USER MOD reduce.3.24.130724 H: found=0, std=0, add=657, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 657 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 5 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 8 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 CYS SG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ 169:sc= 0.0259 (180deg=0.0139) USER MOD Single : A 13 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 17 CYS SG : rot 180:sc= 0 USER MOD Single : A 23 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 CYS SG : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 124:sc= 1.29 USER MOD Single : A 44 LYS NZ :NH3+ 173:sc= 1.1 (180deg=1.05) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= 0.941 K(o=0.94,f=-0.019) USER MOD Single : A 54 LYS NZ :NH3+ -171:sc= -0.0138 (180deg=-0.138) USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc=0.000248 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 4 22.597 87.897 44.262 1.00 0.00 N ATOM 2 CA VAL A 4 22.336 87.866 42.816 1.00 0.00 C ATOM 3 C VAL A 4 22.914 86.565 42.242 1.00 0.00 C ATOM 4 O VAL A 4 23.986 86.563 41.627 1.00 0.00 O ATOM 5 CB VAL A 4 22.875 89.147 42.153 1.00 0.00 C ATOM 6 CG1 VAL A 4 22.615 89.236 40.644 1.00 0.00 C ATOM 7 CG2 VAL A 4 22.203 90.389 42.761 1.00 0.00 C ATOM 0 HA VAL A 4 21.267 87.860 42.604 1.00 0.00 H new ATOM 0 HB VAL A 4 23.950 89.109 42.330 1.00 0.00 H new ATOM 0 HG11 VAL A 4 23.027 90.168 40.258 1.00 0.00 H new ATOM 0 HG12 VAL A 4 23.092 88.394 40.142 1.00 0.00 H new ATOM 0 HG13 VAL A 4 21.541 89.209 40.458 1.00 0.00 H new ATOM 0 HG21 VAL A 4 22.595 91.286 42.282 1.00 0.00 H new ATOM 0 HG22 VAL A 4 21.126 90.334 42.603 1.00 0.00 H new ATOM 0 HG23 VAL A 4 22.411 90.429 43.830 1.00 0.00 H new ATOM 17 N ASN A 5 22.248 85.449 42.526 1.00 0.00 N ATOM 18 CA ASN A 5 22.709 84.093 42.220 1.00 0.00 C ATOM 19 C ASN A 5 21.637 83.211 41.560 1.00 0.00 C ATOM 20 O ASN A 5 21.935 82.521 40.578 1.00 0.00 O ATOM 21 CB ASN A 5 23.224 83.446 43.533 1.00 0.00 C ATOM 22 CG ASN A 5 24.710 83.160 43.509 1.00 0.00 C ATOM 23 OD1 ASN A 5 25.544 84.064 43.402 1.00 0.00 O ATOM 24 ND2 ASN A 5 25.084 81.914 43.518 1.00 0.00 N ATOM 0 H ASN A 5 21.341 85.462 42.992 1.00 0.00 H new ATOM 0 HA ASN A 5 23.509 84.169 41.484 1.00 0.00 H new ATOM 0 HB2 ASN A 5 23.001 84.108 44.370 1.00 0.00 H new ATOM 0 HB3 ASN A 5 22.684 82.516 43.709 1.00 0.00 H new ATOM 0 HD21 ASN A 5 26.073 81.678 43.436 1.00 0.00 H new ATOM 0 HD22 ASN A 5 24.388 81.173 43.607 1.00 0.00 H new ATOM 31 N GLU A 6 20.398 83.227 42.077 1.00 0.00 N ATOM 32 CA GLU A 6 19.302 82.332 41.664 1.00 0.00 C ATOM 33 C GLU A 6 17.951 83.063 41.537 1.00 0.00 C ATOM 34 O GLU A 6 17.516 83.321 40.407 1.00 0.00 O ATOM 35 CB GLU A 6 19.275 81.122 42.622 1.00 0.00 C ATOM 36 CG GLU A 6 18.179 80.095 42.317 1.00 0.00 C ATOM 37 CD GLU A 6 18.209 78.862 43.249 1.00 0.00 C ATOM 38 OE1 GLU A 6 18.729 78.925 44.388 1.00 0.00 O ATOM 39 OE2 GLU A 6 17.632 77.820 42.853 1.00 0.00 O ATOM 0 H GLU A 6 20.123 83.878 42.812 1.00 0.00 H new ATOM 0 HA GLU A 6 19.488 81.965 40.655 1.00 0.00 H new ATOM 0 HB2 GLU A 6 20.243 80.623 42.585 1.00 0.00 H new ATOM 0 HB3 GLU A 6 19.142 81.484 43.641 1.00 0.00 H new ATOM 0 HG2 GLU A 6 17.206 80.579 42.400 1.00 0.00 H new ATOM 0 HG3 GLU A 6 18.282 79.762 41.284 1.00 0.00 H new ATOM 46 N ALA A 7 17.327 83.430 42.661 1.00 0.00 N ATOM 47 CA ALA A 7 16.019 84.098 42.824 1.00 0.00 C ATOM 48 C ALA A 7 14.773 83.361 42.268 1.00 0.00 C ATOM 49 O ALA A 7 14.613 83.168 41.060 1.00 0.00 O ATOM 50 CB ALA A 7 16.118 85.562 42.362 1.00 0.00 C ATOM 0 H ALA A 7 17.760 83.253 43.567 1.00 0.00 H new ATOM 0 HA ALA A 7 15.816 84.064 43.894 1.00 0.00 H new ATOM 0 HB1 ALA A 7 15.150 86.049 42.485 1.00 0.00 H new ATOM 0 HB2 ALA A 7 16.865 86.083 42.961 1.00 0.00 H new ATOM 0 HB3 ALA A 7 16.409 85.593 41.312 1.00 0.00 H new ATOM 56 N ASN A 8 13.814 83.020 43.137 1.00 0.00 N ATOM 57 CA ASN A 8 12.569 82.333 42.779 1.00 0.00 C ATOM 58 C ASN A 8 11.558 83.247 42.053 1.00 0.00 C ATOM 59 O ASN A 8 11.058 82.875 40.997 1.00 0.00 O ATOM 60 CB ASN A 8 11.896 81.744 44.031 1.00 0.00 C ATOM 61 CG ASN A 8 12.581 80.503 44.567 1.00 0.00 C ATOM 62 OD1 ASN A 8 13.483 80.574 45.397 1.00 0.00 O ATOM 63 ND2 ASN A 8 12.123 79.336 44.186 1.00 0.00 N ATOM 0 H ASN A 8 13.885 83.220 44.135 1.00 0.00 H new ATOM 0 HA ASN A 8 12.854 81.538 42.090 1.00 0.00 H new ATOM 0 HB2 ASN A 8 11.877 82.503 44.813 1.00 0.00 H new ATOM 0 HB3 ASN A 8 10.860 81.502 43.795 1.00 0.00 H new ATOM 0 HD21 ASN A 8 12.516 78.481 44.579 1.00 0.00 H new ATOM 0 HD22 ASN A 8 11.374 79.283 43.496 1.00 0.00 H new ATOM 70 N CYS A 9 11.237 84.406 42.622 1.00 0.00 N ATOM 71 CA CYS A 9 10.096 85.231 42.198 1.00 0.00 C ATOM 72 C CYS A 9 10.436 86.382 41.230 1.00 0.00 C ATOM 73 O CYS A 9 9.615 87.275 41.033 1.00 0.00 O ATOM 74 CB CYS A 9 9.328 85.698 43.450 1.00 0.00 C ATOM 75 SG CYS A 9 8.641 84.257 44.320 1.00 0.00 S ATOM 0 H CYS A 9 11.763 84.808 43.398 1.00 0.00 H new ATOM 0 HA CYS A 9 9.452 84.599 41.586 1.00 0.00 H new ATOM 0 HB2 CYS A 9 9.994 86.251 44.112 1.00 0.00 H new ATOM 0 HB3 CYS A 9 8.526 86.379 43.164 1.00 0.00 H new ATOM 0 HG CYS A 9 7.996 84.655 45.376 1.00 0.00 H new ATOM 81 N LYS A 10 11.654 86.374 40.655 1.00 0.00 N ATOM 82 CA LYS A 10 12.188 87.306 39.622 1.00 0.00 C ATOM 83 C LYS A 10 11.860 88.807 39.804 1.00 0.00 C ATOM 84 O LYS A 10 11.630 89.545 38.841 1.00 0.00 O ATOM 85 CB LYS A 10 11.962 86.753 38.209 1.00 0.00 C ATOM 86 CG LYS A 10 10.488 86.626 37.742 1.00 0.00 C ATOM 87 CD LYS A 10 10.082 85.196 37.359 1.00 0.00 C ATOM 88 CE LYS A 10 10.160 84.254 38.568 1.00 0.00 C ATOM 89 NZ LYS A 10 9.782 82.866 38.235 1.00 0.00 N ATOM 0 H LYS A 10 12.346 85.670 40.913 1.00 0.00 H new ATOM 0 HA LYS A 10 13.265 87.330 39.787 1.00 0.00 H new ATOM 0 HB2 LYS A 10 12.489 87.395 37.503 1.00 0.00 H new ATOM 0 HB3 LYS A 10 12.424 85.768 38.150 1.00 0.00 H new ATOM 0 HG2 LYS A 10 9.832 86.979 38.538 1.00 0.00 H new ATOM 0 HG3 LYS A 10 10.330 87.281 36.885 1.00 0.00 H new ATOM 0 HD2 LYS A 10 9.067 85.198 36.961 1.00 0.00 H new ATOM 0 HD3 LYS A 10 10.735 84.830 36.567 1.00 0.00 H new ATOM 0 HE2 LYS A 10 11.175 84.264 38.966 1.00 0.00 H new ATOM 0 HE3 LYS A 10 9.505 84.626 39.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 10.028 82.240 39.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 8.758 82.818 38.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 10.294 82.562 37.382 1.00 0.00 H new ATOM 103 N ALA A 11 11.807 89.208 41.076 1.00 0.00 N ATOM 104 CA ALA A 11 11.585 90.571 41.574 1.00 0.00 C ATOM 105 C ALA A 11 11.993 90.728 43.057 1.00 0.00 C ATOM 106 O ALA A 11 12.433 91.806 43.460 1.00 0.00 O ATOM 107 CB ALA A 11 10.092 90.917 41.440 1.00 0.00 C ATOM 0 H ALA A 11 11.926 88.543 41.841 1.00 0.00 H new ATOM 0 HA ALA A 11 12.205 91.243 40.980 1.00 0.00 H new ATOM 0 HB1 ALA A 11 9.918 91.928 41.808 1.00 0.00 H new ATOM 0 HB2 ALA A 11 9.797 90.856 40.392 1.00 0.00 H new ATOM 0 HB3 ALA A 11 9.501 90.212 42.025 1.00 0.00 H new ATOM 113 N ALA A 12 11.869 89.667 43.864 1.00 0.00 N ATOM 114 CA ALA A 12 12.028 89.666 45.326 1.00 0.00 C ATOM 115 C ALA A 12 13.326 90.346 45.841 1.00 0.00 C ATOM 116 O ALA A 12 13.240 91.122 46.798 1.00 0.00 O ATOM 117 CB ALA A 12 11.921 88.227 45.814 1.00 0.00 C ATOM 0 H ALA A 12 11.644 88.741 43.499 1.00 0.00 H new ATOM 0 HA ALA A 12 11.230 90.281 45.742 1.00 0.00 H new ATOM 0 HB1 ALA A 12 12.036 88.201 46.898 1.00 0.00 H new ATOM 0 HB2 ALA A 12 10.946 87.822 45.543 1.00 0.00 H new ATOM 0 HB3 ALA A 12 12.704 87.627 45.351 1.00 0.00 H new ATOM 123 N MET A 13 14.457 90.150 45.160 1.00 0.00 N ATOM 124 CA MET A 13 15.751 90.793 45.442 1.00 0.00 C ATOM 125 C MET A 13 15.822 92.292 45.061 1.00 0.00 C ATOM 126 O MET A 13 16.901 92.875 44.928 1.00 0.00 O ATOM 127 CB MET A 13 16.917 90.000 44.828 1.00 0.00 C ATOM 128 CG MET A 13 16.933 90.025 43.292 1.00 0.00 C ATOM 129 SD MET A 13 18.363 89.223 42.525 1.00 0.00 S ATOM 130 CE MET A 13 18.201 89.885 40.844 1.00 0.00 C ATOM 0 H MET A 13 14.503 89.514 44.364 1.00 0.00 H new ATOM 0 HA MET A 13 15.848 90.773 46.527 1.00 0.00 H new ATOM 0 HB2 MET A 13 17.858 90.406 45.200 1.00 0.00 H new ATOM 0 HB3 MET A 13 16.860 88.965 45.166 1.00 0.00 H new ATOM 0 HG2 MET A 13 16.026 89.542 42.927 1.00 0.00 H new ATOM 0 HG3 MET A 13 16.897 91.063 42.961 1.00 0.00 H new ATOM 0 HE1 MET A 13 19.006 89.496 40.220 1.00 0.00 H new ATOM 0 HE2 MET A 13 17.240 89.585 40.426 1.00 0.00 H new ATOM 0 HE3 MET A 13 18.259 90.973 40.874 1.00 0.00 H new ATOM 140 N GLU A 14 14.679 92.932 44.837 1.00 0.00 N ATOM 141 CA GLU A 14 14.565 94.351 44.506 1.00 0.00 C ATOM 142 C GLU A 14 13.326 95.028 45.117 1.00 0.00 C ATOM 143 O GLU A 14 13.267 96.261 45.122 1.00 0.00 O ATOM 144 CB GLU A 14 14.560 94.488 42.976 1.00 0.00 C ATOM 145 CG GLU A 14 15.212 95.794 42.518 1.00 0.00 C ATOM 146 CD GLU A 14 14.799 96.105 41.081 1.00 0.00 C ATOM 147 OE1 GLU A 14 15.424 95.570 40.135 1.00 0.00 O ATOM 148 OE2 GLU A 14 13.856 96.909 40.919 1.00 0.00 O ATOM 0 H GLU A 14 13.775 92.462 44.882 1.00 0.00 H new ATOM 0 HA GLU A 14 15.420 94.868 44.942 1.00 0.00 H new ATOM 0 HB2 GLU A 14 15.089 93.644 42.534 1.00 0.00 H new ATOM 0 HB3 GLU A 14 13.534 94.447 42.611 1.00 0.00 H new ATOM 0 HG2 GLU A 14 14.913 96.610 43.176 1.00 0.00 H new ATOM 0 HG3 GLU A 14 16.297 95.712 42.584 1.00 0.00 H new ATOM 155 N ILE A 15 12.368 94.268 45.670 1.00 0.00 N ATOM 156 CA ILE A 15 11.063 94.767 46.166 1.00 0.00 C ATOM 157 C ILE A 15 11.214 95.910 47.174 1.00 0.00 C ATOM 158 O ILE A 15 