HG3 GLN 86 2HG GLN 86 -8.289 -13.608 11.652 657 HE21 GLN 86 1HE2 GLN 86 -6.424 -10.387 11.557 658 HE22 GLN 86 2HE2 GLN 86 -5.159 -11.063 12.581 659 H VAL 87 H VAL 87 -7.085 -11.165 7.379 660 HA VAL 87 HA VAL 87 -4.980 -9.437 8.194 661 HB VAL 87 HB VAL 87 -5.915 -10.508 5.485 662 HG11 VAL 87 1HG1 VAL 87 -4.736 -8.533 4.882 663 HG12 VAL 87 2HG1 VAL 87 -3.471 -8.818 6.117 664 HG13 VAL 87 3HG1 VAL 87 -3.576 -9.848 4.682 665 HG21 VAL 87 3HG2 VAL 87 -4.959 -12.141 7.163 666 HG22 VAL 87 1HG2 VAL 87 -4.024 -12.011 5.666 667 HG23 VAL 87 2HG2 VAL 87 -3.454 -11.201 7.135 668 H ALA 88 H ALA 88 -7.924 -8.823 6.149 669 HA ALA 88 HA ALA 88 -7.283 -6.113 5.634 670 HB1 ALA 88 1HB ALA 88 -10.016 -7.439 5.877 671 HB2 ALA 88 2HB ALA 88 -9.684 -5.874 5.124 672 HB3 ALA 88 3HB ALA 88 -9.018 -7.347 4.404 673 H ALA 89 H ALA 89 -8.698 -7.655 8.504 674 HA ALA 89 HA ALA 89 -9.547 -5.203 9.781 675 HB1 ALA 89 1HB ALA 89 -10.424 -7.421 10.449 676 HB2 ALA 89 2HB ALA 89 -8.808 -7.899 11.018 677 HB3 ALA 89 3HB ALA 89 -9.675 -6.580 11.817 678 H GLU 90 H GLU 90 -6.557 -7.188 9.938 679 HA GLU 90 HA GLU 90 -5.158 -5.544 11.810 680 HB2 GLU 90 1HB GLU 90 -4.159 -7.392 9.601 681 HB3 GLU 90 2HB GLU 90 -3.104 -6.514 10.743 682 HG2 GLU 90 1HG GLU 90 -4.863 -7.617 12.448 683 HG3 GLU 90 2HG GLU 90 -4.904 -8.832 11.188 684 H LEU 91 H LEU 91 -5.036 -5.472 8.158 685 HA LEU 91 HA LEU 91 -3.401 -3.240 8.008 686 HB2 LEU 91 1HB LEU 91 -5.669 -4.200 6.220 687 HB3 LEU 91 2HB LEU 91 -4.734 -2.762 5.849 688 HG LEU 91 HG LEU 91 -3.912 -4.476 4.604 689 HD11 LEU 91 1HD1 LEU 91 -1.854 -4.157 6.819 690 HD12 LEU 91 2HD1 LEU 91 -2.181 -2.962 5.536 691 HD13 LEU 91 3HD1 LEU 91 -1.520 -4.552 5.134 692 HD21 LEU 91 3HD2 LEU 91 -3.476 -6.237 6.952 693 HD22 LEU 91 1HD2 LEU 91 -2.878 -6.540 5.307 694 HD23 LEU 91 2HD2 LEU 91 -4.619 -6.416 5.595 695 H ASP 92 H ASP 92 -6.992 -3.291 8.470 696 HA ASP 92 HA ASP 92 -7.350 -0.507 8.032 697 HB2 ASP 92 1HB ASP 92 -9.252 -1.987 7.998 698 HB3 ASP 92 2HB ASP 92 -8.971 -2.464 9.679 699 H ALA 93 H ALA 93 -6.583 -2.301 11.001 700 HA ALA 93 HA ALA 93 -6.797 -0.116 12.834 701 HB1 ALA 93 1HB ALA 93 -6.614 -2.501 13.503 702 HB2 ALA 93 2HB ALA 93 -4.927 -2.523 12.936 703 HB3 ALA 93 3HB ALA 93 -5.395 -1.487 14.293 704 H LEU 94 H LEU 94 -4.268 -1.138 10.615 705 HA LEU 94 HA LEU 94 -2.295 0.647 11.847 706 HB2 LEU 94 1HB LEU 94 -1.888 -1.734 11.256 707 HB3 LEU 94 2HB LEU 94 -2.031 -1.344 9.553 708 HG LEU 94 HG LEU 