10.443 96.865 47.121 1.00 0.00 O ATOM 159 CB ILE A 15 10.248 93.597 46.784 1.00 0.00 C ATOM 160 CG1 ILE A 15 9.801 92.556 45.739 1.00 0.00 C ATOM 161 CG2 ILE A 15 9.011 94.068 47.589 1.00 0.00 C ATOM 162 CD1 ILE A 15 8.739 93.001 44.718 1.00 0.00 C ATOM 0 H ILE A 15 12.477 93.261 45.791 1.00 0.00 H new ATOM 0 HA ILE A 15 10.524 95.174 45.310 1.00 0.00 H new ATOM 0 HB ILE A 15 10.947 93.124 47.473 1.00 0.00 H new ATOM 0 HG12 ILE A 15 10.683 92.228 45.189 1.00 0.00 H new ATOM 0 HG13 ILE A 15 9.416 91.686 46.271 1.00 0.00 H new ATOM 0 HG21 ILE A 15 8.488 93.201 47.993 1.00 0.00 H new ATOM 0 HG22 ILE A 15 9.333 94.711 48.408 1.00 0.00 H new ATOM 0 HG23 ILE A 15 8.340 94.624 46.934 1.00 0.00 H new ATOM 0 HD11 ILE A 15 8.515 92.175 44.042 1.00 0.00 H new ATOM 0 HD12 ILE A 15 7.831 93.296 45.243 1.00 0.00 H new ATOM 0 HD13 ILE A 15 9.118 93.847 44.144 1.00 0.00 H new ATOM 174 N VAL A 16 12.207 95.835 48.071 1.00 0.00 N ATOM 175 CA VAL A 16 12.578 96.971 48.937 1.00 0.00 C ATOM 176 C VAL A 16 14.091 97.014 49.230 1.00 0.00 C ATOM 177 O VAL A 16 14.749 97.957 48.790 1.00 0.00 O ATOM 178 CB VAL A 16 11.669 97.053 50.181 1.00 0.00 C ATOM 179 CG1 VAL A 16 11.943 95.993 51.265 1.00 0.00 C ATOM 180 CG2 VAL A 16 11.720 98.450 50.790 1.00 0.00 C ATOM 0 H VAL A 16 12.771 94.998 48.219 1.00 0.00 H new ATOM 0 HA VAL A 16 12.389 97.894 48.388 1.00 0.00 H new ATOM 0 HB VAL A 16 10.668 96.834 49.810 1.00 0.00 H new ATOM 0 HG11 VAL A 16 11.253 96.136 52.096 1.00 0.00 H new ATOM 0 HG12 VAL A 16 11.803 94.997 50.844 1.00 0.00 H new ATOM 0 HG13 VAL A 16 12.968 96.095 51.623 1.00 0.00 H new ATOM 0 HG21 VAL A 16 11.073 98.489 51.666 1.00 0.00 H new ATOM 0 HG22 VAL A 16 12.744 98.681 51.084 1.00 0.00 H new ATOM 0 HG23 VAL A 16 11.380 99.180 50.055 1.00 0.00 H new ATOM 190 N CYS A 17 14.666 95.994 49.879 1.00 0.00 N ATOM 191 CA CYS A 17 16.120 95.911 50.164 1.00 0.00 C ATOM 192 C CYS A 17 16.568 94.472 50.523 1.00 0.00 C ATOM 193 O CYS A 17 17.091 94.238 51.605 1.00 0.00 O ATOM 194 CB CYS A 17 16.478 96.920 51.269 1.00 0.00 C ATOM 195 SG CYS A 17 18.258 97.280 51.193 1.00 0.00 S ATOM 0 H CYS A 17 14.139 95.193 50.227 1.00 0.00 H new ATOM 0 HA CYS A 17 16.668 96.171 49.258 1.00 0.00 H new ATOM 0 HB2 CYS A 17 15.903 97.837 51.141 1.00 0.00 H new ATOM 0 HB3 CYS A 17 16.218 96.515 52.247 1.00 0.00 H new ATOM 0 HG CYS A 17 18.568 98.134 52.123 1.00 0.00 H new ATOM 201 N ARG A 18 16.320 93.491 49.642 1.00 0.00 N ATOM 202 CA ARG A 18 16.766 92.089 49.828 1.00 0.00 C ATOM 203 C ARG A 18 17.797 91.684 48.783 1.00 0.00 C ATOM 204 O ARG A 18 17.660 92.094 47.631 1.00 0.00 O ATOM 205 CB ARG A 18 15.576 91.102 49.798 1.00 0.00 C ATOM 206 CG ARG A 18 14.582 91.315 50.949 1.00 0.00 C ATOM 207 CD ARG A 18 13.292 92.035 50.494 1.00 0.00 C ATOM 208 NE ARG A 18 12.215 91.104 50.102 1.00 0.00 N ATOM 209 CZ ARG A 18 11.418 90.459 50.945 1.00 0.00 C ATOM 210 NH1 ARG A 18 11.641 90.465 52.222 1.00 0.00 N ATOM 211 NH2 ARG A 18 10.375 89.800 50.529 1.00 0.00 N ATOM 0 H ARG A 18 15.803 93.641 48.776 1.00 0.00 H new ATOM 0 HA ARG A 18 17.232 92.040 50.812 1.00 0.00 H new ATOM 0 HB2 ARG A 18 15.050 91.206 48.849 1.00 0.00 H new ATOM 0 HB3 ARG A 18 15.958 90.082 49.841 1.00 0.00 H new ATOM 0 HG2 ARG A 18 14.321 90.349 51.382 1.00 0.00 H new ATOM 0 HG3 ARG A 18 15.061 91.898 51.735 1.00 0.00 H new ATOM 0 HD2 ARG A 18 12.935 92.674 51.302 1.00 0.00 H new ATOM 0 HD3 ARG A 18 13.525 92.687 49.652 1.00 0.00 H new ATOM 0 HE ARG A 18 12.072 90.944 49.105 1.00 0.00 H new ATOM 0 HH11 ARG A 18 12.442 90.972 52.597 1.00 0.00 H new ATOM 0 HH12 ARG A 18 11.015 89.962 52.851 1.00 0.00 H new ATOM 0 HH21 ARG A 18 10.154 89.771 49.534 1.00 0.00 H new ATOM 0 HH22 ARG A 18 9.779 89.313 51.198 1.00 0.00 H new ATOM 225 N ARG A 19 18.760 90.828 49.136 1.00 0.00 N ATOM 226 CA ARG A 19 19.668 90.118 48.227 1.00 0.00 C ATOM 227 C ARG A 19 20.031 88.756 48.845 1.00 0.00 C ATOM 228 O ARG A 19 20.576 88.721 49.946 1.00 0.00 O ATOM 229 CB ARG A 19 20.958 90.928 47.958 1.00 0.00 C ATOM 230 CG ARG A 19 20.738 92.266 47.238 1.00 0.00 C ATOM 231 CD ARG A 19 22.081 92.800 46.742 1.00 0.00 C ATOM 232 NE ARG A 19 22.040 94.219 46.343 1.00 0.00 N ATOM 233 CZ ARG A 19 23.053 94.913 45.854 1.00 0.00 C ATOM 234 NH1 ARG A 19 24.197 94.369 45.531 1.00 0.00 N ATOM 235 NH2 ARG A 19 22.939 96.192 45.695 1.00 0.00 N ATOM 0 H ARG A 19 18.938 90.599 50.114 1.00 0.00 H new ATOM 0 HA ARG A 19 19.160 89.980 47.273 1.00 0.00 H new ATOM 0 HB2 ARG A 19 21.455 91.120 48.909 1.00 0.00 H new ATOM 0 HB3 ARG A 19 21.636 90.318 47.362 1.00 0.00 H new ATOM 0 HG2 ARG A 19 20.055 92.133 46.399 1.00 0.00 H new ATOM 0 HG3 ARG A 19 20.276 92.984 47.915 1.00 0.00 H new ATOM 0 HD2 ARG A 19 22.826 92.673 47.528 1.00 0.00 H new ATOM 0 HD3 ARG A 19 22.409 92.201 45.892 1.00 0.00 H new ATOM 0 HE ARG A 19 21.152 94.708 46.454 1.00 0.00 H new ATOM 0 HH11 ARG A 19 24.337 93.366 45.653 1.00 0.00 H new ATOM 0 HH12 ARG A 19 24.949 94.947 45.157 1.00 0.00 H new ATOM 0 HH21 ARG A 19 22.069 96.662 45.947 1.00 0.00 H new ATOM 0 HH22 ARG A 19 23.719 96.731 45.318 1.00 0.00 H new ATOM 249 N GLU A 20 19.719 87.665 48.138 1.00 0.00 N ATOM 250 CA GLU A 20 19.884 86.269 48.578 1.00 0.00 C ATOM 251 C GLU A 20 19.504 86.055 50.067 1.00 0.00 C ATOM 252 O GLU A 20 18.311 86.122 50.366 1.00 0.00 O ATOM 253 CB GLU A 20 21.243 85.694 48.097 1.00 0.00 C ATOM 254 CG GLU A 20 21.105 84.782 46.862 1.00 0.00 C ATOM 255 CD GLU A 20 20.625 85.465 45.570 1.00 0.00 C ATOM 256 OE1 GLU A 20 20.527 86.712 45.502 1.00 0.00 O ATOM 257 OE2 GLU A 20 20.366 84.748 44.575 1.00 0.00 O ATOM 0 H GLU A 20 19.326 87.730 47.199 1.00 0.00 H new ATOM 0 HA GLU A 20 19.145 85.643 48.078 1.00 0.00 H new ATOM 0 HB2 GLU A 20 21.917 86.517 47.861 1.00 0.00 H new ATOM 0 HB3 GLU A 20 21.701 85.130 48.909 1.00 0.00 H new ATOM 0 HG2 GLU A 20 22.072 84.319 46.667 1.00 0.00 H new ATOM 0 HG3 GLU A 20 20.410 83.978 47.104 1.00 0.00 H new ATOM 264 N PHE A 21 20.459 85.883 50.995 1.00 0.00 N ATOM 265 CA PHE A 21 20.233 86.024 52.437 1.00 0.00 C ATOM 266 C PHE A 21 20.651 87.425 52.931 1.00 0.00 C ATOM 267 O PHE A 21 19.780 88.246 53.256 1.00 0.00 O ATOM 268 CB PHE A 21 20.893 84.883 53.229 1.00 0.00 C ATOM 269 CG PHE A 21 19.903 83.849 53.744 1.00 0.00 C ATOM 270 CD1 PHE A 21 19.377 82.877 52.868 1.00 0.00 C ATOM 271 CD2 PHE A 21 19.531 83.844 55.102 1.00 0.00 C ATOM 272 CE1 PHE A 21 18.478 81.904 53.359 1.00 0.00 C ATOM 273 CE2 PHE A 21 18.633 82.878 55.581 1.00 0.00 C ATOM 274 CZ PHE A 21 18.106 81.909 54.715 1.00 0.00 C ATOM 0 H PHE A 21 21.421 85.639 50.759 1.00 0.00 H new ATOM 0 HA PHE A 21 19.163 85.937 52.623 1.00 0.00 H new ATOM 0 HB2 PHE A 21 21.626 84.387 52.593 1.00 0.00 H new ATOM 0 HB3 PHE A 21 21.437 85.305 54.074 1.00 0.00 H new ATOM 0 HD1 PHE A 21 19.660 82.876 51.826 1.00 0.00 H new ATOM 0 HD2 PHE A 21 19.937 84.584 55.775 1.00 0.00 H new ATOM 0 HE1 PHE A 21 18.076 81.156 52.692 1.00 0.00 H new ATOM 0 HE2 PHE A 21 18.346 82.881 56.622 1.00 0.00 H new ATOM 0 HZ PHE A 21 17.415 81.168 55.089 1.00 0.00 H new ATOM 284 N GLY A 22 21.952 87.719 52.938 1.00 0.00 N ATOM 285 CA GLY A 22 22.500 89.032 53.319 1.00 0.00 C ATOM 286 C GLY A 22 23.572 89.498 52.336 1.00 0.00 C ATOM 287 O GLY A 22 24.479 88.739 52.006 1.00 0.00 O ATOM 0 H GLY A 22 22.670 87.044 52.676 1.00 0.00 H new ATOM 0 HA2 GLY A 22 21.695 89.766 53.356 1.00 0.00 H new ATOM 0 HA3 GLY A 22 22.925 88.973 54.321 1.00 0.00 H new ATOM 291 N HIS A 23 23.472 90.761 51.881 1.00 0.00 N ATOM 292 CA HIS A 23 24.389 91.516 51.000 1.00 0.00 C ATOM 293 C HIS A 23 24.962 90.807 49.754 1.00 0.00 C ATOM 294 O HIS A 23 24.644 91.226 48.637 1.00 0.00 O ATOM 295 CB HIS A 23 25.524 92.165 51.809 1.00 0.00 C ATOM 296 CG HIS A 23 25.116 93.236 52.781 1.00 0.00 C ATOM 297 ND1 HIS A 23 25.676 93.397 54.045 1.00 0.00 N ATOM 298 CD2 HIS A 23 24.293 94.291 52.523 1.00 0.00 C ATOM 299 CE1 HIS A 23 25.157 94.541 54.535 1.00 0.00 C ATOM 300 NE2 HIS A 23 24.329 95.092 53.634 1.00 0.00 N ATOM 0 H HIS A 23 22.671 91.335 52.145 1.00 0.00 H new ATOM 0 HA HIS A 23 23.722 92.263 50.571 1.00 0.00 H new ATOM 0 HB2 HIS A 23 26.043 91.381 52.361 1.00 0.00 H new ATOM 0 HB3 HIS A 23 26.243 92.592 51.110 1.00 0.00 H new ATOM 0 HD2 HIS A 23 23.725 94.462 51.621 1.00 0.00 H new ATOM 0 HE1 HIS A 23 25.375 94.953 55.509 1.00 0.00 H new ATOM 0 HE2 HIS A 23 23.812 95.963 53.756 1.00 0.00 H new ATOM 308 N LYS A 24 25.868 89.837 49.910 1.00 0.00 N ATOM 309 CA LYS A 24 26.539 89.118 48.799 1.00 0.00 C ATOM 310 C LYS A 24 25.903 87.753 48.587 1.00 0.00 C ATOM 311 O LYS A 24 25.445 87.483 47.478 1.00 0.00 O ATOM 312 CB LYS A 24 28.060 88.956 49.030 1.00 0.00 C ATOM 313 CG LYS A 24 28.915 90.227 48.868 1.00 0.00 C ATOM 314 CD LYS A 24 28.708 91.348 49.891 1.00 0.00 C ATOM 315 CE LYS A 24 28.665 90.921 51.363 1.00 0.00 C ATOM 316 NZ LYS A 24 29.989 90.493 51.894 1.00 0.00 N ATOM 0 H LYS A 24 26.169 89.515 50.830 1.00 0.00 H new ATOM 0 HA LYS A 24 26.406 89.728 47.905 1.00 0.00 H new ATOM 0 HB2 LYS A 24 28.213 88.567 50.036 1.00 0.00 H new ATOM 0 HB3 LYS A 24 28.433 88.202 48.336 1.00 0.00 H new ATOM 0 HG2 LYS A 24 29.964 89.934 48.897 1.00 0.00 H new ATOM 0 HG3 LYS A 24 28.726 90.637 47.876 1.00 0.00 H new ATOM 0 HD2 LYS A 24 29.510 92.076 49.769 1.00 0.00 H new ATOM 0 HD3 LYS A 24 27.775 91.859 49.655 1.00 0.00 H new ATOM 0 HE2 LYS A 24 28.292 91.751 51.963 1.00 0.00 H new ATOM 0 HE3 LYS A 24 27.955 90.102 51.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 29.890 90.218 52.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 30.338 89.682 51.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 30.665 91.280 51.817 1.00 0.00 H new ATOM 330 N GLU A 25 25.860 86.915 49.628 1.00 0.00 N ATOM 331 CA GLU A 25 25.418 85.522 49.594 1.00 0.00 C ATOM 332 C GLU A 25 24.681 85.112 50.893 1.00 0.00 C ATOM 333 O GLU A 25 23.461 84.897 50.856 1.00 0.00 O ATOM 334 CB GLU A 25 26.622 84.596 49.334 1.00 0.00 C ATOM 335 CG GLU A 25 26.876 84.335 47.847 1.00 0.00 C ATOM 336 CD GLU A 25 25.841 83.346 47.308 1.00 0.00 C ATOM 337 OE1 GLU A 25 26.009 82.124 47.540 1.00 0.00 O ATOM 338 OE2 GLU A 25 24.820 83.789 46.731 1.00 0.00 O ATOM 0 H GLU A 25 26.147 87.207 50.562 1.00 0.00 H new ATOM 0 HA GLU A 25 24.703 85.419 48.778 1.00 0.00 H new ATOM 0 HB2 GLU A 25 27.514 85.040 49.775 1.00 0.00 H new ATOM 0 HB3 GLU A 25 26.456 83.645 49.839 1.00 0.00 H new ATOM 0 HG2 GLU A 25 26.822 85.271 47.290 1.00 0.00 H new ATOM 0 HG3 GLU A 25 27.881 83.937 47.705 1.00 0.00 H new ATOM 345 N GLU A 26 25.391 84.988 52.022 1.00 0.00 N ATOM 346 CA GLU A 26 24.850 84.490 53.293 1.00 0.00 C ATOM 347 C GLU A 26 24.960 85.567 54.388 1.00 0.00 C ATOM 348 O GLU A 26 23.959 86.173 54.738 1.00 0.00 O ATOM 349 CB GLU A 26 25.491 83.135 53.676 1.00 0.00 C ATOM 350 CG GLU A 26 25.167 82.023 52.659 1.00 0.00 C ATOM 351 CD GLU A 26 25.952 80.727 52.893 1.00 0.00 C ATOM 352 OE1 GLU A 26 25.712 80.064 53.934 1.00 0.00 O ATOM 353 OE2 GLU A 26 26.748 80.352 52.002 1.00 0.00 O ATOM 0 H GLU A 26 26.379 85.236 52.078 1.00 0.00 H new ATOM 0 HA GLU A 26 23.785 84.287 53.177 1.00 0.00 H new ATOM 0 HB2 GLU A 26 26.572 83.255 53.747 1.00 0.00 H new ATOM 0 HB3 GLU A 26 25.138 82.835 54.663 1.00 0.00 H new ATOM 0 HG2 GLU A 26 24.100 81.804 52.701 1.00 0.00 H new ATOM 0 HG3 GLU A 26 25.378 82.389 51.654 1.00 0.00 H new ATOM 360 N GLU A 27 26.177 85.884 54.841 1.00 0.00 N ATOM 361 CA GLU A 27 26.487 87.119 55.604 1.00 0.00 C ATOM 362 C GLU A 27 27.968 87.506 55.370 1.00 0.00 C ATOM 363 O GLU A 27 28.236 88.411 54.569 1.00 0.00 O ATOM 364 CB GLU A 27 26.138 86.992 57.113 1.00 0.00 C ATOM 365 CG GLU A 27 25.016 87.943 57.582 1.00 0.00 C ATOM 366 CD GLU A 27 25.388 89.444 57.560 1.00 0.00 C ATOM 367 OE1 GLU A 27 26.383 89.842 56.917 1.00 0.00 O ATOM 368 OE2 GLU A 27 24.636 90.277 58.125 1.00 0.00 O ATOM 0 H GLU A 27 26.992 85.289 54.691 1.00 0.00 H new ATOM 0 HA GLU A 27 25.853 87.924 55.233 1.00 0.00 H new ATOM 0 HB2 GLU A 27 25.839 85.965 57.321 1.00 0.00 H new ATOM 0 HB3 GLU A 27 27.035 87.188 57.700 1.00 0.00 H new ATOM 0 HG2 GLU A 27 24.141 87.790 56.950 1.00 0.00 H new ATOM 0 HG3 GLU A 27 24.727 87.669 58.597 1.00 0.00 H new ATOM 375 N ASP A 28 28.924 86.800 55.973 1.00 0.00 N ATOM 376 CA ASP A 28 30.369 87.078 55.867 1.00 0.00 C ATOM 377 C ASP A 28 31.175 85.851 55.408 1.00 0.00 C ATOM 378 O ASP A 28 31.118 84.776 56.024 1.00 0.00 O ATOM 379 CB ASP A 28 30.884 87.602 57.219 1.00 0.00 C ATOM 380 CG ASP A 28 32.410 87.810 57.204 1.00 0.00 C ATOM 381 OD1 ASP A 28 32.934 88.316 56.187 1.00 0.00 O ATOM 382 OD2 ASP A 28 33.055 87.468 58.226 1.00 0.00 O ATOM 0 H ASP A 28 28.717 85.996 56.566 1.00 0.00 H new ATOM 0 HA ASP A 28 30.511 87.838 55.099 1.00 0.00 H new ATOM 0 HB2 ASP A 28 30.390 88.544 57.456 1.00 0.00 H new ATOM 0 HB3 ASP A 28 30.620 86.897 58.007 1.00 0.00 H new ATOM 387 N ALA A 29 31.949 86.041 54.334 1.00 0.00 N ATOM 388 CA ALA A 29 32.983 85.149 53.816 1.00 0.00 C ATOM 389 C ALA A 29 33.896 85.935 52.835 1.00 0.00 C ATOM 390 O ALA A 29 33.980 85.601 51.639 1.00 0.00 O ATOM 391 CB ALA A 29 32.335 83.912 53.173 1.00 0.00 C ATOM 0 H ALA A 29 31.860 86.883 53.766 1.00 0.00 H new ATOM 0 HA ALA A 29 33.615 84.785 54.626 1.00 0.00 H new ATOM 0 HB1 ALA A 29 33.113 83.252 52.789 1.00 0.00 H new ATOM 0 HB2 ALA A 29 31.744 83.381 53.920 1.00 0.00 H new ATOM 0 HB3 ALA A 29 31.688 84.225 52.354 1.00 0.00 H new ATOM 397 N SER A 30 34.487 87.051 53.292 1.00 0.00 N ATOM 398 CA SER A 30 35.282 87.971 52.448 1.00 0.00 C ATOM 399 C SER A 30 36.522 88.563 53.155 1.00 0.00 C ATOM 400 O SER A 30 37.248 89.377 52.566 1.00 0.00 O ATOM 401 CB SER A 30 34.369 89.113 51.979 1.00 0.00 C ATOM 402 OG SER A 30 34.739 89.601 50.696 1.00 0.00 O ATOM 0 H SER A 30 34.428 87.347 54.266 1.00 0.00 H new ATOM 0 HA SER A 30 35.663 87.386 51.611 1.00 0.00 H new ATOM 0 HB2 SER A 30 33.337 88.763 51.949 1.00 0.00 H new ATOM 0 HB3 SER A 30 34.408 89.928 52.702 1.00 0.00 H new ATOM 0 HG SER A 30 34.133 90.325 50.434 1.00 0.00 H new ATOM 408 N GLU A 31 36.759 88.198 54.411 1.00 0.00 N ATOM 409 CA GLU A 31 37.620 88.901 55.352 1.00 0.00 C ATOM 410 C GLU A 31 38.501 87.953 56.193 1.00 0.00 C ATOM 411 O GLU A 31 38.421 86.729 56.055 1.00 0.00 O ATOM 412 CB GLU A 31 36.719 89.775 56.263 1.00 0.00 C ATOM 413 CG GLU A 31 36.599 91.206 55.732 1.00 0.00 C ATOM 414 CD GLU A 31 37.831 92.065 56.034 1.00 0.00 C ATOM 415 OE1 GLU A 31 38.881 91.547 56.486 1.00 0.00 O ATOM 416 OE2 GLU A 31 37.724 93.299 55.853 1.00 0.00 O ATOM 0 H GLU A 31 36.335 87.364 54.818 1.00 0.00 H new ATOM 0 HA GLU A 31 38.318 89.520 54.788 1.00 0.00 H new ATOM 0 HB2 GLU A 31 35.727 89.328 56.332 1.00 0.00 H new ATOM 0 HB3 GLU A 31 37.131 89.794 57.272 1.00 0.00 H new ATOM 0 HG2 GLU A 31 36.441 91.175 54.654 1.00 0.00 H new ATOM 0 HG3 GLU A 31 35.719 91.677 56.170 1.00 0.00 H new ATOM 423 N GLY A 32 39.371 88.543 57.023 1.00 0.00 N ATOM 424 CA GLY A 32 40.101 87.835 58.080 1.00 0.00 C ATOM 425 C GLY A 32 41.260 86.927 57.610 1.00 0.00 C ATOM 426 O GLY A 32 41.847 86.229 58.439 1.00 0.00 O ATOM 0 H GLY A 32 39.590 89.538 56.978 1.00 0.00 H new ATOM 0 HA2 GLY A 32 40.502 88.573 58.774 1.00 0.00 H new ATOM 0 HA3 GLY A 32 39.391 87.225 58.639 1.00 0.00 H new ATOM 430 N VAL A 33 41.584 86.880 56.315 1.00 0.00 N ATOM 431 CA VAL A 33 42.762 86.210 55.753 1.00 0.00 C ATOM 432 C VAL A 33 43.056 86.698 54.331 1.00 0.00 C ATOM 433 O VAL A 33 42.137 86.783 53.520 1.00 0.00 O ATOM 434 CB VAL A 33 42.586 84.667 55.780 1.00 0.00 C ATOM 435 CG1 VAL A 33 41.348 84.138 55.031 1.00 0.00 C ATOM 436 CG2 VAL A 33 43.833 83.945 55.252 1.00 0.00 C ATOM 0 H VAL A 33 41.010 87.326 55.599 1.00 0.00 H new ATOM 0 HA VAL A 33 43.618 86.468 56.377 1.00 0.00 H new ATOM 0 HB VAL A 33 42.434 84.443 56.836 1.00 0.00 H new ATOM 0 HG11 VAL A 33 41.313 83.051 55.107 1.00 0.00 H new ATOM 0 HG12 VAL A 33 40.446 84.562 55.473 1.00 0.00 H new ATOM 0 HG13 VAL A 33 41.407 84.426 53.981 1.00 0.00 H new ATOM 0 HG21 VAL A 33 43.672 82.868 55.287 1.00 0.00 H new ATOM 0 HG22 VAL A 33 44.022 84.251 54.223 1.00 0.00 H new ATOM 0 HG23 VAL A 33 44.692 84.203 55.871 1.00 0.00 H new ATOM 446 N THR A 34 44.315 86.996 54.007 1.00 0.00 N ATOM 447 CA THR A 34 44.781 87.276 52.627 1.00 0.00 C ATOM 448 C THR A 34 46.252 86.889 52.402 1.00 0.00 C ATOM 449 O THR A 34 47.026 86.763 53.347 1.00 0.00 O ATOM 450 CB THR A 34 44.649 88.767 52.248 1.00 0.00 C ATOM 451 OG1 THR A 34 45.455 89.593 53.052 1.00 0.00 O ATOM 452 CG2 THR A 34 43.232 89.331 52.274 1.00 0.00 C ATOM 0 H THR A 34 45.061 87.053 54.700 1.00 0.00 H new ATOM 0 HA THR A 34 44.132 86.664 52.000 1.00 0.00 H new ATOM 0 HB THR A 34 44.985 88.778 51.211 1.00 0.00 H new ATOM 0 HG1 THR A 34 45.342 90.527 52.777 1.00 0.00 H new ATOM 0 HG21 THR A 34 43.254 90.384 51.992 1.00 0.00 H new ATOM 0 HG22 THR A 34 42.608 88.780 51.570 1.00 0.00 H new ATOM 0 HG23 THR A 34 42.820 89.233 53.278 1.00 0.00 H new ATOM 460 N THR A 35 46.649 86.750 51.139 1.00 0.00 N ATOM 461 CA THR A 35 48.029 86.863 50.625 1.00 0.00 C ATOM 462 C THR A 35 48.201 88.243 49.975 1.00 0.00 C ATOM 463 O THR A 35 47.348 88.686 49.204 1.00 0.00 O ATOM 464 CB THR A 35 48.341 85.708 49.660 1.00 0.00 C ATOM 465 OG1 THR A 35 48.867 84.609 50.386 1.00 0.00 O ATOM 466 CG2 THR A 35 49.331 86.018 48.524 1.00 0.00 C ATOM 0 H THR A 35 45.982 86.543 50.395 1.00 0.00 H new ATOM 0 HA THR A 35 48.747 86.781 51.441 1.00 0.00 H new ATOM 0 HB THR A 35 47.382 85.498 49.186 1.00 0.00 H new ATOM 0 HG1 THR A 35 49.064 83.873 49.769 1.00 0.00 H new ATOM 0 HG21 THR A 35 49.471 85.128 47.911 1.00 0.00 H new ATOM 0 HG22 THR A 35 48.936 86.825 47.907 1.00 0.00 H new ATOM 0 HG23 THR A 35 50.288 86.321 48.948 1.00 0.00 H new ATOM 474 N GLY A 36 49.315 88.913 50.279 1.00 0.00 N ATOM 475 CA GLY A 36 49.639 90.263 49.810 1.00 0.00 C ATOM 476 C GLY A 36 50.870 90.882 50.499 1.00 0.00 C ATOM 477 O GLY A 36 51.364 90.334 51.488 1.00 0.00 O ATOM 0 H GLY A 36 50.040 88.518 50.878 1.00 0.00 H new ATOM 0 HA2 GLY A 36 49.814 90.232 48.735 1.00 0.00 H new ATOM 0 HA3 GLY A 36 48.778 90.911 49.974 1.00 0.00 H new ATOM 481 N ASP A 37 51.356 92.004 49.970 1.00 0.00 N ATOM 482 CA ASP A 37 52.482 92.789 50.493 1.00 0.00 C ATOM 483 C ASP A 37 52.212 94.310 50.402 1.00 0.00 C ATOM 484 O ASP A 37 52.558 94.946 49.408 1.00 0.00 O ATOM 485 CB ASP A 37 53.813 92.387 49.807 1.00 0.00 C ATOM 486 CG ASP A 37 53.830 92.251 48.281 1.00 0.00 C ATOM 487 OD1 ASP A 37 52.957 92.759 47.535 1.00 0.00 O ATOM 488 OD2 ASP A 37 54.732 91.523 47.799 1.00 0.00 O ATOM 0 H ASP A 37 50.959 92.413 49.124 1.00 0.00 H new ATOM 0 HA ASP A 37 52.584 92.555 51.553 1.00 0.00 H new ATOM 0 HB2 ASP A 37 54.566 93.125 50.084 1.00 0.00 H new ATOM 0 HB3 ASP A 37 54.130 91.434 50.230 1.00 0.00 H new ATOM 493 N PRO A 38 51.540 94.935 51.395 1.00 0.00 N ATOM 494 CA PRO A 38 51.145 96.341 51.321 1.00 0.00 C ATOM 495 C PRO A 38 52.319 97.333 51.379 1.00 0.00 C ATOM 496 O PRO A 38 52.227 98.408 50.796 1.00 0.00 O ATOM 497 CB PRO A 38 50.185 96.570 52.497 1.00 0.00 C ATOM 498 CG PRO A 38 50.579 95.488 53.494 1.00 0.00 C ATOM 499 CD PRO A 38 51.000 94.322 52.605 1.00 0.00 C ATOM 0 HA