94 0.245 -1.591 10.755 709 HD11 LEU 94 1HD1 LEU 94 1.402 -0.102 9.213 710 HD12 LEU 94 2HD1 LEU 94 -0.168 0.621 8.755 711 HD13 LEU 94 3HD1 LEU 94 0.160 -1.100 8.467 712 HD21 LEU 94 3HD2 LEU 94 -0.148 -0.041 12.569 713 HD22 LEU 94 1HD2 LEU 94 0.019 1.312 11.399 714 HD23 LEU 94 2HD2 LEU 94 1.359 0.169 11.673 715 H PHE 95 H PHE 95 -4.343 0.616 8.991 716 HA PHE 95 HA PHE 95 -2.910 2.978 7.961 717 HB2 PHE 95 1HB PHE 95 -4.458 0.908 6.409 718 HB3 PHE 95 2HB PHE 95 -3.981 2.457 5.769 719 HD1 PHE 95 1HD PHE 95 -2.616 -0.804 6.976 720 HD2 PHE 95 2HD PHE 95 -1.761 2.990 5.146 721 HE1 PHE 95 1HE PHE 95 -0.402 -1.652 6.239 722 HE2 PHE 95 2HE PHE 95 0.510 2.172 4.513 723 HZ PHE 95 HZ PHE 95 1.164 -0.160 5.026 724 HA PRO 96 HA PRO 96 -7.077 4.584 9.305 725 HB2 PRO 96 1HB PRO 96 -6.195 6.773 10.704 726 HB3 PRO 96 2HB PRO 96 -6.286 5.139 11.439 727 HG2 PRO 96 1HG PRO 96 -3.851 6.484 10.230 728 HG3 PRO 96 2HG PRO 96 -4.005 5.679 11.829 729 HD2 PRO 96 1HD PRO 96 -3.021 4.386 9.663 730 HD3 PRO 96 2HD PRO 96 -4.056 3.537 10.853 731 H VAL 97 H VAL 97 -8.016 6.522 8.549 732 HA VAL 97 HA VAL 97 -7.467 7.307 5.954 733 HB VAL 97 HB VAL 97 -9.585 7.077 7.220 734 HG11 VAL 97 1HG1 VAL 97 -10.533 8.944 8.470 735 HG12 VAL 97 2HG1 VAL 97 -8.992 8.467 9.213 736 HG13 VAL 97 3HG1 VAL 97 -9.072 9.914 8.203 737 HG21 VAL 97 3HG2 VAL 97 -9.657 9.752 5.822 738 HG22 VAL 97 1HG2 VAL 97 -9.451 8.232 4.959 739 HG23 VAL 97 2HG2 VAL 97 -10.912 8.498 5.926 740 H ASN 98 H ASN 98 -5.370 8.203 7.860 741 HA ASN 98 HA ASN 98 -5.018 10.890 6.621 742 HB2 ASN 98 1HB ASN 98 -3.919 10.165 9.367 743 HB3 ASN 98 2HB ASN 98 -3.647 11.677 8.504 744 HD21 ASN 98 1HD2 ASN 98 -6.691 11.606 7.678 745 HD22 ASN 98 2HD2 ASN 98 -7.435 12.242 9.134 746 H LEU 99 H LEU 99 -3.300 8.308 8.243 747 HA LEU 99 HA LEU 99 -1.229 7.490 7.982 748 HB2 LEU 99 1HB LEU 99 -2.942 6.613 6.122 749 HB3 LEU 99 2HB LEU 99 -1.765 7.301 5.044 750 HG LEU 99 HG LEU 99 -1.098 5.040 5.300 751 HD11 LEU 99 1HD1 LEU 99 0.708 6.554 5.301 752 HD12 LEU 99 2HD1 LEU 99 1.089 5.042 6.125 753 HD13 LEU 99 3HD1 LEU 99 0.817 6.520 7.078 754 HD21 LEU 99 3HD2 LEU 99 -0.864 3.874 7.334 755 HD22 LEU 99 1HD2 LEU 99 -2.365 4.841 7.522 756 HD23 LEU 99 2HD2 LEU 99 -0.868 5.352 8.311 757 H VAL 100 H VAL 100 -0.617 9.858 8.419 758 HA VAL 100 HA VAL 100 0.793 11.269 6.325 759 HB VAL 100 HB VAL 100 1.058 11.399 9.371 760 HG11 VAL 100 1HG1 VAL 100 1.860 13.423 7.232 761 HG12 VAL 100 2HG1 