PRO A 38 50.682 96.531 50.352 1.00 0.00 H new ATOM 0 HB2 PRO A 38 50.300 97.568 52.921 1.00 0.00 H new ATOM 0 HB3 PRO A 38 49.144 96.473 52.190 1.00 0.00 H new ATOM 0 HG2 PRO A 38 51.394 95.815 54.140 1.00 0.00 H new ATOM 0 HG3 PRO A 38 49.746 95.218 54.143 1.00 0.00 H new ATOM 0 HD2 PRO A 38 51.748 93.701 53.099 1.00 0.00 H new ATOM 0 HD3 PRO A 38 50.152 93.677 52.374 1.00 0.00 H new ATOM 507 N ASP A 39 53.402 96.978 52.077 1.00 0.00 N ATOM 508 CA ASP A 39 54.553 97.860 52.307 1.00 0.00 C ATOM 509 C ASP A 39 55.797 97.468 51.487 1.00 0.00 C ATOM 510 O ASP A 39 56.676 98.302 51.278 1.00 0.00 O ATOM 511 CB ASP A 39 54.875 97.913 53.802 1.00 0.00 C ATOM 512 CG ASP A 39 53.727 98.485 54.637 1.00 0.00 C ATOM 513 OD1 ASP A 39 53.419 99.690 54.505 1.00 0.00 O ATOM 514 OD2 ASP A 39 53.148 97.732 55.451 1.00 0.00 O ATOM 0 H ASP A 39 53.506 96.058 52.504 1.00 0.00 H new ATOM 0 HA ASP A 39 54.270 98.853 51.958 1.00 0.00 H new ATOM 0 HB2 ASP A 39 55.109 96.908 54.154 1.00 0.00 H new ATOM 0 HB3 ASP A 39 55.767 98.520 53.955 1.00 0.00 H new ATOM 519 N CYS A 40 55.858 96.228 50.976 1.00 0.00 N ATOM 520 CA CYS A 40 56.983 95.677 50.205 1.00 0.00 C ATOM 521 C CYS A 40 56.604 95.400 48.729 1.00 0.00 C ATOM 522 O CYS A 40 56.464 94.246 48.338 1.00 0.00 O ATOM 523 CB CYS A 40 57.497 94.410 50.908 1.00 0.00 C ATOM 524 SG CYS A 40 58.097 94.767 52.588 1.00 0.00 S ATOM 0 H CYS A 40 55.098 95.558 51.093 1.00 0.00 H new ATOM 0 HA CYS A 40 57.781 96.419 50.171 1.00 0.00 H new ATOM 0 HB2 CYS A 40 56.697 93.671 50.957 1.00 0.00 H new ATOM 0 HB3 CYS A 40 58.302 93.969 50.320 1.00 0.00 H new ATOM 0 HG CYS A 40 58.518 93.668 53.141 1.00 0.00 H new ATOM 530 N PRO A 41 56.458 96.426 47.855 1.00 0.00 N ATOM 531 CA PRO A 41 56.078 96.273 46.439 1.00 0.00 C ATOM 532 C PRO A 41 57.192 95.684 45.527 1.00 0.00 C ATOM 533 O PRO A 41 57.394 96.133 44.395 1.00 0.00 O ATOM 534 CB PRO A 41 55.614 97.670 46.022 1.00 0.00 C ATOM 535 CG PRO A 41 56.473 98.591 46.880 1.00 0.00 C ATOM 536 CD PRO A 41 56.524 97.844 48.203 1.00 0.00 C ATOM 0 HA PRO A 41 55.293 95.526 46.320 1.00 0.00 H new ATOM 0 HB2 PRO A 41 55.773 97.846 44.958 1.00 0.00 H new ATOM 0 HB3 PRO A 41 54.551 97.816 46.214 1.00 0.00 H new ATOM 0 HG2 PRO A 41 57.466 98.734 46.455 1.00 0.00 H new ATOM 0 HG3 PRO A 41 56.027 99.580 46.988 1.00 0.00 H new ATOM 0 HD2 PRO A 41 57.441 98.072 48.747 1.00 0.00 H new ATOM 0 HD3 PRO A 41 55.692 98.129 48.847 1.00 0.00 H new ATOM 544 N PHE A 42 57.969 94.720 46.050 1.00 0.00 N ATOM 545 CA PHE A 42 59.171 94.140 45.424 1.00 0.00 C ATOM 546 C PHE A 42 59.552 92.762 46.008 1.00 0.00 C ATOM 547 O PHE A 42 60.692 92.329 45.881 1.00 0.00 O ATOM 548 CB PHE A 42 60.323 95.162 45.534 1.00 0.00 C ATOM 549 CG PHE A 42 60.438 95.860 46.878 1.00 0.00 C ATOM 550 CD1 PHE A 42 60.877 95.153 48.010 1.00 0.00 C ATOM 551 CD2 PHE A 42 60.042 97.211 46.991 1.00 0.00 C ATOM 552 CE1 PHE A 42 60.901 95.789 49.264 1.00 0.00 C ATOM 553 CE2 PHE A 42 60.076 97.847 48.246 1.00 0.00 C ATOM 554 CZ PHE A 42 60.495 97.131 49.387 1.00 0.00 C ATOM 0 H PHE A 42 57.768 94.305 46.960 1.00 0.00 H new ATOM 0 HA PHE A 42 58.958 93.944 44.373 1.00 0.00 H new ATOM 0 HB2 PHE A 42 61.263 94.651 45.326 1.00 0.00 H new ATOM 0 HB3 PHE A 42 60.193 95.918 44.759 1.00 0.00 H new ATOM 0 HD1 PHE A 42 61.195 94.125 47.917 1.00 0.00 H new ATOM 0 HD2 PHE A 42 59.714 97.754 46.117 1.00 0.00 H new ATOM 0 HE1 PHE A 42 61.232 95.245 50.136 1.00 0.00 H new ATOM 0 HE2 PHE A 42 59.782 98.882 48.335 1.00 0.00 H new ATOM 0 HZ PHE A 42 60.504 97.612 50.354 1.00 0.00 H new ATOM 564 N THR A 43 58.625 92.032 46.655 1.00 0.00 N ATOM 565 CA THR A 43 58.936 90.784 47.397 1.00 0.00 C ATOM 566 C THR A 43 59.398 89.619 46.505 1.00 0.00 C ATOM 567 O THR A 43 60.226 88.826 46.954 1.00 0.00 O ATOM 568 CB THR A 43 57.711 90.319 48.215 1.00 0.00 C ATOM 569 OG1 THR A 43 57.159 91.410 48.906 1.00 0.00 O ATOM 570 CG2 THR A 43 58.058 89.279 49.278 1.00 0.00 C ATOM 0 H THR A 43 57.637 92.286 46.682 1.00 0.00 H new ATOM 0 HA THR A 43 59.770 91.043 48.050 1.00 0.00 H new ATOM 0 HB THR A 43 57.022 89.883 47.492 1.00 0.00 H new ATOM 0 HG1 THR A 43 56.212 91.500 48.672 1.00 0.00 H new ATOM 0 HG21 THR A 43 57.154 88.994 49.817 1.00 0.00 H new ATOM 0 HG22 THR A 43 58.488 88.399 48.799 1.00 0.00 H new ATOM 0 HG23 THR A 43 58.780 89.700 49.977 1.00 0.00 H new ATOM 578 N LYS A 44 58.901 89.516 45.264 1.00 0.00 N ATOM 579 CA LYS A 44 58.898 88.282 44.438 1.00 0.00 C ATOM 580 C LYS A 44 58.196 87.118 45.160 1.00 0.00 C ATOM 581 O LYS A 44 57.487 87.322 46.152 1.00 0.00 O ATOM 582 CB LYS A 44 60.319 87.907 43.921 1.00 0.00 C ATOM 583 CG LYS A 44 61.025 88.904 42.972 1.00 0.00 C ATOM 584 CD LYS A 44 61.623 90.167 43.601 1.00 0.00 C ATOM 585 CE LYS A 44 62.582 89.833 44.746 1.00 0.00 C ATOM 586 NZ LYS A 44 63.153 91.044 45.379 1.00 0.00 N ATOM 0 H LYS A 44 58.475 90.309 44.785 1.00 0.00 H new ATOM 0 HA LYS A 44 58.309 88.495 43.546 1.00 0.00 H new ATOM 0 HB2 LYS A 44 60.962 87.756 44.788 1.00 0.00 H new ATOM 0 HB3 LYS A 44 60.247 86.948 43.407 1.00 0.00 H new ATOM 0 HG2 LYS A 44 61.825 88.372 42.458 1.00 0.00 H new ATOM 0 HG3 LYS A 44 60.307 89.213 42.212 1.00 0.00 H new ATOM 0 HD2 LYS A 44 62.153 90.737 42.838 1.00 0.00 H new ATOM 0 HD3 LYS A 44 60.820 90.803 43.973 1.00 0.00 H new ATOM 0 HE2 LYS A 44 62.054 89.248 45.499 1.00 0.00 H new ATOM 0 HE3 LYS A 44 63.391 89.209 44.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 63.700 90.771 46.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 63.777 91.528 44.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 62.383 91.685 45.660 1.00 0.00 H new ATOM 600 N ALA A 45 58.347 85.892 44.653 1.00 0.00 N ATOM 601 CA ALA A 45 57.899 84.654 45.304 1.00 0.00 C ATOM 602 C ALA A 45 58.573 84.423 46.674 1.00 0.00 C ATOM 603 O ALA A 45 59.587 85.040 46.989 1.00 0.00 O ATOM 604 CB ALA A 45 58.191 83.507 44.334 1.00 0.00 C ATOM 0 H ALA A 45 58.797 85.726 43.753 1.00 0.00 H new ATOM 0 HA ALA A 45 56.833 84.718 45.521 1.00 0.00 H new ATOM 0 HB1 ALA A 45 57.873 82.564 44.779 1.00 0.00 H new ATOM 0 HB2 ALA A 45 57.648 83.671 43.403 1.00 0.00 H new ATOM 0 HB3 ALA A 45 59.261 83.468 44.128 1.00 0.00 H new ATOM 610 N ILE A 46 58.003 83.492 47.462 1.00 0.00 N ATOM 611 CA ILE A 46 58.410 83.224 48.858 1.00 0.00 C ATOM 612 C ILE A 46 59.928 83.073 48.992 1.00 0.00 C ATOM 613 O ILE A 46 60.491 82.152 48.386 1.00 0.00 O ATOM 614 CB ILE A 46 57.711 81.951 49.393 1.00 0.00 C ATOM 615 CG1 ILE A 46 56.170 82.020 49.364 1.00 0.00 C ATOM 616 CG2 ILE A 46 58.181 81.600 50.818 1.00 0.00 C ATOM 617 CD1 ILE A 46 55.531 83.095 50.258 1.00 0.00 C ATOM 0 H ILE A 46 57.238 82.897 47.145 1.00 0.00 H new ATOM 0 HA ILE A 46 58.103 84.084 49.452 1.00 0.00 H new ATOM 0 HB ILE A 46 58.010 81.163 48.702 1.00 0.00 H new ATOM 0 HG12 ILE A 46 55.852 82.194 48.336 1.00 0.00 H new ATOM 0 HG13 ILE A 46 55.776 81.048 49.659 1.00 0.00 H new ATOM 0 HG21 ILE A 46 57.668 80.701 51.159 1.00 0.00 H new ATOM 0 HG22 ILE A 46 59.257 81.425 50.813 1.00 0.00 H new ATOM 0 HG23 ILE A 46 57.951 82.426 51.491 1.00 0.00 H new ATOM 0 HD11 ILE A 46 54.446 83.053 50.159 1.00 0.00 H new ATOM 0 HD12 ILE A 46 55.808 82.916 51.297 1.00 0.00 H new ATOM 0 HD13 ILE A 46 55.885 84.080 49.953 1.00 0.00 H new ATOM 629 N PRO A 47 60.622 83.931 49.778 1.00 0.00 N ATOM 630 CA PRO A 47 62.048 83.749 50.034 1.00 0.00 C ATOM 631 C PRO A 47 62.273 82.512 50.902 1.00 0.00 C ATOM 632 O PRO A 47 61.524 82.214 51.836 1.00 0.00 O ATOM 633 CB PRO A 47 62.507 85.060 50.678 1.00 0.00 C ATOM 634 CG PRO A 47 61.256 85.588 51.366 1.00 0.00 C ATOM 635 CD PRO A 47 60.125 85.115 50.462 1.00 0.00 C ATOM 0 HA PRO A 47 62.634 83.560 49.134 1.00 0.00 H new ATOM 0 HB2 PRO A 47 63.315 84.894 51.391 1.00 0.00 H new ATOM 0 HB3 PRO A 47 62.879 85.762 49.932 1.00 0.00 H new ATOM 0 HG2 PRO A 47 61.155 85.190 52.376 1.00 0.00 H new ATOM 0 HG3 PRO A 47 61.273 86.674 51.452 1.00 0.00 H new ATOM 0 HD2 PRO A 47 59.233 84.883 51.043 1.00 0.00 H new ATOM 0 HD3 PRO A 47 59.847 85.890 49.747 1.00 0.00 H new ATOM 643 N ARG A 48 63.332 81.762 50.581 1.00 0.00 N ATOM 644 CA ARG A 48 63.757 80.525 51.250 1.00 0.00 C ATOM 645 C ARG A 48 65.182 80.752 51.720 1.00 0.00 C ATOM 646 O ARG A 48 66.131 80.321 51.078 1.00 0.00 O ATOM 647 CB ARG A 48 63.623 79.320 50.289 1.00 0.00 C ATOM 648 CG ARG A 48 62.225 79.077 49.682 1.00 0.00 C ATOM 649 CD ARG A 48 61.327 78.096 50.445 1.00 0.00 C ATOM 650 NE ARG A 48 60.922 78.592 51.764 1.00 0.00 N ATOM 651 CZ ARG A 48 60.143 77.941 52.622 1.00 0.00 C ATOM 652 NH1 ARG A 48 59.559 76.812 52.355 1.00 0.00 N ATOM 653 NH2 ARG A 48 59.946 78.431 53.808 1.00 0.00 N ATOM 0 H ARG A 48 63.949 82.013 49.808 1.00 0.00 H new ATOM 0 HA ARG A 48 63.127 80.287 52.107 1.00 0.00 H new ATOM 0 HB2 ARG A 48 64.331 79.455 49.472 1.00 0.00 H new ATOM 0 HB3 ARG A 48 63.923 78.420 50.826 1.00 0.00 H new ATOM 0 HG2 ARG A 48 61.708 80.034 49.613 1.00 0.00 H new ATOM 0 HG3 ARG A 48 62.351 78.708 48.664 1.00 0.00 H new ATOM 0 HD2 ARG A 48 60.436 77.892 49.851 1.00 0.00 H new ATOM 0 HD3 ARG A 48 61.854 77.149 50.566 1.00 0.00 H new ATOM 0 HE ARG A 48 61.266 79.510 52.046 1.00 0.00 H new ATOM 0 HH11 ARG A 48 59.687 76.375 51.442 1.00 0.00 H new ATOM 0 HH12 ARG A 48 58.973 76.362 53.058 1.00 0.00 H new ATOM 0 HH21 ARG A 48 60.388 79.310 54.076 1.00 0.00 H new ATOM 0 HH22 ARG A 48 59.349 77.937 54.471 1.00 0.00 H new ATOM 667 N GLU A 49 65.351 81.531 52.789 1.00 0.00 N ATOM 668 CA GLU A 49 66.627 82.209 53.093 1.00 0.00 C ATOM 669 C GLU A 49 67.750 81.268 53.555 1.00 0.00 C ATOM 670 O GLU A 49 68.922 81.619 53.464 1.00 0.00 O ATOM 671 CB GLU A 49 66.348 83.318 54.125 1.00 0.00 C ATOM 672 CG GLU A 49 65.446 84.429 53.549 1.00 0.00 C ATOM 673 CD GLU A 49 66.195 85.255 52.496 1.00 0.00 C ATOM 674 OE1 GLU A 49 66.906 86.208 52.874 1.00 0.00 O ATOM 675 OE2 GLU A 49 66.108 84.941 51.283 1.00 0.00 O ATOM 0 H GLU A 49 64.615 81.714 53.471 1.00 0.00 H new ATOM 0 HA GLU A 49 67.008 82.636 52.165 1.00 0.00 H new ATOM 0 HB2 GLU A 49 65.872 82.884 55.004 1.00 0.00 H new ATOM 0 HB3 GLU A 49 67.292 83.752 54.455 1.00 0.00 H new ATOM 0 HG2 GLU A 49 64.556 83.985 53.103 1.00 0.00 H new ATOM 0 HG3 GLU A 49 65.107 85.081 54.354 1.00 0.00 H new ATOM 682 N GLU A 50 67.400 80.054 53.994 1.00 0.00 N ATOM 683 CA GLU A 50 68.313 78.949 54.342 1.00 0.00 C ATOM 684 C GLU A 50 68.412 77.904 53.210 1.00 0.00 C ATOM 685 O GLU A 50 68.985 76.833 53.391 1.00 0.00 O ATOM 686 CB GLU A 50 67.856 78.302 55.668 1.00 0.00 C ATOM 687 CG GLU A 50 67.872 79.208 56.901 1.00 0.00 C ATOM 688 CD GLU A 50 66.905 80.401 56.806 1.00 0.00 C ATOM 689 OE1 GLU A 50 65.725 80.166 56.449 1.00 0.00 O ATOM 690 OE2 GLU A 50 67.352 81.557 56.978 1.00 0.00 O ATOM 0 H GLU A 50 66.421 79.798 54.125 1.00 0.00 H new ATOM 0 HA GLU A 50 69.315 79.357 54.472 1.00 0.00 H new ATOM 0 HB2 GLU A 50 66.843 77.924 55.534 1.00 0.00 H new ATOM 0 HB3 GLU A 50 68.494 77.441 55.867 1.00 0.00 H new ATOM 0 HG2 GLU A 50 67.618 78.615 57.780 1.00 0.00 H new ATOM 0 HG3 GLU A 50 68.884 79.583 57.052 1.00 0.00 H new ATOM 697 N TYR A 51 67.798 78.170 52.053 1.00 0.00 N ATOM 698 CA TYR A 51 67.717 77.293 50.884 1.00 0.00 C ATOM 699 C TYR A 51 67.572 78.124 49.590 1.00 0.00 C ATOM 700 O TYR A 51 66.694 77.899 48.752 1.00 0.00 O ATOM 701 CB TYR A 51 66.585 76.267 51.111 1.00 0.00 C ATOM 702 CG TYR A 51 66.440 75.193 50.040 1.00 0.00 C ATOM 703 CD1 TYR A 51 67.547 74.399 49.642 1.00 0.00 C ATOM 704 CD2 TYR A 51 65.179 74.961 49.458 1.00 0.00 C ATOM 705 CE1 TYR A 51 67.380 73.412 48.654 1.00 0.00 C ATOM 706 CE2 TYR A 51 65.012 73.974 48.470 1.00 0.00 C ATOM 707 CZ TYR A 51 66.119 73.208 48.057 1.00 0.00 C ATOM 708 OH TYR A 51 65.958 72.282 47.069 1.00 0.00 O ATOM 0 H TYR A 51 67.316 79.056 51.900 1.00 0.00 H new ATOM 0 HA TYR A 51 68.640 76.727 50.755 1.00 0.00 H new ATOM 0 HB2 TYR A 51 66.751 75.777 52.070 1.00 0.00 H new ATOM 0 HB3 TYR A 51 65.641 76.807 51.188 1.00 0.00 H new ATOM 0 HD1 TYR A 51 68.515 74.552 50.096 1.00 0.00 H new ATOM 0 HD2 TYR A 51 64.330 75.548 49.774 1.00 0.00 H new ATOM 0 HE1 TYR A 51 68.222 72.807 48.351 1.00 0.00 H new ATOM 0 HE2 TYR A 51 64.040 73.805 48.031 1.00 0.00 H new ATOM 0 HH TYR A 51 65.023 72.276 46.775 1.00 0.00 H new ATOM 718 N ALA A 52 68.443 79.117 49.411 1.00 0.00 N ATOM 719 CA ALA A 52 68.519 79.989 48.226 1.00 0.00 C ATOM 720 C ALA A 52 69.223 79.333 47.017 1.00 0.00 C ATOM 721 O ALA A 52 69.405 79.972 45.969 1.00 0.00 O ATOM 722 CB ALA A 52 69.159 81.325 48.652 1.00 0.00 C ATOM 0 H ALA A 52 69.146 79.350 50.113 1.00 0.00 H new ATOM 0 HA ALA A 52 67.510 80.173 47.858 1.00 0.00 H new ATOM 0 HB1 ALA A 52 69.226 81.988 47.789 1.00 0.00 H new ATOM 0 HB2 ALA A 52 68.546 81.793 49.423 1.00 0.00 H new ATOM 0 HB3 ALA A 52 70.158 81.140 49.046 1.00 0.00 H new ATOM 728 N ASN A 53 69.565 78.051 47.160 1.00 0.00 N ATOM 729 CA ASN A 53 70.348 77.159 46.291 1.00 0.00 C ATOM 730 C ASN A 53 69.865 77.022 44.821 1.00 0.00 C ATOM 731 O ASN A 53 70.446 76.254 44.055 1.00 0.00 O ATOM 732 CB ASN A 53 70.340 75.778 46.995 1.00 0.00 C ATOM 733 CG ASN A 53 71.643 74.993 46.915 1.00 0.00 C ATOM 734 OD1 ASN A 53 72.197 74.552 47.917 1.00 0.00 O ATOM 735 ND2 ASN A 53 72.144 74.772 45.729 1.00 0.00 N ATOM 0 H ASN A 53 69.262 77.547 47.993 1.00 0.00 H new ATOM 0 HA ASN A 53 71.340 77.595 46.176 1.00 0.00 H new ATOM 0 HB2 ASN A 53 70.090 75.927 48.045 1.00 0.00 H new ATOM 0 HB3 ASN A 53 69.544 75.173 46.560 1.00 0.00 H new ATOM 0 HD21 ASN A 53 73.002 74.229 45.631 1.00 0.00 H new ATOM 0 HD22 ASN A 53 71.677 75.142 44.901 1.00 0.00 H new ATOM 742 N LYS A 54 68.780 77.704 44.435 1.00 0.00 N ATOM 743 CA LYS A 54 68.160 77.679 43.103 1.00 0.00 C ATOM 744 C LYS A 54 67.935 79.080 42.494 1.00 0.00 C ATOM 745 O LYS A 54 67.280 79.184 41.463 1.00 0.00 O ATOM 746 CB LYS A 54 66.844 76.871 43.179 1.00 0.00 C ATOM 747 CG LYS A 54 66.552 76.029 41.921 1.00 0.00 C ATOM 748 CD LYS A 54 67.409 74.752 41.876 1.00 0.00 C ATOM 749 CE LYS A 54 67.070 73.829 40.685 1.00 0.00 C ATOM 750 NZ LYS A 54 65.663 73.365 40.720 1.00 0.00 N ATOM 0 H LYS A 54 68.284 78.322 45.077 1.00 0.00 H new ATOM 0 HA LYS A 54 68.858 77.192 42.422 1.00 0.00 H new ATOM 0 HB2 LYS A 54 66.885 76.210 44.045 1.00 0.00 H new ATOM 0 HB3 LYS A 54 66.015 77.560 43.343 1.00 0.00 H new ATOM 0 HG2 LYS A 54 65.496 75.759 41.902 1.00 0.00 H new ATOM 0 HG3 LYS A 54 66.744 76.627 41.030 1.00 0.00 H new ATOM 0 HD2 LYS A 54 68.461 75.031 41.822 1.00 0.00 H new ATOM 0 HD3 LYS A 54 67.273 74.199 42.805 1.00 0.00 H new ATOM 0 HE2 LYS A 54 67.252 74.361 39.751 1.00 0.00 H new ATOM 0 HE3 LYS A 54 67.736 72.966 40.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 65.521 72.633 39.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 65.451 72.969 41.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 65.028 74.167 40.531 1.00 0.00 H new ATOM 764 N TYR A 55 68.422 80.148 43.148 1.00 0.00 N ATOM 765 CA TYR A 55 68.136 81.538 42.757 1.00 0.00 C ATOM 766 C TYR A 55 69.304 82.510 43.025 1.00 0.00 C ATOM 767 O TYR A 55 69.592 83.369 42.195 1.00 0.00 O ATOM 768 CB TYR A 55 66.869 82.006 43.505 1.00 0.00 C ATOM 769 CG TYR A 55 65.796 82.643 42.632 1.00 0.00 C ATOM 770 CD1 TYR A 55 66.100 83.752 41.821 1.00 0.00 C ATOM 771 CD2 TYR A 55 64.477 82.130 42.652 1.00 0.00 C ATOM 772 CE1 TYR A 55 65.096 84.348 41.032 1.00 0.00 C ATOM 773 CE2 TYR A 55 63.470 82.727 41.873 1.00 0.00 C ATOM 774 CZ TYR A 55 63.775 83.846 41.060 1.00 0.00 C ATOM 775 OH TYR A 55 62.793 84.431 40.318 1.00 0.00 O ATOM 0 H TYR A 55 69.027 80.071 43.965 1.00 0.00 H new ATOM 0 HA TYR A 55 67.983 81.551 41.678 1.00 0.00 H new ATOM 0 HB2 TYR A 55 66.434 81.150 44.020 1.00 0.00 H new ATOM 0 HB3 TYR A 55 67.163 82.723 44.271 1.00 0.00 H new ATOM 0 HD1 TYR A 55 67.105 84.147 41.803 1.00 0.00 H new ATOM 0 HD2 TYR A 55 64.243 81.275 43.269 1.00 0.00 H new ATOM 0 HE1 TYR A 55 65.337 85.192 40.403 1.00 0.00 H new ATOM 0 HE2 TYR A 55 62.465 82.333 41.895 1.00 0.00 H new ATOM 0 HH TYR A 55 61.949 83.954 40.459 1.00 0.00 H new ATOM 785 N GLY A 56 70.003 82.377 44.164 1.00 0.00 N ATOM 786 CA GLY A 56 71.081 83.306 44.546 1.00 0.00 C ATOM 787 C GLY A 56 72.383 83.118 43.763 1.00 0.00 C ATOM 788 O GLY A 56 72.629 82.026 43.239 1.00 0.00 O ATOM 0 H GLY A 56 69.840 81.631 44.840 1.00 0.00 H new ATOM 0 HA2 GLY A 56 70.730 84.328 44.405 1.00 0.00 H new ATOM 0 HA3 GLY A 56 71.289 83.185 45.609 1.00 0.00 H new ATOM 792 N PRO A 57 73.272 84.144 43.695 1.00 0.00 N ATOM 793 CA PRO A 57 74.620 84.031 43.125 1.00 0.00 C ATOM 794 C PRO A 57 75.594 83.265 44.044 1.00 0.00 C ATOM 795 O PRO A 57 76.706 82.928 43.634 1.00 0.00 O ATOM 796 CB PRO A 57 75.073 85.468 42.914 1.00 0.00 C ATOM 797 CG PRO A 57 74.386 86.221 44.046 1.00 0.00 C ATOM 798 CD PRO A 57 73.052 85.496 44.186 1.00 0.00 C ATOM 0 HA PRO A 57 74.608 83.456 42.199 1.00 0.00 H new ATOM 0 HB2 PRO A 57 76.158 85.560 42.969 1.00 0.00 H new ATOM 0 HB3 PRO A 57 74.770 85.846 41.937 1.00 0.00 H new ATOM 0 HG2 PRO A 57 74.966 86.179 44.968 1.00 0.00 H new ATOM 0 HG3 PRO A 57 74.248 87.275 43.804 1.00 0.00 H new ATOM 0 HD2 PRO A 57 72.722 85.484 45.225 1.00 0.00 H new ATOM 0 HD3 PRO A 57 72.274 85.998 43.610 1.00 0.00 H new ATOM 806 N THR A 58 75.195 82.981 45.282 1.00 0.00 N ATOM 807 CA THR A 58 75.916 82.119 46.231 1.00 0.00 C ATOM 808 C THR A 58 75.776 80.634 45.870 1.00 0.00 C ATOM 809 O THR A 58 74.820 80.244 45.193 1.00 0.00 O ATOM 810 CB THR A 58 75.388 82.375 47.654 1.00 0.00 C ATOM 811 OG1 THR A 58 73.996 82.172 47.715 1.00 0.00 O ATOM 812 CG2 THR A 58 75.604 83.813 48.121 1.00 0.00 C ATOM 0 H THR A 58 74.330 83.356 45.671 1.00 0.00 H new ATOM 0 HA THR A 58 76.976 82.366 46.180 1.00 0.00 H new ATOM 0 HB THR A 58 75.942 81.681 48.286 1.00 0.00 H new ATOM 0 HG1 THR A 58 73.681 82.338 48.628 1.00 0.00 H new ATOM 0 HG21 THR A 58 75.211 83.931 49.131 1.00 0.00 H new ATOM 0 HG22 THR A 58 76.670 84.040 48.118 1.00 0.00 H new ATOM 0 HG23 THR A 58 75.085 84.496 47.448 1.00 0.00 H new ATOM 820 N ILE A 59 76.687 79.796 46.386 1.00 0.00 N ATOM 821 CA ILE A 59 76.738 78.333 46.194 1.00 0.00 C ATOM 822 C ILE A 59 77.148 77.897 44.771 1.00 0.00 C ATOM 823 O ILE A 59 76.811 78.533 43.776 1.00 0.00 O ATOM 824 CB ILE A 59 75.439 77.647 46.738 1.00 0.00 C ATOM 825 CG1 ILE A 59 75.156 78.075 48.198 1.00 0.00 C ATOM 826 CG2 ILE A 59 75.484 76.114 46.610 1.00 0.00 C ATOM 827 CD1 ILE A 59 73.844 77.562 48.789 1.00 0.00 C ATOM 0 H ILE A 59 77.446 80.133 46.978 1.00 0.00 H new ATOM 0 HA ILE A 59 77.560 77.961 46.805 1.00 0.00 H new ATOM 0 HB ILE A 59 74.615 77.990 46.112 1.00 0.00 H new ATOM 0 HG12 ILE A 59 75.977 77.729 48.826 1.00 0.00 H new ATOM 0 HG13 ILE A 59 75.155 79.164 48.246 1.00 0.00 H new ATOM 0 HG21 ILE A 59 74.560 75.689 47.001 1.00 0.00 H new ATOM 0 HG22 ILE A 59 75.594 75.840 45.561 1.00 0.00 H new ATOM 0 HG23 ILE A 59 76.330 75.726 47.177 1.00 0.00 H new ATOM 0 HD11 ILE A 59 73.743 77.918 49.814 1.00 0.00 H new ATOM 0 HD12 ILE A 59 73.008 77.929 48.193 1.00 0.00 H new ATOM 0 HD13 ILE A 59 73.843 76.472 48.782 1.00 0.00 H new ATOM 839 N GLY A 60 77.909 76.798 44.663 1.00 0.00 N ATOM 840 CA GLY A 60 