VAL 100 1.954 13.654 8.993 762 HG13 VAL 100 3HG1 VAL 100 2.964 12.441 8.218 763 HG21 VAL 100 3HG2 VAL 100 -0.721 13.016 7.499 764 HG22 VAL 100 1HG2 VAL 100 -1.243 11.903 8.772 765 HG23 VAL 100 2HG2 VAL 100 -0.418 13.388 9.208 766 H MET 101 H MET 101 2.239 9.885 5.250 767 HA MET 101 HA MET 101 4.454 8.785 6.933 768 HB2 MET 101 1HB MET 101 4.676 8.374 4.015 769 HB3 MET 101 2HB MET 101 5.097 7.345 5.361 770 HG2 MET 101 1HG MET 101 2.798 6.626 5.606 771 HG3 MET 101 2HG MET 101 2.312 7.787 4.364 772 HE1 MET 101 3HE MET 101 1.676 7.143 2.353 773 HE2 MET 101 1HE MET 101 1.796 5.510 1.669 774 HE3 MET 101 2HE MET 101 1.012 5.753 3.260 775 H GLN 102 H GLN 102 5.008 10.908 7.584 776 HA GLN 102 HA GLN 102 5.901 12.935 5.750 777 HB2 GLN 102 1HB GLN 102 5.140 13.002 8.274 778 HB3 GLN 102 2HB GLN 102 6.799 12.538 8.630 779 HG2 GLN 102 1HG GLN 102 5.846 14.973 7.086 780 HG3 GLN 102 2HG GLN 102 6.358 14.966 8.777 781 HE21 GLN 102 1HE2 GLN 102 7.427 15.489 5.595 782 HE22 GLN 102 2HE2 GLN 102 9.120 15.158 5.784 783 H SER 103 H SER 103 7.765 12.713 4.492 784 HA SER 103 HA SER 103 10.039 11.136 5.577 785 HB2 SER 103 1HB SER 103 8.675 9.907 3.809 786 HB3 SER 103 2HB SER 103 9.183 11.159 2.652 787 HG SER 103 HG SER 103 10.500 9.255 2.690 788 H GLY 104 H GLY 104 11.973 11.717 3.964 789 HA2 GLY 104 2HA GLY 104 12.641 14.442 4.309 790 HA3 GLY 104 1HA GLY 104 13.424 13.351 3.154 791 H GLY 105 H GLY 105 10.730 12.959 1.683 792 HA2 GLY 105 2HA GLY 105 10.968 15.345 0.012 793 HA3 GLY 105 1HA GLY 105 9.914 13.949 -0.245 794 H LEU 106 H LEU 106 8.111 13.712 1.508 795 HA LEU 106 HA LEU 106 6.759 16.252 1.976 796 HB2 LEU 106 1HB LEU 106 5.444 14.387 -0.017 797 HB3 LEU 106 2HB LEU 106 5.143 16.068 0.354 798 HG LEU 106 HG LEU 106 7.469 16.512 -0.735 799 HD11 LEU 106 1HD1 LEU 106 8.433 14.882 -2.087 800 HD12 LEU 106 2HD1 LEU 106 6.887 14.076 -2.381 801 HD13 LEU 106 3HD1 LEU 106 7.728 13.779 -0.873 802 HD21 LEU 106 3HD2 LEU 106 5.388 17.247 -1.715 803 HD22 LEU 106 1HD2 LEU 106 5.080 15.633 -2.385 804 HD23 LEU 106 2HD2 LEU 106 6.456 16.612 -2.965 805 H ALA 107 H ALA 107 4.207 15.175 2.004 806 HA ALA 107 HA ALA 107 4.271 12.985 4.027 807 HB1 ALA 107 1HB ALA 107 3.900 15.091 5.222 808 HB2 ALA 107 2HB ALA 107 2.672 15.608 4.047 809 HB3 ALA 107 3HB ALA 107 2.360 14.221 5.114 810 H VAL 108 H VAL 108 3.691 11.357 2.444 811 HA VAL 108 HA VAL 108 1.525 11.771 0.545 812 HB VAL 108 HB VAL 108 3.319 10.313 -0.013 813 