78.382 76.205 43.407 1.00 0.00 C ATOM 841 C GLY A 60 79.720 76.734 42.890 1.00 0.00 C ATOM 842 O GLY A 60 80.128 77.859 43.174 1.00 0.00 O ATOM 0 H GLY A 60 78.224 76.278 45.482 1.00 0.00 H new ATOM 0 HA2 GLY A 60 78.466 75.127 43.544 1.00 0.00 H new ATOM 0 HA3 GLY A 60 77.625 76.371 42.640 1.00 0.00 H new ATOM 846 N ASP A 61 80.406 75.919 42.070 1.00 0.00 N ATOM 847 CA ASP A 61 81.614 76.306 41.326 1.00 0.00 C ATOM 848 C ASP A 61 81.294 77.341 40.228 1.00 0.00 C ATOM 849 O ASP A 61 81.180 77.050 39.036 1.00 0.00 O ATOM 850 CB ASP A 61 82.342 75.070 40.791 1.00 0.00 C ATOM 851 CG ASP A 61 83.516 75.372 39.827 1.00 0.00 C ATOM 852 OD1 ASP A 61 84.122 76.469 39.877 1.00 0.00 O ATOM 853 OD2 ASP A 61 83.796 74.444 39.042 1.00 0.00 O ATOM 0 H ASP A 61 80.129 74.952 41.903 1.00 0.00 H new ATOM 0 HA ASP A 61 82.300 76.801 42.014 1.00 0.00 H new ATOM 0 HB2 ASP A 61 82.723 74.496 41.636 1.00 0.00 H new ATOM 0 HB3 ASP A 61 81.621 74.436 40.275 1.00 0.00 H new ATOM 858 N LYS A 62 81.183 78.595 40.665 1.00 0.00 N ATOM 859 CA LYS A 62 81.292 79.792 39.829 1.00 0.00 C ATOM 860 C LYS A 62 82.765 80.244 39.664 1.00 0.00 C ATOM 861 O LYS A 62 83.013 81.311 39.119 1.00 0.00 O ATOM 862 CB LYS A 62 80.413 80.888 40.464 1.00 0.00 C ATOM 863 CG LYS A 62 79.840 81.912 39.473 1.00 0.00 C ATOM 864 CD LYS A 62 78.827 81.285 38.487 1.00 0.00 C ATOM 865 CE LYS A 62 77.865 82.357 37.979 1.00 0.00 C ATOM 866 NZ LYS A 62 76.832 81.797 37.080 1.00 0.00 N ATOM 0 H LYS A 62 81.008 78.814 41.646 1.00 0.00 H new ATOM 0 HA LYS A 62 80.940 79.579 38.820 1.00 0.00 H new ATOM 0 HB2 LYS A 62 79.586 80.411 40.990 1.00 0.00 H new ATOM 0 HB3 LYS A 62 81.003 81.418 41.212 1.00 0.00 H new ATOM 0 HG2 LYS A 62 79.353 82.714 40.027 1.00 0.00 H new ATOM 0 HG3 LYS A 62 80.657 82.364 38.910 1.00 0.00 H new ATOM 0 HD2 LYS A 62 79.355 80.831 37.649 1.00 0.00 H new ATOM 0 HD3 LYS A 62 78.270 80.489 38.981 1.00 0.00 H new ATOM 0 HE2 LYS A 62 77.382 82.842 38.828 1.00 0.00 H new ATOM 0 HE3 LYS A 62 78.427 83.126 37.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 76.201 82.559 36.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 77.290 81.357 36.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 76.278 81.081 37.592 1.00 0.00 H new ATOM 880 N ILE A 63 83.720 79.471 40.187 1.00 0.00 N ATOM 881 CA ILE A 63 85.044 79.975 40.584 1.00 0.00 C ATOM 882 C ILE A 63 85.965 80.054 39.374 1.00 0.00 C ATOM 883 O ILE A 63 86.243 81.142 38.882 1.00 0.00 O ATOM 884 CB ILE A 63 85.687 79.185 41.763 1.00 0.00 C ATOM 885 CG1 ILE A 63 84.690 78.453 42.676 1.00 0.00 C ATOM 886 CG2 ILE A 63 86.573 80.175 42.552 1.00 0.00 C ATOM 887 CD1 ILE A 63 85.327 77.572 43.757 1.00 0.00 C ATOM 0 H ILE A 63 83.599 78.471 40.349 1.00 0.00 H new ATOM 0 HA ILE A 63 84.895 80.982 40.973 1.00 0.00 H new ATOM 0 HB ILE A 63 86.278 78.372 41.342 1.00 0.00 H new ATOM 0 HG12 ILE A 63 84.053 79.193 43.161 1.00 0.00 H new ATOM 0 HG13 ILE A 63 84.043 77.832 42.057 1.00 0.00 H new ATOM 0 HG21 ILE A 63 87.042 79.657 43.388 1.00 0.00 H new ATOM 0 HG22 ILE A 63 87.345 80.576 41.895 1.00 0.00 H new ATOM 0 HG23 ILE A 63 85.958 80.992 42.930 1.00 0.00 H new ATOM 0 HD11 ILE A 63 84.544 77.099 44.349 1.00 0.00 H new ATOM 0 HD12 ILE A 63 85.940 76.804 43.286 1.00 0.00 H new ATOM 0 HD13 ILE A 63 85.951 78.186 44.406 1.00 0.00 H new ATOM 899 N ARG A 64 86.463 78.909 38.890 1.00 0.00 N ATOM 900 CA ARG A 64 87.507 78.852 37.844 1.00 0.00 C ATOM 901 C ARG A 64 87.073 78.079 36.606 1.00 0.00 C ATOM 902 O ARG A 64 87.691 78.247 35.557 1.00 0.00 O ATOM 903 CB ARG A 64 88.818 78.255 38.404 1.00 0.00 C ATOM 904 CG ARG A 64 89.355 78.928 39.681 1.00 0.00 C ATOM 905 CD ARG A 64 89.622 77.903 40.787 1.00 0.00 C ATOM 906 NE ARG A 64 90.845 77.121 40.525 1.00 0.00 N ATOM 907 CZ ARG A 64 91.998 77.194 41.155 1.00 0.00 C ATOM 908 NH1 ARG A 64 92.242 78.028 42.126 1.00 0.00 N ATOM 909 NH2 ARG A 64 92.977 76.409 40.783 1.00 0.00 N ATOM 0 H ARG A 64 86.156 77.990 39.210 1.00 0.00 H new ATOM 0 HA ARG A 64 87.679 79.883 37.535 1.00 0.00 H new ATOM 0 HB2 ARG A 64 88.657 77.197 38.611 1.00 0.00 H new ATOM 0 HB3 ARG A 64 89.585 78.315 37.631 1.00 0.00 H new ATOM 0 HG2 ARG A 64 90.276 79.464 39.451 1.00 0.00 H new ATOM 0 HG3 ARG A 64 88.635 79.667 40.034 1.00 0.00 H new ATOM 0 HD2 ARG A 64 89.717 78.417 41.744 1.00 0.00 H new ATOM 0 HD3 ARG A 64 88.770 77.228 40.871 1.00 0.00 H new ATOM 0 HE ARG A 64 90.790 76.443 39.765 1.00 0.00 H new ATOM 0 HH11 ARG A 64 91.517 78.674 42.438 1.00 0.00 H new ATOM 0 HH12 ARG A 64 93.158 78.035 42.574 1.00 0.00 H new ATOM 0 HH21 ARG A 64 92.840 75.752 40.014 1.00 0.00 H new ATOM 0 HH22 ARG A 64 93.877 76.454 41.262 1.00 0.00 H new ATOM 923 N LEU A 65 86.056 77.224 36.741 1.00 0.00 N ATOM 924 CA LEU A 65 85.548 76.358 35.672 1.00 0.00 C ATOM 925 C LEU A 65 84.116 76.760 35.238 1.00 0.00 C ATOM 926 O LEU A 65 83.545 76.132 34.351 1.00 0.00 O ATOM 927 CB LEU A 65 85.629 74.875 36.101 1.00 0.00 C ATOM 928 CG LEU A 65 86.954 74.306 36.690 1.00 0.00 C ATOM 929 CD1 LEU A 65 88.215 74.777 35.951 1.00 0.00 C ATOM 930 CD2 LEU A 65 87.138 74.557 38.183 1.00 0.00 C ATOM 0 H LEU A 65 85.550 77.111 37.619 1.00 0.00 H new ATOM 0 HA LEU A 65 86.182 76.490 34.795 1.00 0.00 H new ATOM 0 HB2 LEU A 65 84.847 74.709 36.842 1.00 0.00 H new ATOM 0 HB3 LEU A 65 85.376 74.271 35.230 1.00 0.00 H new ATOM 0 HG LEU A 65 86.837 73.233 36.537 1.00 0.00 H new ATOM 0 HD11 LEU A 65 89.096 74.339 36.419 1.00 0.00 H new ATOM 0 HD12 LEU A 65 88.164 74.463 34.908 1.00 0.00 H new ATOM 0 HD13 LEU A 65 88.281 75.864 36.000 1.00 0.00 H new ATOM 0 HD21 LEU A 65 88.085 74.128 38.510 1.00 0.00 H new ATOM 0 HD22 LEU A 65 87.140 75.630 38.374 1.00 0.00 H new ATOM 0 HD23 LEU A 65 86.320 74.092 38.734 1.00 0.00 H new ATOM 942 N GLY A 66 83.538 77.798 35.872 1.00 0.00 N ATOM 943 CA GLY A 66 82.251 78.394 35.513 1.00 0.00 C ATOM 944 C GLY A 66 82.306 79.341 34.299 1.00 0.00 C ATOM 945 O GLY A 66 83.347 79.517 33.665 1.00 0.00 O ATOM 0 H GLY A 66 83.974 78.255 36.673 1.00 0.00 H new ATOM 0 HA2 GLY A 66 81.540 77.595 35.303 1.00 0.00 H new ATOM 0 HA3 GLY A 66 81.867 78.945 36.372 1.00 0.00 H new ATOM 949 N ASP A 67 81.171 79.964 33.987 1.00 0.00 N ATOM 950 CA ASP A 67 80.926 80.693 32.723 1.00 0.00 C ATOM 951 C ASP A 67 80.544 82.168 32.991 1.00 0.00 C ATOM 952 O ASP A 67 79.468 82.614 32.600 1.00 0.00 O ATOM 953 CB ASP A 67 79.860 79.881 31.947 1.00 0.00 C ATOM 954 CG ASP A 67 79.588 80.332 30.512 1.00 0.00 C ATOM 955 OD1 ASP A 67 80.554 80.573 29.758 1.00 0.00 O ATOM 956 OD2 ASP A 67 78.400 80.310 30.103 1.00 0.00 O ATOM 0 H ASP A 67 80.369 79.982 34.617 1.00 0.00 H new ATOM 0 HA ASP A 67 81.824 80.767 32.109 1.00 0.00 H new ATOM 0 HB2 ASP A 67 80.172 78.837 31.926 1.00 0.00 H new ATOM 0 HB3 ASP A 67 78.924 79.923 32.504 1.00 0.00 H new ATOM 961 N THR A 68 81.362 82.916 33.760 1.00 0.00 N ATOM 962 CA THR A 68 81.043 84.307 34.161 1.00 0.00 C ATOM 963 C THR A 68 82.237 85.256 34.408 1.00 0.00 C ATOM 964 O THR A 68 82.047 86.462 34.413 1.00 0.00 O ATOM 965 CB THR A 68 80.112 84.295 35.398 1.00 0.00 C ATOM 966 OG1 THR A 68 79.168 85.346 35.355 1.00 0.00 O ATOM 967 CG2 THR A 68 80.817 84.348 36.753 1.00 0.00 C ATOM 0 H THR A 68 82.255 82.579 34.119 1.00 0.00 H new ATOM 0 HA THR A 68 80.551 84.729 33.285 1.00 0.00 H new ATOM 0 HB THR A 68 79.624 83.323 35.327 1.00 0.00 H new ATOM 0 HG1 THR A 68 78.597 85.306 36.151 1.00 0.00 H new ATOM 0 HG21 THR A 68 80.074 84.335 37.550 1.00 0.00 H new ATOM 0 HG22 THR A 68 81.474 83.485 36.855 1.00 0.00 H new ATOM 0 HG23 THR A 68 81.406 85.263 36.821 1.00 0.00 H new ATOM 975 N ASP A 69 83.454 84.738 34.613 1.00 0.00 N ATOM 976 CA ASP A 69 84.673 85.496 34.973 1.00 0.00 C ATOM 977 C ASP A 69 84.555 86.389 36.222 1.00 0.00 C ATOM 978 O ASP A 69 84.330 87.597 36.137 1.00 0.00 O ATOM 979 CB ASP A 69 85.252 86.215 33.730 1.00 0.00 C ATOM 980 CG ASP A 69 85.797 85.240 32.694 1.00 0.00 C ATOM 981 OD1 ASP A 69 86.303 84.156 33.082 1.00 0.00 O ATOM 982 OD2 ASP A 69 85.759 85.562 31.486 1.00 0.00 O ATOM 0 H ASP A 69 83.631 83.737 34.531 1.00 0.00 H new ATOM 0 HA ASP A 69 85.404 84.757 35.300 1.00 0.00 H new ATOM 0 HB2 ASP A 69 84.475 86.828 33.274 1.00 0.00 H new ATOM 0 HB3 ASP A 69 86.048 86.891 34.043 1.00 0.00 H new ATOM 987 N LEU A 70 84.777 85.782 37.387 1.00 0.00 N ATOM 988 CA LEU A 70 84.922 86.443 38.691 1.00 0.00 C ATOM 989 C LEU A 70 86.133 85.919 39.487 1.00 0.00 C ATOM 990 O LEU A 70 86.940 86.712 39.966 1.00 0.00 O ATOM 991 CB LEU A 70 83.632 86.271 39.513 1.00 0.00 C ATOM 992 CG LEU A 70 82.478 87.211 39.107 1.00 0.00 C ATOM 993 CD1 LEU A 70 81.202 86.819 39.838 1.00 0.00 C ATOM 994 CD2 LEU A 70 82.782 88.664 39.475 1.00 0.00 C ATOM 0 H LEU A 70 84.865 84.768 37.455 1.00 0.00 H new ATOM 0 HA LEU A 70 85.099 87.501 38.500 1.00 0.00 H new ATOM 0 HB2 LEU A 70 83.292 85.240 39.419 1.00 0.00 H new ATOM 0 HB3 LEU A 70 83.863 86.436 40.565 1.00 0.00 H new ATOM 0 HG LEU A 70 82.359 87.120 38.027 1.00 0.00 H new ATOM 0 HD11 LEU A 70 80.394 87.489 39.544 1.00 0.00 H new ATOM 0 HD12 LEU A 70 80.935 85.794 39.580 1.00 0.00 H new ATOM 0 HD13 LEU A 70 81.362 86.893 40.914 1.00 0.00 H new ATOM 0 HD21 LEU A 70 81.948 89.298 39.174 1.00 0.00 H new ATOM 0 HD22 LEU A 70 82.928 88.744 40.552 1.00 0.00 H new ATOM 0 HD23 LEU A 70 83.687 88.988 38.961 1.00 0.00 H new ATOM 1006 N ILE A 71 86.293 84.590 39.593 1.00 0.00 N ATOM 1007 CA ILE A 71 87.245 83.899 40.482 1.00 0.00 C ATOM 1008 C ILE A 71 87.062 84.248 41.988 1.00 0.00 C ATOM 1009 O ILE A 71 86.190 85.052 42.326 1.00 0.00 O ATOM 1010 CB ILE A 71 88.691 84.002 39.901 1.00 0.00 C ATOM 1011 CG1 ILE A 71 89.291 82.601 39.693 1.00 0.00 C ATOM 1012 CG2 ILE A 71 89.665 84.905 40.693 1.00 0.00 C ATOM 1013 CD1 ILE A 71 90.663 82.597 39.003 1.00 0.00 C ATOM 0 H ILE A 71 85.739 83.938 39.038 1.00 0.00 H new ATOM 0 HA ILE A 71 87.017 82.833 40.493 1.00 0.00 H new ATOM 0 HB ILE A 71 88.571 84.505 38.942 1.00 0.00 H new ATOM 0 HG12 ILE A 71 89.383 82.111 40.662 1.00 0.00 H new ATOM 0 HG13 ILE A 71 88.597 82.006 39.099 1.00 0.00 H new ATOM 0 HG21 ILE A 71 90.639 84.906 40.204 1.00 0.00 H new ATOM 0 HG22 ILE A 71 89.274 85.922 40.725 1.00 0.00 H new ATOM 0 HG23 ILE A 71 89.769 84.525 41.709 1.00 0.00 H new ATOM 0 HD11 ILE A 71 91.013 81.570 38.896 1.00 0.00 H new ATOM 0 HD12 ILE A 71 90.576 83.056 38.018 1.00 0.00 H new ATOM 0 HD13 ILE A 71 91.375 83.162 39.605 1.00 0.00 H new ATOM 1025 N ALA A 72 87.847 83.621 42.874 1.00 0.00 N ATOM 1026 CA ALA A 72 87.829 83.777 44.344 1.00 0.00 C ATOM 1027 C ALA A 72 86.573 83.245 45.085 1.00 0.00 C ATOM 1028 O ALA A 72 85.457 83.729 44.896 1.00 0.00 O ATOM 1029 CB ALA A 72 88.223 85.208 44.734 1.00 0.00 C ATOM 0 H ALA A 72 88.555 82.951 42.572 1.00 0.00 H new ATOM 0 HA ALA A 72 88.592 83.093 44.715 1.00 0.00 H new ATOM 0 HB1 ALA A 72 88.205 85.307 45.819 1.00 0.00 H new ATOM 0 HB2 ALA A 72 89.227 85.422 44.366 1.00 0.00 H new ATOM 0 HB3 ALA A 72 87.517 85.912 44.294 1.00 0.00 H new ATOM 1035 N GLU A 73 86.798 82.254 45.959 1.00 0.00 N ATOM 1036 CA GLU A 73 85.813 81.491 46.767 1.00 0.00 C ATOM 1037 C GLU A 73 84.492 81.151 46.059 1.00 0.00 C ATOM 1038 O GLU A 73 84.442 80.129 45.391 1.00 0.00 O ATOM 1039 CB GLU A 73 85.718 82.027 48.213 1.00 0.00 C ATOM 1040 CG GLU A 73 85.055 83.408 48.381 1.00 0.00 C ATOM 1041 CD GLU A 73 85.552 84.209 49.595 1.00 0.00 C ATOM 1042 OE1 GLU A 73 86.693 84.018 50.076 1.00 0.00 O ATOM 1043 OE2 GLU A 73 84.811 85.133 49.999 1.00 0.00 O ATOM 0 H GLU A 73 87.749 81.933 46.140 1.00 0.00 H new ATOM 0 HA GLU A 73 86.218 80.485 46.875 1.00 0.00 H new ATOM 0 HB2 GLU A 73 85.163 81.305 48.811 1.00 0.00 H new ATOM 0 HB3 GLU A 73 86.725 82.077 48.627 1.00 0.00 H new ATOM 0 HG2 GLU A 73 85.230 83.994 47.479 1.00 0.00 H new ATOM 0 HG3 GLU A 73 83.977 83.272 48.468 1.00 0.00 H new ATOM 1050 N ILE A 74 83.421 81.957 46.202 1.00 0.00 N ATOM 1051 CA ILE A 74 82.187 81.907 45.395 1.00 0.00 C ATOM 1052 C ILE A 74 81.539 83.301 45.367 1.00 0.00 C ATOM 1053 O ILE A 74 81.218 83.855 44.318 1.00 0.00 O ATOM 1054 CB ILE A 74 81.121 80.892 45.923 1.00 0.00 C ATOM 1055 CG1 ILE A 74 81.667 79.478 46.236 1.00 0.00 C ATOM 1056 CG2 ILE A 74 79.972 80.801 44.892 1.00 0.00 C ATOM 1057 CD1 ILE A 74 80.651 78.515 46.857 1.00 0.00 C ATOM 0 H ILE A 74 83.392 82.689 46.911 1.00 0.00 H new ATOM 0 HA ILE A 74 82.492 81.573 44.403 1.00 0.00 H new ATOM 0 HB ILE A 74 80.773 81.278 46.881 1.00 0.00 H new ATOM 0 HG12 ILE A 74 82.045 79.038 45.313 1.00 0.00 H new ATOM 0 HG13 ILE A 74 82.515 79.574 46.914 1.00 0.00 H new ATOM 0 HG21 ILE A 74 79.220 80.096 45.247 1.00 0.00 H new ATOM 0 HG22 ILE A 74 79.518 81.784 44.766 1.00 0.00 H new ATOM 0 HG23 ILE A 74 80.368 80.459 43.936 1.00 0.00 H new ATOM 0 HD11 ILE A 74 81.127 77.552 47.040 1.00 0.00 H new ATOM 0 HD12 ILE A 74 80.290 78.926 47.800 1.00 0.00 H new ATOM 0 HD13 ILE A 74 79.812 78.381 46.174 1.00 0.00 H new ATOM 1069 N GLU A 75 81.324 83.854 46.568 1.00 0.00 N ATOM 1070 CA GLU A 75 80.620 85.111 46.845 1.00 0.00 C ATOM 1071 C GLU A 75 81.005 85.581 48.264 1.00 0.00 C ATOM 1072 O GLU A 75 81.594 86.648 48.420 1.00 0.00 O ATOM 1073 CB GLU A 75 79.086 84.881 46.748 1.00 0.00 C ATOM 1074 CG GLU A 75 78.357 85.722 45.688 1.00 0.00 C ATOM 1075 CD GLU A 75 77.884 87.108 46.152 1.00 0.00 C ATOM 1076 OE1 GLU A 75 77.921 87.400 47.370 1.00 0.00 O ATOM 1077 OE2 GLU A 75 77.417 87.889 45.301 1.00 0.00 O ATOM 0 H GLU A 75 81.657 83.408 47.423 1.00 0.00 H new ATOM 0 HA GLU A 75 80.900 85.873 46.118 1.00 0.00 H new ATOM 0 HB2 GLU A 75 78.907 83.827 46.537 1.00 0.00 H new ATOM 0 HB3 GLU A 75 78.642 85.091 47.721 1.00 0.00 H new ATOM 0 HG2 GLU A 75 79.021 85.852 44.833 1.00 0.00 H new ATOM 0 HG3 GLU A 75 77.491 85.161 45.337 1.00 0.00 H new ATOM 1084 N LYS A 76 80.768 84.716 49.261 1.00 0.00 N ATOM 1085 CA LYS A 76 81.170 84.849 50.675 1.00 0.00 C ATOM 1086 C LYS A 76 81.237 83.467 51.362 1.00 0.00 C ATOM 1087 O LYS A 76 80.636 83.218 52.409 1.00 0.00 O ATOM 1088 CB LYS A 76 80.272 85.878 51.391 1.00 0.00 C ATOM 1089 CG LYS A 76 78.762 85.589 51.299 1.00 0.00 C ATOM 1090 CD LYS A 76 77.897 86.645 51.986 1.00 0.00 C ATOM 1091 CE LYS A 76 77.848 87.953 51.181 1.00 0.00 C ATOM 1092 NZ LYS A 76 76.693 88.790 51.602 1.00 0.00 N ATOM 0 H LYS A 76 80.258 83.849 49.094 1.00 0.00 H new ATOM 0 HA LYS A 76 82.183 85.246 50.736 1.00 0.00 H new ATOM 0 HB2 LYS A 76 80.557 85.919 52.442 1.00 0.00 H new ATOM 0 HB3 LYS A 76 80.466 86.864 50.970 1.00 0.00 H new ATOM 0 HG2 LYS A 76 78.476 85.523 50.249 1.00 0.00 H new ATOM 0 HG3 LYS A 76 78.558 84.616 51.747 1.00 0.00 H new ATOM 0 HD2 LYS A 76 76.886 86.259 52.115 1.00 0.00 H new ATOM 0 HD3 LYS A 76 78.291 86.846 52.982 1.00 0.00 H new ATOM 0 HE2 LYS A 76 78.776 88.508 51.323 1.00 0.00 H new ATOM 0 HE3 LYS A 76 77.771 87.728 50.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 76.680 89.668 51.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 75.809 88.266 51.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 76.782 89.022 52.612 1.00 0.00 H new ATOM 1106 N ASP A 77 81.923 82.523 50.712 1.00 0.00 N ATOM 1107 CA ASP A 77 82.309 81.197 51.246 1.00 0.00 C ATOM 1108 C ASP A 77 81.167 80.306 51.797 1.00 0.00 C ATOM 1109 O ASP A 77 81.353 79.624 52.802 1.00 0.00 O ATOM 1110 CB ASP A 77 83.478 81.401 52.228 1.00 0.00 C ATOM 1111 CG ASP A 77 84.191 80.095 52.585 1.00 0.00 C ATOM 1112 OD1 ASP A 77 84.607 79.377 51.641 1.00 0.00 O ATOM 1113 OD2 ASP A 77 84.400 79.821 53.787 1.00 0.00 O ATOM 0 H ASP A 77 82.243 82.661 49.753 1.00 0.00 H new ATOM 0 HA ASP A 77 82.629 80.590 50.399 1.00 0.00 H new ATOM 0 HB2 ASP A 77 84.197 82.094 51.790 1.00 0.00 H new ATOM 0 HB3 ASP A 77 83.103 81.865 53.140 1.00 0.00 H new ATOM 1118 N PHE A 78 79.959 80.301 51.215 1.00 0.00 N ATOM 1119 CA PHE A 78 78.831 79.521 51.759 1.00 0.00 C ATOM 1120 C PHE A 78 79.012 77.991 51.668 1.00 0.00 C ATOM 1121 O PHE A 78 78.759 77.282 52.632 1.00 0.00 O ATOM 1122 CB PHE A 78 77.509 79.898 51.072 1.00 0.00 C ATOM 1123 CG PHE A 78 76.770 81.133 51.553 1.00 0.00 C ATOM 1124 CD1 PHE A 78 77.344 82.061 52.457 1.00 0.00 C ATOM 1125 CD2 PHE A 78 75.446 81.345 51.114 1.00 0.00 C ATOM 1126 CE1 PHE A 78 76.613 83.175 52.890 1.00 0.00 C ATOM 1127 CE2 PHE A 78 74.725 82.469 51.547 1.00 0.00 C ATOM 1128 CZ PHE A 78 75.304 83.384 52.435 1.00 0.00 C ATOM 0 H PHE A 78 79.735 80.826 50.370 1.00 0.00 H new ATOM 0 HA PHE A 78 78.805 79.784 52.817 1.00 0.00 H new ATOM 0 HB2 PHE A 78 77.713 80.027 50.009 1.00 0.00 H new ATOM 0 HB3 PHE A 78 76.832 79.049 51.167 1.00 0.00 H new ATOM 0 HD1 PHE A 78 78.352 81.909 52.815 1.00 0.00 H new ATOM 0 HD2 PHE A 78 74.984 80.638 50.441 1.00 0.00 H new ATOM 0 HE1 PHE A 78 77.061 83.877 53.578 1.00 0.00 H new ATOM 0 HE2 PHE A 78 73.717 82.629 51.193 1.00 0.00 H new ATOM 0 HZ PHE A 78 74.745 84.246 52.767 1.00 0.00 H new ATOM 1138 N ALA A 79 79.412 77.482 50.495 1.00 0.00 N ATOM 1139 CA ALA A 79 79.349 76.043 50.193 1.00 0.00 C ATOM 1140 C ALA A 79 80.676 75.286 50.351 1.00 0.00 C ATOM 1141 O ALA A 79 80.704 74.070 50.181 1.00 0.00 O ATOM 1142 CB ALA A 79 78.754 75.873 48.790 1.00 0.00 C ATOM 0 H ALA A 79 79.785 78.049 49.734 1.00 0.00 H new ATOM 0 HA ALA A 79 78.708 75.581 50.943 1.00 0.00 H new ATOM 0 HB1 ALA A 79 78.698 74.812 48.545 1.00 0.00 H new ATOM 0 HB2 ALA A 79 77.754 76.305 48.764 1.00 0.00 H new ATOM 0 HB3 ALA A 79 79.387 76.381 48.062 1.00 0.00 H new ATOM 1148 N LEU A 80 81.773 75.991 50.676 1.00 0.00 N ATOM 1149 CA LEU A 80 83.144 75.468 50.716 1.00 0.00 C ATOM 1150 C LEU A 80 83.565 74.788 49.393 1.00 0.00 C ATOM 1151 O LEU A 80 83.999 75.470 48.459 1.00 0.00 O ATOM 1152 CB LEU A 80 83.347 74.605 51.986 1.00 0.00 C ATOM 1153 CG LEU A 80 83.164 75.367 53.310 1.00 0.00 C ATOM 1154 CD1 LEU A 80 83.022 74.364 54.466 1.00 0.00 C ATOM 1155 CD2 LEU A 80 84.361 76.257 53.620 1.00 0.00 C ATOM 0 H LEU A 80 81.724 76.978 50.927 1.00 0.00 H new ATOM 0 HA LEU A 80 83.837 76.305 50.798 1.00 0.00 H new ATOM 0 HB2 LEU A 80 82.644 73.772 51.960 1.00 0.00 H new ATOM 0 HB3 LEU A 80 84.349 74.177 51.963 1.00 0.00 H new ATOM 0 HG LEU A 80 82.273 75.986 53.206 1.00 0.00 H new ATOM 0 HD11 LEU A 80 82.892 74.905 55.403 1.00 0.00 H new ATOM 0 HD12 LEU A 80 82.154 73.728 54.291 1.00 0.00 H new ATOM 0 HD13 LEU A 80 83.918 73.747 54.524 1.00 0.00 H new ATOM 0 HD21 LEU A 80 84.193 76.778 54.563 1.00 0.00 H new ATOM 0 HD22 LEU A 80 85.259 75.644 53.699 1.00 0.00 H new ATOM 0 HD23 LEU A 80 84.489 76.987 52.820 1.00 0.00 H new ATOM 1167 N TYR A 81 83.434 73.459 49.305 1.00 0.00 N ATOM 1168 CA TYR A 81 83.908 72.602 48.213 1.00 0.00 C ATOM 1169 C TYR A 81 82.967 71.402 47.981 1.00 0.00 C ATOM 1170 O TYR A 81 82.374 70.890 48.934 1.00 0.00 O ATOM 1171 CB TYR A 81 85.322 72.082 48.572 1.00 0.00 C ATOM 1172 CG TYR A 81 86.441 72.507 47.626 1.00 0.00 C ATOM 1173 CD1 TYR A 81 86.918 73.832 47.669 1.00 0.00 C ATOM 1174 CD2 TYR A 81 87.024 71.576 46.756 1.00 0.00 C ATOM 1175 CE1 TYR A 81 87.989 74.226 46.834 1.00 0.00 C ATOM 1176 CE2 TYR A 81 88.105 71.961 45.925 1.00 0.00 C ATOM 1177 CZ TYR A 81 88.591 73.287 45.970 1.00 0.00 C ATOM 1178 OH TYR A 81 89.634 73.658 