HG11 VAL 108 1HG1 VAL 108 2.852 8.931 2.605 814 HG12 VAL 108 2HG1 VAL 108 3.775 8.186 1.288 815 HG13 VAL 108 3HG1 VAL 108 4.329 9.690 2.013 816 HG21 VAL 108 3HG2 VAL 108 1.106 9.569 -0.781 817 HG22 VAL 108 1HG2 VAL 108 2.197 8.195 -0.486 818 HG23 VAL 108 2HG2 VAL 108 0.917 8.583 0.682 819 H ARG 109 H ARG 109 -0.596 11.400 0.943 820 HA ARG 109 HA ARG 109 -1.303 10.380 3.679 821 HB2 ARG 109 1HB ARG 109 -2.110 13.039 2.474 822 HB3 ARG 109 2HB ARG 109 -3.100 12.227 3.703 823 HG2 ARG 109 1HG ARG 109 -1.360 12.283 5.332 824 HG3 ARG 109 2HG ARG 109 -0.169 12.789 4.145 825 HD2 ARG 109 1HD ARG 109 -1.517 14.916 3.817 826 HD3 ARG 109 2HD ARG 109 -2.512 14.424 5.199 827 HE ARG 109 HE ARG 109 0.317 14.404 5.776 828 HH11 ARG 109 1HH1 ARG 109 -2.504 16.662 5.602 829 HH12 ARG 109 2HH1 ARG 109 -1.688 17.844 6.576 830 HH21 ARG 109 1HH2 ARG 109 1.258 16.027 7.178 831 HH22 ARG 109 2HH2 ARG 109 0.271 17.353 7.638 832 H VAL 110 H VAL 110 -3.197 9.310 3.863 833 HA VAL 110 HA VAL 110 -3.571 7.832 1.481 834 HB VAL 110 HB VAL 110 -3.435 6.968 3.772 835 HG11 VAL 110 1HG1 VAL 110 -4.966 8.570 4.865 836 HG12 VAL 110 2HG1 VAL 110 -6.332 7.815 4.041 837 HG13 VAL 110 3HG1 VAL 110 -5.381 6.876 5.200 838 HG21 VAL 110 3HG2 VAL 110 -4.207 5.488 2.040 839 HG22 VAL 110 1HG2 VAL 110 -4.957 5.126 3.606 840 HG23 VAL 110 2HG2 VAL 110 -5.895 5.955 2.347 841 H ARG 111 H ARG 111 -5.536 10.343 2.786 842 HA ARG 111 HA ARG 111 -7.357 11.430 2.178 843 HB2 ARG 111 1HB ARG 111 -6.430 10.366 -0.420 844 HB3 ARG 111 2HB ARG 111 -8.150 10.667 -0.376 845 HG2 ARG 111 1HG ARG 111 -5.968 12.672 0.200 846 HG3 ARG 111 2HG ARG 111 -6.992 12.585 -1.224 847 HD2 ARG 111 1HD ARG 111 -8.983 12.812 0.490 848 HD3 ARG 111 2HD ARG 111 -7.750 13.462 1.586 849 HE ARG 111 HE ARG 111 -9.049 14.770 -0.562 850 HH11 ARG 111 1HH1 ARG 111 -5.881 14.682 1.025 851 HH12 ARG 111 2HH1 ARG 111 -5.176 15.870 -0.009 852 HH21 ARG 111 1HH2 ARG 111 -8.295 16.567 -1.634 853 HH22 ARG 111 2HH2 ARG 111 -6.735 17.269 -1.263 854 H THR 112 H THR 112 -7.790 8.180 0.874 855 HA THR 112 HA THR 112 -10.671 8.235 1.567 856 HB THR 112 HB THR 112 -10.676 6.053 0.413 857 HG1 THR 112 1HG THR 112 -8.512 5.458 0.830 858 HG21 THR 112 3HG2 THR 112 -9.292 8.246 -1.193 859 HG22 THR 112 1HG2 THR 112 -11.050 8.048 -0.941 860 HG23 THR 112 2HG2 THR 112 -10.147 6.829 -1.855 861 HA PRO 113 HA PRO 113 -9.700 5.483 5.058 862 HB2 PRO 113 1HB PRO 113 -11.992 4.112 5.402 863 HB3 PRO 113 2HB PRO 113 -11.950 5.882 5.735 864 HG2 PRO 113 1HG PRO 113 -12.833 4.488 3.170 865 HG3 PRO 113 2HG PRO 113 -13.734 5.704 4.136 866 HD2 PRO 113 1HD PRO 113 -12.203 6.354 1.959 867 HD3 PRO 113 2HD PRO 113 -12.338 7.431 3.364 868 H ILE 114 H ILE 114 -9.926 3.031 5.342 869 HA ILE 114 HA ILE 114 -8.803 1.564 3.144 870 HB ILE 114 HB ILE 114 -9.825 1.088 5.978 871 HG12 ILE 114 1HG1 ILE 114 -7.668 2.306 5.560 872 HG13 ILE 114 2HG1 ILE 114 -7.519 0.904 6.564 873 HG21 ILE 114 1HG2 ILE 114 -8.771 -1.107 4.191 874 HG22 ILE 114 2HG2 ILE 114 -8.857 -1.166 5.962 875 HG23 ILE 114 3HG2 ILE 114 -10.343 -1.012 5.024 876 HD11 ILE 114 3HD1 ILE 114 -6.292 -0.283 4.998 877 HD12 ILE 114 1HD1 ILE 114 -6.985 0.586 3.608 878 HD13 ILE 114 2HD1 ILE 114 -5.794 1.384 4.624 879 H SER 115 H SER 115 -9.762 -0.088 1.977 880 HA SER 115 HA SER 115 -12.671 -0.530 2.354 881 HB2 SER 115 1HB SER 115 -12.007 0.997 0.283 882 HB3 SER 115 2HB SER 115 -11.504 -0.561 -0.418 883 HG SER 115 HG SER 115 -14.074 0.196 0.532 884 H ASN 116 H ASN 116 -13.331 -2.528 1.297 885 HA ASN 116 HA ASN 116 -11.545 -4.509 0.445 886 HB2 ASN 116 1HB ASN 116 -11.131 -5.028 2.799 887 HB3 ASN 116 2HB ASN 116 -12.869 -4.944 3.165 888 HD21 ASN 116 1HD2 ASN 116 -10.873 -6.528 0.580 889 HD22 ASN 116 2HD2 ASN 116 -11.976 -7.885 0.529 890 H GLY 117 H GLY 117 -12.787 -5.889 -0.893 891 HA2 GLY 117 2HA GLY 117 -15.741 -5.993 -0.528 892 HA3 GLY 117 1HA GLY 117 -14.973 -6.022 -2.117 893 H GLN 118 H GLN 118 -16.532 -8.150 -1.696 894 HA GLN 118 HA GLN 118 -15.331 -10.394 -0.423 895 HB2 GLN 118 1HB GLN 118 -17.589 -9.747 -2.297 896 HB3 GLN 118 2HB GLN 118 -16.992 -11.382 -2.365 897 HG2 GLN 118 1HG GLN 118 -17.374 -11.697 0.050 898 HG3 GLN 118 2HG GLN 118 -17.903 -10.016 0.192 899 HE21 GLN 118 1HE2 GLN 118 -19.324 -12.908 0.411 900 HE22 GLN 118 2HE2 GLN 118 -20.792 -12.563 -0.480 901 HA PRO 119 HA PRO 119 -12.330 -11.450 -3.414 902 HB2 PRO 119 1HB PRO 119 -12.205 -14.225 -3.299 903 HB3 PRO 119 2HB PRO 119 -11.578 -13.157 -2.033 904 HG2 PRO 119 1HG PRO 119 -14.196 -14.646 -2.143 905 HG3 PRO 119 2HG PRO 119 -13.115 -14.362 -0.738 906 HD2 PRO 119 1HD PRO 119 -15.421 -12.920 -1.224 907 HD3 PRO 119 2HD PRO 119 -14.008 -12.262 -0.347 908 H THR 120 H THR 120 -11.763 -12.482 -5.490 909 HA THR 120 HA THR 120 -14.238 -13.119 -7.035 910 HB THR 120 HB THR 120 -13.157 -12.366 -8.877 911 HG1 THR 120 1HG THR 120 -11.381 -13.952 -8.722 912 HG21 THR 120 3HG2 THR 120 -11.730 -10.430 -8.362 913 HG22 THR 120 1HG2 THR 120 -11.294 -11.159 -6.806 914 HG23 THR 120 2HG2 THR 120 -12.954 -10.584 -7.079 915 H THR 121 H THR 121 -12.062 -14.584 -5.410 916 HA THR 121 HA THR 121 -11.307 -16.766 -4.976 917 HB THR 121 HB THR 121 -13.069 -17.907 -7.154 918 HG1 THR 121 1HG THR 121 -14.465 -16.774 -5.950 919 HG21 THR 121 3HG2 THR 121 -12.040 -19.012 -4.491 920 HG22 THR 121 1HG2 THR 121 -11.575 -19.561 -6.106 921 HG23 THR 121 2HG2 THR 121 -13.200 -19.826 -5.554 922 H GLY 122 H GLY 122 -10.123 -18.585 -6.314 923 HA2 GLY 122 2HA GLY 122 -8.766 -17.633 -8.720 924 HA3 GLY 122 1HA GLY 122 -7.866 -18.045 -7.244 925 H ASP 123 H ASP 123 -6.922 -19.744 -8.529 926 HA ASP 123 HA ASP 123 -8.397 -21.947 -9.688 927 HB2 ASP 123 1HB ASP 123 -6.082 -21.269 -10.298 928 HB3 ASP 123 2HB ASP 123 -5.531 -21.797 -8.713 929 H ALA 124 H ALA 124 -6.672 -21.471 -6.630 930 HA ALA 124 HA ALA 124 -8.288 -23.403 -5.128 931 HB1 ALA 124 1HB ALA 124 -5.301 -23.859 -5.635 932 HB2 ALA 124 2HB ALA 124 -6.308 -24.780 -4.499 933 HB3 ALA 124 3HB ALA 124 -6.613 -24.900 -6.241 934 H ASP 125 H ASP 125 -7.492 -20.510 -5.297 935 HA ASP 125 HA ASP 125 -6.672 -19.955 -2.576 936 HB2 ASP 125 1HB ASP 125 -5.360 -18.053 -3.651 937 HB3 ASP 125 2HB ASP 125 -4.602 -19.624 -3.665 938 H HIS 126 H HIS 126 -7.168 -17.485 -2.348 939 HA HIS 126 HA HIS 126 -9.186 -16.551 -4.266 940 HB2 HIS 126 1HB HIS 126 -9.503 -16.282 -1.253 941 HB3 HIS 126 2HB HIS 126 -10.400 -15.345 -2.422 942 HD1 HIS 126 1HD HIS 126 -12.835 -16.266 -2.895 943 HD2 HIS 126 2HD HIS 126 -10.012 -18.929 -1.294 944 HE1 HIS 126 1HE HIS 126 -14.140 -18.264 -2.123 945 H THR 127 H THR 127 -9.383 -14.206 -4.109 946 HA THR 127 HA THR 127 -7.224 -12.635 -2.952 947 HB THR 127 HB THR 127 -7.513 -11.686 -5.548 948 HG1 THR 127 1HG THR 127 -7.974 -13.216 -6.855 949 HG21 THR 127 3HG2 THR 127 -5.329 -12.137 -4.189 950 HG22 THR 127 1HG2 THR 127 -5.213 -12.466 -5.924 951 HG23 THR 127 2HG2 THR 127 -5.419 -13.801 -4.768 952 H VAL 128 H VAL 128 -8.094 -10.895 -2.139 953 HA VAL 128 HA VAL 128 -10.912 -10.176 -2.749 954 HB VAL 128 HB VAL 128 -10.781 -9.099 -0.491 955 HG11 VAL 128 1HG1 VAL 128 -10.597 -12.097 -0.393 956 HG12 VAL 128 2HG1 VAL 128 -11.398 -11.021 0.775 957 HG13 VAL 128 3HG1 VAL 128 -12.030 -11.123 -0.859 958 HG21 VAL 128 3HG2 VAL 128 -9.355 -9.640 1.199 959 HG22 VAL 128 1HG2 VAL 128 -8.604 -10.973 0.301 960 HG23 VAL 128 2HG2 VAL 128 -8.276 -9.261 -0.145 