45.185 1.00 0.00 O ATOM 0 H TYR A 81 82.967 72.923 50.036 1.00 0.00 H new ATOM 0 HA TYR A 81 83.930 73.190 47.296 1.00 0.00 H new ATOM 0 HB2 TYR A 81 85.571 72.424 49.577 1.00 0.00 H new ATOM 0 HB3 TYR A 81 85.292 70.993 48.604 1.00 0.00 H new ATOM 0 HD1 TYR A 81 86.465 74.547 48.340 1.00 0.00 H new ATOM 0 HD2 TYR A 81 86.649 70.564 46.719 1.00 0.00 H new ATOM 0 HE1 TYR A 81 88.346 75.245 46.858 1.00 0.00 H new ATOM 0 HE2 TYR A 81 88.557 71.242 45.258 1.00 0.00 H new ATOM 0 HH TYR A 81 89.931 72.891 44.652 1.00 0.00 H new ATOM 1188 N GLY A 82 82.866 70.910 46.747 1.00 0.00 N ATOM 1189 CA GLY A 82 82.138 69.663 46.432 1.00 0.00 C ATOM 1190 C GLY A 82 82.179 69.204 44.971 1.00 0.00 C ATOM 1191 O GLY A 82 81.769 68.081 44.644 1.00 0.00 O ATOM 0 H GLY A 82 83.284 71.358 45.931 1.00 0.00 H new ATOM 0 HA2 GLY A 82 82.543 68.864 47.053 1.00 0.00 H new ATOM 0 HA3 GLY A 82 81.095 69.793 46.721 1.00 0.00 H new ATOM 1195 N ASP A 83 82.682 70.051 44.083 1.00 0.00 N ATOM 1196 CA ASP A 83 82.527 70.011 42.618 1.00 0.00 C ATOM 1197 C ASP A 83 83.840 70.209 41.826 1.00 0.00 C ATOM 1198 O ASP A 83 83.842 70.212 40.593 1.00 0.00 O ATOM 1199 CB ASP A 83 81.455 71.048 42.220 1.00 0.00 C ATOM 1200 CG ASP A 83 81.464 72.398 42.963 1.00 0.00 C ATOM 1201 OD1 ASP A 83 82.400 72.694 43.737 1.00 0.00 O ATOM 1202 OD2 ASP A 83 80.441 73.113 42.833 1.00 0.00 O ATOM 0 H ASP A 83 83.251 70.844 44.379 1.00 0.00 H new ATOM 0 HA ASP A 83 82.211 69.004 42.345 1.00 0.00 H new ATOM 0 HB2 ASP A 83 81.561 71.250 41.154 1.00 0.00 H new ATOM 0 HB3 ASP A 83 80.475 70.592 42.363 1.00 0.00 H new ATOM 1207 N GLU A 84 84.981 70.284 42.517 1.00 0.00 N ATOM 1208 CA GLU A 84 86.321 70.319 41.927 1.00 0.00 C ATOM 1209 C GLU A 84 86.947 68.916 41.860 1.00 0.00 C ATOM 1210 O GLU A 84 86.906 68.279 40.810 1.00 0.00 O ATOM 1211 CB GLU A 84 87.183 71.369 42.659 1.00 0.00 C ATOM 1212 CG GLU A 84 87.384 72.654 41.835 1.00 0.00 C ATOM 1213 CD GLU A 84 88.604 72.509 40.924 1.00 0.00 C ATOM 1214 OE1 GLU A 84 88.563 71.760 39.926 1.00 0.00 O ATOM 1215 OE2 GLU A 84 89.671 73.098 41.243 1.00 0.00 O ATOM 0 H GLU A 84 84.997 70.323 43.536 1.00 0.00 H new ATOM 0 HA GLU A 84 86.258 70.638 40.887 1.00 0.00 H new ATOM 0 HB2 GLU A 84 86.711 71.622 43.609 1.00 0.00 H new ATOM 0 HB3 GLU A 84 88.156 70.936 42.892 1.00 0.00 H new ATOM 0 HG2 GLU A 84 86.495 72.854 41.236 1.00 0.00 H new ATOM 0 HG3 GLU A 84 87.518 73.506 42.502 1.00 0.00 H new ATOM 1222 N SER A 85 87.489 68.383 42.970 1.00 0.00 N ATOM 1223 CA SER A 85 88.200 67.095 43.001 1.00 0.00 C ATOM 1224 C SER A 85 87.825 66.213 44.202 1.00 0.00 C ATOM 1225 O SER A 85 87.328 65.092 44.012 1.00 0.00 O ATOM 1226 CB SER A 85 89.710 67.335 42.946 1.00 0.00 C ATOM 1227 OG SER A 85 90.371 66.143 42.597 1.00 0.00 O ATOM 0 H SER A 85 87.444 68.841 43.880 1.00 0.00 H new ATOM 0 HA SER A 85 87.884 66.538 42.119 1.00 0.00 H new ATOM 0 HB2 SER A 85 89.937 68.114 42.218 1.00 0.00 H new ATOM 0 HB3 SER A 85 90.066 67.689 43.913 1.00 0.00 H new ATOM 0 HG SER A 85 91.337 66.303 42.562 1.00 0.00 H new ATOM 1233 N VAL A 86 87.956 66.725 45.427 1.00 0.00 N ATOM 1234 CA VAL A 86 87.692 66.048 46.715 1.00 0.00 C ATOM 1235 C VAL A 86 88.566 64.797 46.948 1.00 0.00 C ATOM 1236 O VAL A 86 89.675 64.955 47.450 1.00 0.00 O ATOM 1237 CB VAL A 86 86.184 65.856 47.010 1.00 0.00 C ATOM 1238 CG1 VAL A 86 85.965 65.472 48.480 1.00 0.00 C ATOM 1239 CG2 VAL A 86 85.375 67.134 46.744 1.00 0.00 C ATOM 0 H VAL A 86 88.269 67.686 45.564 1.00 0.00 H new ATOM 0 HA VAL A 86 88.026 66.742 47.486 1.00 0.00 H new ATOM 0 HB VAL A 86 85.842 65.064 46.344 1.00 0.00 H new ATOM 0 HG11 VAL A 86 84.899 65.342 48.667 1.00 0.00 H new ATOM 0 HG12 VAL A 86 86.488 64.540 48.694 1.00 0.00 H new ATOM 0 HG13 VAL A 86 86.352 66.262 49.124 1.00 0.00 H new ATOM 0 HG21 VAL A 86 84.323 66.951 46.965 1.00 0.00 H new ATOM 0 HG22 VAL A 86 85.745 67.938 47.380 1.00 0.00 H new ATOM 0 HG23 VAL A 86 85.482 67.421 45.698 1.00 0.00 H new ATOM 1249 N PHE A 87 88.076 63.584 46.653 1.00 0.00 N ATOM 1250 CA PHE A 87 88.810 62.314 46.821 1.00 0.00 C ATOM 1251 C PHE A 87 88.091 61.148 46.088 1.00 0.00 C ATOM 1252 O PHE A 87 87.733 61.290 44.922 1.00 0.00 O ATOM 1253 CB PHE A 87 89.123 62.073 48.328 1.00 0.00 C ATOM 1254 CG PHE A 87 90.615 61.985 48.631 1.00 0.00 C ATOM 1255 CD1 PHE A 87 91.449 61.089 47.929 1.00 0.00 C ATOM 1256 CD2 PHE A 87 91.192 62.817 49.617 1.00 0.00 C ATOM 1257 CE1 PHE A 87 92.835 61.055 48.171 1.00 0.00 C ATOM 1258 CE2 PHE A 87 92.580 62.791 49.846 1.00 0.00 C ATOM 1259 CZ PHE A 87 93.397 61.929 49.114 1.00 0.00 C ATOM 0 H PHE A 87 87.135 63.452 46.282 1.00 0.00 H new ATOM 0 HA PHE A 87 89.782 62.372 46.332 1.00 0.00 H new ATOM 0 HB2 PHE A 87 88.688 62.881 48.915 1.00 0.00 H new ATOM 0 HB3 PHE A 87 88.640 61.150 48.649 1.00 0.00 H new ATOM 0 HD1 PHE A 87 91.019 60.421 47.197 1.00 0.00 H new ATOM 0 HD2 PHE A 87 90.564 63.476 50.198 1.00 0.00 H new ATOM 0 HE1 PHE A 87 93.463 60.360 47.634 1.00 0.00 H new ATOM 0 HE2 PHE A 87 93.015 63.441 50.591 1.00 0.00 H new ATOM 0 HZ PHE A 87 94.465 61.934 49.274 1.00 0.00 H new ATOM 1269 N GLY A 88 87.892 59.991 46.732 1.00 0.00 N ATOM 1270 CA GLY A 88 87.165 58.834 46.203 1.00 0.00 C ATOM 1271 C GLY A 88 85.640 58.992 46.108 1.00 0.00 C ATOM 1272 O GLY A 88 85.089 60.085 46.238 1.00 0.00 O ATOM 0 H GLY A 88 88.248 59.831 47.674 1.00 0.00 H new ATOM 0 HA2 GLY A 88 87.551 58.609 45.209 1.00 0.00 H new ATOM 0 HA3 GLY A 88 87.384 57.972 46.833 1.00 0.00 H new ATOM 1276 N GLY A 89 84.940 57.881 45.855 1.00 0.00 N ATOM 1277 CA GLY A 89 83.482 57.828 45.709 1.00 0.00 C ATOM 1278 C GLY A 89 83.004 56.497 45.118 1.00 0.00 C ATOM 1279 O GLY A 89 83.658 55.468 45.286 1.00 0.00 O ATOM 0 H GLY A 89 85.384 56.970 45.743 1.00 0.00 H new ATOM 0 HA2 GLY A 89 83.016 57.979 46.683 1.00 0.00 H new ATOM 0 HA3 GLY A 89 83.153 58.646 45.068 1.00 0.00 H new ATOM 1283 N GLY A 90 81.853 56.506 44.441 1.00 0.00 N ATOM 1284 CA GLY A 90 81.184 55.317 43.888 1.00 0.00 C ATOM 1285 C GLY A 90 81.839 54.733 42.635 1.00 0.00 C ATOM 1286 O GLY A 90 81.230 54.731 41.571 1.00 0.00 O ATOM 0 H GLY A 90 81.341 57.368 44.254 1.00 0.00 H new ATOM 0 HA2 GLY A 90 81.153 54.545 44.657 1.00 0.00 H new ATOM 0 HA3 GLY A 90 80.151 55.575 43.653 1.00 0.00 H new ATOM 1290 N LYS A 91 83.092 54.259 42.746 1.00 0.00 N ATOM 1291 CA LYS A 91 83.836 53.607 41.648 1.00 0.00 C ATOM 1292 C LYS A 91 84.743 52.500 42.193 1.00 0.00 C ATOM 1293 O LYS A 91 85.751 52.805 42.844 1.00 0.00 O ATOM 1294 CB LYS A 91 84.618 54.681 40.866 1.00 0.00 C ATOM 1295 CG LYS A 91 85.102 54.256 39.477 1.00 0.00 C ATOM 1296 CD LYS A 91 86.371 53.379 39.449 1.00 0.00 C ATOM 1297 CE LYS A 91 86.727 53.085 37.978 1.00 0.00 C ATOM 1298 NZ LYS A 91 87.992 52.323 37.866 1.00 0.00 N ATOM 0 H LYS A 91 83.626 54.318 43.613 1.00 0.00 H new ATOM 0 HA LYS A 91 83.142 53.124 40.960 1.00 0.00 H new ATOM 0 HB2 LYS A 91 83.985 55.562 40.758 1.00 0.00 H new ATOM 0 HB3 LYS A 91 85.483 54.981 41.458 1.00 0.00 H new ATOM 0 HG2 LYS A 91 84.297 53.713 38.982 1.00 0.00 H new ATOM 0 HG3 LYS A 91 85.290 55.154 38.888 1.00 0.00 H new ATOM 0 HD2 LYS A 91 87.196 53.891 39.944 1.00 0.00 H new ATOM 0 HD3 LYS A 91 86.201 52.449 39.991 1.00 0.00 H new ATOM 0 HE2 LYS A 91 85.919 52.520 37.513 1.00 0.00 H new ATOM 0 HE3 LYS A 91 86.817 54.023 37.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 88.201 52.143 36.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 88.767 52.873 38.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 87.897 51.417 38.368 1.00 0.00 H new ATOM 1312 N VAL A 92 84.420 51.234 41.900 1.00 0.00 N ATOM 1313 CA VAL A 92 85.182 50.027 42.278 1.00 0.00 C ATOM 1314 C VAL A 92 85.265 49.034 41.102 1.00 0.00 C ATOM 1315 O VAL A 92 85.248 49.479 39.947 1.00 0.00 O ATOM 1316 CB VAL A 92 84.663 49.396 43.600 1.00 0.00 C ATOM 1317 CG1 VAL A 92 85.803 48.699 44.362 1.00 0.00 C ATOM 1318 CG2 VAL A 92 84.081 50.404 44.601 1.00 0.00 C ATOM 0 H VAL A 92 83.580 51.008 41.367 1.00 0.00 H new ATOM 0 HA VAL A 92 86.207 50.327 42.495 1.00 0.00 H new ATOM 0 HB VAL A 92 83.882 48.712 43.267 1.00 0.00 H new ATOM 0 HG11 VAL A 92 85.413 48.266 45.283 1.00 0.00 H new ATOM 0 HG12 VAL A 92 86.227 47.910 43.741 1.00 0.00 H new ATOM 0 HG13 VAL A 92 86.578 49.427 44.603 1.00 0.00 H new ATOM 0 HG21 VAL A 92 83.743 49.877 45.493 1.00 0.00 H new ATOM 0 HG22 VAL A 92 84.848 51.128 44.876 1.00 0.00 H new ATOM 0 HG23 VAL A 92 83.238 50.923 44.146 1.00 0.00 H new ATOM 1328 N ILE A 93 85.456 47.735 41.353 1.00 0.00 N ATOM 1329 CA ILE A 93 85.813 46.672 40.380 1.00 0.00 C ATOM 1330 C ILE A 93 84.608 45.900 39.839 1.00 0.00 C ATOM 1331 O ILE A 93 83.633 45.675 40.579 1.00 0.00 O ATOM 1332 CB ILE A 93 86.913 45.763 41.009 1.00 0.00 C ATOM 1333 CG1 ILE A 93 87.430 44.644 40.078 1.00 0.00 C ATOM 1334 CG2 ILE A 93 86.423 45.098 42.301 1.00 0.00 C ATOM 1335 CD1 ILE A 93 88.066 45.162 38.780 1.00 0.00 C ATOM 0 H ILE A 93 85.362 47.364 42.298 1.00 0.00 H new ATOM 0 HA ILE A 93 86.222 47.143 39.486 1.00 0.00 H new ATOM 0 HB ILE A 93 87.737 46.450 41.204 1.00 0.00 H new ATOM 0 HG12 ILE A 93 88.164 44.046 40.618 1.00 0.00 H new ATOM 0 HG13 ILE A 93 86.602 43.982 39.827 1.00 0.00 H new ATOM 0 HG21 ILE A 93 87.216 44.472 42.711 1.00 0.00 H new ATOM 0 HG22 ILE A 93 86.155 45.866 43.026 1.00 0.00 H new ATOM 0 HG23 ILE A 93 85.550 44.482 42.085 1.00 0.00 H new ATOM 0 HD11 ILE A 93 88.405 44.318 38.179 1.00 0.00 H new ATOM 0 HD12 ILE A 93 87.329 45.736 38.218 1.00 0.00 H new ATOM 0 HD13 ILE A 93 88.916 45.800 39.021 1.00 0.00 H new TER 1347 ILE A 93