961 HA PRO 129 HA PRO 129 -8.968 -6.447 -4.229 962 HB2 PRO 129 1HB PRO 129 -11.195 -4.791 -4.317 963 HB3 PRO 129 2HB PRO 129 -10.799 -6.034 -5.533 964 HG2 PRO 129 1HG PRO 129 -12.741 -6.203 -3.211 965 HG3 PRO 129 2HG PRO 129 -12.931 -6.864 -4.871 966 HD2 PRO 129 1HD PRO 129 -12.209 -8.338 -2.679 967 HD3 PRO 129 2HD PRO 129 -11.723 -8.754 -4.341 968 H ILE 130 H ILE 130 -7.772 -5.106 -3.003 969 HA ILE 130 HA ILE 130 -8.892 -3.623 -0.708 970 HB ILE 130 HB ILE 130 -6.347 -5.279 -0.555 971 HG12 ILE 130 1HG1 ILE 130 -9.070 -5.594 0.823 972 HG13 ILE 130 2HG1 ILE 130 -8.337 -6.729 -0.304 973 HG21 ILE 130 1HG2 ILE 130 -6.326 -3.095 0.702 974 HG22 ILE 130 2HG2 ILE 130 -7.713 -3.708 1.649 975 HG23 ILE 130 3HG2 ILE 130 -6.114 -4.517 1.703 976 HD11 ILE 130 3HD1 ILE 130 -8.250 -7.584 1.936 977 HD12 ILE 130 1HD1 ILE 130 -6.590 -7.266 1.380 978 HD13 ILE 130 2HD1 ILE 130 -7.388 -6.174 2.542 979 H SER 131 H SER 131 -8.394 -1.562 -1.187 980 HA SER 131 HA SER 131 -5.847 -0.668 -1.955 981 HB2 SER 131 1HB SER 131 -6.524 0.321 -4.245 982 HB3 SER 131 2HB SER 131 -6.058 -1.364 -4.157 983 HG SER 131 HG SER 131 -8.370 -0.228 -4.914 984 H LEU 132 H LEU 132 -5.902 1.770 -2.561 985 HA LEU 132 HA LEU 132 -8.123 3.290 -1.474 986 HB2 LEU 132 1HB LEU 132 -6.634 4.341 0.269 987 HB3 LEU 132 2HB LEU 132 -7.308 2.748 0.594 988 HG LEU 132 HG LEU 132 -4.953 1.850 -0.196 989 HD11 LEU 132 1HD1 LEU 132 -3.247 3.717 0.627 990 HD12 LEU 132 2HD1 LEU 132 -4.479 4.811 -0.034 991 HD13 LEU 132 3HD1 LEU 132 -3.754 3.585 -1.067 992 HD21 LEU 132 3HD2 LEU 132 -5.412 3.256 2.454 993 HD22 LEU 132 1HD2 LEU 132 -4.124 2.067 2.122 994 HD23 LEU 132 2HD2 LEU 132 -5.827 1.609 2.022 995 H GLY 133 H GLY 133 -7.740 5.618 -1.726 996 HA2 GLY 133 2HA GLY 133 -6.049 6.105 -4.152 997 HA3 GLY 133 1HA GLY 133 -7.691 6.675 -3.941 998 H TYR 134 H TYR 134 -4.475 6.965 -2.948 999 HA TYR 134 HA TYR 134 -4.682 8.979 -0.900 1000 HB2 TYR 134 1HB TYR 134 -2.272 8.716 -0.770 1001 HB3 TYR 134 2HB TYR 134 -3.007 7.137 -0.941 1002 HD1 TYR 134 1HD TYR 134 -2.812 5.891 -3.089 1003 HD2 TYR 134 2HD TYR 134 -0.887 9.706 -2.491 1004 HE1 TYR 134 1HE TYR 134 -1.348 5.507 -5.068 1005 HE2 TYR 134 2HE TYR 134 0.526 9.332 -4.482 1006 HH TYR 134 HH TYR 134 0.126 6.469 -6.587 1007 H ASP 135 H ASP 135 -3.067 10.842 -0.912 1008 HA ASP 135 HA ASP 135 -2.643 12.067 -3.516 1009 HB2 ASP 135 1HB ASP 135 -3.420 14.155 -3.043 1010 HB3 ASP 135 2HB ASP 135 -4.718 13.159 -2.394 1011 H VAL 136 H VAL 136 -1.095 14.060 -3.119 1012 HA VAL 136 HA VAL 136 0.220 14.053 -0.598 1013 HB VAL 136 HB VAL 136 1.599 12.460 -2.187 1014 HG11 VAL 136 1HG1 VAL 136 1.563 14.019 -4.075 1015 HG12 VAL 136 2HG1 VAL 136 2.660 15.103 -3.211 1016 HG13 VAL 136 3HG1 VAL 136 3.190 13.447 -3.606 1017 HG21 VAL 136 3HG2 VAL 136 3.668 13.130 -1.135 1018 HG22 VAL 136 1HG2 VAL 136 3.144 14.825 -0.988 1019 HG23 VAL 136 2HG2 VAL 136 2.401 13.593 0.009 1020 H GLN 137 H GLN 137 0.881 16.083 -0.177 1021 HA GLN 137 HA GLN 137 0.396 18.238 -2.177 1022 HB2 GLN 137 1HB GLN 137 -0.057 19.726 -0.414 1023 HB3 GLN 137 2HB GLN 137 -1.058 18.323 -0.096 1024 HG2 GLN 137 1HG GLN 137 1.587 18.936 1.344 1025 HG3 GLN 137 2HG GLN 137 -0.019 19.299 1.935 1026 HE21 GLN 137 1HE2 GLN 137 2.289 16.741 1.236 1027 HE22 GLN 137 2HE2 GLN 137 1.424 15.476 2.133 1028 H PHE 138 H PHE 138 1.927 20.056 -1.950 1029 HA PHE 138 HA PHE 138 4.654 19.257 -1.039 1030 HB2 PHE 138 1HB PHE 138 3.659 20.975 -3.345 1031 HB3 PHE 138 2HB PHE 138 5.291 21.062 -2.729 1032 HD1 PHE 138 2HD PHE 138 3.026 18.105 -3.705 1033 HD2 PHE 138 1HD PHE 138 6.818 20.121 -4.173 1034 HE1 PHE 138 2HE PHE 138 3.693 16.456 -5.376 1035 HE2 PHE 138 1HE PHE 138 7.487 18.421 -5.847 1036 HZ PHE 138 HZ PHE 138 5.930 16.609 -6.483 1037 H TYR 139 H TYR 139 5.459 20.547 0.565 1038 HA TYR 139 HA TYR 139 4.248 23.229 1.035 1039 HB2 TYR 139 1HB TYR 139 5.137 21.188 3.109 1040 HB3 TYR 139 2HB TYR 139 4.862 22.888 3.429 1041 HD1 TYR 139 2HD TYR 139 2.422 23.783 2.578 1042 HD2 TYR 139 1HD TYR 139 3.433 19.782 3.835 1043 HE1 TYR 139 2HE TYR 139 0.053 23.375 3.157 1044 HE2 TYR 139 1HE TYR 139 1.074 19.373 4.446 1045 HH TYR 139 HH TYR 139 -1.471 21.853 4.233 1046 HA PRO 140 HA PRO 140 8.815 23.556 0.296 1047 HB2 PRO 140 1HB PRO 140 8.747 25.765 -1.342 1048 HB3 PRO 140 2HB PRO 140 8.562 24.114 -1.952 1049 HG2 PRO 140 1HG PRO 140 6.447 26.147 -1.395 1050 HG3 PRO 140 2HG PRO 140 6.570 25.025 -2.775 1051 HD2 PRO 140 1HD PRO 140 4.962 24.578 -0.545 1052 HD3 PRO 140 2HD PRO 140 5.624 23.277 -1.574 1053 H GLU 141 H GLU 141 9.790 26.058 0.408 1054 HA GLU 141 HA GLU 141 8.894 27.240 2.926 1055 HB2 GLU 141 1HB GLU 141 11.166 27.822 0.989 1056 HB3 GLU 141 2HB GLU 141 10.846 28.774 2.463 1057 HG2 GLU 141 1HG GLU 141 11.164 26.811 3.858 1058 HG3 GLU 141 2HG GLU 141 11.278 25.732 2.493
Contact the webmaster for help, if required. Saturday, June 1, 2024 3:25:22 AM GMT (wattos1)